USER MOD reduce.3.24.130724 H: found=0, std=0, add=665, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 666 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: B 78 ASN : amide:sc= 1.02 K(o=3.2,f=-3.4) USER MOD Set 1.2: B 81 LYS NZ :NH3+ -170:sc= 2.18 (180deg=1.12) USER MOD Set 2.1: B 72 GLN : amide:sc= 2.16 K(o=5.3,f=-0.74) USER MOD Set 2.2: B 73 GLN : amide:sc= 1.94 K(o=5.3,f=2.6) USER MOD Set 2.3: B 74 GLN : amide:sc= 1.18 K(o=5.3,f=3) USER MOD Set 3.1: B 63 THR OG1 : rot -60:sc= 2.37 USER MOD Set 3.2: B 66 SER OG : rot 32:sc= 1.99 USER MOD Set 3.3: B 71 GLN : amide:sc= 0.829 K(o=5.3,f=1.9!) USER MOD Set 3.4: B 75 GLN : amide:sc= 0.0975! K(o=5.3!,f=-1.5) USER MOD Single : A 12 GLN : amide:sc= -0.0466 X(o=-0.047,f=-0.36) USER MOD Single : A 14 HIS : no HD1:sc= -1.65 X(o=-1.7,f=-1.5) USER MOD Single : A 15 THR OG1 : rot 95:sc= 1.26 USER MOD Single : A 18 SER OG : rot 97:sc= 1.28 USER MOD Single : A 19 ASN : amide:sc= 1.51 K(o=1.5,f=-6.6!) USER MOD Single : A 20 THR OG1 : rot -55:sc= 1.12 USER MOD Single : A 23 THR OG1 : rot 103:sc= 1.13 USER MOD Single : B 51 SER OG : rot 29:sc= 0.19 USER MOD Single : B 53 SER OG : rot -127:sc= 1.19 USER MOD Single : B 55 SER OG : rot 180:sc= 0.0257 USER MOD Single : B 58 GLN : amide:sc= 1.15 K(o=1.1,f=-0.027) USER MOD Single : B 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 68 SER OG : rot -161:sc= 1.63 USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 82 SER OG : rot -79:sc= 1.15 USER MOD Single : B 83 ASN : amide:sc= -2.32 K(o=-2.3,f=-11!) USER MOD Single : B 85 GLN : amide:sc= -0.021 K(o=-0.021,f=-1.2) USER MOD Single : B 87 MET CE :methyl 143:sc= -1.45 (180deg=-4.75!) USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 93 GLN : amide:sc= 0.139 K(o=0.14,f=-1.8) USER MOD Single : B 95 THR OG1 : rot 55:sc= 0.513 USER MOD Single : B 97 LYS NZ :NH3+ -159:sc= 0.99 (180deg=0.241) USER MOD Single : B 98 TYR OH : rot -145:sc= 0.879 USER MOD ----------------------------------------------------------------- ATOM 65 N GLU A 6 13.048 -9.787 -3.734 1.00 10.00 N ATOM 66 CA GLU A 6 11.854 -8.955 -3.942 1.00 10.00 C ATOM 67 C GLU A 6 10.939 -8.990 -2.736 1.00 10.00 C ATOM 68 O GLU A 6 10.502 -7.934 -2.307 1.00 10.00 O ATOM 69 CB GLU A 6 11.103 -9.457 -5.189 1.00 10.00 C ATOM 70 CG GLU A 6 10.199 -8.447 -5.911 1.00 10.00 C ATOM 71 CD GLU A 6 8.966 -7.994 -5.131 1.00 10.00 C ATOM 72 OE1 GLU A 6 8.311 -8.854 -4.496 1.00 10.00 O ATOM 73 OE2 GLU A 6 8.669 -6.774 -5.250 1.00 10.00 O ATOM 0 HA GLU A 6 12.170 -7.922 -4.087 1.00 10.00 H new ATOM 0 HB2 GLU A 6 11.840 -9.824 -5.904 1.00 10.00 H new ATOM 0 HB3 GLU A 6 10.491 -10.310 -4.896 1.00 10.00 H new ATOM 0 HG2 GLU A 6 10.793 -7.568 -6.161 1.00 10.00 H new ATOM 0 HG3 GLU A 6 9.870 -8.888 -6.852 1.00 10.00 H new ATOM 80 N ARG A 7 10.671 -10.168 -2.171 1.00 10.00 N ATOM 81 CA ARG A 7 9.683 -10.324 -1.114 1.00 10.00 C ATOM 82 C ARG A 7 9.956 -9.465 0.113 1.00 10.00 C ATOM 83 O ARG A 7 9.053 -8.751 0.537 1.00 10.00 O ATOM 84 CB ARG A 7 9.482 -11.821 -0.831 1.00 10.00 C ATOM 85 CG ARG A 7 8.144 -12.177 -0.158 1.00 10.00 C ATOM 86 CD ARG A 7 6.843 -11.669 -0.816 1.00 10.00 C ATOM 87 NE ARG A 7 6.984 -11.272 -2.235 1.00 10.00 N ATOM 88 CZ ARG A 7 7.116 -11.979 -3.346 1.00 10.00 C ATOM 89 NH1 ARG A 7 6.977 -13.276 -3.412 1.00 10.00 N ATOM 90 NH2 ARG A 7 7.435 -11.349 -4.441 1.00 10.00 N ATOM 0 H ARG A 7 11.135 -11.037 -2.436 1.00 10.00 H new ATOM 0 HA ARG A 7 8.729 -9.927 -1.460 1.00 10.00 H new ATOM 0 HB2 ARG A 7 9.556 -12.367 -1.771 1.00 10.00 H new ATOM 0 HB3 ARG A 7 10.296 -12.169 -0.195 1.00 10.00 H new ATOM 0 HG2 ARG A 7 8.082 -13.263 -0.092 1.00 10.00 H new ATOM 0 HG3 ARG A 7 8.172 -11.796 0.863 1.00 10.00 H new ATOM 0 HD2 ARG A 7 6.086 -12.450 -0.744 1.00 10.00 H new ATOM 0 HD3 ARG A 7 6.474 -10.815 -0.248 1.00 10.00 H new ATOM 0 HE ARG A 7 6.978 -10.263 -2.385 1.00 10.00 H new ATOM 0 HH11 ARG A 7 6.752 -13.808 -2.571 1.00 10.00 H new ATOM 0 HH12 ARG A 7 7.093 -13.757 -4.304 1.00 10.00 H new ATOM 0 HH21 ARG A 7 7.576 -10.339 -4.426 1.00 10.00 H new ATOM 0 HH22 ARG A 7 7.544 -11.866 -5.313 1.00 10.00 H new ATOM 104 N ALA A 8 11.187 -9.435 0.629 1.00 10.00 N ATOM 105 CA ALA A 8 11.537 -8.538 1.728 1.00 10.00 C ATOM 106 C ALA A 8 11.382 -7.057 1.328 1.00 10.00 C ATOM 107 O ALA A 8 10.930 -6.243 2.139 1.00 10.00 O ATOM 108 CB ALA A 8 12.975 -8.851 2.167 1.00 10.00 C ATOM 0 H ALA A 8 11.955 -10.021 0.303 1.00 10.00 H new ATOM 0 HA ALA A 8 10.853 -8.702 2.561 1.00 10.00 H new ATOM 0 HB1 ALA A 8 13.257 -8.191 2.988 1.00 10.00 H new ATOM 0 HB2 ALA A 8 13.037 -9.888 2.497 1.00 10.00 H new ATOM 0 HB3 ALA A 8 13.653 -8.696 1.328 1.00 10.00 H new ATOM 114 N LEU A 9 11.750 -6.712 0.083 1.00 10.00 N ATOM 115 CA LEU A 9 11.703 -5.349 -0.464 1.00 10.00 C ATOM 116 C LEU A 9 10.247 -4.881 -0.641 1.00 10.00 C ATOM 117 O LEU A 9 9.926 -3.752 -0.271 1.00 10.00 O ATOM 118 CB LEU A 9 12.484 -5.298 -1.793 1.00 10.00 C ATOM 119 CG LEU A 9 13.917 -5.842 -1.713 1.00 10.00 C ATOM 120 CD1 LEU A 9 14.515 -6.022 -3.108 1.00 10.00 C ATOM 121 CD2 LEU A 9 14.853 -4.993 -0.841 1.00 10.00 C ATOM 0 H LEU A 9 12.099 -7.395 -0.589 1.00 10.00 H new ATOM 0 HA LEU A 9 12.176 -4.663 0.238 1.00 10.00 H new ATOM 0 HB2 LEU A 9 11.935 -5.866 -2.544 1.00 10.00 H new ATOM 0 HB3 LEU A 9 12.520 -4.265 -2.139 1.00 10.00 H new ATOM 0 HG LEU A 9 13.834 -6.813 -1.225 1.00 10.00 H new ATOM 0 HD11 LEU A 9 15.531 -6.408 -3.021 1.00 10.00 H new ATOM 0 HD12 LEU A 9 13.906 -6.725 -3.677 1.00 10.00 H new ATOM 0 HD13 LEU A 9 14.535 -5.061 -3.622 1.00 10.00 H new ATOM 0 HD21 LEU A 9 15.847 -5.440 -0.833 1.00 10.00 H new ATOM 0 HD22 LEU A 9 14.912 -3.983 -1.247 1.00 10.00 H new ATOM 0 HD23 LEU A 9 14.465 -4.952 0.177 1.00 10.00 H new ATOM 133 N LEU A 10 9.377 -5.769 -1.134 1.00 10.00 N ATOM 134 CA LEU A 10 7.924 -5.669 -1.223 1.00 10.00 C ATOM 135 C LEU A 10 7.323 -5.501 0.164 1.00 10.00 C ATOM 136 O LEU A 10 6.601 -4.539 0.386 1.00 10.00 O ATOM 137 CB LEU A 10 7.389 -6.942 -1.907 1.00 10.00 C ATOM 138 CG LEU A 10 5.850 -7.086 -1.971 1.00 10.00 C ATOM 139 CD1 LEU A 10 5.229 -6.005 -2.831 1.00 10.00 C ATOM 140 CD2 LEU A 10 5.422 -8.409 -2.596 1.00 10.00 C ATOM 0 H LEU A 10 9.707 -6.656 -1.515 1.00 10.00 H new ATOM 0 HA LEU A 10 7.642 -4.796 -1.812 1.00 10.00 H new ATOM 0 HB2 LEU A 10 7.779 -6.974 -2.924 1.00 10.00 H new ATOM 0 HB3 LEU A 10 7.793 -7.808 -1.383 1.00 10.00 H new ATOM 0 HG LEU A 10 5.514 -7.019 -0.936 1.00 10.00 H new ATOM 0 HD11 LEU A 10 4.147 -6.136 -2.855 1.00 10.00 H new ATOM 0 HD12 LEU A 10 5.467 -5.027 -2.414 1.00 10.00 H new ATOM 0 HD13 LEU A 10 5.625 -6.074 -3.844 1.00 10.00 H new ATOM 0 HD21 LEU A 10 4.334 -8.465 -2.620 1.00 10.00 H new ATOM 0 HD22 LEU A 10 5.811 -8.474 -3.612 1.00 10.00 H new ATOM 0 HD23 LEU A 10 5.815 -9.235 -2.004 1.00 10.00 H new ATOM 152 N ASP A 11 7.640 -6.405 1.088 1.00 10.00 N ATOM 153 CA ASP A 11 7.124 -6.412 2.451 1.00 10.00 C ATOM 154 C ASP A 11 7.396 -5.078 3.158 1.00 10.00 C ATOM 155 O ASP A 11 6.452 -4.448 3.656 1.00 10.00 O ATOM 156 CB ASP A 11 7.679 -7.624 3.238 1.00 10.00 C ATOM 157 CG ASP A 11 7.075 -8.977 2.823 1.00 10.00 C ATOM 158 OD1 ASP A 11 5.893 -8.988 2.397 1.00 10.00 O ATOM 159 OD2 ASP A 11 7.774 -10.003 2.986 1.00 10.00 O ATOM 0 H ASP A 11 8.282 -7.175 0.901 1.00 10.00 H new ATOM 0 HA ASP A 11 6.040 -6.523 2.410 1.00 10.00 H new ATOM 0 HB2 ASP A 11 8.760 -7.665 3.104 1.00 10.00 H new ATOM 0 HB3 ASP A 11 7.495 -7.468 4.301 1.00 10.00 H new ATOM 164 N GLN A 12 8.642 -4.592 3.143 1.00 10.00 N ATOM 165 CA GLN A 12 8.938 -3.285 3.728 1.00 10.00 C ATOM 166 C GLN A 12 8.285 -2.133 2.950 1.00 10.00 C ATOM 167 O GLN A 12 7.878 -1.149 3.584 1.00 10.00 O ATOM 168 CB GLN A 12 10.456 -3.124 3.982 1.00 10.00 C ATOM 169 CG GLN A 12 11.349 -2.995 2.744 1.00 10.00 C ATOM 170 CD GLN A 12 11.445 -1.597 2.150 1.00 10.00 C ATOM 171 OE1 GLN A 12 11.924 -0.652 2.759 1.00 10.00 O ATOM 172 NE2 GLN A 12 11.037 -1.427 0.909 1.00 10.00 N ATOM 0 H GLN A 12 9.445 -5.074 2.740 1.00 10.00 H new ATOM 0 HA GLN A 12 8.470 -3.232 4.711 1.00 10.00 H new ATOM 0 HB2 GLN A 12 10.606 -2.241 4.603 1.00 10.00 H new ATOM 0 HB3 GLN A 12 10.798 -3.982 4.560 1.00 10.00 H new ATOM 0 HG2 GLN A 12 12.353 -3.330 3.005 1.00 10.00 H new ATOM 0 HG3 GLN A 12 10.976 -3.673 1.976 1.00 10.00 H new ATOM 0 HE21 GLN A 12 10.636 -2.210 0.392 1.00 10.00 H new ATOM 0 HE22 GLN A 12 11.122 -0.513 0.465 1.00 10.00 H new ATOM 181 N LEU A 13 8.090 -2.258 1.625 1.00 10.00 N ATOM 182 CA LEU A 13 7.430 -1.215 0.845 1.00 10.00 C ATOM 183 C LEU A 13 5.923 -1.189 1.062 1.00 10.00 C ATOM 184 O LEU A 13 5.396 -0.102 1.255 1.00 10.00 O ATOM 185 CB LEU A 13 7.773 -1.270 -0.656 1.00 10.00 C ATOM 186 CG LEU A 13 8.667 -0.083 -1.048 1.00 10.00 C ATOM 187 CD1 LEU A 13 9.389 -0.247 -2.379 1.00 10.00 C ATOM 188 CD2 LEU A 13 7.858 1.208 -1.114 1.00 10.00 C ATOM 0 H LEU A 13 8.381 -3.070 1.081 1.00 10.00 H new ATOM 0 HA LEU A 13 7.833 -0.277 1.226 1.00 10.00 H new ATOM 0 HB2 LEU A 13 8.281 -2.207 -0.885 1.00 10.00 H new ATOM 0 HB3 LEU A 13 6.856 -1.253 -1.245 1.00 10.00 H new ATOM 0 HG LEU A 13 9.423 -0.043 -0.264 1.00 10.00 H new ATOM 0 HD11 LEU A 13 9.996 0.637 -2.575 1.00 10.00 H new ATOM 0 HD12 LEU A 13 10.031 -1.127 -2.339 1.00 10.00 H new ATOM 0 HD13 LEU A 13 8.657 -0.369 -3.177 1.00 10.00 H new ATOM 0 HD21 LEU A 13 8.513 2.034 -1.393 1.00 10.00 H new ATOM 0 HD22 LEU A 13 7.067 1.104 -1.857 1.00 10.00 H new ATOM 0 HD23 LEU A 13 7.415 1.410 -0.139 1.00 10.00 H new ATOM 200 N HIS A 14 5.199 -2.318 1.056 1.00 10.00 N ATOM 201 CA HIS A 14 3.748 -2.267 1.296 1.00 10.00 C ATOM 202 C HIS A 14 3.452 -1.873 2.741 1.00 10.00 C ATOM 203 O HIS A 14 2.419 -1.241 2.974 1.00 10.00 O ATOM 204 CB HIS A 14 3.007 -3.525 0.830 1.00 10.00 C ATOM 205 CG HIS A 14 3.301 -4.828 1.524 1.00 10.00 C ATOM 206 ND1 HIS A 14 3.644 -5.997 0.858 1.00 10.00 N ATOM 207 CD2 HIS A 14 3.119 -5.114 2.847 1.00 10.00 C ATOM 208 CE1 HIS A 14 3.666 -6.972 1.778 1.00 10.00 C ATOM 209 NE2 HIS A 14 3.377 -6.462 2.984 1.00 10.00 N ATOM 0 H HIS A 14 5.578 -3.251 0.893 1.00 10.00 H new ATOM 0 HA HIS A 14 3.341 -1.478 0.663 1.00 10.00 H new ATOM 0 HB2 HIS A 14 1.938 -3.334 0.922 1.00 10.00 H new ATOM 0 HB3 HIS A 14 3.216 -3.660 -0.231 1.00 10.00 H new ATOM 0 HD2 HIS A 14 2.832 -4.425 3.627 1.00 10.00 H new ATOM 0 HE1 HIS A 14 3.884 -8.011 1.578 1.00 10.00 H new ATOM 0 HE2 HIS A 14 3.352 -6.985 3.859 1.00 10.00 H new ATOM 217 N THR A 15 4.373 -2.165 3.666 1.00 10.00 N ATOM 218 CA THR A 15 4.348 -1.661 5.042 1.00 10.00 C ATOM 219 C THR A 15 4.465 -0.145 5.032 1.00 10.00 C ATOM 220 O THR A 15 3.550 0.505 5.524 1.00 10.00 O ATOM 221 CB THR A 15 5.464 -2.271 5.910 1.00 10.00 C ATOM 222 OG1 THR A 15 5.410 -3.679 5.863 1.00 10.00 O ATOM 223 CG2 THR A 15 5.292 -1.894 7.382 1.00 10.00 C ATOM 0 H THR A 15 5.172 -2.770 3.475 1.00 10.00 H new ATOM 0 HA THR A 15 3.398 -1.959 5.485 1.00 10.00 H new ATOM 0 HB THR A 15 6.406 -1.888 5.517 1.00 10.00 H new ATOM 0 HG1 THR A 15 6.028 -4.007 5.177 1.00 10.00 H new ATOM 0 HG21 THR A 15 6.095 -2.340 7.968 1.00 10.00 H new ATOM 0 HG22 THR A 15 5.326 -0.810 7.486 1.00 10.00 H new ATOM 0 HG23 THR A 15 4.332 -2.263 7.742 1.00 10.00 H new ATOM 231 N LEU A 16 5.509 0.439 4.423 1.00 10.00 N ATOM 232 CA LEU A 16 5.625 1.887 4.193 1.00 10.00 C ATOM 233 C LEU A 16 4.328 2.449 3.607 1.00 10.00 C ATOM 234 O LEU A 16 3.753 3.386 4.153 1.00 10.00 O ATOM 235 CB LEU A 16 6.826 2.169 3.262 1.00 10.00 C ATOM 236 CG LEU A 16 6.996 3.656 2.871 1.00 10.00 C ATOM 237 CD1 LEU A 16 7.884 4.407 3.867 1.00 10.00 C ATOM 238 CD2 LEU A 16 7.608 3.741 1.468 1.00 10.00 C ATOM 0 H LEU A 16 6.308 -0.089 4.072 1.00 10.00 H new ATOM 0 HA LEU A 16 5.797 2.387 5.146 1.00 10.00 H new ATOM 0 HB2 LEU A 16 7.738 1.828 3.752 1.00 10.00 H new ATOM 0 HB3 LEU A 16 6.712 1.578 2.353 1.00 10.00 H new ATOM 0 HG LEU A 16 6.013 4.126 2.885 1.00 10.00 H new ATOM 0 HD11 LEU A 16 7.979 5.448 3.557 1.00 10.00 H new ATOM 0 HD12 LEU A 16 7.435 4.363 4.859 1.00 10.00 H new ATOM 0 HD13 LEU A 16 8.871 3.945 3.894 1.00 10.00 H new ATOM 0 HD21 LEU A 16 7.730 4.787 1.187 1.00 10.00 H new ATOM 0 HD22 LEU A 16 8.580 3.248 1.465 1.00 10.00 H new ATOM 0 HD23 LEU A 16 6.949 3.248 0.753 1.00 10.00 H new ATOM 250 N LEU A 17 3.835 1.862 2.518 1.00 10.00 N ATOM 251 CA LEU A 17 2.659 2.307 1.773 1.00 10.00 C ATOM 252 C LEU A 17 1.329 2.171 2.522 1.00 10.00 C ATOM 253 O LEU A 17 0.323 2.701 2.059 1.00 10.00 O ATOM 254 CB LEU A 17 2.674 1.584 0.403 1.00 10.00 C ATOM 255 CG LEU A 17 2.574 2.438 -0.880 1.00 10.00 C ATOM 256 CD1 LEU A 17 3.284 3.770 -0.797 1.00 10.00 C ATOM 257 CD2 LEU A 17 3.213 1.676 -2.040 1.00 10.00 C ATOM 0 H LEU A 17 4.262 1.028 2.114 1.00 10.00 H new ATOM 0 HA LEU A 17 2.726 3.385 1.630 1.00 10.00 H new ATOM 0 HB2 LEU A 17 3.595 1.003 0.344 1.00 10.00 H new ATOM 0 HB3 LEU A 17 1.848 0.873 0.394 1.00 10.00 H new ATOM 0 HG LEU A 17 1.510 2.628 -1.021 1.00 10.00 H new ATOM 0 HD11 LEU A 17 3.164 4.305 -1.739 1.00 10.00 H new ATOM 0 HD12 LEU A 17 2.856 4.361 0.013 1.00 10.00 H new ATOM 0 HD13 LEU A 17 4.344 3.606 -0.605 1.00 10.00 H new ATOM 0 HD21 LEU A 17 3.146 2.274 -2.949 1.00 10.00 H new ATOM 0 HD22 LEU A 17 4.261 1.478 -1.812 1.00 10.00 H new ATOM 0 HD23 LEU A 17 2.689 0.731 -2.187 1.00 10.00 H new ATOM 269 N SER A 18 1.307 1.503 3.683 1.00 10.00 N ATOM 270 CA SER A 18 0.056 1.136 4.371 1.00 10.00 C ATOM 271 C SER A 18 0.158 1.227 5.909 1.00 10.00 C ATOM 272 O SER A 18 -0.732 0.758 6.630 1.00 10.00 O ATOM 273 CB SER A 18 -0.354 -0.278 3.943 1.00 10.00 C ATOM 274 OG SER A 18 -0.074 -0.546 2.578 1.00 10.00 O ATOM 0 H SER A 18 2.150 1.202 4.172 1.00 10.00 H new ATOM 0 HA SER A 18 -0.705 1.859 4.077 1.00 10.00 H new ATOM 0 HB2 SER A 18 0.167 -1.006 4.565 1.00 10.00 H new ATOM 0 HB3 SER A 18 -1.421 -0.411 4.123 1.00 10.00 H new ATOM 0 HG SER A 18 0.776 -1.028 2.507 1.00 10.00 H new ATOM 280 N ASN A 19 1.225 1.886 6.382 1.00 10.00 N ATOM 281 CA ASN A 19 1.797 2.037 7.725 1.00 10.00 C ATOM 282 C ASN A 19 0.865 2.438 8.894 1.00 10.00 C ATOM 283 O ASN A 19 1.338 2.486 10.031 1.00 10.00 O ATOM 284 CB ASN A 19 2.948 3.049 7.573 1.00 10.00 C ATOM 285 CG ASN A 19 2.415 4.444 7.265 1.00 10.00 C ATOM 286 OD1 ASN A 19 1.726 5.068 8.054 1.00 10.00 O ATOM 287 ND2 ASN A 19 2.669 4.951 6.081 1.00 10.00 N ATOM 0 H ASN A 19 1.797 2.409 5.719 1.00 10.00 H new ATOM 0 HA ASN A 19 2.097 1.038 8.043 1.00 10.00 H new ATOM 0 HB2 ASN A 19 3.537 3.075 8.490 1.00 10.00 H new ATOM 0 HB3 ASN A 19 3.616 2.727 6.774 1.00 10.00 H new ATOM 0 HD21 ASN A 19 2.291 5.863 5.825 1.00 10.00 H new ATOM 0 HD22 ASN A 19 3.245 4.433 5.417 1.00 10.00 H new ATOM 294 N THR A 20 -0.406 2.751 8.608 1.00 10.00 N ATOM 295 CA THR A 20 -1.552 3.209 9.426 1.00 10.00 C ATOM 296 C THR A 20 -1.980 4.658 9.129 1.00 10.00 C ATOM 297 O THR A 20 -3.117 5.007 9.432 1.00 10.00 O ATOM 298 CB THR A 20 -1.481 2.975 10.941 1.00 10.00 C ATOM 299 OG1 THR A 20 -0.382 3.613 11.536 1.00 10.00 O ATOM 300 CG2 THR A 20 -1.458 1.481 11.295 1.00 10.00 C ATOM 0 H THR A 20 -0.706 2.677 7.636 1.00 10.00 H new ATOM 0 HA THR A 20 -2.327 2.524 9.081 1.00 10.00 H new ATOM 0 HB THR A 20 -2.392 3.418 11.344 1.00 10.00 H new ATOM 0 HG1 THR A 20 0.442 3.331 11.087 1.00 10.00 H new ATOM 0 HG21 THR A 20 -1.407 1.364 12.378 1.00 10.00 H new ATOM 0 HG22 THR A 20 -2.364 1.004 10.921 1.00 10.00 H new ATOM 0 HG23 THR A 20 -0.586 1.012 10.839 1.00 10.00 H new ATOM 308 N ASP A 21 -1.141 5.473 8.474 1.00 10.00 N ATOM 309 CA ASP A 21 -1.523 6.806 7.979 1.00 10.00 C ATOM 310 C ASP A 21 -2.677 6.765 6.943 1.00 10.00 C ATOM 311 O ASP A 21 -3.044 5.723 6.398 1.00 10.00 O ATOM 312 CB ASP A 21 -0.260 7.519 7.428 1.00 10.00 C ATOM 313 CG ASP A 21 -0.516 8.915 6.825 1.00 10.00 C ATOM 314 OD1 ASP A 21 -1.268 9.708 7.457 1.00 10.00 O ATOM 315 OD2 ASP A 21 -0.062 9.163 5.680 1.00 10.00 O ATOM 0 H ASP A 21 -0.172 5.226 8.271 1.00 10.00 H new ATOM 0 HA ASP A 21 -1.924 7.380 8.814 1.00 10.00 H new ATOM 0 HB2 ASP A 21 0.467 7.615 8.235 1.00 10.00 H new ATOM 0 HB3 ASP A 21 0.193 6.887 6.665 1.00 10.00 H new ATOM 320 N ALA A 22 -3.249 7.942 6.698 1.00 10.00 N ATOM 321 CA ALA A 22 -4.200 8.267 5.634 1.00 10.00 C ATOM 322 C ALA A 22 -4.031 9.691 5.041 1.00 10.00 C ATOM 323 O ALA A 22 -4.601 9.985 3.994 1.00 10.00 O ATOM 324 CB ALA A 22 -5.628 8.094 6.180 1.00 10.00 C ATOM 0 H ALA A 22 -3.046 8.754 7.280 1.00 10.00 H new ATOM 0 HA ALA A 22 -4.001 7.581 4.811 1.00 10.00 H new ATOM 0 HB1 ALA A 22 -6.348 8.333 5.397 1.00 10.00 H new ATOM 0 HB2 ALA A 22 -5.772 7.063 6.503 1.00 10.00 H new ATOM 0 HB3 ALA A 22 -5.777 8.763 7.027 1.00 10.00 H new ATOM 330 N THR A 23 -3.208 10.559 5.648 1.00 10.00 N ATOM 331 CA THR A 23 -3.072 12.006 5.411 1.00 10.00 C ATOM 332 C THR A 23 -2.968 12.452 3.959 1.00 10.00 C ATOM 333 O THR A 23 -3.719 13.334 3.550 1.00 10.00 O ATOM 334 CB THR A 23 -1.912 12.576 6.252 1.00 10.00 C ATOM 335 OG1 THR A 23 -1.947 12.099 7.576 1.00 10.00 O ATOM 336 CG2 THR A 23 -1.952 14.105 6.331 1.00 10.00 C ATOM 0 H THR A 23 -2.568 10.243 6.377 1.00 10.00 H new ATOM 0 HA THR A 23 -4.025 12.425 5.735 1.00 10.00 H new ATOM 0 HB THR A 23 -1.003 12.248 5.747 1.00 10.00 H new ATOM 0 HG1 THR A 23 -1.271 11.399 7.689 1.00 10.00 H new ATOM 0 HG21 THR A 23 -1.116 14.460 6.933 1.00 10.00 H new ATOM 0 HG22 THR A 23 -1.879 14.523 5.327 1.00 10.00 H new ATOM 0 HG23 THR A 23 -2.889 14.421 6.789 1.00 10.00 H new ATOM 344 N GLY A 24 -2.038 11.893 3.185 1.00 10.00 N ATOM 345 CA GLY A 24 -1.988 12.059 1.724 1.00 10.00 C ATOM 346 C GLY A 24 -2.202 10.753 0.963 1.00 10.00 C ATOM 347 O GLY A 24 -2.408 10.747 -0.253 1.00 10.00 O ATOM 0 H GLY A 24 -1.289 11.306 3.553 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -2.749 12.778 1.420 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -1.022 12.480 1.445 1.00 10.00 H new ATOM 351 N LEU A 25 -2.188 9.641 1.695 1.00 10.00 N ATOM 352 CA LEU A 25 -2.593 8.328 1.218 1.00 10.00 C ATOM 353 C LEU A 25 -4.036 8.330 0.698 1.00 10.00 C ATOM 354 O LEU A 25 -4.327 7.613 -0.267 1.00 10.00 O ATOM 355 CB LEU A 25 -2.364 7.359 2.388 1.00 10.00 C ATOM 356 CG LEU A 25 -0.930 6.848 2.633 1.00 10.00 C ATOM 357 CD1 LEU A 25 -0.898 6.079 3.954 1.00 10.00 C ATOM 358 CD2 LEU A 25 -0.532 5.850 1.543 1.00 10.00 C ATOM 0 H LEU A 25 -1.884 9.633 2.668 1.00 10.00 H new ATOM 0 HA LEU A 25 -2.004 8.014 0.356 1.00 10.00 H new ATOM 0 HB2 LEU A 25 -2.704 7.850 3.300 1.00 10.00 H new ATOM 0 HB3 LEU A 25 -3.006 6.492 2.234 1.00 10.00 H new ATOM 0 HG LEU A 25 -0.255 7.704 2.640 1.00 10.00 H new ATOM 0 HD11 LEU A 25 0.112 5.713 4.137 1.00 10.00 H new ATOM 0 HD12 LEU A 25 -1.198 6.740 4.767 1.00 10.00 H new ATOM 0 HD13 LEU A 25 -1.586 5.235 3.900 1.00 10.00 H new ATOM 0 HD21 LEU A 25 0.482 5.496 1.727 1.00 10.00 H new ATOM 0 HD22 LEU A 25 -1.219 5.004 1.556 1.00 10.00 H new ATOM 0 HD23 LEU A 25 -0.575 6.338 0.569 1.00 10.00 H new ATOM 370 N GLU A 26 -4.894 9.182 1.280 1.00 10.00 N ATOM 371 CA GLU A 26 -6.277 9.469 0.892 1.00 10.00 C ATOM 372 C GLU A 26 -6.528 9.609 -0.608 1.00 10.00 C ATOM 373 O GLU A 26 -7.373 8.891 -1.144 1.00 10.00 O ATOM 374 CB GLU A 26 -6.793 10.674 1.714 1.00 10.00 C ATOM 375 CG GLU A 26 -5.917 11.952 1.743 1.00 10.00 C ATOM 376 CD GLU A 26 -6.208 12.960 0.632 1.00 10.00 C ATOM 377 OE1 GLU A 26 -7.386 13.368 0.512 1.00 10.00 O ATOM 378 OE2 GLU A 26 -5.284 13.308 -0.143 1.00 10.00 O ATOM 0 H GLU A 26 -4.615 9.728 2.095 1.00 10.00 H new ATOM 0 HA GLU A 26 -6.863 8.583 1.136 1.00 10.00 H new ATOM 0 HB2 GLU A 26 -7.775 10.948 1.327 1.00 10.00 H new ATOM 0 HB3 GLU A 26 -6.937 10.342 2.742 1.00 10.00 H new ATOM 0 HG2 GLU A 26 -6.053 12.446 2.705 1.00 10.00 H new ATOM 0 HG3 GLU A 26 -4.869 11.658 1.681 1.00 10.00 H new ATOM 385 N GLU A 27 -5.781 10.462 -1.324 1.00 10.00 N ATOM 386 CA GLU A 27 -5.927 10.625 -2.778 1.00 10.00 C ATOM 387 C GLU A 27 -5.684 9.325 -3.538 1.00 10.00 C ATOM 388 O GLU A 27 -6.450 8.950 -4.429 1.00 10.00 O ATOM 389 CB GLU A 27 -4.923 11.672 -3.253 1.00 10.00 C ATOM 390 CG GLU A 27 -5.160 12.238 -4.664 1.00 10.00 C ATOM 391 CD GLU A 27 -6.385 13.156 -4.677 1.00 10.00 C ATOM 392 OE1 GLU A 27 -6.308 14.262 -4.089 1.00 10.00 O ATOM 393 OE2 GLU A 27 -7.459 12.710 -5.137 1.00 10.00 O ATOM 0 H GLU A 27 -5.061 11.056 -0.913 1.00 10.00 H new ATOM 0 HA GLU A 27 -6.952 10.935 -2.979 1.00 10.00 H new ATOM 0 HB2 GLU A 27 -4.928 12.500 -2.545 1.00 10.00 H new ATOM 0 HB3 GLU A 27 -3.926 11.232 -3.222 1.00 10.00 H new ATOM 0 HG2 GLU A 27 -4.280 12.792 -4.992 1.00 10.00 H new ATOM 0 HG3 GLU A 27 -5.304 11.420 -5.370 1.00 10.00 H new ATOM 400 N ILE A 28 -4.601 8.641 -3.174 1.00 10.00 N ATOM 401 CA ILE A 28 -4.138 7.437 -3.840 1.00 10.00 C ATOM 402 C ILE A 28 -5.146 6.306 -3.606 1.00 10.00 C ATOM 403 O ILE A 28 -5.397 5.498 -4.501 1.00 10.00 O ATOM 404 CB ILE A 28 -2.739 7.046 -3.325 1.00 10.00 C ATOM 405 CG1 ILE A 28 -1.769 8.235 -3.089 1.00 10.00 C ATOM 406 CG2 ILE A 28 -2.090 6.067 -4.318 1.00 10.00 C ATOM 407 CD1 ILE A 28 -0.601 7.819 -2.198 1.00 10.00 C ATOM 0 H ILE A 28 -4.011 8.919 -2.389 1.00 10.00 H new ATOM 0 HA ILE A 28 -4.060 7.621 -4.912 1.00 10.00 H new ATOM 0 HB ILE A 28 -2.903 6.593 -2.347 1.00 10.00 H new ATOM 0 HG12 ILE A 28 -1.391 8.596 -4.045 1.00 10.00 H new ATOM 0 HG13 ILE A 28 -2.307 9.062 -2.626 1.00 10.00 H new ATOM 0 HG21 ILE A 28 -1.100 5.787 -3.958 1.00 10.00 H new ATOM 0 HG22 ILE A 28 -2.710 5.175 -4.407 1.00 10.00 H new ATOM 0 HG23 ILE A 28 -2.000 6.545 -5.294 1.00 10.00 H new ATOM 0 HD11 ILE A 28 0.064 8.670 -2.048 1.00 10.00 H new ATOM 0 HD12 ILE A 28 -0.981 7.481 -1.234 1.00 10.00 H new ATOM 0 HD13 ILE A 28 -0.050 7.008 -2.675 1.00 10.00 H new ATOM 419 N ASP A 29 -5.755 6.245 -2.414 1.00 10.00 N ATOM 420 CA ASP A 29 -6.754 5.220 -2.112 1.00 10.00 C ATOM 421 C ASP A 29 -8.142 5.545 -2.677 1.00 10.00 C ATOM 422 O ASP A 29 -8.791 4.610 -3.149 1.00 10.00 O ATOM 423 CB ASP A 29 -6.705 4.865 -0.642 1.00 10.00 C ATOM 424 CG ASP A 29 -7.266 5.873 0.339 1.00 10.00 C ATOM 425 OD1 ASP A 29 -8.504 5.994 0.454 1.00 10.00 O ATOM 426 OD2 ASP A 29 -6.455 6.328 1.178 1.00 10.00 O ATOM 0 H ASP A 29 -5.572 6.893 -1.648 1.00 10.00 H new ATOM 0 HA ASP A 29 -6.498 4.305 -2.647 1.00 10.00 H new ATOM 0 HB2 ASP A 29 -7.242 3.927 -0.504 1.00 10.00 H new ATOM 0 HB3 ASP A 29 -5.665 4.679 -0.375 1.00 10.00 H new ATOM 431 N ARG A 30 -8.559 6.826 -2.769 1.00 10.00 N ATOM 432 CA ARG A 30 -9.779 7.148 -3.523 1.00 10.00 C ATOM 433 C ARG A 30 -9.579 6.901 -5.027 1.00 10.00 C ATOM 434 O ARG A 30 -10.490 6.373 -5.650 1.00 10.00 O ATOM 435 CB ARG A 30 -10.353 8.543 -3.202 1.00 10.00 C ATOM 436 CG ARG A 30 -9.515 9.731 -3.659 1.00 10.00 C ATOM 437 CD ARG A 30 -10.255 11.061 -3.440 1.00 10.00 C ATOM 438 NE ARG A 30 -9.304 12.176 -3.271 1.00 10.00 N ATOM 439 CZ ARG A 30 -8.855 12.670 -2.124 1.00 10.00 C ATOM 440 NH1 ARG A 30 -9.225 12.199 -0.961 1.00 10.00 N ATOM 441 NH2 ARG A 30 -7.955 13.624 -2.082 1.00 10.00 N ATOM 0 H ARG A 30 -8.086 7.625 -2.346 1.00 10.00 H new ATOM 0 HA ARG A 30 -10.552 6.458 -3.185 1.00 10.00 H new ATOM 0 HB2 ARG A 30 -11.339 8.622 -3.659 1.00 10.00 H new ATOM 0 HB3 ARG A 30 -10.494 8.617 -2.124 1.00 10.00 H new ATOM 0 HG2 ARG A 30 -8.572 9.744 -3.112 1.00 10.00 H new ATOM 0 HG3 ARG A 30 -9.270 9.620 -4.715 1.00 10.00 H new ATOM 0 HD2 ARG A 30 -10.908 11.262 -4.289 1.00 10.00 H new ATOM 0 HD3 ARG A 30 -10.892 10.986 -2.559 1.00 10.00 H new ATOM 0 HE ARG A 30 -8.955 12.613 -4.124 1.00 10.00 H new ATOM 0 HH11 ARG A 30 -9.884 11.422 -0.912 1.00 10.00 H new ATOM 0 HH12 ARG A 30 -8.855 12.609 -0.104 1.00 10.00 H new ATOM 0 HH21 ARG A 30 -7.579 14.009 -2.949 1.00 10.00 H new ATOM 0 HH22 ARG A 30 -7.632 13.981 -1.183 1.00 10.00 H new ATOM 455 N ALA A 31 -8.383 7.152 -5.578 1.00 10.00 N ATOM 456 CA ALA A 31 -8.015 6.797 -6.961 1.00 10.00 C ATOM 457 C ALA A 31 -8.087 5.287 -7.254 1.00 10.00 C ATOM 458 O ALA A 31 -8.173 4.908 -8.418 1.00 10.00 O ATOM 459 CB ALA A 31 -6.635 7.375 -7.291 1.00 10.00 C ATOM 0 H ALA A 31 -7.630 7.615 -5.069 1.00 10.00 H new ATOM 0 HA ALA A 31 -8.761 7.244 -7.618 1.00 10.00 H new ATOM 0 HB1 ALA A 31 -6.365 7.111 -8.314 1.00 10.00 H new ATOM 0 HB2 ALA A 31 -6.662 8.460 -7.191 1.00 10.00 H new ATOM 0 HB3 ALA A 31 -5.895 6.965 -6.603 1.00 10.00 H new ATOM 465 N LEU A 32 -8.059 4.431 -6.223 1.00 10.00 N ATOM 466 CA LEU A 32 -8.189 2.971 -6.318 1.00 10.00 C ATOM 467 C LEU A 32 -9.489 2.447 -5.667 1.00 10.00 C ATOM 468 O LEU A 32 -9.657 1.243 -5.488 1.00 10.00 O ATOM 469 CB LEU A 32 -6.907 2.309 -5.778 1.00 10.00 C ATOM 470 CG LEU A 32 -5.611 2.760 -6.475 1.00 10.00 C ATOM 471 CD1 LEU A 32 -4.415 2.219 -5.691 1.00 10.00 C ATOM 472 CD2 LEU A 32 -5.527 2.262 -7.914 1.00 10.00 C ATOM 0 H LEU A 32 -7.940 4.750 -5.262 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.289 2.689 -7.366 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -6.824 2.523 -4.712 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -7.001 1.228 -5.880 1.00 10.00 H new ATOM 0 HG LEU A 32 -5.606 3.850 -6.500 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -3.490 2.532 -6.176 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -4.441 2.608 -4.673 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -4.460 1.130 -5.664 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -4.596 2.605 -8.364 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -5.555 1.172 -7.924 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -6.371 2.652 -8.484 1.00 10.00 H new ATOM 484 N GLY A 33 -10.426 3.344 -5.327 1.00 10.00 N ATOM 485 CA GLY A 33 -11.761 3.018 -4.812 1.00 10.00 C ATOM 486 C GLY A 33 -11.812 2.391 -3.409 1.00 10.00 C ATOM 487 O GLY A 33 -12.879 1.956 -2.978 1.00 10.00 O ATOM 0 H GLY A 33 -10.269 4.349 -5.406 1.00 10.00 H new ATOM 0 HA2 GLY A 33 -12.357 3.931 -4.801 1.00 10.00 H new ATOM 0 HA3 GLY A 33 -12.240 2.333 -5.511 1.00 10.00 H new ATOM 491 N ILE A 34 -10.683 2.335 -2.694 1.00 10.00 N ATOM 492 CA ILE A 34 -10.503 1.619 -1.413 1.00 10.00 C ATOM 493 C ILE A 34 -11.568 1.993 -0.354 1.00 10.00 C ATOM 494 O ILE A 34 -12.163 1.067 0.204 1.00 10.00 O ATOM 495 CB ILE A 34 -9.034 1.704 -0.934 1.00 10.00 C ATOM 496 CG1 ILE A 34 -8.079 1.303 -2.082 1.00 10.00 C ATOM 497 CG2 ILE A 34 -8.762 0.847 0.317 1.00 10.00 C ATOM 498 CD1 ILE A 34 -6.606 1.145 -1.719 1.00 10.00 C ATOM 0 H ILE A 34 -9.831 2.805 -2.999 1.00 10.00 H new ATOM 0 HA ILE A 34 -10.692 0.560 -1.586 1.00 10.00 H new ATOM 0 HB ILE A 34 -8.849 2.740 -0.649 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -8.429 0.361 -2.504 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -8.158 2.053 -2.869 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -7.716 0.947 0.606 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -9.398 1.185 1.135 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -8.979 -0.198 0.096 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -6.041 0.863 -2.607 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -6.224 2.089 -1.330 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -6.499 0.370 -0.960 1.00 10.00 H new ATOM 510 N PRO A 35 -11.905 3.275 -0.102 1.00 10.00 N ATOM 511 CA PRO A 35 -13.009 3.644 0.799 1.00 10.00 C ATOM 512 C PRO A 35 -14.376 3.089 0.364 1.00 10.00 C ATOM 513 O PRO A 35 -15.161 2.686 1.221 1.00 10.00 O ATOM 514 CB PRO A 35 -13.038 5.180 0.819 1.00 10.00 C ATOM 515 CG PRO A 35 -11.618 5.567 0.413 1.00 10.00 C ATOM 516 CD PRO A 35 -11.241 4.479 -0.590 1.00 10.00 C ATOM 0 HA PRO A 35 -12.833 3.211 1.784 1.00 10.00 H new ATOM 0 HB2 PRO A 35 -13.777 5.577 0.123 1.00 10.00 H new ATOM 0 HB3 PRO A 35 -13.292 5.564 1.807 1.00 10.00 H new ATOM 0 HG2 PRO A 35 -11.583 6.560 -0.036 1.00 10.00 H new ATOM 0 HG3 PRO A 35 -10.943 5.579 1.268 1.00 10.00 H new ATOM 0 HD2 PRO A 35 -11.575 4.735 -1.595 1.00 10.00 H new ATOM 0 HD3 PRO A 35 -10.161 4.343 -0.638 1.00 10.00 H new ATOM 524 N GLU A 36 -14.671 3.070 -0.939 1.00 10.00 N ATOM 525 CA GLU A 36 -15.910 2.491 -1.464 1.00 10.00 C ATOM 526 C GLU A 36 -15.921 0.976 -1.279 1.00 10.00 C ATOM 527 O GLU A 36 -16.886 0.415 -0.773 1.00 10.00 O ATOM 528 CB GLU A 36 -16.110 2.883 -2.941 1.00 10.00 C ATOM 529 CG GLU A 36 -17.448 3.595 -3.178 1.00 10.00 C ATOM 530 CD GLU A 36 -18.654 2.732 -2.779 1.00 10.00 C ATOM 531 OE1 GLU A 36 -19.011 1.848 -3.584 1.00 10.00 O ATOM 532 OE2 GLU A 36 -19.159 2.937 -1.655 1.00 10.00 O ATOM 0 H GLU A 36 -14.059 3.455 -1.658 1.00 10.00 H new ATOM 0 HA GLU A 36 -16.748 2.897 -0.898 1.00 10.00 H new ATOM 0 HB2 GLU A 36 -15.294 3.534 -3.256 1.00 10.00 H new ATOM 0 HB3 GLU A 36 -16.062 1.988 -3.562 1.00 10.00 H new ATOM 0 HG2 GLU A 36 -17.467 4.524 -2.609 1.00 10.00 H new ATOM 0 HG3 GLU A 36 -17.531 3.864 -4.231 1.00 10.00 H new ATOM 539 N LEU A 37 -14.814 0.302 -1.620 1.00 10.00 N ATOM 540 CA LEU A 37 -14.625 -1.129 -1.386 1.00 10.00 C ATOM 541 C LEU A 37 -14.847 -1.505 0.095 1.00 10.00 C ATOM 542 O LEU A 37 -15.536 -2.486 0.381 1.00 10.00 O ATOM 543 CB LEU A 37 -13.229 -1.552 -1.884 1.00 10.00 C ATOM 544 CG LEU A 37 -13.064 -1.501 -3.417 1.00 10.00 C ATOM 545 CD1 LEU A 37 -11.566 -1.581 -3.765 1.00 10.00 C ATOM 546 CD2 LEU A 37 -13.810 -2.657 -4.107 1.00 10.00 C ATOM 0 H LEU A 37 -14.015 0.746 -2.073 1.00 10.00 H new ATOM 0 HA LEU A 37 -15.378 -1.677 -1.952 1.00 10.00 H new ATOM 0 HB2 LEU A 37 -12.481 -0.904 -1.427 1.00 10.00 H new ATOM 0 HB3 LEU A 37 -13.025 -2.566 -1.541 1.00 10.00 H new ATOM 0 HG LEU A 37 -13.491 -0.564 -3.775 1.00 10.00 H new ATOM 0 HD11 LEU A 37 -11.441 -1.546 -4.847 1.00 10.00 H new ATOM 0 HD12 LEU A 37 -11.042 -0.740 -3.312 1.00 10.00 H new ATOM 0 HD13 LEU A 37 -11.153 -2.514 -3.383 1.00 10.00 H new ATOM 0 HD21 LEU A 37 -13.671 -2.588 -5.186 1.00 10.00 H new ATOM 0 HD22 LEU A 37 -13.416 -3.609 -3.751 1.00 10.00 H new ATOM 0 HD23 LEU A 37 -14.873 -2.595 -3.874 1.00 10.00 H new ATOM 558 N VAL A 38 -14.346 -0.693 1.039 1.00 10.00 N ATOM 559 CA VAL A 38 -14.621 -0.846 2.482 1.00 10.00 C ATOM 560 C VAL A 38 -16.119 -0.689 2.780 1.00 10.00 C ATOM 561 O VAL A 38 -16.685 -1.545 3.447 1.00 10.00 O ATOM 562 CB VAL A 38 -13.752 0.124 3.306 1.00 10.00 C ATOM 563 CG1 VAL A 38 -14.104 0.159 4.798 1.00 10.00 C ATOM 564 CG2 VAL A 38 -12.277 -0.239 3.177 1.00 10.00 C ATOM 0 H VAL A 38 -13.734 0.094 0.824 1.00 10.00 H new ATOM 0 HA VAL A 38 -14.348 -1.857 2.783 1.00 10.00 H new ATOM 0 HB VAL A 38 -13.956 1.112 2.892 1.00 10.00 H new ATOM 0 HG11 VAL A 38 -13.449 0.864 5.310 1.00 10.00 H new ATOM 0 HG12 VAL A 38 -15.141 0.472 4.920 1.00 10.00 H new ATOM 0 HG13 VAL A 38 -13.972 -0.835 5.226 1.00 10.00 H new ATOM 0 HG21 VAL A 38 -11.678 0.456 3.765 1.00 10.00 H new ATOM 0 HG22 VAL A 38 -12.119 -1.254 3.543 1.00 10.00 H new ATOM 0 HG23 VAL A 38 -11.978 -0.180 2.131 1.00 10.00 H new ATOM 765 N SER B 51 12.428 -9.701 -9.661 1.00 10.00 N ATOM 766 CA SER B 51 12.330 -8.650 -8.657 1.00 10.00 C ATOM 767 C SER B 51 11.864 -7.354 -9.321 1.00 10.00 C ATOM 768 O SER B 51 12.668 -6.679 -9.964 1.00 10.00 O ATOM 769 CB SER B 51 13.649 -8.427 -7.925 1.00 10.00 C ATOM 770 OG SER B 51 14.071 -9.660 -7.398 1.00 10.00 O ATOM 0 HA SER B 51 11.602 -8.966 -7.910 1.00 10.00 H new ATOM 0 HB2 SER B 51 14.400 -8.028 -8.607 1.00 10.00 H new ATOM 0 HB3 SER B 51 13.522 -7.696 -7.127 1.00 10.00 H new ATOM 0 HG SER B 51 13.740 -10.388 -7.964 1.00 10.00 H new ATOM 776 N ILE B 52 10.580 -6.993 -9.156 1.00 10.00 N ATOM 777 CA ILE B 52 9.990 -5.799 -9.789 1.00 10.00 C ATOM 778 C ILE B 52 10.127 -4.544 -8.899 1.00 10.00 C ATOM 779 O ILE B 52 9.846 -3.446 -9.352 1.00 10.00 O ATOM 780 CB ILE B 52 8.510 -6.012 -10.228 1.00 10.00 C ATOM 781 CG1 ILE B 52 7.964 -7.447 -10.158 1.00 10.00 C ATOM 782 CG2 ILE B 52 8.392 -5.495 -11.675 1.00 10.00 C ATOM 783 CD1 ILE B 52 7.492 -7.870 -8.764 1.00 10.00 C ATOM 0 H ILE B 52 9.922 -7.519 -8.581 1.00 10.00 H new ATOM 0 HA ILE B 52 10.569 -5.631 -10.697 1.00 10.00 H new ATOM 0 HB ILE B 52 7.900 -5.468 -9.507 1.00 10.00 H new ATOM 0 HG12 ILE B 52 7.132 -7.542 -10.856 1.00 10.00 H new ATOM 0 HG13 ILE B 52 8.740 -8.136 -10.492 1.00 10.00 H new ATOM 0 HG21 ILE B 52 7.368 -5.625 -12.025 1.00 10.00 H new ATOM 0 HG22 ILE B 52 8.655 -4.438 -11.706 1.00 10.00 H new ATOM 0 HG23 ILE B 52 9.069 -6.056 -12.318 1.00 10.00 H new ATOM 0 HD11 ILE B 52 7.122 -8.895 -8.801 1.00 10.00 H new ATOM 0 HD12 ILE B 52 8.325 -7.810 -8.064 1.00 10.00 H new ATOM 0 HD13 ILE B 52 6.692 -7.207 -8.434 1.00 10.00 H new ATOM 795 N SER B 53 10.540 -4.688 -7.631 1.00 10.00 N ATOM 796 CA SER B 53 10.742 -3.573 -6.688 1.00 10.00 C ATOM 797 C SER B 53 12.163 -3.001 -6.505 1.00 10.00 C ATOM 798 O SER B 53 12.226 -1.993 -5.814 1.00 10.00 O ATOM 799 CB SER B 53 10.129 -3.869 -5.307 1.00 10.00 C ATOM 800 OG SER B 53 10.496 -5.151 -4.845 1.00 10.00 O ATOM 0 H SER B 53 10.747 -5.599 -7.223 1.00 10.00 H new ATOM 0 HA SER B 53 10.209 -2.776 -7.207 1.00 10.00 H new ATOM 0 HB2 SER B 53 10.458 -3.115 -4.592 1.00 10.00 H new ATOM 0 HB3 SER B 53 9.043 -3.799 -5.367 1.00 10.00 H new ATOM 0 HG SER B 53 9.691 -5.655 -4.605 1.00 10.00 H new ATOM 806 N PRO B 54 13.283 -3.469 -7.095 1.00 10.00 N ATOM 807 CA PRO B 54 14.606 -2.868 -6.825 1.00 10.00 C ATOM 808 C PRO B 54 14.737 -1.410 -7.305 1.00 10.00 C ATOM 809 O PRO B 54 15.608 -0.673 -6.837 1.00 10.00 O ATOM 810 CB PRO B 54 15.620 -3.805 -7.469 1.00 10.00 C ATOM 811 CG PRO B 54 14.824 -4.369 -8.635 1.00 10.00 C ATOM 812 CD PRO B 54 13.422 -4.519 -8.074 1.00 10.00 C ATOM 0 HA PRO B 54 14.775 -2.780 -5.752 1.00 10.00 H new ATOM 0 HB2 PRO B 54 16.513 -3.275 -7.801 1.00 10.00 H new ATOM 0 HB3 PRO B 54 15.949 -4.585 -6.783 1.00 10.00 H new ATOM 0 HG2 PRO B 54 14.842 -3.698 -9.494 1.00 10.00 H new ATOM 0 HG3 PRO B 54 15.226 -5.325 -8.969 1.00 10.00 H new ATOM 0 HD2 PRO B 54 12.673 -4.424 -8.860 1.00 10.00 H new ATOM 0 HD3 PRO B 54 13.284 -5.500 -7.619 1.00 10.00 H new ATOM 820 N SER B 55 13.858 -0.979 -8.215 1.00 10.00 N ATOM 821 CA SER B 55 13.678 0.418 -8.614 1.00 10.00 C ATOM 822 C SER B 55 12.795 1.161 -7.612 1.00 10.00 C ATOM 823 O SER B 55 13.212 2.179 -7.071 1.00 10.00 O ATOM 824 CB SER B 55 13.062 0.466 -10.021 1.00 10.00 C ATOM 825 OG SER B 55 11.920 -0.385 -10.047 1.00 10.00 O ATOM 0 H SER B 55 13.232 -1.615 -8.710 1.00 10.00 H new ATOM 0 HA SER B 55 14.649 0.914 -8.628 1.00 10.00 H new ATOM 0 HB2 SER B 55 12.778 1.487 -10.275 1.00 10.00 H new ATOM 0 HB3 SER B 55 13.791 0.143 -10.764 1.00 10.00 H new ATOM 0 HG SER B 55 11.516 -0.363 -10.939 1.00 10.00 H new ATOM 831 N ALA B 56 11.593 0.634 -7.326 1.00 10.00 N ATOM 832 CA ALA B 56 10.675 1.146 -6.306 1.00 10.00 C ATOM 833 C ALA B 56 11.316 1.284 -4.907 1.00 10.00 C ATOM 834 O ALA B 56 11.012 2.207 -4.154 1.00 10.00 O ATOM 835 CB ALA B 56 9.453 0.219 -6.270 1.00 10.00 C ATOM 0 H ALA B 56 11.227 -0.183 -7.814 1.00 10.00 H new ATOM 0 HA ALA B 56 10.387 2.161 -6.579 1.00 10.00 H new ATOM 0 HB1 ALA B 56 8.749 0.575 -5.518 1.00 10.00 H new ATOM 0 HB2 ALA B 56 8.970 0.216 -7.247 1.00 10.00 H new ATOM 0 HB3 ALA B 56 9.771 -0.793 -6.019 1.00 10.00 H new ATOM 841 N LEU B 57 12.254 0.398 -4.579 1.00 10.00 N ATOM 842 CA LEU B 57 13.104 0.400 -3.402 1.00 10.00 C ATOM 843 C LEU B 57 13.937 1.678 -3.287 1.00 10.00 C ATOM 844 O LEU B 57 14.264 2.093 -2.178 1.00 10.00 O ATOM 845 CB LEU B 57 13.992 -0.858 -3.570 1.00 10.00 C ATOM 846 CG LEU B 57 15.216 -1.038 -2.667 1.00 10.00 C ATOM 847 CD1 LEU B 57 14.784 -1.265 -1.217 1.00 10.00 C ATOM 848 CD2 LEU B 57 16.020 -2.222 -3.230 1.00 10.00 C ATOM 0 H LEU B 57 12.451 -0.402 -5.181 1.00 10.00 H new ATOM 0 HA LEU B 57 12.523 0.376 -2.480 1.00 10.00 H new ATOM 0 HB2 LEU B 57 13.353 -1.730 -3.433 1.00 10.00 H new ATOM 0 HB3 LEU B 57 14.341 -0.877 -4.602 1.00 10.00 H new ATOM 0 HG LEU B 57 15.840 -0.144 -2.658 1.00 10.00 H new ATOM 0 HD11 LEU B 57 15.667 -1.391 -0.590 1.00 10.00 H new ATOM 0 HD12 LEU B 57 14.211 -0.405 -0.869 1.00 10.00 H new ATOM 0 HD13 LEU B 57 14.166 -2.161 -1.157 1.00 10.00 H new ATOM 0 HD21 LEU B 57 16.905 -2.386 -2.615 1.00 10.00 H new ATOM 0 HD22 LEU B 57 15.401 -3.119 -3.222 1.00 10.00 H new ATOM 0 HD23 LEU B 57 16.325 -2.001 -4.253 1.00 10.00 H new ATOM 860 N GLN B 58 14.269 2.310 -4.414 1.00 10.00 N ATOM 861 CA GLN B 58 14.864 3.639 -4.450 1.00 10.00 C ATOM 862 C GLN B 58 13.756 4.691 -4.527 1.00 10.00 C ATOM 863 O GLN B 58 13.611 5.518 -3.630 1.00 10.00 O ATOM 864 CB GLN B 58 15.827 3.731 -5.653 1.00 10.00 C ATOM 865 CG GLN B 58 16.979 2.725 -5.562 1.00 10.00 C ATOM 866 CD GLN B 58 17.597 2.471 -6.935 1.00 10.00 C ATOM 867 OE1 GLN B 58 18.364 3.259 -7.461 1.00 10.00 O ATOM 868 NE2 GLN B 58 17.308 1.353 -7.570 1.00 10.00 N ATOM 0 H GLN B 58 14.128 1.904 -5.339 1.00 10.00 H new ATOM 0 HA GLN B 58 15.438 3.825 -3.542 1.00 10.00 H new ATOM 0 HB2 GLN B 58 15.270 3.558 -6.574 1.00 10.00 H new ATOM 0 HB3 GLN B 58 16.234 4.740 -5.712 1.00 10.00 H new ATOM 0 HG2 GLN B 58 17.742 3.102 -4.881 1.00 10.00 H new ATOM 0 HG3 GLN B 58 16.614 1.786 -5.145 1.00 10.00 H new ATOM 0 HE21 GLN B 58 16.669 0.678 -7.150 1.00 10.00 H new ATOM 0 HE22 GLN B 58 17.724 1.162 -8.482 1.00 10.00 H new ATOM 877 N ASP B 59 12.930 4.634 -5.579 1.00 10.00 N ATOM 878 CA ASP B 59 11.974 5.679 -5.934 1.00 10.00 C ATOM 879 C ASP B 59 10.685 5.722 -5.101 1.00 10.00 C ATOM 880 O ASP B 59 10.298 6.788 -4.631 1.00 10.00 O ATOM 881 CB ASP B 59 11.661 5.574 -7.443 1.00 10.00 C ATOM 882 CG ASP B 59 11.806 6.941 -8.116 1.00 10.00 C ATOM 883 OD1 ASP B 59 12.879 7.572 -7.983 1.00 10.00 O ATOM 884 OD2 ASP B 59 10.776 7.460 -8.599 1.00 10.00 O ATOM 0 H ASP B 59 12.911 3.840 -6.219 1.00 10.00 H new ATOM 0 HA ASP B 59 12.459 6.625 -5.695 1.00 10.00 H new ATOM 0 HB2 ASP B 59 12.336 4.858 -7.912 1.00 10.00 H new ATOM 0 HB3 ASP B 59 10.648 5.198 -7.585 1.00 10.00 H new ATOM 889 N LEU B 60 9.997 4.595 -4.904 1.00 10.00 N ATOM 890 CA LEU B 60 8.721 4.586 -4.185 1.00 10.00 C ATOM 891 C LEU B 60 8.982 4.781 -2.687 1.00 10.00 C ATOM 892 O LEU B 60 8.289 5.548 -2.012 1.00 10.00 O ATOM 893 CB LEU B 60 7.967 3.272 -4.454 1.00 10.00 C ATOM 894 CG LEU B 60 6.451 3.482 -4.552 1.00 10.00 C ATOM 895 CD1 LEU B 60 5.773 2.147 -4.865 1.00 10.00 C ATOM 896 CD2 LEU B 60 5.804 4.037 -3.289 1.00 10.00 C ATOM 0 H LEU B 60 10.301 3.678 -5.232 1.00 10.00 H new ATOM 0 HA LEU B 60 8.095 5.405 -4.539 1.00 10.00 H new ATOM 0 HB2 LEU B 60 8.331 2.830 -5.381 1.00 10.00 H new ATOM 0 HB3 LEU B 60 8.183 2.562 -3.656 1.00 10.00 H new ATOM 0 HG LEU B 60 6.313 4.222 -5.341 1.00 10.00 H new ATOM 0 HD11 LEU B 60 4.695 2.294 -4.935 1.00 10.00 H new ATOM 0 HD12 LEU B 60 6.149 1.761 -5.813 1.00 10.00 H new ATOM 0 HD13 LEU B 60 5.991 1.433 -4.071 1.00 10.00 H new ATOM 0 HD21 LEU B 60 4.732 4.153 -3.450 1.00 10.00 H new ATOM 0 HD22 LEU B 60 5.974 3.349 -2.461 1.00 10.00 H new ATOM 0 HD23 LEU B 60 6.242 5.006 -3.052 1.00 10.00 H new ATOM 908 N LEU B 61 10.051 4.137 -2.200 1.00 10.00 N ATOM 909 CA LEU B 61 10.558 4.305 -0.850 1.00 10.00 C ATOM 910 C LEU B 61 10.834 5.791 -0.585 1.00 10.00 C ATOM 911 O LEU B 61 10.272 6.316 0.368 1.00 10.00 O ATOM 912 CB LEU B 61 11.752 3.358 -0.653 1.00 10.00 C ATOM 913 CG LEU B 61 12.230 3.139 0.805 1.00 10.00 C ATOM 914 CD1 LEU B 61 11.101 2.753 1.769 1.00 10.00 C ATOM 915 CD2 LEU B 61 13.284 2.023 0.854 1.00 10.00 C ATOM 0 H LEU B 61 10.592 3.473 -2.753 1.00 10.00 H new ATOM 0 HA LEU B 61 9.827 4.021 -0.093 1.00 10.00 H new ATOM 0 HB2 LEU B 61 11.491 2.388 -1.075 1.00 10.00 H new ATOM 0 HB3 LEU B 61 12.591 3.742 -1.233 1.00 10.00 H new ATOM 0 HG LEU B 61 12.640 4.097 1.126 1.00 10.00 H new ATOM 0 HD11 LEU B 61 11.509 2.616 2.771 1.00 10.00 H new ATOM 0 HD12 LEU B 61 10.352 3.545 1.787 1.00 10.00 H new ATOM 0 HD13 LEU B 61 10.639 1.824 1.435 1.00 10.00 H new ATOM 0 HD21 LEU B 61 13.613 1.878 1.883 1.00 10.00 H new ATOM 0 HD22 LEU B 61 12.851 1.096 0.477 1.00 10.00 H new ATOM 0 HD23 LEU B 61 14.138 2.302 0.236 1.00 10.00 H new ATOM 927 N ARG B 62 11.563 6.507 -1.464 1.00 10.00 N ATOM 928 CA ARG B 62 11.709 7.967 -1.427 1.00 10.00 C ATOM 929 C ARG B 62 10.352 8.682 -1.409 1.00 10.00 C ATOM 930 O ARG B 62 10.111 9.510 -0.534 1.00 10.00 O ATOM 931 CB ARG B 62 12.585 8.311 -2.638 1.00 10.00 C ATOM 932 CG ARG B 62 12.844 9.783 -2.924 1.00 10.00 C ATOM 933 CD ARG B 62 11.698 10.635 -3.531 1.00 10.00 C ATOM 934 NE ARG B 62 10.876 9.971 -4.569 1.00 10.00 N ATOM 935 CZ ARG B 62 11.210 9.529 -5.772 1.00 10.00 C ATOM 936 NH1 ARG B 62 12.446 9.495 -6.210 1.00 10.00 N ATOM 937 NH2 ARG B 62 10.262 9.083 -6.554 1.00 10.00 N ATOM 0 H ARG B 62 12.075 6.074 -2.233 1.00 10.00 H new ATOM 0 HA ARG B 62 12.181 8.315 -0.508 1.00 10.00 H new ATOM 0 HB2 ARG B 62 13.549 7.820 -2.506 1.00 10.00 H new ATOM 0 HB3 ARG B 62 12.123 7.873 -3.523 1.00 10.00 H new ATOM 0 HG2 ARG B 62 13.146 10.254 -1.989 1.00 10.00 H new ATOM 0 HG3 ARG B 62 13.696 9.844 -3.601 1.00 10.00 H new ATOM 0 HD2 ARG B 62 11.040 10.952 -2.722 1.00 10.00 H new ATOM 0 HD3 ARG B 62 12.132 11.538 -3.961 1.00 10.00 H new ATOM 0 HE ARG B 62 9.897 9.832 -4.317 1.00 10.00 H new ATOM 0 HH11 ARG B 62 13.207 9.820 -5.614 1.00 10.00 H new ATOM 0 HH12 ARG B 62 12.646 9.144 -7.147 1.00 10.00 H new ATOM 0 HH21 ARG B 62 9.294 9.082 -6.232 1.00 10.00 H new ATOM 0 HH22 ARG B 62 10.490 8.737 -7.486 1.00 10.00 H new ATOM 951 N THR B 63 9.469 8.344 -2.350 1.00 10.00 N ATOM 952 CA THR B 63 8.142 8.955 -2.616 1.00 10.00 C ATOM 953 C THR B 63 7.159 8.943 -1.451 1.00 10.00 C ATOM 954 O THR B 63 6.262 9.792 -1.439 1.00 10.00 O ATOM 955 CB THR B 63 7.573 8.289 -3.876 1.00 10.00 C ATOM 956 OG1 THR B 63 7.985 9.091 -4.963 1.00 10.00 O ATOM 957 CG2 THR B 63 6.078 8.015 -4.040 1.00 10.00 C ATOM 0 H THR B 63 9.665 7.582 -2.999 1.00 10.00 H new ATOM 0 HA THR B 63 8.295 10.023 -2.769 1.00 10.00 H new ATOM 0 HB THR B 63 7.962 7.273 -3.807 1.00 10.00 H new ATOM 0 HG1 THR B 63 7.629 9.998 -4.854 1.00 10.00 H new ATOM 0 HG21 THR B 63 5.899 7.539 -5.004 1.00 10.00 H new ATOM 0 HG22 THR B 63 5.739 7.355 -3.241 1.00 10.00 H new ATOM 0 HG23 THR B 63 5.528 8.955 -3.992 1.00 10.00 H new ATOM 965 N LEU B 64 7.340 8.033 -0.483 1.00 10.00 N ATOM 966 CA LEU B 64 6.610 8.056 0.790 1.00 10.00 C ATOM 967 C LEU B 64 7.500 8.346 2.018 1.00 10.00 C ATOM 968 O LEU B 64 6.967 8.760 3.047 1.00 10.00 O ATOM 969 CB LEU B 64 5.780 6.774 0.955 1.00 10.00 C ATOM 970 CG LEU B 64 4.313 7.080 1.318 1.00 10.00 C ATOM 971 CD1 LEU B 64 3.474 7.348 0.065 1.00 10.00 C ATOM 972 CD2 LEU B 64 3.724 5.907 2.109 1.00 10.00 C ATOM 0 H LEU B 64 7.999 7.259 -0.563 1.00 10.00 H new ATOM 0 HA LEU B 64 5.927 8.904 0.745 1.00 10.00 H new ATOM 0 HB2 LEU B 64 5.812 6.199 0.029 1.00 10.00 H new ATOM 0 HB3 LEU B 64 6.224 6.152 1.732 1.00 10.00 H new ATOM 0 HG LEU B 64 4.291 7.981 1.932 1.00 10.00 H new ATOM 0 HD11 LEU B 64 2.445 7.560 0.355 1.00 10.00 H new ATOM 0 HD12 LEU B 64 3.884 8.204 -0.471 1.00 10.00 H new ATOM 0 HD13 LEU B 64 3.495 6.471 -0.582 1.00 10.00 H new ATOM 0 HD21 LEU B 64 2.687 6.125 2.365 1.00 10.00 H new ATOM 0 HD22 LEU B 64 3.766 5.002 1.503 1.00 10.00 H new ATOM 0 HD23 LEU B 64 4.300 5.759 3.023 1.00 10.00 H new ATOM 984 N LYS B 65 8.834 8.169 1.925 1.00 10.00 N ATOM 985 CA LYS B 65 9.787 8.655 2.945 1.00 10.00 C ATOM 986 C LYS B 65 9.576 10.164 3.083 1.00 10.00 C ATOM 987 O LYS B 65 9.554 10.681 4.198 1.00 10.00 O ATOM 988 CB LYS B 65 11.241 8.300 2.600 1.00 10.00 C ATOM 989 CG LYS B 65 11.633 6.949 3.216 1.00 10.00 C ATOM 990 CD LYS B 65 13.066 6.547 2.848 1.00 10.00 C ATOM 991 CE LYS B 65 13.459 5.257 3.577 1.00 10.00 C ATOM 992 NZ LYS B 65 14.778 4.742 3.134 1.00 10.00 N ATOM 0 H LYS B 65 9.280 7.687 1.144 1.00 10.00 H new ATOM 0 HA LYS B 65 9.597 8.162 3.898 1.00 10.00 H new ATOM 0 HB2 LYS B 65 11.364 8.261 1.518 1.00 10.00 H new ATOM 0 HB3 LYS B 65 11.908 9.080 2.968 1.00 10.00 H new ATOM 0 HG2 LYS B 65 11.538 7.003 4.301 1.00 10.00 H new ATOM 0 HG3 LYS B 65 10.941 6.180 2.874 1.00 10.00 H new ATOM 0 HD2 LYS B 65 13.145 6.403 1.771 1.00 10.00 H new ATOM 0 HD3 LYS B 65 13.756 7.348 3.114 1.00 10.00 H new ATOM 0 HE2 LYS B 65 13.485 5.442 4.651 1.00 10.00 H new ATOM 0 HE3 LYS B 65 12.697 4.497 3.403 1.00 10.00 H new ATOM 0 HZ1 LYS B 65 15.002 3.869 3.653 1.00 10.00 H new ATOM 0 HZ2 LYS B 65 14.747 4.540 2.114 1.00 10.00 H new ATOM 0 HZ3 LYS B 65 15.511 5.455 3.323 1.00 10.00 H new ATOM 1006 N SER B 66 9.399 10.859 1.948 1.00 10.00 N ATOM 1007 CA SER B 66 8.897 12.232 1.901 1.00 10.00 C ATOM 1008 C SER B 66 7.412 12.057 2.284 1.00 10.00 C ATOM 1009 O SER B 66 6.671 11.488 1.473 1.00 10.00 O ATOM 1010 CB SER B 66 9.050 12.784 0.483 1.00 10.00 C ATOM 1011 OG SER B 66 8.439 11.905 -0.439 1.00 10.00 O ATOM 0 H SER B 66 9.605 10.473 1.027 1.00 10.00 H new ATOM 0 HA SER B 66 9.421 12.930 2.554 1.00 10.00 H new ATOM 0 HB2 SER B 66 8.594 13.772 0.416 1.00 10.00 H new ATOM 0 HB3 SER B 66 10.106 12.904 0.241 1.00 10.00 H new ATOM 0 HG SER B 66 7.671 11.469 -0.015 1.00 10.00 H new ATOM 1017 N PRO B 67 6.972 12.449 3.496 1.00 10.00 N ATOM 1018 CA PRO B 67 5.659 12.072 4.008 1.00 10.00 C ATOM 1019 C PRO B 67 4.452 12.467 3.184 1.00 10.00 C ATOM 1020 O PRO B 67 4.445 13.499 2.515 1.00 10.00 O ATOM 1021 CB PRO B 67 5.576 12.629 5.437 1.00 10.00 C ATOM 1022 CG PRO B 67 7.036 12.876 5.812 1.00 10.00 C ATOM 1023 CD PRO B 67 7.673 13.257 4.482 1.00 10.00 C ATOM 0 HA PRO B 67 5.599 10.985 3.965 1.00 10.00 H new ATOM 0 HB2 PRO B 67 4.991 13.548 5.476 1.00 10.00 H new ATOM 0 HB3 PRO B 67 5.102 11.921 6.116 1.00 10.00 H new ATOM 0 HG2 PRO B 67 7.134 13.673 6.549 1.00 10.00 H new ATOM 0 HG3 PRO B 67 7.498 11.987 6.241 1.00 10.00 H new ATOM 0 HD2 PRO B 67 7.557 14.321 4.277 1.00 10.00 H new ATOM 0 HD3 PRO B 67 8.742 13.046 4.480 1.00 10.00 H new ATOM 1031 N SER B 68 3.405 11.638 3.314 1.00 10.00 N ATOM 1032 CA SER B 68 2.192 11.663 2.502 1.00 10.00 C ATOM 1033 C SER B 68 1.551 13.046 2.382 1.00 10.00 C ATOM 1034 O SER B 68 1.062 13.379 1.312 1.00 10.00 O ATOM 1035 CB SER B 68 1.189 10.614 3.018 1.00 10.00 C ATOM 1036 OG SER B 68 0.565 11.021 4.215 1.00 10.00 O ATOM 0 H SER B 68 3.386 10.902 4.020 1.00 10.00 H new ATOM 0 HA SER B 68 2.491 11.405 1.486 1.00 10.00 H new ATOM 0 HB2 SER B 68 0.430 10.434 2.257 1.00 10.00 H new ATOM 0 HB3 SER B 68 1.706 9.669 3.182 1.00 10.00 H new ATOM 0 HG SER B 68 0.185 10.240 4.668 1.00 10.00 H new ATOM 1042 N SER B 69 1.602 13.874 3.431 1.00 10.00 N ATOM 1043 CA SER B 69 0.956 15.190 3.513 1.00 10.00 C ATOM 1044 C SER B 69 1.151 16.077 2.265 1.00 10.00 C ATOM 1045 O SER B 69 0.160 16.302 1.567 1.00 10.00 O ATOM 1046 CB SER B 69 1.341 15.854 4.846 1.00 10.00 C ATOM 1047 OG SER B 69 0.837 17.168 4.925 1.00 10.00 O ATOM 0 H SER B 69 2.115 13.637 4.280 1.00 10.00 H new ATOM 0 HA SER B 69 -0.124 15.044 3.510 1.00 10.00 H new ATOM 0 HB2 SER B 69 0.953 15.262 5.675 1.00 10.00 H new ATOM 0 HB3 SER B 69 2.426 15.871 4.947 1.00 10.00 H new ATOM 0 HG SER B 69 1.095 17.566 5.783 1.00 10.00 H new ATOM 1053 N PRO B 70 2.359 16.552 1.901 1.00 10.00 N ATOM 1054 CA PRO B 70 2.586 17.200 0.601 1.00 10.00 C ATOM 1055 C PRO B 70 2.633 16.198 -0.570 1.00 10.00 C ATOM 1056 O PRO B 70 2.416 16.586 -1.713 1.00 10.00 O ATOM 1057 CB PRO B 70 3.932 17.913 0.747 1.00 10.00 C ATOM 1058 CG PRO B 70 4.679 17.065 1.778 1.00 10.00 C ATOM 1059 CD PRO B 70 3.559 16.636 2.721 1.00 10.00 C ATOM 0 HA PRO B 70 1.766 17.878 0.362 1.00 10.00 H new ATOM 0 HB2 PRO B 70 4.468 17.955 -0.201 1.00 10.00 H new ATOM 0 HB3 PRO B 70 3.806 18.940 1.088 1.00 10.00 H new ATOM 0 HG2 PRO B 70 5.174 16.209 1.319 1.00 10.00 H new ATOM 0 HG3 PRO B 70 5.448 17.638 2.295 1.00 10.00 H new ATOM 0 HD2 PRO B 70 3.784 15.675 3.184 1.00 10.00 H new ATOM 0 HD3 PRO B 70 3.431 17.356 3.529 1.00 10.00 H new ATOM 1067 N GLN B 71 2.916 14.921 -0.305 1.00 10.00 N ATOM 1068 CA GLN B 71 3.213 13.880 -1.305 1.00 10.00 C ATOM 1069 C GLN B 71 2.013 13.079 -1.839 1.00 10.00 C ATOM 1070 O GLN B 71 2.205 12.125 -2.603 1.00 10.00 O ATOM 1071 CB GLN B 71 4.356 13.007 -0.764 1.00 10.00 C ATOM 1072 CG GLN B 71 5.687 13.746 -0.996 1.00 10.00 C ATOM 1073 CD GLN B 71 6.172 13.624 -2.450 1.00 10.00 C ATOM 1074 OE1 GLN B 71 5.625 14.225 -3.361 1.00 10.00 O ATOM 1075 NE2 GLN B 71 7.204 12.852 -2.717 1.00 10.00 N ATOM 0 H GLN B 71 2.947 14.564 0.650 1.00 10.00 H new ATOM 0 HA GLN B 71 3.530 14.389 -2.215 1.00 10.00 H new ATOM 0 HB2 GLN B 71 4.212 12.810 0.298 1.00 10.00 H new ATOM 0 HB3 GLN B 71 4.366 12.041 -1.269 1.00 10.00 H new ATOM 0 HG2 GLN B 71 5.565 14.799 -0.742 1.00 10.00 H new ATOM 0 HG3 GLN B 71 6.446 13.343 -0.326 1.00 10.00 H new ATOM 0 HE21 GLN B 71 7.670 12.345 -1.965 1.00 10.00 H new ATOM 0 HE22 GLN B 71 7.538 12.761 -3.676 1.00 10.00 H new ATOM 1084 N GLN B 72 0.793 13.515 -1.505 1.00 10.00 N ATOM 1085 CA GLN B 72 -0.504 12.891 -1.828 1.00 10.00 C ATOM 1086 C GLN B 72 -0.793 12.669 -3.320 1.00 10.00 C ATOM 1087 O GLN B 72 -1.658 11.876 -3.677 1.00 10.00 O ATOM 1088 CB GLN B 72 -1.618 13.714 -1.144 1.00 10.00 C ATOM 1089 CG GLN B 72 -1.937 15.114 -1.703 1.00 10.00 C ATOM 1090 CD GLN B 72 -3.083 15.154 -2.706 1.00 10.00 C ATOM 1091 OE1 GLN B 72 -2.888 15.506 -3.867 1.00 10.00 O ATOM 1092 NE2 GLN B 72 -4.305 14.845 -2.306 1.00 10.00 N ATOM 0 H GLN B 72 0.673 14.372 -0.965 1.00 10.00 H new ATOM 0 HA GLN B 72 -0.466 11.873 -1.440 1.00 10.00 H new ATOM 0 HB2 GLN B 72 -2.535 13.125 -1.177 1.00 10.00 H new ATOM 0 HB3 GLN B 72 -1.350 13.828 -0.094 1.00 10.00 H new ATOM 0 HG2 GLN B 72 -2.177 15.776 -0.871 1.00 10.00 H new ATOM 0 HG3 GLN B 72 -1.041 15.513 -2.179 1.00 10.00 H new ATOM 0 HE21 GLN B 72 -4.468 14.553 -1.342 1.00 10.00 H new ATOM 0 HE22 GLN B 72 -5.085 14.899 -2.961 1.00 10.00 H new ATOM 1101 N GLN B 73 -0.053 13.345 -4.191 1.00 10.00 N ATOM 1102 CA GLN B 73 -0.243 13.297 -5.626 1.00 10.00 C ATOM 1103 C GLN B 73 0.110 11.943 -6.284 1.00 10.00 C ATOM 1104 O GLN B 73 0.765 11.067 -5.711 1.00 10.00 O ATOM 1105 CB GLN B 73 0.550 14.458 -6.247 1.00 10.00 C ATOM 1106 CG GLN B 73 -0.274 15.760 -6.270 1.00 10.00 C ATOM 1107 CD GLN B 73 -1.522 15.615 -7.152 1.00 10.00 C ATOM 1108 OE1 GLN B 73 -1.418 15.347 -8.344 1.00 10.00 O ATOM 1109 NE2 GLN B 73 -2.705 15.706 -6.590 1.00 10.00 N ATOM 0 H GLN B 73 0.713 13.955 -3.906 1.00 10.00 H new ATOM 0 HA GLN B 73 -1.310 13.403 -5.822 1.00 10.00 H new ATOM 0 HB2 GLN B 73 1.467 14.617 -5.680 1.00 10.00 H new ATOM 0 HB3 GLN B 73 0.845 14.195 -7.263 1.00 10.00 H new ATOM 0 HG2 GLN B 73 -0.572 16.022 -5.255 1.00 10.00 H new ATOM 0 HG3 GLN B 73 0.344 16.577 -6.642 1.00 10.00 H new ATOM 0 HE21 GLN B 73 -2.782 15.929 -5.598 1.00 10.00 H new ATOM 0 HE22 GLN B 73 -3.547 15.553 -7.146 1.00 10.00 H new ATOM 1118 N GLN B 74 -0.302 11.833 -7.555 1.00 10.00 N ATOM 1119 CA GLN B 74 -0.096 10.675 -8.431 1.00 10.00 C ATOM 1120 C GLN B 74 1.359 10.221 -8.599 1.00 10.00 C ATOM 1121 O GLN B 74 1.565 9.144 -9.152 1.00 10.00 O ATOM 1122 CB GLN B 74 -0.742 10.877 -9.819 1.00 10.00 C ATOM 1123 CG GLN B 74 -0.844 12.318 -10.358 1.00 10.00 C ATOM 1124 CD GLN B 74 0.493 13.047 -10.423 1.00 10.00 C ATOM 1125 OE1 GLN B 74 1.488 12.535 -10.901 1.00 10.00 O ATOM 1126 NE2 GLN B 74 0.557 14.266 -9.925 1.00 10.00 N ATOM 0 H GLN B 74 -0.811 12.585 -8.020 1.00 10.00 H new ATOM 0 HA GLN B 74 -0.600 9.868 -7.900 1.00 10.00 H new ATOM 0 HB2 GLN B 74 -0.177 10.288 -10.541 1.00 10.00 H new ATOM 0 HB3 GLN B 74 -1.748 10.459 -9.785 1.00 10.00 H new ATOM 0 HG2 GLN B 74 -1.282 12.293 -11.356 1.00 10.00 H new ATOM 0 HG3 GLN B 74 -1.526 12.885 -9.725 1.00 10.00 H new ATOM 0 HE21 GLN B 74 -0.276 14.697 -9.524 1.00 10.00 H new ATOM 0 HE22 GLN B 74 1.439 14.778 -9.941 1.00 10.00 H new ATOM 1135 N GLN B 75 2.357 10.948 -8.088 1.00 10.00 N ATOM 1136 CA GLN B 75 3.729 10.446 -8.030 1.00 10.00 C ATOM 1137 C GLN B 75 3.859 9.096 -7.342 1.00 10.00 C ATOM 1138 O GLN B 75 4.661 8.283 -7.789 1.00 10.00 O ATOM 1139 CB GLN B 75 4.675 11.468 -7.394 1.00 10.00 C ATOM 1140 CG GLN B 75 4.329 11.870 -5.946 1.00 10.00 C ATOM 1141 CD GLN B 75 5.236 11.337 -4.839 1.00 10.00 C ATOM 1142 OE1 GLN B 75 6.440 11.129 -4.996 1.00 10.00 O ATOM 1143 NE2 GLN B 75 4.693 11.089 -3.661 1.00 10.00 N ATOM 0 H GLN B 75 2.238 11.887 -7.709 1.00 10.00 H new ATOM 0 HA GLN B 75 4.024 10.292 -9.068 1.00 10.00 H new ATOM 0 HB2 GLN B 75 5.686 11.062 -7.410 1.00 10.00 H new ATOM 0 HB3 GLN B 75 4.682 12.366 -8.012 1.00 10.00 H new ATOM 0 HG2 GLN B 75 4.329 12.958 -5.888 1.00 10.00 H new ATOM 0 HG3 GLN B 75 3.311 11.540 -5.738 1.00 10.00 H new ATOM 0 HE21 GLN B 75 3.698 11.255 -3.513 1.00 10.00 H new ATOM 0 HE22 GLN B 75 5.269 10.731 -2.899 1.00 10.00 H new ATOM 1152 N VAL B 76 3.046 8.824 -6.317 1.00 10.00 N ATOM 1153 CA VAL B 76 3.062 7.498 -5.719 1.00 10.00 C ATOM 1154 C VAL B 76 2.472 6.521 -6.710 1.00 10.00 C ATOM 1155 O VAL B 76 3.102 5.520 -7.010 1.00 10.00 O ATOM 1156 CB VAL B 76 2.282 7.365 -4.404 1.00 10.00 C ATOM 1157 CG1 VAL B 76 2.799 6.137 -3.662 1.00 10.00 C ATOM 1158 CG2 VAL B 76 2.411 8.549 -3.473 1.00 10.00 C ATOM 0 H VAL B 76 2.390 9.484 -5.899 1.00 10.00 H new ATOM 0 HA VAL B 76 4.105 7.293 -5.478 1.00 10.00 H new ATOM 0 HB VAL B 76 1.230 7.292 -4.681 1.00 10.00 H new ATOM 0 HG11 VAL B 76 2.257 6.024 -2.723 1.00 10.00 H new ATOM 0 HG12 VAL B 76 2.648 5.250 -4.277 1.00 10.00 H new ATOM 0 HG13 VAL B 76 3.862 6.258 -3.455 1.00 10.00 H new ATOM 0 HG21 VAL B 76 1.827 8.367 -2.570 1.00 10.00 H new ATOM 0 HG22 VAL B 76 3.458 8.689 -3.206 1.00 10.00 H new ATOM 0 HG23 VAL B 76 2.040 9.445 -3.971 1.00 10.00 H new ATOM 1168 N LEU B 77 1.272 6.824 -7.215 1.00 10.00 N ATOM 1169 CA LEU B 77 0.498 5.949 -8.086 1.00 10.00 C ATOM 1170 C LEU B 77 1.293 5.585 -9.361 1.00 10.00 C ATOM 1171 O LEU B 77 1.296 4.435 -9.800 1.00 10.00 O ATOM 1172 CB LEU B 77 -0.874 6.585 -8.392 1.00 10.00 C ATOM 1173 CG LEU B 77 -2.029 5.559 -8.352 1.00 10.00 C ATOM 1174 CD1 LEU B 77 -3.376 6.272 -8.365 1.00 10.00 C ATOM 1175 CD2 LEU B 77 -2.012 4.591 -9.547 1.00 10.00 C ATOM 0 H LEU B 77 0.804 7.709 -7.021 1.00 10.00 H new ATOM 0 HA LEU B 77 0.309 5.007 -7.571 1.00 10.00 H new ATOM 0 HB2 LEU B 77 -1.072 7.377 -7.670 1.00 10.00 H new ATOM 0 HB3 LEU B 77 -0.842 7.052 -9.376 1.00 10.00 H new ATOM 0 HG LEU B 77 -1.887 4.990 -7.433 1.00 10.00 H new ATOM 0 HD11 LEU B 77 -4.178 5.535 -8.336 1.00 10.00 H new ATOM 0 HD12 LEU B 77 -3.451 6.924 -7.495 1.00 10.00 H new ATOM 0 HD13 LEU B 77 -3.463 6.868 -9.273 1.00 10.00 H new ATOM 0 HD21 LEU B 77 -2.847 3.895 -9.463 1.00 10.00 H new ATOM 0 HD22 LEU B 77 -2.103 5.156 -10.475 1.00 10.00 H new ATOM 0 HD23 LEU B 77 -1.075 4.035 -9.551 1.00 10.00 H new ATOM 1187 N ASN B 78 2.056 6.544 -9.890 1.00 10.00 N ATOM 1188 CA ASN B 78 2.967 6.396 -11.011 1.00 10.00 C ATOM 1189 C ASN B 78 4.057 5.342 -10.774 1.00 10.00 C ATOM 1190 O ASN B 78 4.387 4.597 -11.706 1.00 10.00 O ATOM 1191 CB ASN B 78 3.573 7.766 -11.353 1.00 10.00 C ATOM 1192 CG ASN B 78 4.563 7.669 -12.508 1.00 10.00 C ATOM 1193 OD1 ASN B 78 4.220 7.239 -13.603 1.00 10.00 O ATOM 1194 ND2 ASN B 78 5.815 8.022 -12.305 1.00 10.00 N ATOM 0 H ASN B 78 2.049 7.495 -9.522 1.00 10.00 H new ATOM 0 HA ASN B 78 2.392 6.026 -11.860 1.00 10.00 H new ATOM 0 HB2 ASN B 78 2.776 8.462 -11.614 1.00 10.00 H new ATOM 0 HB3 ASN B 78 4.076 8.171 -10.475 1.00 10.00 H new ATOM 0 HD21 ASN B 78 6.497 7.937 -13.058 1.00 10.00 H new ATOM 0 HD22 ASN B 78 6.103 8.380 -11.394 1.00 10.00 H new ATOM 1201 N ILE B 79 4.604 5.270 -9.554 1.00 10.00 N ATOM 1202 CA ILE B 79 5.665 4.323 -9.201 1.00 10.00 C ATOM 1203 C ILE B 79 5.039 3.005 -8.719 1.00 10.00 C ATOM 1204 O ILE B 79 5.496 1.939 -9.128 1.00 10.00 O ATOM 1205 CB ILE B 79 6.632 4.955 -8.193 1.00 10.00 C ATOM 1206 CG1 ILE B 79 7.219 6.309 -8.677 1.00 10.00 C ATOM 1207 CG2 ILE B 79 7.784 3.980 -7.908 1.00 10.00 C ATOM 1208 CD1 ILE B 79 7.691 7.187 -7.514 1.00 10.00 C ATOM 0 H ILE B 79 4.320 5.871 -8.781 1.00 10.00 H new ATOM 0 HA ILE B 79 6.266 4.082 -10.078 1.00 10.00 H new ATOM 0 HB ILE B 79 6.058 5.157 -7.289 1.00 10.00 H new ATOM 0 HG12 ILE B 79 8.056 6.120 -9.350 1.00 10.00 H new ATOM 0 HG13 ILE B 79 6.464 6.846 -9.251 1.00 10.00 H new ATOM 0 HG21 ILE B 79 8.472 4.429 -7.191 1.00 10.00 H new ATOM 0 HG22 ILE B 79 7.383 3.054 -7.495 1.00 10.00 H new ATOM 0 HG23 ILE B 79 8.316 3.764 -8.835 1.00 10.00 H new ATOM 0 HD11 ILE B 79 8.093 8.122 -7.904 1.00 10.00 H new ATOM 0 HD12 ILE B 79 6.850 7.401 -6.855 1.00 10.00 H new ATOM 0 HD13 ILE B 79 8.467 6.664 -6.955 1.00 10.00 H new ATOM 1220 N LEU B 80 3.943 3.064 -7.947 1.00 10.00 N ATOM 1221 CA LEU B 80 3.071 1.960 -7.539 1.00 10.00 C ATOM 1222 C LEU B 80 2.790 1.012 -8.710 1.00 10.00 C ATOM 1223 O LEU B 80 3.056 -0.183 -8.598 1.00 10.00 O ATOM 1224 CB LEU B 80 1.745 2.548 -7.025 1.00 10.00 C ATOM 1225 CG LEU B 80 1.618 2.751 -5.506 1.00 10.00 C ATOM 1226 CD1 LEU B 80 0.516 3.744 -5.127 1.00 10.00 C ATOM 1227 CD2 LEU B 80 1.244 1.431 -4.854 1.00 10.00 C ATOM 0 H LEU B 80 3.622 3.953 -7.565 1.00 10.00 H new ATOM 0 HA LEU B 80 3.568 1.388 -6.756 1.00 10.00 H new ATOM 0 HB2 LEU B 80 1.590 3.512 -7.510 1.00 10.00 H new ATOM 0 HB3 LEU B 80 0.935 1.894 -7.349 1.00 10.00 H new ATOM 0 HG LEU B 80 2.580 3.135 -5.167 1.00 10.00 H new ATOM 0 HD11 LEU B 80 0.475 3.845 -4.043 1.00 10.00 H new ATOM 0 HD12 LEU B 80 0.731 4.714 -5.574 1.00 10.00 H new ATOM 0 HD13 LEU B 80 -0.444 3.380 -5.494 1.00 10.00 H new ATOM 0 HD21 LEU B 80 1.153 1.570 -3.777 1.00 10.00 H new ATOM 0 HD22 LEU B 80 0.293 1.083 -5.257 1.00 10.00 H new ATOM 0 HD23 LEU B 80 2.018 0.691 -5.060 1.00 10.00 H new ATOM 1239 N LYS B 81 2.291 1.536 -9.841 1.00 10.00 N ATOM 1240 CA LYS B 81 1.951 0.708 -11.010 1.00 10.00 C ATOM 1241 C LYS B 81 3.145 -0.054 -11.621 1.00 10.00 C ATOM 1242 O LYS B 81 2.920 -0.955 -12.423 1.00 10.00 O ATOM 1243 CB LYS B 81 1.197 1.537 -12.068 1.00 10.00 C ATOM 1244 CG LYS B 81 2.016 2.705 -12.628 1.00 10.00 C ATOM 1245 CD LYS B 81 1.311 3.356 -13.815 1.00 10.00 C ATOM 1246 CE LYS B 81 1.899 4.712 -14.239 1.00 10.00 C ATOM 1247 NZ LYS B 81 3.381 4.737 -14.262 1.00 10.00 N ATOM 0 H LYS B 81 2.114 2.532 -9.971 1.00 10.00 H new ATOM 0 HA LYS B 81 1.287 -0.073 -10.638 1.00 10.00 H new ATOM 0 HB2 LYS B 81 0.904 0.883 -12.889 1.00 10.00 H new ATOM 0 HB3 LYS B 81 0.279 1.926 -11.627 1.00 10.00 H new ATOM 0 HG2 LYS B 81 2.177 3.447 -11.846 1.00 10.00 H new ATOM 0 HG3 LYS B 81 2.999 2.348 -12.937 1.00 10.00 H new ATOM 0 HD2 LYS B 81 1.352 2.674 -14.665 1.00 10.00 H new ATOM 0 HD3 LYS B 81 0.258 3.492 -13.567 1.00 10.00 H new ATOM 0 HE2 LYS B 81 1.525 4.966 -15.231 1.00 10.00 H new ATOM 0 HE3 LYS B 81 1.542 5.483 -13.556 1.00 10.00 H new ATOM 0 HZ1 LYS B 81 3.710 5.715 -14.389 1.00 10.00 H new ATOM 0 HZ2 LYS B 81 3.749 4.362 -13.364 1.00 10.00 H new ATOM 0 HZ3 LYS B 81 3.726 4.151 -15.049 1.00 10.00 H new ATOM 1261 N SER B 82 4.393 0.262 -11.249 1.00 10.00 N ATOM 1262 CA SER B 82 5.605 -0.409 -11.751 1.00 10.00 C ATOM 1263 C SER B 82 5.920 -1.749 -11.085 1.00 10.00 C ATOM 1264 O SER B 82 6.675 -2.536 -11.651 1.00 10.00 O ATOM 1265 CB SER B 82 6.831 0.521 -11.661 1.00 10.00 C ATOM 1266 OG SER B 82 7.289 0.642 -10.328 1.00 10.00 O ATOM 0 H SER B 82 4.595 1.004 -10.579 1.00 10.00 H new ATOM 0 HA SER B 82 5.382 -0.637 -12.793 1.00 10.00 H new ATOM 0 HB2 SER B 82 7.632 0.131 -12.289 1.00 10.00 H new ATOM 0 HB3 SER B 82 6.572 1.506 -12.049 1.00 10.00 H new ATOM 0 HG SER B 82 6.718 1.273 -9.842 1.00 10.00 H new ATOM 1272 N ASN B 83 5.323 -2.045 -9.924 1.00 10.00 N ATOM 1273 CA ASN B 83 5.430 -3.355 -9.291 1.00 10.00 C ATOM 1274 C ASN B 83 4.015 -3.884 -9.022 1.00 10.00 C ATOM 1275 O ASN B 83 3.360 -3.438 -8.080 1.00 10.00 O ATOM 1276 CB ASN B 83 6.302 -3.293 -8.038 1.00 10.00 C ATOM 1277 CG ASN B 83 6.420 -4.663 -7.377 1.00 10.00 C ATOM 1278 OD1 ASN B 83 5.474 -5.419 -7.220 1.00 10.00 O ATOM 1279 ND2 ASN B 83 7.610 -5.014 -6.976 1.00 10.00 N ATOM 0 H ASN B 83 4.753 -1.380 -9.401 1.00 10.00 H new ATOM 0 HA ASN B 83 5.933 -4.058 -9.956 1.00 10.00 H new ATOM 0 HB2 ASN B 83 7.294 -2.927 -8.301 1.00 10.00 H new ATOM 0 HB3 ASN B 83 5.876 -2.581 -7.331 1.00 10.00 H new ATOM 0 HD21 ASN B 83 7.751 -5.921 -6.531 1.00 10.00 H new ATOM 0 HD22 ASN B 83 8.400 -4.382 -7.108 1.00 10.00 H new ATOM 1286 N PRO B 84 3.521 -4.837 -9.831 1.00 10.00 N ATOM 1287 CA PRO B 84 2.151 -5.332 -9.743 1.00 10.00 C ATOM 1288 C PRO B 84 1.815 -5.948 -8.371 1.00 10.00 C ATOM 1289 O PRO B 84 0.730 -5.716 -7.840 1.00 10.00 O ATOM 1290 CB PRO B 84 2.006 -6.344 -10.885 1.00 10.00 C ATOM 1291 CG PRO B 84 3.161 -6.002 -11.833 1.00 10.00 C ATOM 1292 CD PRO B 84 4.242 -5.506 -10.902 1.00 10.00 C ATOM 0 HA PRO B 84 1.439 -4.512 -9.840 1.00 10.00 H new ATOM 0 HB2 PRO B 84 2.078 -7.369 -10.521 1.00 10.00 H new ATOM 0 HB3 PRO B 84 1.040 -6.249 -11.382 1.00 10.00 H new ATOM 0 HG2 PRO B 84 3.488 -6.874 -12.400 1.00 10.00 H new ATOM 0 HG3 PRO B 84 2.874 -5.240 -12.558 1.00 10.00 H new ATOM 0 HD2 PRO B 84 4.846 -6.329 -10.520 1.00 10.00 H new ATOM 0 HD3 PRO B 84 4.921 -4.822 -11.411 1.00 10.00 H new ATOM 1300 N GLN B 85 2.766 -6.689 -7.780 1.00 10.00 N ATOM 1301 CA GLN B 85 2.597 -7.304 -6.460 1.00 10.00 C ATOM 1302 C GLN B 85 2.506 -6.225 -5.370 1.00 10.00 C ATOM 1303 O GLN B 85 1.633 -6.317 -4.505 1.00 10.00 O ATOM 1304 CB GLN B 85 3.750 -8.282 -6.165 1.00 10.00 C ATOM 1305 CG GLN B 85 3.814 -9.447 -7.168 1.00 10.00 C ATOM 1306 CD GLN B 85 4.967 -10.419 -6.895 1.00 10.00 C ATOM 1307 OE1 GLN B 85 6.122 -10.040 -6.785 1.00 10.00 O ATOM 1308 NE2 GLN B 85 4.731 -11.716 -6.792 1.00 10.00 N ATOM 0 H GLN B 85 3.673 -6.877 -8.207 1.00 10.00 H new ATOM 0 HA GLN B 85 1.664 -7.868 -6.461 1.00 10.00 H new ATOM 0 HB2 GLN B 85 4.695 -7.739 -6.185 1.00 10.00 H new ATOM 0 HB3 GLN B 85 3.633 -8.682 -5.158 1.00 10.00 H new ATOM 0 HG2 GLN B 85 2.872 -9.994 -7.139 1.00 10.00 H new ATOM 0 HG3 GLN B 85 3.918 -9.045 -8.176 1.00 10.00 H new ATOM 0 HE21 GLN B 85 3.778 -12.069 -6.879 1.00 10.00 H new ATOM 0 HE22 GLN B 85 5.502 -12.363 -6.626 1.00 10.00 H new ATOM 1317 N LEU B 86 3.350 -5.190 -5.430 1.00 10.00 N ATOM 1318 CA LEU B 86 3.323 -4.021 -4.541 1.00 10.00 C ATOM 1319 C LEU B 86 2.015 -3.252 -4.707 1.00 10.00 C ATOM 1320 O LEU B 86 1.407 -2.861 -3.719 1.00 10.00 O ATOM 1321 CB LEU B 86 4.528 -3.119 -4.836 1.00 10.00 C ATOM 1322 CG LEU B 86 5.100 -2.306 -3.668 1.00 10.00 C ATOM 1323 CD1 LEU B 86 6.045 -1.249 -4.256 1.00 10.00 C ATOM 1324 CD2 LEU B 86 4.072 -1.596 -2.790 1.00 10.00 C ATOM 0 H LEU B 86 4.097 -5.140 -6.122 1.00 10.00 H new ATOM 0 HA LEU B 86 3.383 -4.359 -3.506 1.00 10.00 H new ATOM 0 HB2 LEU B 86 5.327 -3.743 -5.236 1.00 10.00 H new ATOM 0 HB3 LEU B 86 4.243 -2.422 -5.624 1.00 10.00 H new ATOM 0 HG LEU B 86 5.595 -3.023 -3.013 1.00 10.00 H new ATOM 0 HD11 LEU B 86 6.470 -0.652 -3.449 1.00 10.00 H new ATOM 0 HD12 LEU B 86 6.848 -1.743 -4.804 1.00 10.00 H new ATOM 0 HD13 LEU B 86 5.489 -0.601 -4.933 1.00 10.00 H new ATOM 0 HD21 LEU B 86 4.585 -1.052 -1.997 1.00 10.00 H new ATOM 0 HD22 LEU B 86 3.497 -0.896 -3.396 1.00 10.00 H new ATOM 0 HD23 LEU B 86 3.400 -2.332 -2.349 1.00 10.00 H new ATOM 1336 N MET B 87 1.557 -3.063 -5.950 1.00 10.00 N ATOM 1337 CA MET B 87 0.277 -2.421 -6.246 1.00 10.00 C ATOM 1338 C MET B 87 -0.888 -3.169 -5.588 1.00 10.00 C ATOM 1339 O MET B 87 -1.664 -2.576 -4.838 1.00 10.00 O ATOM 1340 CB MET B 87 0.103 -2.271 -7.774 1.00 10.00 C ATOM 1341 CG MET B 87 -0.289 -0.837 -8.120 1.00 10.00 C ATOM 1342 SD MET B 87 -1.942 -0.345 -7.575 1.00 10.00 S ATOM 1343 CE MET B 87 -1.792 1.423 -7.865 1.00 10.00 C ATOM 0 H MET B 87 2.070 -3.354 -6.782 1.00 10.00 H new ATOM 0 HA MET B 87 0.274 -1.420 -5.815 1.00 10.00 H new ATOM 0 HB2 MET B 87 1.031 -2.535 -8.281 1.00 10.00 H new ATOM 0 HB3 MET B 87 -0.662 -2.961 -8.130 1.00 10.00 H new ATOM 0 HG2 MET B 87 0.440 -0.160 -7.676 1.00 10.00 H new ATOM 0 HG3 MET B 87 -0.226 -0.710 -9.201 1.00 10.00 H new ATOM 0 HE1 MET B 87 -2.742 1.814 -8.230 1.00 10.00 H new ATOM 0 HE2 MET B 87 -1.528 1.923 -6.933 1.00 10.00 H new ATOM 0 HE3 MET B 87 -1.015 1.605 -8.607 1.00 10.00 H new ATOM 1353 N ALA B 88 -0.986 -4.485 -5.809 1.00 10.00 N ATOM 1354 CA ALA B 88 -2.004 -5.299 -5.161 1.00 10.00 C ATOM 1355 C ALA B 88 -1.834 -5.311 -3.624 1.00 10.00 C ATOM 1356 O ALA B 88 -2.824 -5.179 -2.905 1.00 10.00 O ATOM 1357 CB ALA B 88 -1.951 -6.709 -5.738 1.00 10.00 C ATOM 0 H ALA B 88 -0.369 -5.004 -6.434 1.00 10.00 H new ATOM 0 HA ALA B 88 -2.984 -4.865 -5.359 1.00 10.00 H new ATOM 0 HB1 ALA B 88 -2.710 -7.327 -5.259 1.00 10.00 H new ATOM 0 HB2 ALA B 88 -2.139 -6.670 -6.811 1.00 10.00 H new ATOM 0 HB3 ALA B 88 -0.966 -7.139 -5.557 1.00 10.00 H new ATOM 1363 N ALA B 89 -0.604 -5.427 -3.103 1.00 10.00 N ATOM 1364 CA ALA B 89 -0.324 -5.397 -1.667 1.00 10.00 C ATOM 1365 C ALA B 89 -0.666 -4.047 -1.012 1.00 10.00 C ATOM 1366 O ALA B 89 -1.227 -4.040 0.084 1.00 10.00 O ATOM 1367 CB ALA B 89 1.137 -5.774 -1.434 1.00 10.00 C ATOM 0 H ALA B 89 0.231 -5.545 -3.676 1.00 10.00 H new ATOM 0 HA ALA B 89 -0.974 -6.127 -1.185 1.00 10.00 H new ATOM 0 HB1 ALA B 89 1.352 -5.753 -0.366 1.00 10.00 H new ATOM 0 HB2 ALA B 89 1.321 -6.776 -1.822 1.00 10.00 H new ATOM 0 HB3 ALA B 89 1.783 -5.062 -1.948 1.00 10.00 H new ATOM 1373 N PHE B 90 -0.405 -2.917 -1.689 1.00 10.00 N ATOM 1374 CA PHE B 90 -0.862 -1.585 -1.284 1.00 10.00 C ATOM 1375 C PHE B 90 -2.375 -1.580 -1.152 1.00 10.00 C ATOM 1376 O PHE B 90 -2.862 -1.279 -0.069 1.00 10.00 O ATOM 1377 CB PHE B 90 -0.405 -0.506 -2.269 1.00 10.00 C ATOM 1378 CG PHE B 90 -1.020 0.876 -2.064 1.00 10.00 C ATOM 1379 CD1 PHE B 90 -0.748 1.613 -0.897 1.00 10.00 C ATOM 1380 CD2 PHE B 90 -1.833 1.458 -3.060 1.00 10.00 C ATOM 1381 CE1 PHE B 90 -1.197 2.931 -0.763 1.00 10.00 C ATOM 1382 CE2 PHE B 90 -2.311 2.772 -2.890 1.00 10.00 C ATOM 1383 CZ PHE B 90 -1.998 3.512 -1.747 1.00 10.00 C ATOM 0 H PHE B 90 0.141 -2.908 -2.550 1.00 10.00 H new ATOM 0 HA PHE B 90 -0.414 -1.352 -0.318 1.00 10.00 H new ATOM 0 HB2 PHE B 90 0.679 -0.415 -2.203 1.00 10.00 H new ATOM 0 HB3 PHE B 90 -0.636 -0.841 -3.280 1.00 10.00 H new ATOM 0 HD1 PHE B 90 -0.186 1.156 -0.096 1.00 10.00 H new ATOM 0 HD2 PHE B 90 -2.087 0.899 -3.948 1.00 10.00 H new ATOM 0 HE1 PHE B 90 -0.921 3.504 0.110 1.00 10.00 H new ATOM 0 HE2 PHE B 90 -2.930 3.215 -3.656 1.00 10.00 H new ATOM 0 HZ PHE B 90 -2.370 4.519 -1.627 1.00 10.00 H new ATOM 1393 N ILE B 91 -3.099 -1.946 -2.231 1.00 10.00 N ATOM 1394 CA ILE B 91 -4.559 -2.013 -2.195 1.00 10.00 C ATOM 1395 C ILE B 91 -4.987 -2.888 -1.011 1.00 10.00 C ATOM 1396 O ILE B 91 -5.634 -2.385 -0.101 1.00 10.00 O ATOM 1397 CB ILE B 91 -5.171 -2.457 -3.546 1.00 10.00 C ATOM 1398 CG1 ILE B 91 -4.854 -1.436 -4.669 1.00 10.00 C ATOM 1399 CG2 ILE B 91 -6.699 -2.590 -3.401 1.00 10.00 C ATOM 1400 CD1 ILE B 91 -5.236 -1.896 -6.080 1.00 10.00 C ATOM 0 H ILE B 91 -2.690 -2.197 -3.131 1.00 10.00 H new ATOM 0 HA ILE B 91 -4.959 -1.011 -2.041 1.00 10.00 H new ATOM 0 HB ILE B 91 -4.733 -3.417 -3.817 1.00 10.00 H new ATOM 0 HG12 ILE B 91 -5.376 -0.504 -4.452 1.00 10.00 H new ATOM 0 HG13 ILE B 91 -3.787 -1.216 -4.650 1.00 10.00 H new ATOM 0 HG21 ILE B 91 -7.129 -2.903 -4.353 1.00 10.00 H new ATOM 0 HG22 ILE B 91 -6.929 -3.333 -2.637 1.00 10.00 H new ATOM 0 HG23 ILE B 91 -7.122 -1.628 -3.110 1.00 10.00 H new ATOM 0 HD11 ILE B 91 -4.978 -1.118 -6.799 1.00 10.00 H new ATOM 0 HD12 ILE B 91 -4.694 -2.810 -6.324 1.00 10.00 H new ATOM 0 HD13 ILE B 91 -6.308 -2.087 -6.122 1.00 10.00 H new ATOM 1412 N LYS B 92 -4.536 -4.153 -0.954 1.00 10.00 N ATOM 1413 CA LYS B 92 -4.860 -5.107 0.112 1.00 10.00 C ATOM 1414 C LYS B 92 -4.610 -4.548 1.508 1.00 10.00 C ATOM 1415 O LYS B 92 -5.552 -4.489 2.304 1.00 10.00 O ATOM 1416 CB LYS B 92 -4.093 -6.421 -0.098 1.00 10.00 C ATOM 1417 CG LYS B 92 -4.363 -7.514 0.949 1.00 10.00 C ATOM 1418 CD LYS B 92 -5.793 -8.074 0.913 1.00 10.00 C ATOM 1419 CE LYS B 92 -6.820 -7.319 1.766 1.00 10.00 C ATOM 1420 NZ LYS B 92 -8.194 -7.737 1.427 1.00 10.00 N ATOM 0 H LYS B 92 -3.922 -4.546 -1.667 1.00 10.00 H new ATOM 0 HA LYS B 92 -5.930 -5.303 0.049 1.00 10.00 H new ATOM 0 HB2 LYS B 92 -4.343 -6.815 -1.083 1.00 10.00 H new ATOM 0 HB3 LYS B 92 -3.025 -6.202 -0.104 1.00 10.00 H new ATOM 0 HG2 LYS B 92 -3.659 -8.332 0.795 1.00 10.00 H new ATOM 0 HG3 LYS B 92 -4.168 -7.108 1.942 1.00 10.00 H new ATOM 0 HD2 LYS B 92 -6.137 -8.077 -0.121 1.00 10.00 H new ATOM 0 HD3 LYS B 92 -5.766 -9.113 1.243 1.00 10.00 H new ATOM 0 HE2 LYS B 92 -6.629 -7.506 2.823 1.00 10.00 H new ATOM 0 HE3 LYS B 92 -6.712 -6.246 1.607 1.00 10.00 H new ATOM 0 HZ1 LYS B 92 -8.872 -7.213 2.017 1.00 10.00 H new ATOM 0 HZ2 LYS B 92 -8.380 -7.536 0.424 1.00 10.00 H new ATOM 0 HZ3 LYS B 92 -8.300 -8.757 1.601 1.00 10.00 H new ATOM 1434 N GLN B 93 -3.371 -4.169 1.846 1.00 10.00 N ATOM 1435 CA GLN B 93 -3.103 -3.709 3.208 1.00 10.00 C ATOM 1436 C GLN B 93 -3.748 -2.355 3.492 1.00 10.00 C ATOM 1437 O GLN B 93 -4.101 -2.135 4.645 1.00 10.00 O ATOM 1438 CB GLN B 93 -1.609 -3.773 3.602 1.00 10.00 C ATOM 1439 CG GLN B 93 -1.391 -3.993 5.121 1.00 10.00 C ATOM 1440 CD GLN B 93 -0.982 -2.763 5.944 1.00 10.00 C ATOM 1441 OE1 GLN B 93 0.174 -2.629 6.316 1.00 10.00 O ATOM 1442 NE2 GLN B 93 -1.875 -1.832 6.241 1.00 10.00 N ATOM 0 H GLN B 93 -2.567 -4.171 1.219 1.00 10.00 H new ATOM 0 HA GLN B 93 -3.589 -4.426 3.870 1.00 10.00 H new ATOM 0 HB2 GLN B 93 -1.128 -4.581 3.051 1.00 10.00 H new ATOM 0 HB3 GLN B 93 -1.120 -2.847 3.301 1.00 10.00 H new ATOM 0 HG2 GLN B 93 -2.313 -4.393 5.543 1.00 10.00 H new ATOM 0 HG3 GLN B 93 -0.624 -4.757 5.248 1.00 10.00 H new ATOM 0 HE21 GLN B 93 -2.842 -1.937 5.934 1.00 10.00 H new ATOM 0 HE22 GLN B 93 -1.596 -1.010 6.777 1.00 10.00 H new ATOM 1451 N ARG B 94 -3.987 -1.484 2.497 1.00 10.00 N ATOM 1452 CA ARG B 94 -4.806 -0.276 2.689 1.00 10.00 C ATOM 1453 C ARG B 94 -6.253 -0.630 3.020 1.00 10.00 C ATOM 1454 O ARG B 94 -6.751 -0.118 4.025 1.00 10.00 O ATOM 1455 CB ARG B 94 -4.752 0.681 1.485 1.00 10.00 C ATOM 1456 CG ARG B 94 -3.460 1.509 1.400 1.00 10.00 C ATOM 1457 CD ARG B 94 -3.124 2.321 2.669 1.00 10.00 C ATOM 1458 NE ARG B 94 -4.251 3.125 3.193 1.00 10.00 N ATOM 1459 CZ ARG B 94 -4.785 4.205 2.660 1.00 10.00 C ATOM 1460 NH1 ARG B 94 -4.354 4.705 1.541 1.00 10.00 N ATOM 1461 NH2 ARG B 94 -5.802 4.813 3.209 1.00 10.00 N ATOM 0 H ARG B 94 -3.624 -1.595 1.550 1.00 10.00 H new ATOM 0 HA ARG B 94 -4.370 0.250 3.539 1.00 10.00 H new ATOM 0 HB2 ARG B 94 -4.860 0.101 0.568 1.00 10.00 H new ATOM 0 HB3 ARG B 94 -5.603 1.360 1.535 1.00 10.00 H new ATOM 0 HG2 ARG B 94 -2.629 0.837 1.185 1.00 10.00 H new ATOM 0 HG3 ARG B 94 -3.541 2.196 0.557 1.00 10.00 H new ATOM 0 HD2 ARG B 94 -2.789 1.635 3.447 1.00 10.00 H new ATOM 0 HD3 ARG B 94 -2.289 2.986 2.450 1.00 10.00 H new ATOM 0 HE ARG B 94 -4.663 2.805 4.070 1.00 10.00 H new ATOM 0 HH11 ARG B 94 -3.580 4.260 1.048 1.00 10.00 H new ATOM 0 HH12 ARG B 94 -4.790 5.543 1.155 1.00 10.00 H new ATOM 0 HH21 ARG B 94 -6.205 4.453 4.074 1.00 10.00 H new ATOM 0 HH22 ARG B 94 -6.194 5.647 2.772 1.00 10.00 H new ATOM 1475 N THR B 95 -6.914 -1.494 2.231 1.00 10.00 N ATOM 1476 CA THR B 95 -8.286 -1.932 2.540 1.00 10.00 C ATOM 1477 C THR B 95 -8.356 -2.579 3.932 1.00 10.00 C ATOM 1478 O THR B 95 -9.279 -2.289 4.699 1.00 10.00 O ATOM 1479 CB THR B 95 -8.881 -2.887 1.481 1.00 10.00 C ATOM 1480 OG1 THR B 95 -8.380 -2.691 0.187 1.00 10.00 O ATOM 1481 CG2 THR B 95 -10.369 -2.604 1.346 1.00 10.00 C ATOM 0 H THR B 95 -6.524 -1.900 1.381 1.00 10.00 H new ATOM 0 HA THR B 95 -8.896 -1.029 2.527 1.00 10.00 H new ATOM 0 HB THR B 95 -8.630 -3.889 1.828 1.00 10.00 H new ATOM 0 HG1 THR B 95 -7.402 -2.756 0.201 1.00 10.00 H new ATOM 0 HG21 THR B 95 -10.800 -3.272 0.601 1.00 10.00 H new ATOM 0 HG22 THR B 95 -10.859 -2.767 2.306 1.00 10.00 H new ATOM 0 HG23 THR B 95 -10.516 -1.570 1.034 1.00 10.00 H new ATOM 1489 N ALA B 96 -7.360 -3.389 4.292 1.00 10.00 N ATOM 1490 CA ALA B 96 -7.217 -3.940 5.635 1.00 10.00 C ATOM 1491 C ALA B 96 -7.014 -2.857 6.714 1.00 10.00 C ATOM 1492 O ALA B 96 -7.704 -2.895 7.727 1.00 10.00 O ATOM 1493 CB ALA B 96 -6.089 -4.983 5.641 1.00 10.00 C ATOM 0 H ALA B 96 -6.623 -3.683 3.651 1.00 10.00 H new ATOM 0 HA ALA B 96 -8.154 -4.430 5.900 1.00 10.00 H new ATOM 0 HB1 ALA B 96 -5.981 -5.396 6.644 1.00 10.00 H new ATOM 0 HB2 ALA B 96 -6.331 -5.784 4.943 1.00 10.00 H new ATOM 0 HB3 ALA B 96 -5.154 -4.510 5.341 1.00 10.00 H new ATOM 1499 N LYS B 97 -6.115 -1.876 6.504 1.00 10.00 N ATOM 1500 CA LYS B 97 -5.891 -0.717 7.398 1.00 10.00 C ATOM 1501 C LYS B 97 -7.200 -0.005 7.676 1.00 10.00 C ATOM 1502 O LYS B 97 -7.486 0.317 8.828 1.00 10.00 O ATOM 1503 CB LYS B 97 -4.746 0.218 6.905 1.00 10.00 C ATOM 1504 CG LYS B 97 -5.067 1.651 6.455 1.00 10.00 C ATOM 1505 CD LYS B 97 -5.225 2.627 7.628 1.00 10.00 C ATOM 1506 CE LYS B 97 -5.589 4.035 7.147 1.00 10.00 C ATOM 1507 NZ LYS B 97 -5.593 4.989 8.281 1.00 10.00 N ATOM 0 H LYS B 97 -5.506 -1.865 5.686 1.00 10.00 H new ATOM 0 HA LYS B 97 -5.527 -1.090 8.355 1.00 10.00 H new ATOM 0 HB2 LYS B 97 -4.014 0.287 7.710 1.00 10.00 H new ATOM 0 HB3 LYS B 97 -4.255 -0.282 6.070 1.00 10.00 H new ATOM 0 HG2 LYS B 97 -4.273 2.006 5.799 1.00 10.00 H new ATOM 0 HG3 LYS B 97 -5.986 1.645 5.869 1.00 10.00 H new ATOM 0 HD2 LYS B 97 -5.998 2.262 8.304 1.00 10.00 H new ATOM 0 HD3 LYS B 97 -4.296 2.665 8.197 1.00 10.00 H new ATOM 0 HE2 LYS B 97 -4.875 4.363 6.391 1.00 10.00 H new ATOM 0 HE3 LYS B 97 -6.571 4.021 6.673 1.00 10.00 H new ATOM 0 HZ1 LYS B 97 -6.165 5.821 8.033 1.00 10.00 H new ATOM 0 HZ2 LYS B 97 -5.998 4.528 9.121 1.00 10.00 H new ATOM 0 HZ3 LYS B 97 -4.618 5.288 8.486 1.00 10.00 H new ATOM 1521 N TYR B 98 -8.004 0.204 6.628 1.00 10.00 N ATOM 1522 CA TYR B 98 -9.332 0.773 6.762 1.00 10.00 C ATOM 1523 C TYR B 98 -10.214 -0.049 7.706 1.00 10.00 C ATOM 1524 O TYR B 98 -10.602 0.497 8.735 1.00 10.00 O ATOM 1525 CB TYR B 98 -9.991 0.972 5.406 1.00 10.00 C ATOM 1526 CG TYR B 98 -9.617 2.269 4.743 1.00 10.00 C ATOM 1527 CD1 TYR B 98 -10.012 3.472 5.344 1.00 10.00 C ATOM 1528 CD2 TYR B 98 -8.930 2.282 3.516 1.00 10.00 C ATOM 1529 CE1 TYR B 98 -9.716 4.699 4.726 1.00 10.00 C ATOM 1530 CE2 TYR B 98 -8.698 3.499 2.848 1.00 10.00 C ATOM 1531 CZ TYR B 98 -9.092 4.716 3.462 1.00 10.00 C ATOM 1532 OH TYR B 98 -8.867 5.937 2.902 1.00 10.00 O ATOM 0 H TYR B 98 -7.744 -0.019 5.667 1.00 10.00 H new ATOM 0 HA TYR B 98 -9.216 1.757 7.215 1.00 10.00 H new ATOM 0 HB2 TYR B 98 -9.715 0.145 4.752 1.00 10.00 H new ATOM 0 HB3 TYR B 98 -11.074 0.934 5.528 1.00 10.00 H new ATOM 0 HD1 TYR B 98 -10.545 3.456 6.283 1.00 10.00 H new ATOM 0 HD2 TYR B 98 -8.580 1.356 3.085 1.00 10.00 H new ATOM 0 HE1 TYR B 98 -9.966 5.627 5.218 1.00 10.00 H new ATOM 0 HE2 TYR B 98 -8.225 3.506 1.877 1.00 10.00 H new ATOM 0 HH TYR B 98 -8.975 5.876 1.930 1.00 10.00 H new ATOM 1542 N VAL B 99 -10.476 -1.325 7.411 1.00 10.00 N ATOM 1543 CA VAL B 99 -11.340 -2.148 8.273 1.00 10.00 C ATOM 1544 C VAL B 99 -10.753 -2.436 9.656 1.00 10.00 C ATOM 1545 O VAL B 99 -11.504 -2.742 10.575 1.00 10.00 O ATOM 1546 CB VAL B 99 -11.832 -3.437 7.591 1.00 10.00 C ATOM 1547 CG1 VAL B 99 -12.699 -3.057 6.394 1.00 10.00 C ATOM 1548 CG2 VAL B 99 -10.727 -4.388 7.136 1.00 10.00 C ATOM 0 H VAL B 99 -10.109 -1.810 6.592 1.00 10.00 H new ATOM 0 HA VAL B 99 -12.215 -1.520 8.441 1.00 10.00 H new ATOM 0 HB VAL B 99 -12.394 -3.986 8.347 1.00 10.00 H new ATOM 0 HG11 VAL B 99 -13.055 -3.962 5.901 1.00 10.00 H new ATOM 0 HG12 VAL B 99 -13.552 -2.470 6.734 1.00 10.00 H new ATOM 0 HG13 VAL B 99 -12.110 -2.468 5.691 1.00 10.00 H new ATOM 0 HG21 VAL B 99 -11.172 -5.266 6.668 1.00 10.00 H new ATOM 0 HG22 VAL B 99 -10.083 -3.881 6.417 1.00 10.00 H new ATOM 0 HG23 VAL B 99 -10.135 -4.697 7.998 1.00 10.00 H new