USER MOD reduce.3.24.130724 H: found=0, std=0, add=1049, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1051 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 71 GLN : amide:sc= 0.177 K(o=2.9,f=-4.1!) USER MOD Set 1.2: A 75 THR OG1 : rot 62:sc= 1.98 USER MOD Set 1.3: B 75 THR OG1 : rot 65:sc= 0.707 USER MOD Set 2.1: B 20 SER OG : rot -57:sc= 1.57 USER MOD Set 2.2: B 26 LYS NZ :NH3+ -154:sc= 2.18 (180deg=0.793!) USER MOD Set 2.3: B 30 SER OG : rot 38:sc= 1.03 USER MOD Set 3.1: A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: B 69 ASN : amide:sc= -0.161 K(o=-0.16,f=-2.3!) USER MOD Set 4.1: A 20 SER OG : rot 89:sc= 1.01 USER MOD Set 4.2: A 27 HIS : no HD1:sc= 0.465 K(o=2.7,f=-7.9!) USER MOD Set 4.3: A 28 THR OG1 : rot 31:sc= 1.26 USER MOD Single : A 17 HIS : no HD1:sc= -1.91 K(o=-1.9,f=-1) USER MOD Single : A 18 LYS NZ :NH3+ -121:sc= 1.2 (180deg=-0.406) USER MOD Single : A 19 TYR OH : rot 180:sc= 1.24 USER MOD Single : A 26 LYS NZ :NH3+ 176:sc= 0.658 (180deg=0.57) USER MOD Single : A 30 SER OG : rot 180:sc= -0.22 USER MOD Single : A 31 LYS NZ :NH3+ 175:sc= 1.78 (180deg=1.48) USER MOD Single : A 32 LYS NZ :NH3+ -152:sc= 1.19 (180deg=-2.44) USER MOD Single : A 35 LYS NZ :NH3+ 130:sc= 1.14 (180deg=0.884) USER MOD Single : A 39 GLN : amide:sc= -0.594 X(o=-0.59,f=-0.096) USER MOD Single : A 40 LYS NZ :NH3+ -172:sc= -0.132! (180deg=-0.725!) USER MOD Single : A 43 THR OG1 : rot -29:sc= 0.958 USER MOD Single : A 57 MET CE :methyl -176:sc= 0 (180deg=-0.0251) USER MOD Single : A 63 ASN : amide:sc= 0.275 K(o=0.27,f=-0.8) USER MOD Single : A 64 LYS NZ :NH3+ -166:sc= 0.527! (180deg=-1.14!) USER MOD Single : A 66 GLN : amide:sc= 1.1 K(o=1.1,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.873 K(o=0.87,f=-6.6!) USER MOD Single : A 73 TYR OH : rot 157:sc= 1.21 USER MOD Single : A 84 TYR OH : rot 160:sc= 1.23 USER MOD Single : A 85 ASN : amide:sc= -1 X(o=-1,f=-1.5) USER MOD Single : B 17 HIS : no HD1:sc= -2.98 K(o=-3,f=-3.7!) USER MOD Single : B 18 LYS NZ :NH3+ 142:sc= -0.333 (180deg=-2.24!) USER MOD Single : B 19 TYR OH : rot 146:sc= 1.24 USER MOD Single : B 27 HIS : no HD1:sc= -0.277 X(o=-0.28,f=-0.017) USER MOD Single : B 28 THR OG1 : rot 82:sc= 1.24 USER MOD Single : B 31 LYS NZ :NH3+ 155:sc= 0.615! (180deg=-0.976!) USER MOD Single : B 32 LYS NZ :NH3+ 151:sc= 1.26 (180deg=-0.125) USER MOD Single : B 35 LYS NZ :NH3+ 173:sc= 1.38 (180deg=1.08) USER MOD Single : B 39 GLN : amide:sc= 0 K(o=0,f=0.66) USER MOD Single : B 40 LYS NZ :NH3+ 148:sc= -0.0313 (180deg=-2.23!) USER MOD Single : B 43 THR OG1 : rot -110:sc= 1.29 USER MOD Single : B 63 ASN : amide:sc= -0.299 X(o=-0.3,f=-0.0031) USER MOD Single : B 64 LYS NZ :NH3+ -171:sc= 0.833! (180deg=0.557) USER MOD Single : B 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 73 TYR OH : rot -35:sc= 0.971 USER MOD Single : B 82 MET CE :methyl 179:sc= 0 (180deg=-0.00168) USER MOD Single : B 84 TYR OH : rot -141:sc= 1.14 USER MOD Single : B 85 ASN : amide:sc= -1.47 K(o=-1.5,f=-0.045) USER MOD ----------------------------------------------------------------- ATOM 113 N ILE A 9 -1.777 -3.838 -6.835 1.00 0.00 N ATOM 114 CA ILE A 9 -1.132 -2.634 -6.317 1.00 0.00 C ATOM 115 C ILE A 9 -0.232 -3.023 -5.135 1.00 0.00 C ATOM 116 O ILE A 9 0.898 -2.552 -5.010 1.00 0.00 O ATOM 117 CB ILE A 9 -2.200 -1.589 -5.933 1.00 0.00 C ATOM 118 CG1 ILE A 9 -3.078 -1.160 -7.125 1.00 0.00 C ATOM 119 CG2 ILE A 9 -1.562 -0.353 -5.289 1.00 0.00 C ATOM 120 CD1 ILE A 9 -2.359 -0.312 -8.181 1.00 0.00 C ATOM 0 HA ILE A 9 -0.503 -2.175 -7.079 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.849 -2.080 -5.208 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -3.475 -2.054 -7.606 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -3.931 -0.597 -6.746 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -2.340 0.365 -5.030 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -1.026 -0.648 -4.387 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -0.866 0.105 -5.992 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -3.056 -0.058 -8.980 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -1.986 0.603 -7.721 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -1.523 -0.877 -8.594 1.00 0.00 H new ATOM 132 N GLY A 10 -0.731 -3.926 -4.293 1.00 0.00 N ATOM 133 CA GLY A 10 -0.053 -4.542 -3.170 1.00 0.00 C ATOM 134 C GLY A 10 1.355 -5.005 -3.518 1.00 0.00 C ATOM 135 O GLY A 10 2.271 -4.745 -2.747 1.00 0.00 O ATOM 0 H GLY A 10 -1.688 -4.266 -4.391 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -0.004 -3.831 -2.345 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -0.636 -5.395 -2.822 1.00 0.00 H new ATOM 139 N LEU A 11 1.552 -5.668 -4.662 1.00 0.00 N ATOM 140 CA LEU A 11 2.891 -6.058 -5.103 1.00 0.00 C ATOM 141 C LEU A 11 3.807 -4.831 -5.151 1.00 0.00 C ATOM 142 O LEU A 11 4.864 -4.804 -4.516 1.00 0.00 O ATOM 143 CB LEU A 11 2.852 -6.749 -6.476 1.00 0.00 C ATOM 144 CG LEU A 11 2.018 -8.040 -6.533 1.00 0.00 C ATOM 145 CD1 LEU A 11 2.031 -8.578 -7.968 1.00 0.00 C ATOM 146 CD2 LEU A 11 2.545 -9.116 -5.578 1.00 0.00 C ATOM 0 H LEU A 11 0.802 -5.944 -5.296 1.00 0.00 H new ATOM 0 HA LEU A 11 3.288 -6.773 -4.382 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.455 -6.046 -7.208 1.00 0.00 H new ATOM 0 HB3 LEU A 11 3.873 -6.981 -6.778 1.00 0.00 H new ATOM 0 HG LEU A 11 1.003 -7.797 -6.220 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.442 -9.494 -8.019 1.00 0.00 H new ATOM 0 HD12 LEU A 11 1.603 -7.834 -8.640 1.00 0.00 H new ATOM 0 HD13 LEU A 11 3.057 -8.790 -8.268 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.923 -10.008 -5.655 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.572 -9.366 -5.843 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.516 -8.741 -4.555 1.00 0.00 H new ATOM 158 N LEU A 12 3.388 -3.794 -5.882 1.00 0.00 N ATOM 159 CA LEU A 12 4.167 -2.572 -6.022 1.00 0.00 C ATOM 160 C LEU A 12 4.385 -1.926 -4.651 1.00 0.00 C ATOM 161 O LEU A 12 5.481 -1.445 -4.366 1.00 0.00 O ATOM 162 CB LEU A 12 3.504 -1.591 -7.004 1.00 0.00 C ATOM 163 CG LEU A 12 3.579 -1.963 -8.499 1.00 0.00 C ATOM 164 CD1 LEU A 12 5.021 -2.127 -8.994 1.00 0.00 C ATOM 165 CD2 LEU A 12 2.750 -3.198 -8.865 1.00 0.00 C ATOM 0 H LEU A 12 2.503 -3.783 -6.389 1.00 0.00 H new ATOM 0 HA LEU A 12 5.140 -2.832 -6.439 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.454 -1.490 -6.729 1.00 0.00 H new ATOM 0 HB3 LEU A 12 3.964 -0.612 -6.872 1.00 0.00 H new ATOM 0 HG LEU A 12 3.135 -1.112 -9.015 1.00 0.00 H new ATOM 0 HD11 LEU A 12 5.015 -2.389 -10.052 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.562 -1.191 -8.855 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.512 -2.918 -8.428 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.850 -3.400 -9.931 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.107 -4.057 -8.297 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.702 -3.016 -8.627 1.00 0.00 H new ATOM 177 N ILE A 13 3.369 -1.922 -3.784 1.00 0.00 N ATOM 178 CA ILE A 13 3.536 -1.455 -2.411 1.00 0.00 C ATOM 179 C ILE A 13 4.566 -2.316 -1.664 1.00 0.00 C ATOM 180 O ILE A 13 5.345 -1.795 -0.870 1.00 0.00 O ATOM 181 CB ILE A 13 2.192 -1.391 -1.667 1.00 0.00 C ATOM 182 CG1 ILE A 13 1.254 -0.346 -2.296 1.00 0.00 C ATOM 183 CG2 ILE A 13 2.479 -1.009 -0.211 1.00 0.00 C ATOM 184 CD1 ILE A 13 -0.188 -0.418 -1.776 1.00 0.00 C ATOM 0 H ILE A 13 2.426 -2.237 -4.011 1.00 0.00 H new ATOM 0 HA ILE A 13 3.922 -0.436 -2.447 1.00 0.00 H new ATOM 0 HB ILE A 13 1.698 -2.361 -1.730 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.652 0.650 -2.101 1.00 0.00 H new ATOM 0 HG13 ILE A 13 1.248 -0.481 -3.378 1.00 0.00 H new ATOM 0 HG21 ILE A 13 1.542 -0.956 0.343 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.126 -1.761 0.242 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.974 -0.038 -0.180 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -0.790 0.348 -2.265 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.605 -1.401 -1.995 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -0.195 -0.253 -0.699 1.00 0.00 H new ATOM 196 N GLY A 14 4.580 -3.627 -1.899 1.00 0.00 N ATOM 197 CA GLY A 14 5.566 -4.542 -1.353 1.00 0.00 C ATOM 198 C GLY A 14 6.965 -4.038 -1.687 1.00 0.00 C ATOM 199 O GLY A 14 7.735 -3.694 -0.788 1.00 0.00 O ATOM 0 H GLY A 14 3.887 -4.088 -2.489 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.445 -4.622 -0.273 1.00 0.00 H new ATOM 0 HA3 GLY A 14 5.419 -5.540 -1.765 1.00 0.00 H new ATOM 203 N ILE A 15 7.260 -3.947 -2.989 1.00 0.00 N ATOM 204 CA ILE A 15 8.542 -3.443 -3.471 1.00 0.00 C ATOM 205 C ILE A 15 8.820 -2.062 -2.863 1.00 0.00 C ATOM 206 O ILE A 15 9.946 -1.797 -2.447 1.00 0.00 O ATOM 207 CB ILE A 15 8.605 -3.444 -5.017 1.00 0.00 C ATOM 208 CG1 ILE A 15 8.842 -4.855 -5.596 1.00 0.00 C ATOM 209 CG2 ILE A 15 9.775 -2.583 -5.528 1.00 0.00 C ATOM 210 CD1 ILE A 15 7.638 -5.796 -5.528 1.00 0.00 C ATOM 0 H ILE A 15 6.617 -4.221 -3.732 1.00 0.00 H new ATOM 0 HA ILE A 15 9.336 -4.113 -3.141 1.00 0.00 H new ATOM 0 HB ILE A 15 7.640 -3.052 -5.340 1.00 0.00 H new ATOM 0 HG12 ILE A 15 9.148 -4.757 -6.638 1.00 0.00 H new ATOM 0 HG13 ILE A 15 9.673 -5.315 -5.062 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.793 -2.603 -6.618 1.00 0.00 H new ATOM 0 HG22 ILE A 15 9.647 -1.556 -5.186 1.00 0.00 H new ATOM 0 HG23 ILE A 15 10.714 -2.979 -5.142 1.00 0.00 H new ATOM 0 HD11 ILE A 15 7.905 -6.761 -5.959 1.00 0.00 H new ATOM 0 HD12 ILE A 15 7.341 -5.933 -4.488 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.808 -5.366 -6.088 1.00 0.00 H new ATOM 222 N PHE A 16 7.794 -1.199 -2.803 1.00 0.00 N ATOM 223 CA PHE A 16 7.928 0.205 -2.449 1.00 0.00 C ATOM 224 C PHE A 16 8.839 0.411 -1.247 1.00 0.00 C ATOM 225 O PHE A 16 9.997 0.801 -1.378 1.00 0.00 O ATOM 226 CB PHE A 16 6.549 0.865 -2.286 1.00 0.00 C ATOM 227 CG PHE A 16 6.554 2.307 -1.830 1.00 0.00 C ATOM 228 CD1 PHE A 16 7.160 3.289 -2.632 1.00 0.00 C ATOM 229 CD2 PHE A 16 5.832 2.688 -0.680 1.00 0.00 C ATOM 230 CE1 PHE A 16 7.154 4.633 -2.221 1.00 0.00 C ATOM 231 CE2 PHE A 16 5.794 4.038 -0.293 1.00 0.00 C ATOM 232 CZ PHE A 16 6.514 4.994 -1.025 1.00 0.00 C ATOM 0 H PHE A 16 6.832 -1.473 -3.005 1.00 0.00 H new ATOM 0 HA PHE A 16 8.423 0.713 -3.276 1.00 0.00 H new ATOM 0 HB2 PHE A 16 6.026 0.808 -3.241 1.00 0.00 H new ATOM 0 HB3 PHE A 16 5.971 0.280 -1.571 1.00 0.00 H new ATOM 0 HD1 PHE A 16 7.630 3.011 -3.564 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.309 1.943 -0.098 1.00 0.00 H new ATOM 0 HE1 PHE A 16 7.640 5.386 -2.824 1.00 0.00 H new ATOM 0 HE2 PHE A 16 5.212 4.339 0.566 1.00 0.00 H new ATOM 0 HZ PHE A 16 6.576 6.011 -0.667 1.00 0.00 H new ATOM 242 N HIS A 17 8.333 0.109 -0.059 1.00 0.00 N ATOM 243 CA HIS A 17 9.126 0.312 1.141 1.00 0.00 C ATOM 244 C HIS A 17 10.209 -0.760 1.298 1.00 0.00 C ATOM 245 O HIS A 17 11.176 -0.508 2.013 1.00 0.00 O ATOM 246 CB HIS A 17 8.228 0.517 2.362 1.00 0.00 C ATOM 247 CG HIS A 17 7.050 -0.413 2.414 1.00 0.00 C ATOM 248 ND1 HIS A 17 7.092 -1.754 2.099 1.00 0.00 N ATOM 249 CD2 HIS A 17 5.740 -0.018 2.451 1.00 0.00 C ATOM 250 CE1 HIS A 17 5.828 -2.156 1.908 1.00 0.00 C ATOM 251 NE2 HIS A 17 4.982 -1.141 2.182 1.00 0.00 N ATOM 0 H HIS A 17 7.398 -0.269 0.097 1.00 0.00 H new ATOM 0 HA HIS A 17 9.687 1.241 1.043 1.00 0.00 H new ATOM 0 HB2 HIS A 17 8.824 0.384 3.265 1.00 0.00 H new ATOM 0 HB3 HIS A 17 7.867 1.545 2.367 1.00 0.00 H new ATOM 0 HD2 HIS A 17 5.371 0.977 2.651 1.00 0.00 H new ATOM 0 HE1 HIS A 17 5.531 -3.143 1.584 1.00 0.00 H new ATOM 0 HE2 HIS A 17 3.963 -1.194 2.189 1.00 0.00 H new ATOM 259 N LYS A 18 10.122 -1.911 0.606 1.00 0.00 N ATOM 260 CA LYS A 18 11.254 -2.841 0.568 1.00 0.00 C ATOM 261 C LYS A 18 12.501 -2.095 0.097 1.00 0.00 C ATOM 262 O LYS A 18 13.598 -2.315 0.623 1.00 0.00 O ATOM 263 CB LYS A 18 10.962 -4.085 -0.290 1.00 0.00 C ATOM 264 CG LYS A 18 12.053 -5.167 -0.179 1.00 0.00 C ATOM 265 CD LYS A 18 13.233 -4.999 -1.158 1.00 0.00 C ATOM 266 CE LYS A 18 14.590 -5.403 -0.553 1.00 0.00 C ATOM 267 NZ LYS A 18 14.957 -4.541 0.591 1.00 0.00 N ATOM 0 H LYS A 18 9.301 -2.210 0.080 1.00 0.00 H new ATOM 0 HA LYS A 18 11.429 -3.219 1.575 1.00 0.00 H new ATOM 0 HB2 LYS A 18 10.005 -4.511 0.012 1.00 0.00 H new ATOM 0 HB3 LYS A 18 10.862 -3.784 -1.333 1.00 0.00 H new ATOM 0 HG2 LYS A 18 12.442 -5.168 0.839 1.00 0.00 H new ATOM 0 HG3 LYS A 18 11.596 -6.142 -0.347 1.00 0.00 H new ATOM 0 HD2 LYS A 18 13.046 -5.601 -2.047 1.00 0.00 H new ATOM 0 HD3 LYS A 18 13.282 -3.959 -1.481 1.00 0.00 H new ATOM 0 HE2 LYS A 18 14.548 -6.442 -0.227 1.00 0.00 H new ATOM 0 HE3 LYS A 18 15.363 -5.340 -1.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 15.863 -4.070 0.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 14.218 -3.824 0.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 15.048 -5.122 1.448 1.00 0.00 H new ATOM 281 N TYR A 19 12.349 -1.164 -0.849 1.00 0.00 N ATOM 282 CA TYR A 19 13.427 -0.272 -1.260 1.00 0.00 C ATOM 283 C TYR A 19 13.676 0.820 -0.195 1.00 0.00 C ATOM 284 O TYR A 19 13.711 2.012 -0.483 1.00 0.00 O ATOM 285 CB TYR A 19 13.172 0.242 -2.693 1.00 0.00 C ATOM 286 CG TYR A 19 13.569 -0.723 -3.805 1.00 0.00 C ATOM 287 CD1 TYR A 19 13.129 -2.059 -3.782 1.00 0.00 C ATOM 288 CD2 TYR A 19 14.357 -0.282 -4.888 1.00 0.00 C ATOM 289 CE1 TYR A 19 13.589 -2.973 -4.741 1.00 0.00 C ATOM 290 CE2 TYR A 19 14.710 -1.168 -5.923 1.00 0.00 C ATOM 291 CZ TYR A 19 14.381 -2.530 -5.813 1.00 0.00 C ATOM 292 OH TYR A 19 14.838 -3.432 -6.721 1.00 0.00 O ATOM 0 H TYR A 19 11.473 -1.011 -1.349 1.00 0.00 H new ATOM 0 HA TYR A 19 14.371 -0.815 -1.314 1.00 0.00 H new ATOM 0 HB2 TYR A 19 12.112 0.475 -2.796 1.00 0.00 H new ATOM 0 HB3 TYR A 19 13.718 1.175 -2.830 1.00 0.00 H new ATOM 0 HD1 TYR A 19 12.433 -2.382 -3.022 1.00 0.00 H new ATOM 0 HD2 TYR A 19 14.692 0.744 -4.924 1.00 0.00 H new ATOM 0 HE1 TYR A 19 13.334 -4.019 -4.655 1.00 0.00 H new ATOM 0 HE2 TYR A 19 15.230 -0.804 -6.796 1.00 0.00 H new ATOM 0 HH TYR A 19 15.370 -2.970 -7.402 1.00 0.00 H new ATOM 302 N SER A 20 13.877 0.388 1.052 1.00 0.00 N ATOM 303 CA SER A 20 14.384 1.156 2.179 1.00 0.00 C ATOM 304 C SER A 20 15.638 0.484 2.746 1.00 0.00 C ATOM 305 O SER A 20 16.474 1.152 3.360 1.00 0.00 O ATOM 306 CB SER A 20 13.323 1.306 3.272 1.00 0.00 C ATOM 307 OG SER A 20 12.185 1.938 2.731 1.00 0.00 O ATOM 0 H SER A 20 13.674 -0.577 1.314 1.00 0.00 H new ATOM 0 HA SER A 20 14.640 2.154 1.823 1.00 0.00 H new ATOM 0 HB2 SER A 20 13.055 0.328 3.672 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.719 1.892 4.102 1.00 0.00 H new ATOM 0 HG SER A 20 11.580 1.262 2.361 1.00 0.00 H new ATOM 376 N LYS A 26 7.241 -0.355 5.887 1.00 0.00 N ATOM 377 CA LYS A 26 5.895 0.185 5.803 1.00 0.00 C ATOM 378 C LYS A 26 5.863 1.675 5.423 1.00 0.00 C ATOM 379 O LYS A 26 4.793 2.150 5.048 1.00 0.00 O ATOM 380 CB LYS A 26 5.169 -0.096 7.127 1.00 0.00 C ATOM 381 CG LYS A 26 3.652 0.109 7.016 1.00 0.00 C ATOM 382 CD LYS A 26 2.949 -0.577 8.197 1.00 0.00 C ATOM 383 CE LYS A 26 1.427 -0.374 8.190 1.00 0.00 C ATOM 384 NZ LYS A 26 0.833 -0.698 6.879 1.00 0.00 N ATOM 0 HA LYS A 26 5.371 -0.316 4.989 1.00 0.00 H new ATOM 0 HB2 LYS A 26 5.373 -1.120 7.440 1.00 0.00 H new ATOM 0 HB3 LYS A 26 5.566 0.559 7.902 1.00 0.00 H new ATOM 0 HG2 LYS A 26 3.419 1.174 7.010 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.288 -0.302 6.075 1.00 0.00 H new ATOM 0 HD2 LYS A 26 3.168 -1.645 8.172 1.00 0.00 H new ATOM 0 HD3 LYS A 26 3.357 -0.190 9.130 1.00 0.00 H new ATOM 0 HE2 LYS A 26 0.974 -1.001 8.958 1.00 0.00 H new ATOM 0 HE3 LYS A 26 1.198 0.660 8.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -0.202 -0.613 6.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 1.195 -0.038 6.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 1.086 -1.671 6.614 1.00 0.00 H new ATOM 398 N HIS A 27 6.973 2.427 5.517 1.00 0.00 N ATOM 399 CA HIS A 27 6.922 3.881 5.310 1.00 0.00 C ATOM 400 C HIS A 27 7.113 4.232 3.827 1.00 0.00 C ATOM 401 O HIS A 27 6.694 3.490 2.940 1.00 0.00 O ATOM 402 CB HIS A 27 7.876 4.613 6.285 1.00 0.00 C ATOM 403 CG HIS A 27 9.351 4.310 6.129 1.00 0.00 C ATOM 404 ND1 HIS A 27 10.170 4.697 5.081 1.00 0.00 N ATOM 405 CD2 HIS A 27 10.024 3.369 6.853 1.00 0.00 C ATOM 406 CE1 HIS A 27 11.275 3.935 5.118 1.00 0.00 C ATOM 407 NE2 HIS A 27 11.201 3.114 6.181 1.00 0.00 N ATOM 0 H HIS A 27 7.900 2.059 5.731 1.00 0.00 H new ATOM 0 HA HIS A 27 5.927 4.250 5.560 1.00 0.00 H new ATOM 0 HB2 HIS A 27 7.732 5.687 6.164 1.00 0.00 H new ATOM 0 HB3 HIS A 27 7.581 4.365 7.304 1.00 0.00 H new ATOM 0 HD2 HIS A 27 9.697 2.912 7.775 1.00 0.00 H new ATOM 0 HE1 HIS A 27 12.090 3.975 4.410 1.00 0.00 H new ATOM 0 HE2 HIS A 27 11.899 2.419 6.446 1.00 0.00 H new ATOM 415 N THR A 28 7.730 5.382 3.561 1.00 0.00 N ATOM 416 CA THR A 28 8.217 5.814 2.262 1.00 0.00 C ATOM 417 C THR A 28 9.231 4.815 1.694 1.00 0.00 C ATOM 418 O THR A 28 9.766 3.989 2.432 1.00 0.00 O ATOM 419 CB THR A 28 8.924 7.157 2.508 1.00 0.00 C ATOM 420 OG1 THR A 28 9.670 7.051 3.715 1.00 0.00 O ATOM 421 CG2 THR A 28 7.905 8.289 2.658 1.00 0.00 C ATOM 0 H THR A 28 7.911 6.072 4.290 1.00 0.00 H new ATOM 0 HA THR A 28 7.396 5.893 1.549 1.00 0.00 H new ATOM 0 HB THR A 28 9.572 7.381 1.661 1.00 0.00 H new ATOM 0 HG1 THR A 28 9.976 6.127 3.830 1.00 0.00 H new ATOM 0 HG21 THR A 28 8.429 9.229 2.831 1.00 0.00 H new ATOM 0 HG22 THR A 28 7.311 8.367 1.747 1.00 0.00 H new ATOM 0 HG23 THR A 28 7.249 8.078 3.502 1.00 0.00 H new ATOM 429 N LEU A 29 9.537 4.930 0.402 1.00 0.00 N ATOM 430 CA LEU A 29 10.673 4.256 -0.210 1.00 0.00 C ATOM 431 C LEU A 29 11.857 5.186 0.055 1.00 0.00 C ATOM 432 O LEU A 29 11.656 6.393 0.184 1.00 0.00 O ATOM 433 CB LEU A 29 10.352 4.011 -1.694 1.00 0.00 C ATOM 434 CG LEU A 29 11.471 3.422 -2.563 1.00 0.00 C ATOM 435 CD1 LEU A 29 10.861 2.808 -3.823 1.00 0.00 C ATOM 436 CD2 LEU A 29 12.491 4.443 -3.074 1.00 0.00 C ATOM 0 H LEU A 29 8.997 5.498 -0.251 1.00 0.00 H new ATOM 0 HA LEU A 29 10.905 3.270 0.191 1.00 0.00 H new ATOM 0 HB2 LEU A 29 9.494 3.342 -1.748 1.00 0.00 H new ATOM 0 HB3 LEU A 29 10.045 4.959 -2.135 1.00 0.00 H new ATOM 0 HG LEU A 29 11.979 2.709 -1.913 1.00 0.00 H new ATOM 0 HD11 LEU A 29 11.653 2.388 -4.443 1.00 0.00 H new ATOM 0 HD12 LEU A 29 10.163 2.019 -3.542 1.00 0.00 H new ATOM 0 HD13 LEU A 29 10.331 3.578 -4.383 1.00 0.00 H new ATOM 0 HD21 LEU A 29 13.243 3.935 -3.678 1.00 0.00 H new ATOM 0 HD22 LEU A 29 11.983 5.192 -3.681 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.974 4.930 -2.227 1.00 0.00 H new ATOM 448 N SER A 30 13.072 4.656 0.208 1.00 0.00 N ATOM 449 CA SER A 30 14.221 5.467 0.576 1.00 0.00 C ATOM 450 C SER A 30 15.102 5.759 -0.641 1.00 0.00 C ATOM 451 O SER A 30 15.408 4.879 -1.450 1.00 0.00 O ATOM 452 CB SER A 30 15.000 4.783 1.696 1.00 0.00 C ATOM 453 OG SER A 30 15.841 5.698 2.371 1.00 0.00 O ATOM 0 H SER A 30 13.280 3.666 0.081 1.00 0.00 H new ATOM 0 HA SER A 30 13.872 6.430 0.948 1.00 0.00 H new ATOM 0 HB2 SER A 30 14.304 4.335 2.405 1.00 0.00 H new ATOM 0 HB3 SER A 30 15.599 3.972 1.282 1.00 0.00 H new ATOM 0 HG SER A 30 16.326 5.232 3.084 1.00 0.00 H new ATOM 459 N LYS A 31 15.536 7.015 -0.745 1.00 0.00 N ATOM 460 CA LYS A 31 16.387 7.524 -1.809 1.00 0.00 C ATOM 461 C LYS A 31 17.644 6.685 -2.090 1.00 0.00 C ATOM 462 O LYS A 31 18.169 6.754 -3.199 1.00 0.00 O ATOM 463 CB LYS A 31 16.717 9.000 -1.532 1.00 0.00 C ATOM 464 CG LYS A 31 17.322 9.237 -0.135 1.00 0.00 C ATOM 465 CD LYS A 31 17.634 10.716 0.144 1.00 0.00 C ATOM 466 CE LYS A 31 16.484 11.691 -0.160 1.00 0.00 C ATOM 467 NZ LYS A 31 15.196 11.313 0.458 1.00 0.00 N ATOM 0 H LYS A 31 15.292 7.731 -0.060 1.00 0.00 H new ATOM 0 HA LYS A 31 15.819 7.442 -2.735 1.00 0.00 H new ATOM 0 HB2 LYS A 31 17.416 9.357 -2.288 1.00 0.00 H new ATOM 0 HB3 LYS A 31 15.808 9.593 -1.632 1.00 0.00 H new ATOM 0 HG2 LYS A 31 16.629 8.869 0.622 1.00 0.00 H new ATOM 0 HG3 LYS A 31 18.238 8.654 -0.039 1.00 0.00 H new ATOM 0 HD2 LYS A 31 17.912 10.822 1.193 1.00 0.00 H new ATOM 0 HD3 LYS A 31 18.503 11.006 -0.447 1.00 0.00 H new ATOM 0 HE2 LYS A 31 16.764 12.686 0.187 1.00 0.00 H new ATOM 0 HE3 LYS A 31 16.352 11.755 -1.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 14.493 12.059 0.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 14.863 10.418 0.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 15.324 11.196 1.483 1.00 0.00 H new ATOM 481 N LYS A 32 18.141 5.894 -1.128 1.00 0.00 N ATOM 482 CA LYS A 32 19.267 5.008 -1.402 1.00 0.00 C ATOM 483 C LYS A 32 18.855 3.947 -2.413 1.00 0.00 C ATOM 484 O LYS A 32 19.365 3.931 -3.527 1.00 0.00 O ATOM 485 CB LYS A 32 19.853 4.334 -0.143 1.00 0.00 C ATOM 486 CG LYS A 32 20.172 5.240 1.053 1.00 0.00 C ATOM 487 CD LYS A 32 19.042 5.338 2.095 1.00 0.00 C ATOM 488 CE LYS A 32 18.870 4.153 3.074 1.00 0.00 C ATOM 489 NZ LYS A 32 18.263 2.937 2.487 1.00 0.00 N ATOM 0 H LYS A 32 17.785 5.853 -0.173 1.00 0.00 H new ATOM 0 HA LYS A 32 20.059 5.637 -1.808 1.00 0.00 H new ATOM 0 HB2 LYS A 32 19.150 3.570 0.190 1.00 0.00 H new ATOM 0 HB3 LYS A 32 20.770 3.819 -0.431 1.00 0.00 H new ATOM 0 HG2 LYS A 32 21.072 4.870 1.544 1.00 0.00 H new ATOM 0 HG3 LYS A 32 20.399 6.241 0.685 1.00 0.00 H new ATOM 0 HD2 LYS A 32 19.205 6.240 2.684 1.00 0.00 H new ATOM 0 HD3 LYS A 32 18.102 5.472 1.560 1.00 0.00 H new ATOM 0 HE2 LYS A 32 19.847 3.893 3.480 1.00 0.00 H new ATOM 0 HE3 LYS A 32 18.254 4.480 3.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 17.762 2.407 3.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 17.591 3.210 1.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 19.009 2.339 2.078 1.00 0.00 H new ATOM 503 N GLU A 33 17.937 3.058 -2.041 1.00 0.00 N ATOM 504 CA GLU A 33 17.542 1.951 -2.891 1.00 0.00 C ATOM 505 C GLU A 33 16.921 2.492 -4.181 1.00 0.00 C ATOM 506 O GLU A 33 17.070 1.876 -5.239 1.00 0.00 O ATOM 507 CB GLU A 33 16.602 1.013 -2.128 1.00 0.00 C ATOM 508 CG GLU A 33 17.274 0.299 -0.939 1.00 0.00 C ATOM 509 CD GLU A 33 17.663 1.230 0.197 1.00 0.00 C ATOM 510 OE1 GLU A 33 16.999 2.279 0.364 1.00 0.00 O ATOM 511 OE2 GLU A 33 18.648 0.947 0.913 1.00 0.00 O ATOM 0 H GLU A 33 17.451 3.089 -1.145 1.00 0.00 H new ATOM 0 HA GLU A 33 18.415 1.362 -3.173 1.00 0.00 H new ATOM 0 HB2 GLU A 33 15.749 1.585 -1.763 1.00 0.00 H new ATOM 0 HB3 GLU A 33 16.212 0.264 -2.817 1.00 0.00 H new ATOM 0 HG2 GLU A 33 16.596 -0.463 -0.555 1.00 0.00 H new ATOM 0 HG3 GLU A 33 18.166 -0.217 -1.294 1.00 0.00 H new ATOM 518 N LEU A 34 16.289 3.673 -4.119 1.00 0.00 N ATOM 519 CA LEU A 34 15.862 4.367 -5.326 1.00 0.00 C ATOM 520 C LEU A 34 16.984 4.402 -6.374 1.00 0.00 C ATOM 521 O LEU A 34 16.686 4.188 -7.549 1.00 0.00 O ATOM 522 CB LEU A 34 15.355 5.780 -5.014 1.00 0.00 C ATOM 523 CG LEU A 34 14.717 6.466 -6.236 1.00 0.00 C ATOM 524 CD1 LEU A 34 13.372 5.858 -6.648 1.00 0.00 C ATOM 525 CD2 LEU A 34 14.544 7.963 -5.978 1.00 0.00 C ATOM 0 H LEU A 34 16.067 4.158 -3.250 1.00 0.00 H new ATOM 0 HA LEU A 34 15.029 3.805 -5.747 1.00 0.00 H new ATOM 0 HB2 LEU A 34 14.623 5.729 -4.208 1.00 0.00 H new ATOM 0 HB3 LEU A 34 16.185 6.388 -4.653 1.00 0.00 H new ATOM 0 HG LEU A 34 15.406 6.302 -7.065 1.00 0.00 H new ATOM 0 HD11 LEU A 34 12.982 6.391 -7.515 1.00 0.00 H new ATOM 0 HD12 LEU A 34 13.510 4.807 -6.900 1.00 0.00 H new ATOM 0 HD13 LEU A 34 12.666 5.943 -5.822 1.00 0.00 H new ATOM 0 HD21 LEU A 34 14.092 8.433 -6.851 1.00 0.00 H new ATOM 0 HD22 LEU A 34 13.899 8.111 -5.112 1.00 0.00 H new ATOM 0 HD23 LEU A 34 15.518 8.414 -5.787 1.00 0.00 H new ATOM 537 N LYS A 35 18.255 4.623 -5.980 1.00 0.00 N ATOM 538 CA LYS A 35 19.360 4.638 -6.944 1.00 0.00 C ATOM 539 C LYS A 35 19.344 3.402 -7.844 1.00 0.00 C ATOM 540 O LYS A 35 19.643 3.488 -9.032 1.00 0.00 O ATOM 541 CB LYS A 35 20.731 4.819 -6.258 1.00 0.00 C ATOM 542 CG LYS A 35 21.381 3.547 -5.671 1.00 0.00 C ATOM 543 CD LYS A 35 22.254 2.757 -6.667 1.00 0.00 C ATOM 544 CE LYS A 35 22.740 1.443 -6.032 1.00 0.00 C ATOM 545 NZ LYS A 35 23.170 0.452 -7.042 1.00 0.00 N ATOM 0 H LYS A 35 18.533 4.791 -5.013 1.00 0.00 H new ATOM 0 HA LYS A 35 19.206 5.509 -7.581 1.00 0.00 H new ATOM 0 HB2 LYS A 35 21.421 5.251 -6.983 1.00 0.00 H new ATOM 0 HB3 LYS A 35 20.617 5.546 -5.454 1.00 0.00 H new ATOM 0 HG2 LYS A 35 21.994 3.829 -4.815 1.00 0.00 H new ATOM 0 HG3 LYS A 35 20.594 2.891 -5.298 1.00 0.00 H new ATOM 0 HD2 LYS A 35 21.682 2.542 -7.570 1.00 0.00 H new ATOM 0 HD3 LYS A 35 23.110 3.361 -6.968 1.00 0.00 H new ATOM 0 HE2 LYS A 35 23.570 1.654 -5.358 1.00 0.00 H new ATOM 0 HE3 LYS A 35 21.939 1.017 -5.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 24.110 0.084 -6.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 22.488 -0.332 -7.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 23.215 0.906 -7.977 1.00 0.00 H new ATOM 559 N GLU A 36 19.040 2.240 -7.259 1.00 0.00 N ATOM 560 CA GLU A 36 19.023 0.980 -7.976 1.00 0.00 C ATOM 561 C GLU A 36 17.817 0.979 -8.904 1.00 0.00 C ATOM 562 O GLU A 36 17.930 0.739 -10.110 1.00 0.00 O ATOM 563 CB GLU A 36 18.996 -0.169 -6.952 1.00 0.00 C ATOM 564 CG GLU A 36 19.090 -1.556 -7.593 1.00 0.00 C ATOM 565 CD GLU A 36 20.377 -1.780 -8.371 1.00 0.00 C ATOM 566 OE1 GLU A 36 21.384 -1.110 -8.043 1.00 0.00 O ATOM 567 OE2 GLU A 36 20.320 -2.639 -9.275 1.00 0.00 O ATOM 0 H GLU A 36 18.799 2.156 -6.271 1.00 0.00 H new ATOM 0 HA GLU A 36 19.914 0.844 -8.589 1.00 0.00 H new ATOM 0 HB2 GLU A 36 19.823 -0.043 -6.253 1.00 0.00 H new ATOM 0 HB3 GLU A 36 18.076 -0.107 -6.371 1.00 0.00 H new ATOM 0 HG2 GLU A 36 19.010 -2.314 -6.814 1.00 0.00 H new ATOM 0 HG3 GLU A 36 18.241 -1.696 -8.262 1.00 0.00 H new ATOM 574 N LEU A 37 16.667 1.294 -8.308 1.00 0.00 N ATOM 575 CA LEU A 37 15.374 1.234 -8.964 1.00 0.00 C ATOM 576 C LEU A 37 15.428 2.025 -10.267 1.00 0.00 C ATOM 577 O LEU A 37 15.112 1.503 -11.335 1.00 0.00 O ATOM 578 CB LEU A 37 14.261 1.748 -8.036 1.00 0.00 C ATOM 579 CG LEU A 37 12.939 0.990 -8.252 1.00 0.00 C ATOM 580 CD1 LEU A 37 11.967 1.264 -7.109 1.00 0.00 C ATOM 581 CD2 LEU A 37 12.231 1.379 -9.553 1.00 0.00 C ATOM 0 H LEU A 37 16.614 1.603 -7.337 1.00 0.00 H new ATOM 0 HA LEU A 37 15.139 0.196 -9.198 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.576 1.641 -6.998 1.00 0.00 H new ATOM 0 HB3 LEU A 37 14.103 2.812 -8.213 1.00 0.00 H new ATOM 0 HG LEU A 37 13.213 -0.064 -8.298 1.00 0.00 H new ATOM 0 HD11 LEU A 37 11.039 0.719 -7.282 1.00 0.00 H new ATOM 0 HD12 LEU A 37 12.410 0.937 -6.168 1.00 0.00 H new ATOM 0 HD13 LEU A 37 11.756 2.332 -7.059 1.00 0.00 H new ATOM 0 HD21 LEU A 37 11.306 0.811 -9.648 1.00 0.00 H new ATOM 0 HD22 LEU A 37 12.002 2.445 -9.538 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.880 1.159 -10.400 1.00 0.00 H new ATOM 593 N ILE A 38 15.858 3.288 -10.180 1.00 0.00 N ATOM 594 CA ILE A 38 15.827 4.194 -11.320 1.00 0.00 C ATOM 595 C ILE A 38 16.760 3.774 -12.451 1.00 0.00 C ATOM 596 O ILE A 38 16.688 4.339 -13.541 1.00 0.00 O ATOM 597 CB ILE A 38 16.041 5.658 -10.903 1.00 0.00 C ATOM 598 CG1 ILE A 38 17.461 5.901 -10.361 1.00 0.00 C ATOM 599 CG2 ILE A 38 14.926 6.072 -9.935 1.00 0.00 C ATOM 600 CD1 ILE A 38 17.687 7.341 -9.893 1.00 0.00 C ATOM 0 H ILE A 38 16.232 3.702 -9.326 1.00 0.00 H new ATOM 0 HA ILE A 38 14.819 4.122 -11.728 1.00 0.00 H new ATOM 0 HB ILE A 38 15.972 6.303 -11.779 1.00 0.00 H new ATOM 0 HG12 ILE A 38 17.647 5.222 -9.529 1.00 0.00 H new ATOM 0 HG13 ILE A 38 18.186 5.660 -11.138 1.00 0.00 H new ATOM 0 HG21 ILE A 38 15.071 7.110 -9.635 1.00 0.00 H new ATOM 0 HG22 ILE A 38 13.959 5.969 -10.428 1.00 0.00 H new ATOM 0 HG23 ILE A 38 14.954 5.432 -9.053 1.00 0.00 H new ATOM 0 HD11 ILE A 38 18.707 7.447 -9.522 1.00 0.00 H new ATOM 0 HD12 ILE A 38 17.531 8.024 -10.728 1.00 0.00 H new ATOM 0 HD13 ILE A 38 16.984 7.579 -9.095 1.00 0.00 H new ATOM 612 N GLN A 39 17.691 2.852 -12.203 1.00 0.00 N ATOM 613 CA GLN A 39 18.457 2.230 -13.264 1.00 0.00 C ATOM 614 C GLN A 39 17.795 0.918 -13.679 1.00 0.00 C ATOM 615 O GLN A 39 17.177 0.828 -14.740 1.00 0.00 O ATOM 616 CB GLN A 39 19.922 2.095 -12.831 1.00 0.00 C ATOM 617 CG GLN A 39 20.530 3.447 -12.415 1.00 0.00 C ATOM 618 CD GLN A 39 20.643 4.459 -13.555 1.00 0.00 C ATOM 619 OE1 GLN A 39 21.735 4.705 -14.053 1.00 0.00 O ATOM 620 NE2 GLN A 39 19.540 5.078 -13.978 1.00 0.00 N ATOM 0 H GLN A 39 17.928 2.523 -11.267 1.00 0.00 H new ATOM 0 HA GLN A 39 18.465 2.853 -14.158 1.00 0.00 H new ATOM 0 HB2 GLN A 39 19.990 1.396 -11.998 1.00 0.00 H new ATOM 0 HB3 GLN A 39 20.504 1.673 -13.650 1.00 0.00 H new ATOM 0 HG2 GLN A 39 19.921 3.878 -11.620 1.00 0.00 H new ATOM 0 HG3 GLN A 39 21.522 3.274 -11.998 1.00 0.00 H new ATOM 0 HE21 GLN A 39 18.639 4.861 -13.553 1.00 0.00 H new ATOM 0 HE22 GLN A 39 19.598 5.768 -14.727 1.00 0.00 H new ATOM 629 N LYS A 40 17.928 -0.099 -12.829 1.00 0.00 N ATOM 630 CA LYS A 40 17.603 -1.468 -13.182 1.00 0.00 C ATOM 631 C LYS A 40 16.097 -1.673 -13.350 1.00 0.00 C ATOM 632 O LYS A 40 15.634 -1.936 -14.460 1.00 0.00 O ATOM 633 CB LYS A 40 18.253 -2.405 -12.154 1.00 0.00 C ATOM 634 CG LYS A 40 18.246 -3.875 -12.611 1.00 0.00 C ATOM 635 CD LYS A 40 19.212 -4.760 -11.802 1.00 0.00 C ATOM 636 CE LYS A 40 18.650 -5.285 -10.472 1.00 0.00 C ATOM 637 NZ LYS A 40 18.213 -4.198 -9.580 1.00 0.00 N ATOM 0 H LYS A 40 18.266 0.011 -11.873 1.00 0.00 H new ATOM 0 HA LYS A 40 18.015 -1.711 -14.162 1.00 0.00 H new ATOM 0 HB2 LYS A 40 19.281 -2.088 -11.976 1.00 0.00 H new ATOM 0 HB3 LYS A 40 17.725 -2.320 -11.204 1.00 0.00 H new ATOM 0 HG2 LYS A 40 17.235 -4.273 -12.521 1.00 0.00 H new ATOM 0 HG3 LYS A 40 18.515 -3.923 -13.666 1.00 0.00 H new ATOM 0 HD2 LYS A 40 19.503 -5.611 -12.418 1.00 0.00 H new ATOM 0 HD3 LYS A 40 20.118 -4.190 -11.597 1.00 0.00 H new ATOM 0 HE2 LYS A 40 17.808 -5.948 -10.673 1.00 0.00 H new ATOM 0 HE3 LYS A 40 19.411 -5.881 -9.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 17.969 -4.590 -8.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 18.982 -3.506 -9.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 17.379 -3.729 -9.987 1.00 0.00 H new ATOM 651 N GLU A 41 15.336 -1.567 -12.258 1.00 0.00 N ATOM 652 CA GLU A 41 13.925 -1.937 -12.256 1.00 0.00 C ATOM 653 C GLU A 41 13.127 -1.033 -13.192 1.00 0.00 C ATOM 654 O GLU A 41 12.212 -1.504 -13.863 1.00 0.00 O ATOM 655 CB GLU A 41 13.351 -1.902 -10.835 1.00 0.00 C ATOM 656 CG GLU A 41 13.718 -3.140 -10.010 1.00 0.00 C ATOM 657 CD GLU A 41 15.215 -3.321 -9.853 1.00 0.00 C ATOM 658 OE1 GLU A 41 15.823 -2.626 -9.012 1.00 0.00 O ATOM 659 OE2 GLU A 41 15.797 -4.161 -10.567 1.00 0.00 O ATOM 0 H GLU A 41 15.679 -1.225 -11.360 1.00 0.00 H new ATOM 0 HA GLU A 41 13.842 -2.960 -12.624 1.00 0.00 H new ATOM 0 HB2 GLU A 41 13.715 -1.011 -10.324 1.00 0.00 H new ATOM 0 HB3 GLU A 41 12.266 -1.817 -10.890 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.261 -3.062 -9.024 1.00 0.00 H new ATOM 0 HG3 GLU A 41 13.298 -4.026 -10.487 1.00 0.00 H new ATOM 666 N LEU A 42 13.453 0.262 -13.236 1.00 0.00 N ATOM 667 CA LEU A 42 12.823 1.148 -14.197 1.00 0.00 C ATOM 668 C LEU A 42 13.215 0.754 -15.621 1.00 0.00 C ATOM 669 O LEU A 42 12.317 0.528 -16.422 1.00 0.00 O ATOM 670 CB LEU A 42 13.101 2.630 -13.903 1.00 0.00 C ATOM 671 CG LEU A 42 12.397 3.197 -12.651 1.00 0.00 C ATOM 672 CD1 LEU A 42 12.342 4.716 -12.782 1.00 0.00 C ATOM 673 CD2 LEU A 42 10.959 2.703 -12.473 1.00 0.00 C ATOM 0 H LEU A 42 14.138 0.707 -12.625 1.00 0.00 H new ATOM 0 HA LEU A 42 11.744 1.029 -14.101 1.00 0.00 H new ATOM 0 HB2 LEU A 42 14.176 2.765 -13.788 1.00 0.00 H new ATOM 0 HB3 LEU A 42 12.797 3.219 -14.769 1.00 0.00 H new ATOM 0 HG LEU A 42 12.971 2.859 -11.788 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.848 5.139 -11.907 1.00 0.00 H new ATOM 0 HD12 LEU A 42 13.355 5.112 -12.853 1.00 0.00 H new ATOM 0 HD13 LEU A 42 11.784 4.984 -13.679 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.531 3.144 -11.573 1.00 0.00 H new ATOM 0 HD22 LEU A 42 10.364 2.995 -13.338 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.956 1.617 -12.381 1.00 0.00 H new ATOM 685 N THR A 43 14.513 0.665 -15.942 1.00 0.00 N ATOM 686 CA THR A 43 14.996 0.322 -17.281 1.00 0.00 C ATOM 687 C THR A 43 14.788 1.472 -18.275 1.00 0.00 C ATOM 688 O THR A 43 13.788 2.184 -18.228 1.00 0.00 O ATOM 689 CB THR A 43 14.309 -0.952 -17.822 1.00 0.00 C ATOM 690 OG1 THR A 43 14.122 -1.913 -16.798 1.00 0.00 O ATOM 691 CG2 THR A 43 15.136 -1.622 -18.924 1.00 0.00 C ATOM 0 H THR A 43 15.263 0.831 -15.270 1.00 0.00 H new ATOM 0 HA THR A 43 16.065 0.135 -17.183 1.00 0.00 H new ATOM 0 HB THR A 43 13.349 -0.624 -18.220 1.00 0.00 H new ATOM 0 HG1 THR A 43 14.825 -1.812 -16.123 1.00 0.00 H new ATOM 0 HG21 THR A 43 14.618 -2.514 -19.277 1.00 0.00 H new ATOM 0 HG22 THR A 43 15.268 -0.927 -19.753 1.00 0.00 H new ATOM 0 HG23 THR A 43 16.112 -1.903 -18.527 1.00 0.00 H new ATOM 699 N ILE A 44 15.678 1.612 -19.261 1.00 0.00 N ATOM 700 CA ILE A 44 15.458 2.513 -20.393 1.00 0.00 C ATOM 701 C ILE A 44 14.606 1.811 -21.466 1.00 0.00 C ATOM 702 O ILE A 44 14.931 1.804 -22.656 1.00 0.00 O ATOM 703 CB ILE A 44 16.796 3.028 -20.933 1.00 0.00 C ATOM 704 CG1 ILE A 44 17.762 1.883 -21.281 1.00 0.00 C ATOM 705 CG2 ILE A 44 17.428 3.992 -19.917 1.00 0.00 C ATOM 706 CD1 ILE A 44 18.879 2.346 -22.222 1.00 0.00 C ATOM 0 H ILE A 44 16.564 1.108 -19.297 1.00 0.00 H new ATOM 0 HA ILE A 44 14.898 3.389 -20.064 1.00 0.00 H new ATOM 0 HB ILE A 44 16.600 3.563 -21.862 1.00 0.00 H new ATOM 0 HG12 ILE A 44 18.200 1.486 -20.365 1.00 0.00 H new ATOM 0 HG13 ILE A 44 17.207 1.069 -21.748 1.00 0.00 H new ATOM 0 HG21 ILE A 44 18.380 4.356 -20.304 1.00 0.00 H new ATOM 0 HG22 ILE A 44 16.758 4.835 -19.750 1.00 0.00 H new ATOM 0 HG23 ILE A 44 17.596 3.469 -18.975 1.00 0.00 H new ATOM 0 HD11 ILE A 44 19.539 1.507 -22.443 1.00 0.00 H new ATOM 0 HD12 ILE A 44 18.443 2.719 -23.149 1.00 0.00 H new ATOM 0 HD13 ILE A 44 19.451 3.142 -21.744 1.00 0.00 H new ATOM 888 N LEU A 56 13.990 11.152 -18.504 1.00 0.00 N ATOM 889 CA LEU A 56 14.492 12.439 -18.051 1.00 0.00 C ATOM 890 C LEU A 56 13.315 13.361 -17.742 1.00 0.00 C ATOM 891 O LEU A 56 13.282 13.968 -16.674 1.00 0.00 O ATOM 892 CB LEU A 56 15.460 13.016 -19.099 1.00 0.00 C ATOM 893 CG LEU A 56 16.216 14.278 -18.643 1.00 0.00 C ATOM 894 CD1 LEU A 56 17.531 14.380 -19.424 1.00 0.00 C ATOM 895 CD2 LEU A 56 15.418 15.568 -18.885 1.00 0.00 C ATOM 0 HA LEU A 56 15.061 12.330 -17.128 1.00 0.00 H new ATOM 0 HB2 LEU A 56 16.187 12.249 -19.365 1.00 0.00 H new ATOM 0 HB3 LEU A 56 14.899 13.251 -20.003 1.00 0.00 H new ATOM 0 HG LEU A 56 16.386 14.181 -17.571 1.00 0.00 H new ATOM 0 HD11 LEU A 56 18.074 15.271 -19.108 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.139 13.497 -19.230 1.00 0.00 H new ATOM 0 HD13 LEU A 56 17.317 14.445 -20.491 1.00 0.00 H new ATOM 0 HD21 LEU A 56 15.999 16.425 -18.545 1.00 0.00 H new ATOM 0 HD22 LEU A 56 15.208 15.672 -19.950 1.00 0.00 H new ATOM 0 HD23 LEU A 56 14.479 15.524 -18.333 1.00 0.00 H new ATOM 907 N MET A 57 12.340 13.460 -18.654 1.00 0.00 N ATOM 908 CA MET A 57 11.176 14.310 -18.416 1.00 0.00 C ATOM 909 C MET A 57 10.413 13.830 -17.175 1.00 0.00 C ATOM 910 O MET A 57 10.156 14.603 -16.253 1.00 0.00 O ATOM 911 CB MET A 57 10.273 14.353 -19.655 1.00 0.00 C ATOM 912 CG MET A 57 10.958 15.072 -20.826 1.00 0.00 C ATOM 913 SD MET A 57 9.908 15.417 -22.261 1.00 0.00 S ATOM 914 CE MET A 57 9.454 13.746 -22.774 1.00 0.00 C ATOM 0 H MET A 57 12.336 12.969 -19.548 1.00 0.00 H new ATOM 0 HA MET A 57 11.516 15.328 -18.226 1.00 0.00 H new ATOM 0 HB2 MET A 57 10.013 13.337 -19.952 1.00 0.00 H new ATOM 0 HB3 MET A 57 9.341 14.862 -19.410 1.00 0.00 H new ATOM 0 HG2 MET A 57 11.364 16.016 -20.461 1.00 0.00 H new ATOM 0 HG3 MET A 57 11.803 14.467 -21.155 1.00 0.00 H new ATOM 0 HE1 MET A 57 8.865 13.794 -23.690 1.00 0.00 H new ATOM 0 HE2 MET A 57 10.357 13.162 -22.953 1.00 0.00 H new ATOM 0 HE3 MET A 57 8.865 13.272 -21.989 1.00 0.00 H new ATOM 924 N ASP A 58 10.081 12.539 -17.148 1.00 0.00 N ATOM 925 CA ASP A 58 9.456 11.863 -16.018 1.00 0.00 C ATOM 926 C ASP A 58 10.195 12.159 -14.703 1.00 0.00 C ATOM 927 O ASP A 58 9.569 12.470 -13.687 1.00 0.00 O ATOM 928 CB ASP A 58 9.421 10.365 -16.344 1.00 0.00 C ATOM 929 CG ASP A 58 9.209 9.495 -15.121 1.00 0.00 C ATOM 930 OD1 ASP A 58 8.046 9.395 -14.683 1.00 0.00 O ATOM 931 OD2 ASP A 58 10.236 8.941 -14.666 1.00 0.00 O ATOM 0 H ASP A 58 10.246 11.917 -17.940 1.00 0.00 H new ATOM 0 HA ASP A 58 8.441 12.230 -15.866 1.00 0.00 H new ATOM 0 HB2 ASP A 58 8.623 10.174 -17.061 1.00 0.00 H new ATOM 0 HB3 ASP A 58 10.357 10.082 -16.826 1.00 0.00 H new ATOM 936 N ASP A 59 11.533 12.098 -14.732 1.00 0.00 N ATOM 937 CA ASP A 59 12.374 12.209 -13.544 1.00 0.00 C ATOM 938 C ASP A 59 12.039 13.419 -12.682 1.00 0.00 C ATOM 939 O ASP A 59 12.126 13.368 -11.462 1.00 0.00 O ATOM 940 CB ASP A 59 13.874 12.196 -13.876 1.00 0.00 C ATOM 941 CG ASP A 59 14.637 11.534 -12.740 1.00 0.00 C ATOM 942 OD1 ASP A 59 14.408 10.311 -12.591 1.00 0.00 O ATOM 943 OD2 ASP A 59 15.402 12.236 -12.050 1.00 0.00 O ATOM 0 H ASP A 59 12.063 11.969 -15.594 1.00 0.00 H new ATOM 0 HA ASP A 59 12.147 11.316 -12.961 1.00 0.00 H new ATOM 0 HB2 ASP A 59 14.047 11.657 -14.807 1.00 0.00 H new ATOM 0 HB3 ASP A 59 14.233 13.214 -14.025 1.00 0.00 H new ATOM 948 N LEU A 60 11.633 14.515 -13.316 1.00 0.00 N ATOM 949 CA LEU A 60 11.403 15.794 -12.672 1.00 0.00 C ATOM 950 C LEU A 60 10.395 15.702 -11.525 1.00 0.00 C ATOM 951 O LEU A 60 10.505 16.454 -10.551 1.00 0.00 O ATOM 952 CB LEU A 60 10.968 16.806 -13.733 1.00 0.00 C ATOM 953 CG LEU A 60 11.978 16.899 -14.891 1.00 0.00 C ATOM 954 CD1 LEU A 60 11.423 17.860 -15.948 1.00 0.00 C ATOM 955 CD2 LEU A 60 13.351 17.405 -14.429 1.00 0.00 C ATOM 0 H LEU A 60 11.451 14.533 -14.320 1.00 0.00 H new ATOM 0 HA LEU A 60 12.334 16.126 -12.212 1.00 0.00 H new ATOM 0 HB2 LEU A 60 9.992 16.522 -14.126 1.00 0.00 H new ATOM 0 HB3 LEU A 60 10.853 17.787 -13.272 1.00 0.00 H new ATOM 0 HG LEU A 60 12.116 15.897 -15.297 1.00 0.00 H new ATOM 0 HD11 LEU A 60 12.128 17.937 -16.776 1.00 0.00 H new ATOM 0 HD12 LEU A 60 10.469 17.483 -16.317 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.277 18.845 -15.504 1.00 0.00 H new ATOM 0 HD21 LEU A 60 14.027 17.453 -15.283 1.00 0.00 H new ATOM 0 HD22 LEU A 60 13.245 18.399 -13.994 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.757 16.723 -13.682 1.00 0.00 H new ATOM 967 N ASP A 61 9.438 14.765 -11.588 1.00 0.00 N ATOM 968 CA ASP A 61 8.491 14.596 -10.488 1.00 0.00 C ATOM 969 C ASP A 61 9.197 14.237 -9.164 1.00 0.00 C ATOM 970 O ASP A 61 8.630 14.408 -8.084 1.00 0.00 O ATOM 971 CB ASP A 61 7.377 13.600 -10.846 1.00 0.00 C ATOM 972 CG ASP A 61 6.287 13.636 -9.783 1.00 0.00 C ATOM 973 OD1 ASP A 61 6.008 14.746 -9.277 1.00 0.00 O ATOM 974 OD2 ASP A 61 5.845 12.567 -9.308 1.00 0.00 O ATOM 0 H ASP A 61 9.304 14.127 -12.373 1.00 0.00 H new ATOM 0 HA ASP A 61 8.011 15.561 -10.327 1.00 0.00 H new ATOM 0 HB2 ASP A 61 6.955 13.848 -11.820 1.00 0.00 H new ATOM 0 HB3 ASP A 61 7.788 12.594 -10.923 1.00 0.00 H new ATOM 979 N ARG A 62 10.463 13.804 -9.240 1.00 0.00 N ATOM 980 CA ARG A 62 11.327 13.578 -8.087 1.00 0.00 C ATOM 981 C ARG A 62 11.472 14.802 -7.183 1.00 0.00 C ATOM 982 O ARG A 62 11.846 14.633 -6.028 1.00 0.00 O ATOM 983 CB ARG A 62 12.723 13.116 -8.533 1.00 0.00 C ATOM 984 CG ARG A 62 12.696 11.712 -9.155 1.00 0.00 C ATOM 985 CD ARG A 62 13.108 10.618 -8.168 1.00 0.00 C ATOM 986 NE ARG A 62 12.373 10.721 -6.897 1.00 0.00 N ATOM 987 CZ ARG A 62 12.889 10.906 -5.675 1.00 0.00 C ATOM 988 NH1 ARG A 62 14.189 11.105 -5.453 1.00 0.00 N ATOM 989 NH2 ARG A 62 12.078 10.893 -4.630 1.00 0.00 N ATOM 0 H ARG A 62 10.920 13.598 -10.129 1.00 0.00 H new ATOM 0 HA ARG A 62 10.838 12.798 -7.504 1.00 0.00 H new ATOM 0 HB2 ARG A 62 13.125 13.825 -9.257 1.00 0.00 H new ATOM 0 HB3 ARG A 62 13.396 13.119 -7.676 1.00 0.00 H new ATOM 0 HG2 ARG A 62 11.692 11.502 -9.524 1.00 0.00 H new ATOM 0 HG3 ARG A 62 13.364 11.688 -10.016 1.00 0.00 H new ATOM 0 HD2 ARG A 62 12.927 9.640 -8.614 1.00 0.00 H new ATOM 0 HD3 ARG A 62 14.179 10.687 -7.975 1.00 0.00 H new ATOM 0 HE ARG A 62 11.358 10.643 -6.953 1.00 0.00 H new ATOM 0 HH11 ARG A 62 14.843 11.122 -6.235 1.00 0.00 H new ATOM 0 HH12 ARG A 62 14.529 11.241 -4.501 1.00 0.00 H new ATOM 0 HH21 ARG A 62 11.078 10.744 -4.763 1.00 0.00 H new ATOM 0 HH22 ARG A 62 12.453 11.032 -3.692 1.00 0.00 H new ATOM 1003 N ASN A 63 11.237 16.024 -7.680 1.00 0.00 N ATOM 1004 CA ASN A 63 11.421 17.246 -6.891 1.00 0.00 C ATOM 1005 C ASN A 63 10.942 17.140 -5.448 1.00 0.00 C ATOM 1006 O ASN A 63 11.667 17.489 -4.521 1.00 0.00 O ATOM 1007 CB ASN A 63 10.714 18.460 -7.491 1.00 0.00 C ATOM 1008 CG ASN A 63 9.196 18.301 -7.646 1.00 0.00 C ATOM 1009 OD1 ASN A 63 8.432 18.845 -6.857 1.00 0.00 O ATOM 1010 ND2 ASN A 63 8.734 17.531 -8.627 1.00 0.00 N ATOM 0 H ASN A 63 10.916 16.191 -8.634 1.00 0.00 H new ATOM 0 HA ASN A 63 12.503 17.376 -6.910 1.00 0.00 H new ATOM 0 HB2 ASN A 63 10.913 19.328 -6.862 1.00 0.00 H new ATOM 0 HB3 ASN A 63 11.146 18.669 -8.469 1.00 0.00 H new ATOM 0 HD21 ASN A 63 7.730 17.386 -8.731 1.00 0.00 H new ATOM 0 HD22 ASN A 63 9.384 17.086 -9.275 1.00 0.00 H new ATOM 1017 N LYS A 64 9.708 16.677 -5.258 1.00 0.00 N ATOM 1018 CA LYS A 64 9.073 16.640 -3.951 1.00 0.00 C ATOM 1019 C LYS A 64 9.553 15.440 -3.133 1.00 0.00 C ATOM 1020 O LYS A 64 8.867 15.076 -2.177 1.00 0.00 O ATOM 1021 CB LYS A 64 7.549 16.644 -4.133 1.00 0.00 C ATOM 1022 CG LYS A 64 7.072 15.327 -4.753 1.00 0.00 C ATOM 1023 CD LYS A 64 5.712 15.500 -5.437 1.00 0.00 C ATOM 1024 CE LYS A 64 5.258 14.182 -6.071 1.00 0.00 C ATOM 1025 NZ LYS A 64 6.294 13.621 -6.955 1.00 0.00 N ATOM 0 H LYS A 64 9.122 16.317 -6.011 1.00 0.00 H new ATOM 0 HA LYS A 64 9.357 17.527 -3.385 1.00 0.00 H new ATOM 0 HB2 LYS A 64 7.063 16.794 -3.169 1.00 0.00 H new ATOM 0 HB3 LYS A 64 7.257 17.478 -4.771 1.00 0.00 H new ATOM 0 HG2 LYS A 64 7.806 14.976 -5.479 1.00 0.00 H new ATOM 0 HG3 LYS A 64 6.999 14.563 -3.979 1.00 0.00 H new ATOM 0 HD2 LYS A 64 4.972 15.834 -4.709 1.00 0.00 H new ATOM 0 HD3 LYS A 64 5.779 16.274 -6.202 1.00 0.00 H new ATOM 0 HE2 LYS A 64 5.020 13.463 -5.287 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.343 14.347 -6.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 5.879 12.871 -7.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 6.673 14.372 -7.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 7.063 13.223 -6.379 1.00 0.00 H new ATOM 1039 N ASP A 65 10.701 14.848 -3.509 1.00 0.00 N ATOM 1040 CA ASP A 65 11.329 13.685 -2.913 1.00 0.00 C ATOM 1041 C ASP A 65 10.982 13.583 -1.448 1.00 0.00 C ATOM 1042 O ASP A 65 10.241 12.679 -1.073 1.00 0.00 O ATOM 1043 CB ASP A 65 12.860 13.749 -3.096 1.00 0.00 C ATOM 1044 CG ASP A 65 13.601 12.674 -2.305 1.00 0.00 C ATOM 1045 OD1 ASP A 65 13.895 12.904 -1.118 1.00 0.00 O ATOM 1046 OD2 ASP A 65 13.873 11.610 -2.904 1.00 0.00 O ATOM 0 H ASP A 65 11.243 15.206 -4.296 1.00 0.00 H new ATOM 0 HA ASP A 65 10.952 12.796 -3.418 1.00 0.00 H new ATOM 0 HB2 ASP A 65 13.099 13.643 -4.154 1.00 0.00 H new ATOM 0 HB3 ASP A 65 13.217 14.731 -2.786 1.00 0.00 H new ATOM 1051 N GLN A 66 11.483 14.553 -0.674 1.00 0.00 N ATOM 1052 CA GLN A 66 11.495 14.510 0.795 1.00 0.00 C ATOM 1053 C GLN A 66 12.097 13.165 1.252 1.00 0.00 C ATOM 1054 O GLN A 66 13.270 13.068 1.619 1.00 0.00 O ATOM 1055 CB GLN A 66 10.083 14.780 1.342 1.00 0.00 C ATOM 1056 CG GLN A 66 9.621 16.205 1.001 1.00 0.00 C ATOM 1057 CD GLN A 66 8.106 16.332 1.102 1.00 0.00 C ATOM 1058 OE1 GLN A 66 7.580 16.859 2.076 1.00 0.00 O ATOM 1059 NE2 GLN A 66 7.391 15.849 0.091 1.00 0.00 N ATOM 0 H GLN A 66 11.898 15.403 -1.055 1.00 0.00 H new ATOM 0 HA GLN A 66 12.128 15.297 1.205 1.00 0.00 H new ATOM 0 HB2 GLN A 66 9.383 14.057 0.923 1.00 0.00 H new ATOM 0 HB3 GLN A 66 10.076 14.641 2.423 1.00 0.00 H new ATOM 0 HG2 GLN A 66 10.094 16.915 1.679 1.00 0.00 H new ATOM 0 HG3 GLN A 66 9.944 16.463 -0.008 1.00 0.00 H new ATOM 0 HE21 GLN A 66 7.860 15.416 -0.705 1.00 0.00 H new ATOM 0 HE22 GLN A 66 6.373 15.911 0.111 1.00 0.00 H new ATOM 1068 N GLU A 67 11.262 12.132 1.225 1.00 0.00 N ATOM 1069 CA GLU A 67 11.628 10.732 1.238 1.00 0.00 C ATOM 1070 C GLU A 67 10.580 10.068 0.342 1.00 0.00 C ATOM 1071 O GLU A 67 9.392 10.369 0.465 1.00 0.00 O ATOM 1072 CB GLU A 67 11.798 10.151 2.648 1.00 0.00 C ATOM 1073 CG GLU A 67 12.667 8.880 2.613 1.00 0.00 C ATOM 1074 CD GLU A 67 14.018 9.163 1.965 1.00 0.00 C ATOM 1075 OE1 GLU A 67 14.849 9.854 2.590 1.00 0.00 O ATOM 1076 OE2 GLU A 67 14.180 8.853 0.761 1.00 0.00 O ATOM 0 H GLU A 67 10.251 12.265 1.191 1.00 0.00 H new ATOM 0 HA GLU A 67 12.628 10.545 0.846 1.00 0.00 H new ATOM 0 HB2 GLU A 67 12.258 10.894 3.300 1.00 0.00 H new ATOM 0 HB3 GLU A 67 10.821 9.918 3.071 1.00 0.00 H new ATOM 0 HG2 GLU A 67 12.816 8.508 3.627 1.00 0.00 H new ATOM 0 HG3 GLU A 67 12.150 8.096 2.059 1.00 0.00 H new ATOM 1083 N VAL A 68 11.033 9.238 -0.601 1.00 0.00 N ATOM 1084 CA VAL A 68 10.246 8.793 -1.746 1.00 0.00 C ATOM 1085 C VAL A 68 8.827 8.342 -1.378 1.00 0.00 C ATOM 1086 O VAL A 68 8.635 7.418 -0.588 1.00 0.00 O ATOM 1087 CB VAL A 68 10.994 7.750 -2.590 1.00 0.00 C ATOM 1088 CG1 VAL A 68 10.384 7.702 -4.000 1.00 0.00 C ATOM 1089 CG2 VAL A 68 12.507 7.990 -2.666 1.00 0.00 C ATOM 0 H VAL A 68 11.976 8.851 -0.586 1.00 0.00 H new ATOM 0 HA VAL A 68 10.112 9.674 -2.373 1.00 0.00 H new ATOM 0 HB VAL A 68 10.871 6.789 -2.091 1.00 0.00 H new ATOM 0 HG11 VAL A 68 10.914 6.962 -4.601 1.00 0.00 H new ATOM 0 HG12 VAL A 68 9.331 7.428 -3.932 1.00 0.00 H new ATOM 0 HG13 VAL A 68 10.474 8.682 -4.469 1.00 0.00 H new ATOM 0 HG21 VAL A 68 12.968 7.215 -3.278 1.00 0.00 H new ATOM 0 HG22 VAL A 68 12.699 8.966 -3.112 1.00 0.00 H new ATOM 0 HG23 VAL A 68 12.931 7.960 -1.662 1.00 0.00 H new ATOM 1099 N ASN A 69 7.831 9.004 -1.970 1.00 0.00 N ATOM 1100 CA ASN A 69 6.420 8.881 -1.640 1.00 0.00 C ATOM 1101 C ASN A 69 5.729 8.000 -2.686 1.00 0.00 C ATOM 1102 O ASN A 69 6.147 7.963 -3.845 1.00 0.00 O ATOM 1103 CB ASN A 69 5.801 10.284 -1.548 1.00 0.00 C ATOM 1104 CG ASN A 69 5.924 11.043 -2.867 1.00 0.00 C ATOM 1105 OD1 ASN A 69 5.000 10.998 -3.673 1.00 0.00 O ATOM 1106 ND2 ASN A 69 7.069 11.693 -3.099 1.00 0.00 N ATOM 0 H ASN A 69 7.999 9.669 -2.725 1.00 0.00 H new ATOM 0 HA ASN A 69 6.287 8.399 -0.671 1.00 0.00 H new ATOM 0 HB2 ASN A 69 4.750 10.201 -1.273 1.00 0.00 H new ATOM 0 HB3 ASN A 69 6.294 10.848 -0.756 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.207 12.184 -3.982 1.00 0.00 H new ATOM 0 HD22 ASN A 69 7.805 11.698 -2.393 1.00 0.00 H new ATOM 1113 N PHE A 70 4.704 7.246 -2.269 1.00 0.00 N ATOM 1114 CA PHE A 70 4.106 6.223 -3.121 1.00 0.00 C ATOM 1115 C PHE A 70 3.487 6.855 -4.358 1.00 0.00 C ATOM 1116 O PHE A 70 3.702 6.352 -5.456 1.00 0.00 O ATOM 1117 CB PHE A 70 3.077 5.376 -2.365 1.00 0.00 C ATOM 1118 CG PHE A 70 2.562 4.177 -3.144 1.00 0.00 C ATOM 1119 CD1 PHE A 70 3.439 3.125 -3.462 1.00 0.00 C ATOM 1120 CD2 PHE A 70 1.218 4.107 -3.557 1.00 0.00 C ATOM 1121 CE1 PHE A 70 2.983 2.018 -4.195 1.00 0.00 C ATOM 1122 CE2 PHE A 70 0.767 3.005 -4.308 1.00 0.00 C ATOM 1123 CZ PHE A 70 1.657 1.975 -4.650 1.00 0.00 C ATOM 0 H PHE A 70 4.275 7.329 -1.347 1.00 0.00 H new ATOM 0 HA PHE A 70 4.904 5.550 -3.436 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.525 5.026 -1.435 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.232 6.009 -2.093 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.469 3.169 -3.141 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.532 4.900 -3.297 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.654 1.199 -4.409 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -0.265 2.952 -4.621 1.00 0.00 H new ATOM 0 HZ PHE A 70 1.321 1.151 -5.262 1.00 0.00 H new ATOM 1133 N GLN A 71 2.748 7.959 -4.178 1.00 0.00 N ATOM 1134 CA GLN A 71 2.173 8.713 -5.285 1.00 0.00 C ATOM 1135 C GLN A 71 3.230 8.932 -6.355 1.00 0.00 C ATOM 1136 O GLN A 71 3.023 8.546 -7.497 1.00 0.00 O ATOM 1137 CB GLN A 71 1.571 10.043 -4.808 1.00 0.00 C ATOM 1138 CG GLN A 71 1.074 10.924 -5.975 1.00 0.00 C ATOM 1139 CD GLN A 71 2.153 11.868 -6.522 1.00 0.00 C ATOM 1140 OE1 GLN A 71 2.613 12.748 -5.805 1.00 0.00 O ATOM 1141 NE2 GLN A 71 2.572 11.716 -7.778 1.00 0.00 N ATOM 0 H GLN A 71 2.536 8.348 -3.259 1.00 0.00 H new ATOM 0 HA GLN A 71 1.355 8.135 -5.714 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.740 9.840 -4.132 1.00 0.00 H new ATOM 0 HB3 GLN A 71 2.320 10.592 -4.237 1.00 0.00 H new ATOM 0 HG2 GLN A 71 0.720 10.282 -6.781 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.221 11.514 -5.639 1.00 0.00 H new ATOM 0 HE21 GLN A 71 2.178 10.978 -8.361 1.00 0.00 H new ATOM 0 HE22 GLN A 71 3.287 12.338 -8.156 1.00 0.00 H new ATOM 1150 N GLU A 72 4.360 9.537 -5.999 1.00 0.00 N ATOM 1151 CA GLU A 72 5.431 9.781 -6.943 1.00 0.00 C ATOM 1152 C GLU A 72 5.854 8.473 -7.593 1.00 0.00 C ATOM 1153 O GLU A 72 5.637 8.281 -8.785 1.00 0.00 O ATOM 1154 CB GLU A 72 6.562 10.437 -6.171 1.00 0.00 C ATOM 1155 CG GLU A 72 7.804 10.772 -6.987 1.00 0.00 C ATOM 1156 CD GLU A 72 8.738 11.538 -6.081 1.00 0.00 C ATOM 1157 OE1 GLU A 72 8.230 12.504 -5.460 1.00 0.00 O ATOM 1158 OE2 GLU A 72 9.902 11.104 -5.972 1.00 0.00 O ATOM 0 H GLU A 72 4.552 9.867 -5.053 1.00 0.00 H new ATOM 0 HA GLU A 72 5.118 10.440 -7.753 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.186 11.355 -5.720 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.852 9.776 -5.354 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.282 9.863 -7.352 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.541 11.367 -7.861 1.00 0.00 H new ATOM 1165 N TYR A 73 6.416 7.565 -6.793 1.00 0.00 N ATOM 1166 CA TYR A 73 6.916 6.271 -7.234 1.00 0.00 C ATOM 1167 C TYR A 73 5.990 5.616 -8.269 1.00 0.00 C ATOM 1168 O TYR A 73 6.434 5.212 -9.344 1.00 0.00 O ATOM 1169 CB TYR A 73 7.102 5.413 -5.978 1.00 0.00 C ATOM 1170 CG TYR A 73 7.196 3.920 -6.197 1.00 0.00 C ATOM 1171 CD1 TYR A 73 8.453 3.300 -6.324 1.00 0.00 C ATOM 1172 CD2 TYR A 73 6.038 3.133 -6.066 1.00 0.00 C ATOM 1173 CE1 TYR A 73 8.549 1.906 -6.173 1.00 0.00 C ATOM 1174 CE2 TYR A 73 6.131 1.736 -6.033 1.00 0.00 C ATOM 1175 CZ TYR A 73 7.391 1.127 -6.037 1.00 0.00 C ATOM 1176 OH TYR A 73 7.489 -0.195 -5.738 1.00 0.00 O ATOM 0 H TYR A 73 6.537 7.719 -5.792 1.00 0.00 H new ATOM 0 HA TYR A 73 7.869 6.384 -7.752 1.00 0.00 H new ATOM 0 HB2 TYR A 73 8.008 5.742 -5.469 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.269 5.608 -5.303 1.00 0.00 H new ATOM 0 HD1 TYR A 73 9.334 3.889 -6.535 1.00 0.00 H new ATOM 0 HD2 TYR A 73 5.071 3.609 -5.990 1.00 0.00 H new ATOM 0 HE1 TYR A 73 9.520 1.432 -6.162 1.00 0.00 H new ATOM 0 HE2 TYR A 73 5.236 1.132 -6.005 1.00 0.00 H new ATOM 0 HH TYR A 73 6.652 -0.501 -5.329 1.00 0.00 H new ATOM 1186 N ILE A 74 4.700 5.519 -7.956 1.00 0.00 N ATOM 1187 CA ILE A 74 3.733 4.815 -8.782 1.00 0.00 C ATOM 1188 C ILE A 74 3.239 5.675 -9.959 1.00 0.00 C ATOM 1189 O ILE A 74 2.993 5.131 -11.030 1.00 0.00 O ATOM 1190 CB ILE A 74 2.602 4.293 -7.887 1.00 0.00 C ATOM 1191 CG1 ILE A 74 1.843 3.095 -8.477 1.00 0.00 C ATOM 1192 CG2 ILE A 74 1.645 5.443 -7.615 1.00 0.00 C ATOM 1193 CD1 ILE A 74 2.636 1.790 -8.367 1.00 0.00 C ATOM 0 H ILE A 74 4.297 5.931 -7.115 1.00 0.00 H new ATOM 0 HA ILE A 74 4.213 3.958 -9.254 1.00 0.00 H new ATOM 0 HB ILE A 74 3.053 3.923 -6.966 1.00 0.00 H new ATOM 0 HG12 ILE A 74 0.890 2.982 -7.961 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.617 3.292 -9.525 1.00 0.00 H new ATOM 0 HG21 ILE A 74 0.830 5.096 -6.979 1.00 0.00 H new ATOM 0 HG22 ILE A 74 2.179 6.250 -7.113 1.00 0.00 H new ATOM 0 HG23 ILE A 74 1.239 5.809 -8.558 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.056 0.974 -8.798 1.00 0.00 H new ATOM 0 HD12 ILE A 74 3.578 1.890 -8.906 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.840 1.575 -7.318 1.00 0.00 H new ATOM 1205 N THR A 75 3.094 6.999 -9.792 1.00 0.00 N ATOM 1206 CA THR A 75 2.779 7.920 -10.892 1.00 0.00 C ATOM 1207 C THR A 75 3.845 7.757 -11.965 1.00 0.00 C ATOM 1208 O THR A 75 3.561 7.636 -13.150 1.00 0.00 O ATOM 1209 CB THR A 75 2.787 9.380 -10.392 1.00 0.00 C ATOM 1210 OG1 THR A 75 1.730 9.579 -9.482 1.00 0.00 O ATOM 1211 CG2 THR A 75 2.669 10.405 -11.525 1.00 0.00 C ATOM 0 H THR A 75 3.192 7.461 -8.888 1.00 0.00 H new ATOM 0 HA THR A 75 1.789 7.692 -11.287 1.00 0.00 H new ATOM 0 HB THR A 75 3.751 9.537 -9.909 1.00 0.00 H new ATOM 0 HG1 THR A 75 1.853 8.995 -8.705 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.681 11.412 -11.107 1.00 0.00 H new ATOM 0 HG22 THR A 75 3.508 10.287 -12.211 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.735 10.246 -12.063 1.00 0.00 H new ATOM 1219 N PHE A 76 5.080 7.766 -11.486 1.00 0.00 N ATOM 1220 CA PHE A 76 6.321 7.735 -12.219 1.00 0.00 C ATOM 1221 C PHE A 76 6.438 6.405 -12.965 1.00 0.00 C ATOM 1222 O PHE A 76 6.446 6.372 -14.197 1.00 0.00 O ATOM 1223 CB PHE A 76 7.368 7.962 -11.129 1.00 0.00 C ATOM 1224 CG PHE A 76 8.777 8.256 -11.530 1.00 0.00 C ATOM 1225 CD1 PHE A 76 9.096 9.606 -11.730 1.00 0.00 C ATOM 1226 CD2 PHE A 76 9.778 7.335 -11.183 1.00 0.00 C ATOM 1227 CE1 PHE A 76 10.406 10.048 -11.532 1.00 0.00 C ATOM 1228 CE2 PHE A 76 11.122 7.755 -11.115 1.00 0.00 C ATOM 1229 CZ PHE A 76 11.434 9.123 -11.286 1.00 0.00 C ATOM 0 H PHE A 76 5.245 7.798 -10.480 1.00 0.00 H new ATOM 0 HA PHE A 76 6.427 8.484 -13.004 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.023 8.789 -10.508 1.00 0.00 H new ATOM 0 HB3 PHE A 76 7.384 7.074 -10.497 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.330 10.303 -12.037 1.00 0.00 H new ATOM 0 HD2 PHE A 76 9.519 6.308 -10.969 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.629 11.104 -11.568 1.00 0.00 H new ATOM 0 HE2 PHE A 76 11.908 7.037 -10.934 1.00 0.00 H new ATOM 0 HZ PHE A 76 12.460 9.456 -11.228 1.00 0.00 H new ATOM 1239 N LEU A 77 6.420 5.288 -12.219 1.00 0.00 N ATOM 1240 CA LEU A 77 6.295 3.956 -12.804 1.00 0.00 C ATOM 1241 C LEU A 77 5.165 3.946 -13.835 1.00 0.00 C ATOM 1242 O LEU A 77 5.329 3.419 -14.927 1.00 0.00 O ATOM 1243 CB LEU A 77 5.989 2.911 -11.719 1.00 0.00 C ATOM 1244 CG LEU A 77 7.223 2.459 -10.926 1.00 0.00 C ATOM 1245 CD1 LEU A 77 6.793 1.841 -9.591 1.00 0.00 C ATOM 1246 CD2 LEU A 77 8.002 1.399 -11.715 1.00 0.00 C ATOM 0 H LEU A 77 6.492 5.289 -11.202 1.00 0.00 H new ATOM 0 HA LEU A 77 7.241 3.705 -13.284 1.00 0.00 H new ATOM 0 HB2 LEU A 77 5.256 3.324 -11.027 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.530 2.040 -12.186 1.00 0.00 H new ATOM 0 HG LEU A 77 7.852 3.332 -10.751 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.676 1.524 -9.036 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.244 2.580 -9.008 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.153 0.979 -9.779 1.00 0.00 H new ATOM 0 HD21 LEU A 77 8.875 1.087 -11.141 1.00 0.00 H new ATOM 0 HD22 LEU A 77 7.361 0.537 -11.897 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.325 1.819 -12.668 1.00 0.00 H new ATOM 1258 N GLY A 78 4.022 4.531 -13.482 1.00 0.00 N ATOM 1259 CA GLY A 78 2.834 4.621 -14.305 1.00 0.00 C ATOM 1260 C GLY A 78 3.089 5.290 -15.654 1.00 0.00 C ATOM 1261 O GLY A 78 2.747 4.732 -16.696 1.00 0.00 O ATOM 0 H GLY A 78 3.901 4.973 -12.571 1.00 0.00 H new ATOM 0 HA2 GLY A 78 2.438 3.619 -14.472 1.00 0.00 H new ATOM 0 HA3 GLY A 78 2.068 5.181 -13.768 1.00 0.00 H new ATOM 1265 N ALA A 79 3.664 6.494 -15.631 1.00 0.00 N ATOM 1266 CA ALA A 79 3.934 7.291 -16.818 1.00 0.00 C ATOM 1267 C ALA A 79 4.825 6.500 -17.769 1.00 0.00 C ATOM 1268 O ALA A 79 4.536 6.388 -18.959 1.00 0.00 O ATOM 1269 CB ALA A 79 4.594 8.611 -16.408 1.00 0.00 C ATOM 0 H ALA A 79 3.959 6.947 -14.766 1.00 0.00 H new ATOM 0 HA ALA A 79 3.002 7.521 -17.334 1.00 0.00 H new ATOM 0 HB1 ALA A 79 4.796 9.208 -17.297 1.00 0.00 H new ATOM 0 HB2 ALA A 79 3.926 9.161 -15.745 1.00 0.00 H new ATOM 0 HB3 ALA A 79 5.530 8.404 -15.889 1.00 0.00 H new ATOM 1275 N LEU A 80 5.899 5.922 -17.227 1.00 0.00 N ATOM 1276 CA LEU A 80 6.782 5.074 -18.010 1.00 0.00 C ATOM 1277 C LEU A 80 6.004 3.871 -18.543 1.00 0.00 C ATOM 1278 O LEU A 80 6.011 3.623 -19.746 1.00 0.00 O ATOM 1279 CB LEU A 80 7.987 4.642 -17.163 1.00 0.00 C ATOM 1280 CG LEU A 80 8.794 5.829 -16.611 1.00 0.00 C ATOM 1281 CD1 LEU A 80 9.851 5.311 -15.634 1.00 0.00 C ATOM 1282 CD2 LEU A 80 9.469 6.635 -17.724 1.00 0.00 C ATOM 0 H LEU A 80 6.173 6.029 -16.250 1.00 0.00 H new ATOM 0 HA LEU A 80 7.164 5.633 -18.865 1.00 0.00 H new ATOM 0 HB2 LEU A 80 7.638 4.030 -16.331 1.00 0.00 H new ATOM 0 HB3 LEU A 80 8.642 4.015 -17.768 1.00 0.00 H new ATOM 0 HG LEU A 80 8.100 6.496 -16.100 1.00 0.00 H new ATOM 0 HD11 LEU A 80 10.425 6.150 -15.241 1.00 0.00 H new ATOM 0 HD12 LEU A 80 9.362 4.789 -14.812 1.00 0.00 H new ATOM 0 HD13 LEU A 80 10.520 4.625 -16.152 1.00 0.00 H new ATOM 0 HD21 LEU A 80 10.027 7.463 -17.287 1.00 0.00 H new ATOM 0 HD22 LEU A 80 10.151 5.990 -18.278 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.710 7.027 -18.401 1.00 0.00 H new ATOM 1294 N ALA A 81 5.323 3.145 -17.651 1.00 0.00 N ATOM 1295 CA ALA A 81 4.582 1.922 -17.928 1.00 0.00 C ATOM 1296 C ALA A 81 3.684 2.111 -19.135 1.00 0.00 C ATOM 1297 O ALA A 81 3.855 1.405 -20.128 1.00 0.00 O ATOM 1298 CB ALA A 81 3.779 1.483 -16.702 1.00 0.00 C ATOM 0 H ALA A 81 5.275 3.413 -16.668 1.00 0.00 H new ATOM 0 HA ALA A 81 5.294 1.129 -18.157 1.00 0.00 H new ATOM 0 HB1 ALA A 81 3.234 0.568 -16.933 1.00 0.00 H new ATOM 0 HB2 ALA A 81 4.458 1.301 -15.869 1.00 0.00 H new ATOM 0 HB3 ALA A 81 3.073 2.267 -16.430 1.00 0.00 H new ATOM 1304 N MET A 82 2.761 3.072 -19.031 1.00 0.00 N ATOM 1305 CA MET A 82 1.815 3.468 -20.065 1.00 0.00 C ATOM 1306 C MET A 82 2.459 3.330 -21.446 1.00 0.00 C ATOM 1307 O MET A 82 1.982 2.569 -22.289 1.00 0.00 O ATOM 1308 CB MET A 82 1.363 4.906 -19.751 1.00 0.00 C ATOM 1309 CG MET A 82 0.185 5.449 -20.568 1.00 0.00 C ATOM 1310 SD MET A 82 0.501 5.745 -22.328 1.00 0.00 S ATOM 1311 CE MET A 82 -0.927 6.762 -22.761 1.00 0.00 C ATOM 0 H MET A 82 2.652 3.620 -18.177 1.00 0.00 H new ATOM 0 HA MET A 82 0.937 2.822 -20.078 1.00 0.00 H new ATOM 0 HB2 MET A 82 1.097 4.957 -18.695 1.00 0.00 H new ATOM 0 HB3 MET A 82 2.214 5.570 -19.898 1.00 0.00 H new ATOM 0 HG2 MET A 82 -0.644 4.747 -20.482 1.00 0.00 H new ATOM 0 HG3 MET A 82 -0.142 6.385 -20.116 1.00 0.00 H new ATOM 0 HE1 MET A 82 -0.878 7.028 -23.817 1.00 0.00 H new ATOM 0 HE2 MET A 82 -1.843 6.203 -22.570 1.00 0.00 H new ATOM 0 HE3 MET A 82 -0.923 7.670 -22.158 1.00 0.00 H new ATOM 1321 N ILE A 83 3.581 4.026 -21.637 1.00 0.00 N ATOM 1322 CA ILE A 83 4.321 4.033 -22.883 1.00 0.00 C ATOM 1323 C ILE A 83 5.108 2.729 -23.062 1.00 0.00 C ATOM 1324 O ILE A 83 4.770 1.903 -23.914 1.00 0.00 O ATOM 1325 CB ILE A 83 5.242 5.275 -22.916 1.00 0.00 C ATOM 1326 CG1 ILE A 83 4.461 6.601 -22.815 1.00 0.00 C ATOM 1327 CG2 ILE A 83 6.136 5.280 -24.165 1.00 0.00 C ATOM 1328 CD1 ILE A 83 3.592 6.925 -24.036 1.00 0.00 C ATOM 0 H ILE A 83 4.001 4.608 -20.913 1.00 0.00 H new ATOM 0 HA ILE A 83 3.627 4.093 -23.721 1.00 0.00 H new ATOM 0 HB ILE A 83 5.875 5.202 -22.032 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.824 6.566 -21.931 1.00 0.00 H new ATOM 0 HG13 ILE A 83 5.170 7.415 -22.664 1.00 0.00 H new ATOM 0 HG21 ILE A 83 6.770 6.167 -24.155 1.00 0.00 H new ATOM 0 HG22 ILE A 83 6.761 4.387 -24.169 1.00 0.00 H new ATOM 0 HG23 ILE A 83 5.512 5.290 -25.059 1.00 0.00 H new ATOM 0 HD11 ILE A 83 3.080 7.874 -23.877 1.00 0.00 H new ATOM 0 HD12 ILE A 83 4.222 6.997 -24.922 1.00 0.00 H new ATOM 0 HD13 ILE A 83 2.855 6.135 -24.178 1.00 0.00 H new ATOM 1340 N TYR A 84 6.169 2.553 -22.267 1.00 0.00 N ATOM 1341 CA TYR A 84 7.191 1.545 -22.507 1.00 0.00 C ATOM 1342 C TYR A 84 6.769 0.091 -22.306 1.00 0.00 C ATOM 1343 O TYR A 84 7.540 -0.788 -22.680 1.00 0.00 O ATOM 1344 CB TYR A 84 8.535 1.919 -21.845 1.00 0.00 C ATOM 1345 CG TYR A 84 8.781 1.648 -20.365 1.00 0.00 C ATOM 1346 CD1 TYR A 84 7.768 1.200 -19.495 1.00 0.00 C ATOM 1347 CD2 TYR A 84 10.081 1.837 -19.854 1.00 0.00 C ATOM 1348 CE1 TYR A 84 8.056 0.937 -18.144 1.00 0.00 C ATOM 1349 CE2 TYR A 84 10.348 1.638 -18.495 1.00 0.00 C ATOM 1350 CZ TYR A 84 9.345 1.156 -17.643 1.00 0.00 C ATOM 1351 OH TYR A 84 9.615 0.881 -16.338 1.00 0.00 O ATOM 0 H TYR A 84 6.338 3.115 -21.433 1.00 0.00 H new ATOM 0 HA TYR A 84 7.352 1.571 -23.585 1.00 0.00 H new ATOM 0 HB2 TYR A 84 9.319 1.403 -22.399 1.00 0.00 H new ATOM 0 HB3 TYR A 84 8.683 2.987 -22.003 1.00 0.00 H new ATOM 0 HD1 TYR A 84 6.764 1.058 -19.868 1.00 0.00 H new ATOM 0 HD2 TYR A 84 10.878 2.138 -20.517 1.00 0.00 H new ATOM 0 HE1 TYR A 84 7.281 0.565 -17.491 1.00 0.00 H new ATOM 0 HE2 TYR A 84 11.330 1.856 -18.101 1.00 0.00 H new ATOM 0 HH TYR A 84 10.582 0.775 -16.219 1.00 0.00 H new ATOM 1361 N ASN A 85 5.584 -0.190 -21.742 1.00 0.00 N ATOM 1362 CA ASN A 85 5.109 -1.570 -21.717 1.00 0.00 C ATOM 1363 C ASN A 85 4.785 -2.010 -23.142 1.00 0.00 C ATOM 1364 O ASN A 85 5.529 -2.782 -23.739 1.00 0.00 O ATOM 1365 CB ASN A 85 4.019 -1.837 -20.654 1.00 0.00 C ATOM 1366 CG ASN A 85 2.571 -1.629 -21.098 1.00 0.00 C ATOM 1367 OD1 ASN A 85 1.813 -2.576 -21.272 1.00 0.00 O ATOM 1368 ND2 ASN A 85 2.157 -0.383 -21.301 1.00 0.00 N ATOM 0 H ASN A 85 4.962 0.495 -21.314 1.00 0.00 H new ATOM 0 HA ASN A 85 5.907 -2.223 -21.362 1.00 0.00 H new ATOM 0 HB2 ASN A 85 4.125 -2.865 -20.306 1.00 0.00 H new ATOM 0 HB3 ASN A 85 4.210 -1.189 -19.798 1.00 0.00 H new ATOM 0 HD21 ASN A 85 1.199 -0.207 -21.605 1.00 0.00 H new ATOM 0 HD22 ASN A 85 2.797 0.397 -21.153 1.00 0.00 H new ATOM 1375 N GLU A 86 3.712 -1.451 -23.699 1.00 0.00 N ATOM 1376 CA GLU A 86 3.210 -1.720 -25.038 1.00 0.00 C ATOM 1377 C GLU A 86 2.212 -0.649 -25.470 1.00 0.00 C ATOM 1378 O GLU A 86 1.157 -0.986 -26.008 1.00 0.00 O ATOM 1379 CB GLU A 86 2.538 -3.104 -25.131 1.00 0.00 C ATOM 1380 CG GLU A 86 3.330 -4.372 -24.787 1.00 0.00 C ATOM 1381 CD GLU A 86 2.463 -5.619 -24.917 1.00 0.00 C ATOM 1382 OE1 GLU A 86 1.535 -5.601 -25.751 1.00 0.00 O ATOM 1383 OE2 GLU A 86 2.678 -6.540 -24.097 1.00 0.00 O ATOM 0 H GLU A 86 3.144 -0.765 -23.201 1.00 0.00 H new ATOM 0 HA GLU A 86 4.072 -1.707 -25.705 1.00 0.00 H new ATOM 0 HB2 GLU A 86 1.664 -3.083 -24.480 1.00 0.00 H new ATOM 0 HB3 GLU A 86 2.173 -3.218 -26.152 1.00 0.00 H new ATOM 0 HG2 GLU A 86 4.192 -4.455 -25.449 1.00 0.00 H new ATOM 0 HG3 GLU A 86 3.715 -4.298 -23.770 1.00 0.00 H new ATOM 1552 N ALA B 8 2.419 -7.781 -14.008 1.00 0.00 N ATOM 1553 CA ALA B 8 1.740 -7.115 -12.902 1.00 0.00 C ATOM 1554 C ALA B 8 1.118 -5.801 -13.377 1.00 0.00 C ATOM 1555 O ALA B 8 -0.085 -5.582 -13.237 1.00 0.00 O ATOM 1556 CB ALA B 8 2.725 -6.885 -11.751 1.00 0.00 C ATOM 0 HA ALA B 8 0.933 -7.751 -12.537 1.00 0.00 H new ATOM 0 HB1 ALA B 8 2.213 -6.387 -10.928 1.00 0.00 H new ATOM 0 HB2 ALA B 8 3.115 -7.844 -11.409 1.00 0.00 H new ATOM 0 HB3 ALA B 8 3.549 -6.260 -12.096 1.00 0.00 H new ATOM 1562 N ILE B 9 1.939 -4.945 -13.988 1.00 0.00 N ATOM 1563 CA ILE B 9 1.489 -3.732 -14.659 1.00 0.00 C ATOM 1564 C ILE B 9 0.364 -4.082 -15.644 1.00 0.00 C ATOM 1565 O ILE B 9 -0.672 -3.423 -15.687 1.00 0.00 O ATOM 1566 CB ILE B 9 2.710 -3.084 -15.341 1.00 0.00 C ATOM 1567 CG1 ILE B 9 3.708 -2.494 -14.324 1.00 0.00 C ATOM 1568 CG2 ILE B 9 2.329 -2.044 -16.394 1.00 0.00 C ATOM 1569 CD1 ILE B 9 3.221 -1.233 -13.598 1.00 0.00 C ATOM 0 H ILE B 9 2.949 -5.080 -14.029 1.00 0.00 H new ATOM 0 HA ILE B 9 1.074 -3.010 -13.956 1.00 0.00 H new ATOM 0 HB ILE B 9 3.210 -3.899 -15.865 1.00 0.00 H new ATOM 0 HG12 ILE B 9 3.940 -3.257 -13.581 1.00 0.00 H new ATOM 0 HG13 ILE B 9 4.638 -2.261 -14.843 1.00 0.00 H new ATOM 0 HG21 ILE B 9 3.233 -1.626 -16.836 1.00 0.00 H new ATOM 0 HG22 ILE B 9 1.730 -2.517 -17.172 1.00 0.00 H new ATOM 0 HG23 ILE B 9 1.752 -1.247 -15.926 1.00 0.00 H new ATOM 0 HD11 ILE B 9 3.990 -0.893 -12.904 1.00 0.00 H new ATOM 0 HD12 ILE B 9 3.017 -0.449 -14.327 1.00 0.00 H new ATOM 0 HD13 ILE B 9 2.309 -1.460 -13.046 1.00 0.00 H new ATOM 1581 N GLY B 10 0.559 -5.154 -16.406 1.00 0.00 N ATOM 1582 CA GLY B 10 -0.377 -5.725 -17.353 1.00 0.00 C ATOM 1583 C GLY B 10 -1.745 -5.954 -16.724 1.00 0.00 C ATOM 1584 O GLY B 10 -2.749 -5.604 -17.336 1.00 0.00 O ATOM 0 H GLY B 10 1.434 -5.677 -16.372 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -0.478 -5.060 -18.211 1.00 0.00 H new ATOM 0 HA3 GLY B 10 0.015 -6.671 -17.727 1.00 0.00 H new ATOM 1588 N LEU B 11 -1.810 -6.511 -15.510 1.00 0.00 N ATOM 1589 CA LEU B 11 -3.082 -6.655 -14.807 1.00 0.00 C ATOM 1590 C LEU B 11 -3.748 -5.286 -14.662 1.00 0.00 C ATOM 1591 O LEU B 11 -4.892 -5.105 -15.077 1.00 0.00 O ATOM 1592 CB LEU B 11 -2.915 -7.322 -13.431 1.00 0.00 C ATOM 1593 CG LEU B 11 -2.243 -8.704 -13.453 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -2.200 -9.262 -12.026 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -2.970 -9.695 -14.369 1.00 0.00 C ATOM 0 H LEU B 11 -1.001 -6.866 -15.000 1.00 0.00 H new ATOM 0 HA LEU B 11 -3.719 -7.310 -15.401 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -2.329 -6.661 -12.793 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -3.898 -7.421 -12.971 1.00 0.00 H new ATOM 0 HG LEU B 11 -1.236 -8.577 -13.849 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -1.724 -10.243 -12.033 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -1.630 -8.587 -11.388 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -3.215 -9.354 -11.640 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -2.455 -10.655 -14.348 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.995 -9.826 -14.023 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -2.978 -9.310 -15.389 1.00 0.00 H new ATOM 1607 N LEU B 12 -3.024 -4.310 -14.109 1.00 0.00 N ATOM 1608 CA LEU B 12 -3.543 -2.958 -13.912 1.00 0.00 C ATOM 1609 C LEU B 12 -4.031 -2.361 -15.235 1.00 0.00 C ATOM 1610 O LEU B 12 -5.097 -1.745 -15.283 1.00 0.00 O ATOM 1611 CB LEU B 12 -2.489 -2.055 -13.252 1.00 0.00 C ATOM 1612 CG LEU B 12 -1.936 -2.604 -11.924 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -0.862 -1.648 -11.397 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -3.036 -2.769 -10.869 1.00 0.00 C ATOM 0 H LEU B 12 -2.064 -4.436 -13.787 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.398 -3.020 -13.238 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.661 -1.912 -13.947 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.928 -1.073 -13.073 1.00 0.00 H new ATOM 0 HG LEU B 12 -1.512 -3.590 -12.116 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -0.465 -2.030 -10.456 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -0.055 -1.569 -12.126 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.300 -0.663 -11.233 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -2.602 -3.159 -9.948 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -3.498 -1.802 -10.671 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -3.791 -3.464 -11.236 1.00 0.00 H new ATOM 1626 N ILE B 13 -3.265 -2.541 -16.315 1.00 0.00 N ATOM 1627 CA ILE B 13 -3.623 -2.073 -17.648 1.00 0.00 C ATOM 1628 C ILE B 13 -4.819 -2.853 -18.204 1.00 0.00 C ATOM 1629 O ILE B 13 -5.629 -2.283 -18.930 1.00 0.00 O ATOM 1630 CB ILE B 13 -2.405 -2.131 -18.591 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -1.338 -1.133 -18.104 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -2.815 -1.803 -20.037 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -0.014 -1.285 -18.851 1.00 0.00 C ATOM 0 H ILE B 13 -2.367 -3.023 -16.282 1.00 0.00 H new ATOM 0 HA ILE B 13 -3.930 -1.030 -17.576 1.00 0.00 H new ATOM 0 HB ILE B 13 -1.996 -3.141 -18.578 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -1.710 -0.116 -18.232 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -1.169 -1.278 -17.037 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -1.939 -1.850 -20.683 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -3.557 -2.526 -20.378 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -3.241 -0.800 -20.076 1.00 0.00 H new ATOM 0 HD11 ILE B 13 0.704 -0.559 -18.470 1.00 0.00 H new ATOM 0 HD12 ILE B 13 0.375 -2.292 -18.701 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -0.175 -1.113 -19.915 1.00 0.00 H new ATOM 1645 N GLY B 14 -4.946 -4.143 -17.903 1.00 0.00 N ATOM 1646 CA GLY B 14 -6.057 -4.968 -18.349 1.00 0.00 C ATOM 1647 C GLY B 14 -7.352 -4.505 -17.688 1.00 0.00 C ATOM 1648 O GLY B 14 -8.372 -4.326 -18.362 1.00 0.00 O ATOM 0 H GLY B 14 -4.268 -4.649 -17.333 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -6.152 -4.909 -19.433 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -5.867 -6.012 -18.102 1.00 0.00 H new ATOM 1652 N ILE B 15 -7.287 -4.311 -16.369 1.00 0.00 N ATOM 1653 CA ILE B 15 -8.365 -3.818 -15.524 1.00 0.00 C ATOM 1654 C ILE B 15 -8.770 -2.409 -15.970 1.00 0.00 C ATOM 1655 O ILE B 15 -9.953 -2.145 -16.167 1.00 0.00 O ATOM 1656 CB ILE B 15 -7.904 -3.865 -14.050 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -7.771 -5.331 -13.588 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -8.874 -3.116 -13.127 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -6.970 -5.477 -12.290 1.00 0.00 C ATOM 0 H ILE B 15 -6.437 -4.505 -15.840 1.00 0.00 H new ATOM 0 HA ILE B 15 -9.250 -4.447 -15.618 1.00 0.00 H new ATOM 0 HB ILE B 15 -6.935 -3.370 -13.989 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -8.766 -5.753 -13.445 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -7.289 -5.912 -14.374 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -8.515 -3.172 -12.099 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.935 -2.072 -13.434 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -9.862 -3.571 -13.191 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -6.911 -6.530 -12.016 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -5.964 -5.083 -12.437 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -7.464 -4.922 -11.493 1.00 0.00 H new ATOM 1671 N PHE B 16 -7.783 -1.526 -16.146 1.00 0.00 N ATOM 1672 CA PHE B 16 -7.913 -0.092 -16.384 1.00 0.00 C ATOM 1673 C PHE B 16 -9.194 0.294 -17.122 1.00 0.00 C ATOM 1674 O PHE B 16 -10.100 0.882 -16.543 1.00 0.00 O ATOM 1675 CB PHE B 16 -6.607 0.385 -17.049 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.541 1.733 -17.731 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -7.309 2.822 -17.285 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -5.585 1.925 -18.749 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -7.263 4.038 -17.986 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -5.522 3.151 -19.432 1.00 0.00 C ATOM 1681 CZ PHE B 16 -6.420 4.176 -19.100 1.00 0.00 C ATOM 0 H PHE B 16 -6.806 -1.818 -16.124 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.036 0.437 -15.439 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -5.833 0.374 -16.282 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -6.331 -0.365 -17.791 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -7.931 2.724 -16.408 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -4.901 1.129 -19.004 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -7.877 4.868 -17.668 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -4.787 3.303 -20.208 1.00 0.00 H new ATOM 0 HZ PHE B 16 -6.463 5.072 -19.702 1.00 0.00 H new ATOM 1691 N HIS B 17 -9.268 -0.038 -18.403 1.00 0.00 N ATOM 1692 CA HIS B 17 -10.392 0.341 -19.264 1.00 0.00 C ATOM 1693 C HIS B 17 -11.500 -0.719 -19.309 1.00 0.00 C ATOM 1694 O HIS B 17 -12.480 -0.540 -20.025 1.00 0.00 O ATOM 1695 CB HIS B 17 -9.883 0.731 -20.660 1.00 0.00 C ATOM 1696 CG HIS B 17 -8.778 -0.175 -21.130 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -8.903 -1.539 -21.302 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -7.457 0.101 -20.921 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -7.692 -2.083 -21.130 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -6.795 -1.107 -20.921 1.00 0.00 N ATOM 0 H HIS B 17 -8.549 -0.581 -18.882 1.00 0.00 H new ATOM 0 HA HIS B 17 -10.866 1.218 -18.822 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -10.709 0.694 -21.370 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -9.525 1.760 -20.641 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -7.017 1.077 -20.783 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -7.472 -3.140 -21.155 1.00 0.00 H new ATOM 0 HE2 HIS B 17 -5.793 -1.238 -20.785 1.00 0.00 H new ATOM 1708 N LYS B 18 -11.385 -1.817 -18.548 1.00 0.00 N ATOM 1709 CA LYS B 18 -12.429 -2.841 -18.477 1.00 0.00 C ATOM 1710 C LYS B 18 -13.772 -2.228 -18.080 1.00 0.00 C ATOM 1711 O LYS B 18 -14.820 -2.651 -18.559 1.00 0.00 O ATOM 1712 CB LYS B 18 -12.014 -3.930 -17.471 1.00 0.00 C ATOM 1713 CG LYS B 18 -12.705 -5.277 -17.729 1.00 0.00 C ATOM 1714 CD LYS B 18 -11.795 -6.320 -18.403 1.00 0.00 C ATOM 1715 CE LYS B 18 -11.392 -5.989 -19.849 1.00 0.00 C ATOM 1716 NZ LYS B 18 -10.434 -4.871 -19.942 1.00 0.00 N ATOM 0 H LYS B 18 -10.569 -2.017 -17.969 1.00 0.00 H new ATOM 0 HA LYS B 18 -12.548 -3.289 -19.463 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -10.934 -4.067 -17.517 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -12.250 -3.594 -16.461 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -13.064 -5.679 -16.781 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -13.581 -5.112 -18.357 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -10.890 -6.432 -17.806 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -12.303 -7.284 -18.395 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -10.953 -6.874 -20.309 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -12.286 -5.742 -20.421 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -9.744 -5.067 -20.695 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -10.946 -3.993 -20.162 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -9.936 -4.764 -19.035 1.00 0.00 H new ATOM 1730 N TYR B 19 -13.720 -1.212 -17.224 1.00 0.00 N ATOM 1731 CA TYR B 19 -14.877 -0.459 -16.783 1.00 0.00 C ATOM 1732 C TYR B 19 -15.652 0.111 -17.968 1.00 0.00 C ATOM 1733 O TYR B 19 -16.885 0.066 -17.972 1.00 0.00 O ATOM 1734 CB TYR B 19 -14.411 0.625 -15.805 1.00 0.00 C ATOM 1735 CG TYR B 19 -13.888 0.055 -14.500 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -12.590 -0.483 -14.421 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -14.758 -0.075 -13.404 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -12.205 -1.215 -13.288 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -14.382 -0.827 -12.279 1.00 0.00 C ATOM 1740 CZ TYR B 19 -13.117 -1.439 -12.245 1.00 0.00 C ATOM 1741 OH TYR B 19 -12.722 -2.180 -11.177 1.00 0.00 O ATOM 0 H TYR B 19 -12.847 -0.885 -16.810 1.00 0.00 H new ATOM 0 HA TYR B 19 -15.574 -1.117 -16.264 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -13.628 1.220 -16.276 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -15.241 1.299 -15.595 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -11.892 -0.333 -15.231 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -15.724 0.407 -13.427 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -11.202 -1.608 -13.218 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -15.060 -0.934 -11.445 1.00 0.00 H new ATOM 0 HH TYR B 19 -13.149 -1.837 -10.365 1.00 0.00 H new ATOM 1751 N SER B 20 -14.948 0.579 -19.002 1.00 0.00 N ATOM 1752 CA SER B 20 -15.567 1.060 -20.227 1.00 0.00 C ATOM 1753 C SER B 20 -16.126 -0.071 -21.096 1.00 0.00 C ATOM 1754 O SER B 20 -16.610 0.214 -22.183 1.00 0.00 O ATOM 1755 CB SER B 20 -14.566 1.909 -21.018 1.00 0.00 C ATOM 1756 OG SER B 20 -14.224 3.062 -20.270 1.00 0.00 O ATOM 0 H SER B 20 -13.929 0.633 -19.007 1.00 0.00 H new ATOM 0 HA SER B 20 -16.420 1.675 -19.939 1.00 0.00 H new ATOM 0 HB2 SER B 20 -13.671 1.326 -21.235 1.00 0.00 H new ATOM 0 HB3 SER B 20 -14.997 2.200 -21.976 1.00 0.00 H new ATOM 0 HG SER B 20 -15.036 3.569 -20.060 1.00 0.00 H new ATOM 1762 N GLY B 21 -16.110 -1.330 -20.638 1.00 0.00 N ATOM 1763 CA GLY B 21 -16.510 -2.500 -21.416 1.00 0.00 C ATOM 1764 C GLY B 21 -17.803 -2.312 -22.216 1.00 0.00 C ATOM 1765 O GLY B 21 -17.912 -2.807 -23.333 1.00 0.00 O ATOM 0 H GLY B 21 -15.810 -1.564 -19.692 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -15.705 -2.757 -22.104 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -16.634 -3.346 -20.740 1.00 0.00 H new ATOM 1825 N LYS B 26 -11.740 -0.105 -25.235 1.00 0.00 N ATOM 1826 CA LYS B 26 -11.148 1.179 -25.639 1.00 0.00 C ATOM 1827 C LYS B 26 -10.266 1.772 -24.532 1.00 0.00 C ATOM 1828 O LYS B 26 -10.735 2.057 -23.434 1.00 0.00 O ATOM 1829 CB LYS B 26 -12.304 2.082 -26.118 1.00 0.00 C ATOM 1830 CG LYS B 26 -12.079 3.604 -26.202 1.00 0.00 C ATOM 1831 CD LYS B 26 -12.285 4.403 -24.899 1.00 0.00 C ATOM 1832 CE LYS B 26 -13.584 4.046 -24.157 1.00 0.00 C ATOM 1833 NZ LYS B 26 -13.820 4.888 -22.970 1.00 0.00 N ATOM 0 HA LYS B 26 -10.450 1.060 -26.468 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -12.601 1.738 -27.109 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -13.152 1.911 -25.454 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -11.062 3.780 -26.553 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -12.751 4.007 -26.959 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -11.438 4.226 -24.236 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -12.291 5.468 -25.132 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -14.426 4.148 -24.841 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -13.546 3.000 -23.852 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -14.408 4.369 -22.287 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -12.910 5.130 -22.529 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -14.309 5.761 -23.255 1.00 0.00 H new ATOM 1847 N HIS B 27 -8.964 1.914 -24.828 1.00 0.00 N ATOM 1848 CA HIS B 27 -7.899 2.128 -23.846 1.00 0.00 C ATOM 1849 C HIS B 27 -7.827 3.523 -23.201 1.00 0.00 C ATOM 1850 O HIS B 27 -6.734 4.046 -22.997 1.00 0.00 O ATOM 1851 CB HIS B 27 -6.547 1.603 -24.398 1.00 0.00 C ATOM 1852 CG HIS B 27 -6.457 0.090 -24.556 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -5.306 -0.691 -24.541 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -7.514 -0.773 -24.642 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -5.678 -1.986 -24.573 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -7.019 -2.055 -24.619 1.00 0.00 N ATOM 0 H HIS B 27 -8.617 1.881 -25.787 1.00 0.00 H new ATOM 0 HA HIS B 27 -8.171 1.525 -22.980 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -6.364 2.066 -25.368 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -5.749 1.931 -23.733 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -8.555 -0.496 -24.715 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -5.006 -2.832 -24.563 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -7.574 -2.911 -24.634 1.00 0.00 H new ATOM 1864 N THR B 28 -8.974 4.065 -22.789 1.00 0.00 N ATOM 1865 CA THR B 28 -9.133 5.250 -21.957 1.00 0.00 C ATOM 1866 C THR B 28 -10.434 5.034 -21.169 1.00 0.00 C ATOM 1867 O THR B 28 -11.420 4.537 -21.720 1.00 0.00 O ATOM 1868 CB THR B 28 -9.148 6.538 -22.799 1.00 0.00 C ATOM 1869 OG1 THR B 28 -9.962 6.389 -23.941 1.00 0.00 O ATOM 1870 CG2 THR B 28 -7.751 6.951 -23.270 1.00 0.00 C ATOM 0 H THR B 28 -9.873 3.658 -23.047 1.00 0.00 H new ATOM 0 HA THR B 28 -8.292 5.382 -21.276 1.00 0.00 H new ATOM 0 HB THR B 28 -9.545 7.312 -22.143 1.00 0.00 H new ATOM 0 HG1 THR B 28 -10.899 6.540 -23.697 1.00 0.00 H new ATOM 0 HG21 THR B 28 -7.821 7.865 -23.859 1.00 0.00 H new ATOM 0 HG22 THR B 28 -7.112 7.125 -22.404 1.00 0.00 H new ATOM 0 HG23 THR B 28 -7.324 6.157 -23.882 1.00 0.00 H new ATOM 1878 N LEU B 29 -10.419 5.295 -19.860 1.00 0.00 N ATOM 1879 CA LEU B 29 -11.518 4.917 -18.980 1.00 0.00 C ATOM 1880 C LEU B 29 -12.539 6.054 -18.961 1.00 0.00 C ATOM 1881 O LEU B 29 -12.237 7.154 -18.509 1.00 0.00 O ATOM 1882 CB LEU B 29 -10.953 4.607 -17.590 1.00 0.00 C ATOM 1883 CG LEU B 29 -11.828 3.722 -16.692 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -11.097 3.553 -15.357 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -13.220 4.299 -16.424 1.00 0.00 C ATOM 0 H LEU B 29 -9.650 5.770 -19.387 1.00 0.00 H new ATOM 0 HA LEU B 29 -12.027 4.020 -19.334 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -9.985 4.122 -17.713 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -10.774 5.550 -17.074 1.00 0.00 H new ATOM 0 HG LEU B 29 -11.983 2.776 -17.210 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -11.693 2.927 -14.693 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -10.130 3.081 -15.529 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -10.947 4.530 -14.898 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -13.779 3.618 -15.783 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -13.124 5.266 -15.930 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -13.750 4.425 -17.368 1.00 0.00 H new ATOM 1897 N SER B 30 -13.746 5.814 -19.458 1.00 0.00 N ATOM 1898 CA SER B 30 -14.805 6.810 -19.447 1.00 0.00 C ATOM 1899 C SER B 30 -15.186 7.192 -18.013 1.00 0.00 C ATOM 1900 O SER B 30 -15.454 6.321 -17.185 1.00 0.00 O ATOM 1901 CB SER B 30 -16.004 6.241 -20.201 1.00 0.00 C ATOM 1902 OG SER B 30 -16.185 4.889 -19.835 1.00 0.00 O ATOM 0 H SER B 30 -14.016 4.925 -19.879 1.00 0.00 H new ATOM 0 HA SER B 30 -14.461 7.721 -19.936 1.00 0.00 H new ATOM 0 HB2 SER B 30 -16.901 6.816 -19.969 1.00 0.00 H new ATOM 0 HB3 SER B 30 -15.844 6.321 -21.276 1.00 0.00 H new ATOM 0 HG SER B 30 -16.000 4.781 -18.879 1.00 0.00 H new ATOM 1908 N LYS B 31 -15.255 8.497 -17.719 1.00 0.00 N ATOM 1909 CA LYS B 31 -15.589 8.993 -16.386 1.00 0.00 C ATOM 1910 C LYS B 31 -16.800 8.267 -15.785 1.00 0.00 C ATOM 1911 O LYS B 31 -16.775 7.842 -14.632 1.00 0.00 O ATOM 1912 CB LYS B 31 -15.788 10.519 -16.386 1.00 0.00 C ATOM 1913 CG LYS B 31 -16.688 11.075 -17.505 1.00 0.00 C ATOM 1914 CD LYS B 31 -17.410 12.342 -17.019 1.00 0.00 C ATOM 1915 CE LYS B 31 -18.104 13.094 -18.167 1.00 0.00 C ATOM 1916 NZ LYS B 31 -17.223 14.124 -18.748 1.00 0.00 N ATOM 0 H LYS B 31 -15.080 9.235 -18.401 1.00 0.00 H new ATOM 0 HA LYS B 31 -14.737 8.772 -15.743 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -16.211 10.812 -15.425 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -14.810 10.994 -16.461 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -16.088 11.304 -18.386 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -17.418 10.323 -17.803 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -18.150 12.070 -16.266 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -16.692 13.004 -16.536 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -18.398 12.386 -18.942 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -19.017 13.561 -17.798 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -17.509 14.312 -19.730 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -17.299 15.000 -18.192 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -16.239 13.788 -18.732 1.00 0.00 H new ATOM 1930 N LYS B 32 -17.858 8.082 -16.577 1.00 0.00 N ATOM 1931 CA LYS B 32 -19.092 7.484 -16.096 1.00 0.00 C ATOM 1932 C LYS B 32 -18.956 6.003 -15.756 1.00 0.00 C ATOM 1933 O LYS B 32 -19.831 5.467 -15.080 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.226 7.725 -17.104 1.00 0.00 C ATOM 1935 CG LYS B 32 -19.944 7.113 -18.490 1.00 0.00 C ATOM 1936 CD LYS B 32 -21.260 6.957 -19.265 1.00 0.00 C ATOM 1937 CE LYS B 32 -21.085 6.306 -20.647 1.00 0.00 C ATOM 1938 NZ LYS B 32 -20.514 4.946 -20.568 1.00 0.00 N ATOM 0 H LYS B 32 -17.878 8.343 -17.563 1.00 0.00 H new ATOM 0 HA LYS B 32 -19.338 7.979 -15.156 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -21.151 7.304 -16.709 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -20.385 8.798 -17.213 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -19.257 7.750 -19.046 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -19.460 6.143 -18.378 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -21.951 6.356 -18.674 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -21.717 7.938 -19.390 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -22.052 6.261 -21.148 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -20.437 6.933 -21.260 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -20.851 4.381 -21.374 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -19.476 5.003 -20.595 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -20.813 4.495 -19.680 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.916 5.315 -16.226 1.00 0.00 N ATOM 1953 CA GLU B 33 -17.608 3.980 -15.746 1.00 0.00 C ATOM 1954 C GLU B 33 -16.590 4.001 -14.605 1.00 0.00 C ATOM 1955 O GLU B 33 -16.394 2.980 -13.952 1.00 0.00 O ATOM 1956 CB GLU B 33 -17.305 3.039 -16.910 1.00 0.00 C ATOM 1957 CG GLU B 33 -18.362 3.131 -18.032 1.00 0.00 C ATOM 1958 CD GLU B 33 -19.820 3.098 -17.585 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -20.149 2.302 -16.676 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -20.611 3.852 -18.189 1.00 0.00 O ATOM 0 H GLU B 33 -17.276 5.665 -16.939 1.00 0.00 H new ATOM 0 HA GLU B 33 -18.492 3.550 -15.276 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -16.323 3.276 -17.319 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -17.258 2.014 -16.542 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -18.194 4.054 -18.587 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -18.197 2.307 -18.727 1.00 0.00 H new ATOM 1967 N LEU B 34 -15.997 5.159 -14.288 1.00 0.00 N ATOM 1968 CA LEU B 34 -15.167 5.274 -13.100 1.00 0.00 C ATOM 1969 C LEU B 34 -16.024 5.131 -11.838 1.00 0.00 C ATOM 1970 O LEU B 34 -15.543 4.563 -10.860 1.00 0.00 O ATOM 1971 CB LEU B 34 -14.353 6.576 -13.094 1.00 0.00 C ATOM 1972 CG LEU B 34 -13.174 6.498 -12.104 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -11.976 5.746 -12.684 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -12.729 7.900 -11.685 1.00 0.00 C ATOM 0 H LEU B 34 -16.080 6.016 -14.835 1.00 0.00 H new ATOM 0 HA LEU B 34 -14.443 4.459 -13.113 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -13.975 6.775 -14.097 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -15.001 7.411 -12.826 1.00 0.00 H new ATOM 0 HG LEU B 34 -13.534 5.946 -11.236 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -11.172 5.719 -11.948 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -12.273 4.728 -12.935 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -11.628 6.255 -13.583 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -11.896 7.824 -10.986 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -12.414 8.460 -12.565 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -13.560 8.417 -11.204 1.00 0.00 H new ATOM 1986 N LYS B 35 -17.288 5.596 -11.848 1.00 0.00 N ATOM 1987 CA LYS B 35 -18.190 5.431 -10.694 1.00 0.00 C ATOM 1988 C LYS B 35 -18.074 4.040 -10.056 1.00 0.00 C ATOM 1989 O LYS B 35 -17.783 3.909 -8.871 1.00 0.00 O ATOM 1990 CB LYS B 35 -19.649 5.788 -11.039 1.00 0.00 C ATOM 1991 CG LYS B 35 -20.232 5.089 -12.279 1.00 0.00 C ATOM 1992 CD LYS B 35 -21.215 3.933 -12.017 1.00 0.00 C ATOM 1993 CE LYS B 35 -21.869 3.435 -13.325 1.00 0.00 C ATOM 1994 NZ LYS B 35 -20.868 3.084 -14.353 1.00 0.00 N ATOM 0 H LYS B 35 -17.705 6.087 -12.639 1.00 0.00 H new ATOM 0 HA LYS B 35 -17.860 6.147 -9.942 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -20.275 5.546 -10.180 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -19.714 6.866 -11.188 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -20.740 5.838 -12.886 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -19.404 4.705 -12.875 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -20.688 3.109 -11.536 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -21.990 4.263 -11.325 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -22.488 2.563 -13.111 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -22.531 4.208 -13.715 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -21.345 2.645 -15.166 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -20.374 3.944 -14.664 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -20.180 2.415 -13.953 1.00 0.00 H new ATOM 2008 N GLU B 36 -18.224 2.995 -10.870 1.00 0.00 N ATOM 2009 CA GLU B 36 -18.043 1.598 -10.488 1.00 0.00 C ATOM 2010 C GLU B 36 -16.806 1.393 -9.614 1.00 0.00 C ATOM 2011 O GLU B 36 -16.837 0.682 -8.608 1.00 0.00 O ATOM 2012 CB GLU B 36 -17.865 0.781 -11.776 1.00 0.00 C ATOM 2013 CG GLU B 36 -18.946 -0.255 -12.071 1.00 0.00 C ATOM 2014 CD GLU B 36 -19.242 -0.268 -13.560 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -19.771 0.753 -14.052 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -18.882 -1.245 -14.249 1.00 0.00 O ATOM 0 H GLU B 36 -18.485 3.104 -11.850 1.00 0.00 H new ATOM 0 HA GLU B 36 -18.914 1.282 -9.914 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -17.815 1.473 -12.617 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -16.904 0.269 -11.727 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -18.617 -1.242 -11.746 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -19.852 -0.021 -11.511 1.00 0.00 H new ATOM 2023 N LEU B 37 -15.707 1.961 -10.091 1.00 0.00 N ATOM 2024 CA LEU B 37 -14.368 1.788 -9.571 1.00 0.00 C ATOM 2025 C LEU B 37 -14.256 2.536 -8.241 1.00 0.00 C ATOM 2026 O LEU B 37 -13.752 1.987 -7.258 1.00 0.00 O ATOM 2027 CB LEU B 37 -13.365 2.283 -10.630 1.00 0.00 C ATOM 2028 CG LEU B 37 -12.051 1.487 -10.655 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -11.299 1.773 -11.958 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -11.127 1.843 -9.497 1.00 0.00 C ATOM 0 H LEU B 37 -15.733 2.588 -10.895 1.00 0.00 H new ATOM 0 HA LEU B 37 -14.141 0.741 -9.371 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -13.832 2.228 -11.614 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.140 3.333 -10.442 1.00 0.00 H new ATOM 0 HG LEU B 37 -12.323 0.435 -10.571 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -10.368 1.207 -11.972 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -11.916 1.478 -12.807 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -11.077 2.838 -12.024 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.214 1.251 -9.565 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -10.876 2.903 -9.544 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -11.628 1.630 -8.553 1.00 0.00 H new ATOM 2042 N ILE B 38 -14.733 3.789 -8.200 1.00 0.00 N ATOM 2043 CA ILE B 38 -14.615 4.597 -6.991 1.00 0.00 C ATOM 2044 C ILE B 38 -15.569 4.121 -5.901 1.00 0.00 C ATOM 2045 O ILE B 38 -15.131 3.924 -4.772 1.00 0.00 O ATOM 2046 CB ILE B 38 -14.656 6.124 -7.231 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -16.075 6.713 -7.288 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -13.870 6.511 -8.486 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -16.085 8.222 -7.547 1.00 0.00 C ATOM 0 H ILE B 38 -15.196 4.254 -8.981 1.00 0.00 H new ATOM 0 HA ILE B 38 -13.604 4.429 -6.620 1.00 0.00 H new ATOM 0 HB ILE B 38 -14.178 6.563 -6.355 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -16.640 6.211 -8.074 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -16.586 6.508 -6.347 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -13.918 7.591 -8.627 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -12.830 6.206 -8.372 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -14.302 6.012 -9.354 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -17.114 8.579 -7.576 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -15.547 8.732 -6.748 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -15.601 8.431 -8.501 1.00 0.00 H new ATOM 2061 N GLN B 39 -16.856 3.928 -6.215 1.00 0.00 N ATOM 2062 CA GLN B 39 -17.842 3.483 -5.236 1.00 0.00 C ATOM 2063 C GLN B 39 -17.328 2.254 -4.489 1.00 0.00 C ATOM 2064 O GLN B 39 -17.413 2.190 -3.265 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.199 3.188 -5.906 1.00 0.00 C ATOM 2066 CG GLN B 39 -20.236 4.300 -5.689 1.00 0.00 C ATOM 2067 CD GLN B 39 -19.846 5.660 -6.266 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -19.148 5.754 -7.268 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -20.308 6.737 -5.644 1.00 0.00 N ATOM 0 H GLN B 39 -17.236 4.076 -7.150 1.00 0.00 H new ATOM 0 HA GLN B 39 -17.996 4.288 -4.518 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -19.046 3.047 -6.976 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -19.594 2.251 -5.514 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -21.181 3.989 -6.135 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -20.410 4.411 -4.619 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -20.888 6.635 -4.811 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -20.083 7.667 -5.999 1.00 0.00 H new ATOM 2078 N LYS B 40 -16.863 1.260 -5.247 1.00 0.00 N ATOM 2079 CA LYS B 40 -16.324 0.029 -4.701 1.00 0.00 C ATOM 2080 C LYS B 40 -14.786 0.079 -4.544 1.00 0.00 C ATOM 2081 O LYS B 40 -14.270 0.712 -3.622 1.00 0.00 O ATOM 2082 CB LYS B 40 -16.792 -1.098 -5.620 1.00 0.00 C ATOM 2083 CG LYS B 40 -18.308 -1.214 -5.827 1.00 0.00 C ATOM 2084 CD LYS B 40 -18.659 -2.452 -6.677 1.00 0.00 C ATOM 2085 CE LYS B 40 -18.441 -2.325 -8.200 1.00 0.00 C ATOM 2086 NZ LYS B 40 -17.046 -2.020 -8.581 1.00 0.00 N ATOM 0 H LYS B 40 -16.853 1.294 -6.266 1.00 0.00 H new ATOM 0 HA LYS B 40 -16.690 -0.137 -3.688 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -16.322 -0.964 -6.594 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -16.427 -2.043 -5.217 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -18.806 -1.280 -4.860 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -18.681 -0.315 -6.317 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -18.067 -3.293 -6.316 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -19.706 -2.701 -6.502 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -18.743 -3.256 -8.679 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -19.093 -1.541 -8.587 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -16.834 -2.458 -9.500 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -16.923 -0.990 -8.651 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -16.399 -2.398 -7.860 1.00 0.00 H new ATOM 2100 N GLU B 41 -14.069 -0.579 -5.470 1.00 0.00 N ATOM 2101 CA GLU B 41 -12.652 -0.913 -5.469 1.00 0.00 C ATOM 2102 C GLU B 41 -11.767 0.084 -4.726 1.00 0.00 C ATOM 2103 O GLU B 41 -11.108 -0.287 -3.753 1.00 0.00 O ATOM 2104 CB GLU B 41 -12.148 -1.101 -6.915 1.00 0.00 C ATOM 2105 CG GLU B 41 -12.613 -2.395 -7.606 1.00 0.00 C ATOM 2106 CD GLU B 41 -14.074 -2.367 -8.014 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -14.926 -2.667 -7.156 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -14.388 -2.005 -9.168 1.00 0.00 O ATOM 0 H GLU B 41 -14.521 -0.920 -6.318 1.00 0.00 H new ATOM 0 HA GLU B 41 -12.570 -1.848 -4.915 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.478 -0.250 -7.512 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -11.058 -1.082 -6.909 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -11.999 -2.567 -8.490 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -12.447 -3.237 -6.934 1.00 0.00 H new ATOM 2115 N LEU B 42 -11.698 1.324 -5.219 1.00 0.00 N ATOM 2116 CA LEU B 42 -10.699 2.263 -4.707 1.00 0.00 C ATOM 2117 C LEU B 42 -11.159 3.101 -3.509 1.00 0.00 C ATOM 2118 O LEU B 42 -10.491 4.070 -3.152 1.00 0.00 O ATOM 2119 CB LEU B 42 -9.917 2.981 -5.819 1.00 0.00 C ATOM 2120 CG LEU B 42 -10.658 3.937 -6.761 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -11.162 5.180 -6.028 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -9.653 4.395 -7.821 1.00 0.00 C ATOM 0 H LEU B 42 -12.304 1.693 -5.952 1.00 0.00 H new ATOM 0 HA LEU B 42 -9.927 1.657 -4.232 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -9.115 3.546 -5.343 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -9.445 2.215 -6.435 1.00 0.00 H new ATOM 0 HG LEU B 42 -11.517 3.419 -7.187 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -11.681 5.831 -6.731 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -11.848 4.882 -5.235 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -10.317 5.714 -5.594 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -10.142 5.080 -8.514 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -8.819 4.903 -7.336 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -9.281 3.529 -8.368 1.00 0.00 H new ATOM 2134 N THR B 43 -12.257 2.713 -2.850 1.00 0.00 N ATOM 2135 CA THR B 43 -12.635 3.260 -1.553 1.00 0.00 C ATOM 2136 C THR B 43 -13.008 2.089 -0.634 1.00 0.00 C ATOM 2137 O THR B 43 -12.687 0.938 -0.916 1.00 0.00 O ATOM 2138 CB THR B 43 -13.758 4.297 -1.673 1.00 0.00 C ATOM 2139 OG1 THR B 43 -14.936 3.662 -2.105 1.00 0.00 O ATOM 2140 CG2 THR B 43 -13.397 5.470 -2.586 1.00 0.00 C ATOM 0 H THR B 43 -12.905 2.010 -3.206 1.00 0.00 H new ATOM 0 HA THR B 43 -11.795 3.802 -1.120 1.00 0.00 H new ATOM 0 HB THR B 43 -13.914 4.729 -0.685 1.00 0.00 H new ATOM 0 HG1 THR B 43 -15.137 3.936 -3.024 1.00 0.00 H new ATOM 0 HG21 THR B 43 -14.233 6.168 -2.629 1.00 0.00 H new ATOM 0 HG22 THR B 43 -12.518 5.980 -2.193 1.00 0.00 H new ATOM 0 HG23 THR B 43 -13.183 5.099 -3.588 1.00 0.00 H new ATOM 2148 N ILE B 44 -13.639 2.372 0.504 1.00 0.00 N ATOM 2149 CA ILE B 44 -14.098 1.407 1.489 1.00 0.00 C ATOM 2150 C ILE B 44 -12.967 0.912 2.380 1.00 0.00 C ATOM 2151 O ILE B 44 -13.112 0.917 3.605 1.00 0.00 O ATOM 2152 CB ILE B 44 -15.001 0.295 0.902 1.00 0.00 C ATOM 2153 CG1 ILE B 44 -16.200 0.928 0.166 1.00 0.00 C ATOM 2154 CG2 ILE B 44 -15.477 -0.652 2.014 1.00 0.00 C ATOM 2155 CD1 ILE B 44 -17.110 -0.099 -0.514 1.00 0.00 C ATOM 0 H ILE B 44 -13.853 3.332 0.774 1.00 0.00 H new ATOM 0 HA ILE B 44 -14.771 1.944 2.157 1.00 0.00 H new ATOM 0 HB ILE B 44 -14.425 -0.291 0.186 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -16.788 1.508 0.877 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -15.828 1.626 -0.584 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -16.111 -1.428 1.585 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -14.614 -1.113 2.494 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -16.045 -0.088 2.754 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -17.932 0.416 -1.012 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -16.536 -0.663 -1.250 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -17.511 -0.782 0.235 1.00 0.00 H new ATOM 2167 N GLY B 45 -11.838 0.533 1.788 1.00 0.00 N ATOM 2168 CA GLY B 45 -10.620 0.284 2.547 1.00 0.00 C ATOM 2169 C GLY B 45 -10.391 1.453 3.510 1.00 0.00 C ATOM 2170 O GLY B 45 -10.442 2.614 3.102 1.00 0.00 O ATOM 0 H GLY B 45 -11.743 0.392 0.782 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -10.705 -0.651 3.101 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -9.770 0.178 1.873 1.00 0.00 H new ATOM 2373 N ASP B 58 -14.283 11.808 -3.456 1.00 0.00 N ATOM 2374 CA ASP B 58 -13.213 10.908 -3.889 1.00 0.00 C ATOM 2375 C ASP B 58 -13.051 10.855 -5.396 1.00 0.00 C ATOM 2376 O ASP B 58 -12.005 10.406 -5.851 1.00 0.00 O ATOM 2377 CB ASP B 58 -13.366 9.476 -3.343 1.00 0.00 C ATOM 2378 CG ASP B 58 -13.279 9.318 -1.836 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -12.345 9.860 -1.202 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -14.091 8.541 -1.283 1.00 0.00 O ATOM 0 HA ASP B 58 -12.311 11.344 -3.461 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -14.329 9.085 -3.673 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -12.596 8.853 -3.797 1.00 0.00 H new ATOM 2385 N ASP B 59 -13.975 11.402 -6.188 1.00 0.00 N ATOM 2386 CA ASP B 59 -13.719 11.645 -7.605 1.00 0.00 C ATOM 2387 C ASP B 59 -12.682 12.784 -7.772 1.00 0.00 C ATOM 2388 O ASP B 59 -12.800 13.595 -8.676 1.00 0.00 O ATOM 2389 CB ASP B 59 -15.034 11.873 -8.371 1.00 0.00 C ATOM 2390 CG ASP B 59 -14.834 11.665 -9.866 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -14.802 10.495 -10.303 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -14.647 12.656 -10.607 1.00 0.00 O ATOM 0 H ASP B 59 -14.903 11.683 -5.872 1.00 0.00 H new ATOM 0 HA ASP B 59 -13.273 10.759 -8.056 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -15.798 11.188 -8.003 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -15.397 12.884 -8.186 1.00 0.00 H new ATOM 2397 N LEU B 60 -11.772 12.999 -6.808 1.00 0.00 N ATOM 2398 CA LEU B 60 -10.865 14.139 -6.688 1.00 0.00 C ATOM 2399 C LEU B 60 -9.927 14.270 -7.887 1.00 0.00 C ATOM 2400 O LEU B 60 -9.469 15.366 -8.202 1.00 0.00 O ATOM 2401 CB LEU B 60 -10.090 14.010 -5.367 1.00 0.00 C ATOM 2402 CG LEU B 60 -9.200 15.216 -5.021 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -10.008 16.514 -4.895 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -8.486 14.938 -3.694 1.00 0.00 C ATOM 0 H LEU B 60 -11.647 12.334 -6.045 1.00 0.00 H new ATOM 0 HA LEU B 60 -11.452 15.057 -6.679 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -10.803 13.858 -4.557 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -9.466 13.117 -5.414 1.00 0.00 H new ATOM 0 HG LEU B 60 -8.484 15.350 -5.831 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -9.337 17.338 -4.650 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -10.510 16.723 -5.840 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -10.752 16.404 -4.106 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -7.851 15.786 -3.438 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -9.226 14.787 -2.908 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -7.872 14.042 -3.792 1.00 0.00 H new ATOM 2416 N ASP B 61 -9.689 13.160 -8.587 1.00 0.00 N ATOM 2417 CA ASP B 61 -9.041 13.103 -9.888 1.00 0.00 C ATOM 2418 C ASP B 61 -9.815 13.869 -10.964 1.00 0.00 C ATOM 2419 O ASP B 61 -9.327 14.017 -12.080 1.00 0.00 O ATOM 2420 CB ASP B 61 -8.981 11.640 -10.309 1.00 0.00 C ATOM 2421 CG ASP B 61 -10.355 11.003 -10.447 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -11.183 11.201 -9.538 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -10.624 10.408 -11.510 1.00 0.00 O ATOM 0 H ASP B 61 -9.956 12.238 -8.243 1.00 0.00 H new ATOM 0 HA ASP B 61 -8.055 13.558 -9.796 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -8.454 11.563 -11.260 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -8.400 11.081 -9.576 1.00 0.00 H new ATOM 2428 N ARG B 62 -11.013 14.336 -10.611 1.00 0.00 N ATOM 2429 CA ARG B 62 -12.074 14.972 -11.405 1.00 0.00 C ATOM 2430 C ARG B 62 -11.631 15.682 -12.688 1.00 0.00 C ATOM 2431 O ARG B 62 -12.337 15.620 -13.694 1.00 0.00 O ATOM 2432 CB ARG B 62 -12.781 16.018 -10.518 1.00 0.00 C ATOM 2433 CG ARG B 62 -14.286 16.115 -10.807 1.00 0.00 C ATOM 2434 CD ARG B 62 -15.065 16.671 -9.607 1.00 0.00 C ATOM 2435 NE ARG B 62 -15.104 15.697 -8.496 1.00 0.00 N ATOM 2436 CZ ARG B 62 -14.409 15.741 -7.346 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -13.523 16.716 -7.119 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -14.596 14.807 -6.410 1.00 0.00 N ATOM 0 H ARG B 62 -11.302 14.270 -9.635 1.00 0.00 H new ATOM 0 HA ARG B 62 -12.715 14.151 -11.727 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -12.632 15.761 -9.469 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -12.321 16.993 -10.675 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -14.449 16.756 -11.674 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -14.671 15.128 -11.064 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -14.601 17.597 -9.266 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -16.082 16.918 -9.913 1.00 0.00 H new ATOM 0 HE ARG B 62 -15.730 14.900 -8.615 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -13.368 17.438 -7.823 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -13.002 16.738 -6.242 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -15.268 14.056 -6.566 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -14.066 14.845 -5.539 1.00 0.00 H new ATOM 2452 N ASN B 63 -10.474 16.346 -12.671 1.00 0.00 N ATOM 2453 CA ASN B 63 -9.863 16.912 -13.877 1.00 0.00 C ATOM 2454 C ASN B 63 -9.821 15.925 -15.053 1.00 0.00 C ATOM 2455 O ASN B 63 -9.775 16.354 -16.202 1.00 0.00 O ATOM 2456 CB ASN B 63 -8.461 17.459 -13.593 1.00 0.00 C ATOM 2457 CG ASN B 63 -7.463 16.369 -13.209 1.00 0.00 C ATOM 2458 OD1 ASN B 63 -7.187 16.175 -12.030 1.00 0.00 O ATOM 2459 ND2 ASN B 63 -6.901 15.662 -14.186 1.00 0.00 N ATOM 0 H ASN B 63 -9.933 16.507 -11.821 1.00 0.00 H new ATOM 0 HA ASN B 63 -10.509 17.737 -14.175 1.00 0.00 H new ATOM 0 HB2 ASN B 63 -8.096 17.984 -14.476 1.00 0.00 H new ATOM 0 HB3 ASN B 63 -8.519 18.191 -12.788 1.00 0.00 H new ATOM 0 HD21 ASN B 63 -6.220 14.936 -13.963 1.00 0.00 H new ATOM 0 HD22 ASN B 63 -7.151 15.846 -15.158 1.00 0.00 H new ATOM 2466 N LYS B 64 -9.857 14.616 -14.786 1.00 0.00 N ATOM 2467 CA LYS B 64 -9.970 13.584 -15.806 1.00 0.00 C ATOM 2468 C LYS B 64 -11.239 13.663 -16.666 1.00 0.00 C ATOM 2469 O LYS B 64 -11.371 12.854 -17.581 1.00 0.00 O ATOM 2470 CB LYS B 64 -9.855 12.195 -15.162 1.00 0.00 C ATOM 2471 CG LYS B 64 -10.882 11.805 -14.079 1.00 0.00 C ATOM 2472 CD LYS B 64 -12.374 11.979 -14.418 1.00 0.00 C ATOM 2473 CE LYS B 64 -13.306 11.093 -13.573 1.00 0.00 C ATOM 2474 NZ LYS B 64 -13.087 11.205 -12.116 1.00 0.00 N ATOM 0 H LYS B 64 -9.807 14.244 -13.838 1.00 0.00 H new ATOM 0 HA LYS B 64 -9.143 13.761 -16.493 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -9.913 11.453 -15.958 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -8.861 12.113 -14.723 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -10.716 10.760 -13.819 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -10.669 12.393 -13.186 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -12.651 13.023 -14.275 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -12.527 11.751 -15.473 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -14.340 11.356 -13.795 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -13.170 10.053 -13.871 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -13.640 10.474 -11.625 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -12.077 11.075 -11.906 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -13.390 12.145 -11.791 1.00 0.00 H new ATOM 2488 N ASP B 65 -12.187 14.558 -16.345 1.00 0.00 N ATOM 2489 CA ASP B 65 -13.541 14.641 -16.890 1.00 0.00 C ATOM 2490 C ASP B 65 -13.727 14.076 -18.301 1.00 0.00 C ATOM 2491 O ASP B 65 -14.685 13.339 -18.534 1.00 0.00 O ATOM 2492 CB ASP B 65 -14.057 16.081 -16.830 1.00 0.00 C ATOM 2493 CG ASP B 65 -15.465 16.108 -17.399 1.00 0.00 C ATOM 2494 OD1 ASP B 65 -16.395 15.627 -16.716 1.00 0.00 O ATOM 2495 OD2 ASP B 65 -15.615 16.381 -18.606 1.00 0.00 O ATOM 0 H ASP B 65 -12.012 15.287 -15.653 1.00 0.00 H new ATOM 0 HA ASP B 65 -14.132 13.990 -16.246 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -14.056 16.442 -15.801 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -13.404 16.742 -17.400 1.00 0.00 H new ATOM 2500 N GLN B 66 -12.857 14.449 -19.242 1.00 0.00 N ATOM 2501 CA GLN B 66 -12.910 13.940 -20.609 1.00 0.00 C ATOM 2502 C GLN B 66 -13.039 12.409 -20.645 1.00 0.00 C ATOM 2503 O GLN B 66 -14.075 11.884 -21.045 1.00 0.00 O ATOM 2504 CB GLN B 66 -11.753 14.505 -21.452 1.00 0.00 C ATOM 2505 CG GLN B 66 -10.333 14.253 -20.915 1.00 0.00 C ATOM 2506 CD GLN B 66 -9.307 15.080 -21.681 1.00 0.00 C ATOM 2507 OE1 GLN B 66 -8.799 16.076 -21.180 1.00 0.00 O ATOM 2508 NE2 GLN B 66 -9.001 14.684 -22.914 1.00 0.00 N ATOM 0 H GLN B 66 -12.099 15.111 -19.076 1.00 0.00 H new ATOM 0 HA GLN B 66 -13.822 14.303 -21.082 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -11.820 14.081 -22.454 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -11.895 15.581 -21.551 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -10.291 14.505 -19.855 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -10.090 13.194 -21.001 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -9.440 13.851 -23.306 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -8.328 15.214 -23.468 1.00 0.00 H new ATOM 2517 N GLU B 67 -11.994 11.739 -20.168 1.00 0.00 N ATOM 2518 CA GLU B 67 -11.832 10.319 -19.883 1.00 0.00 C ATOM 2519 C GLU B 67 -10.516 10.213 -19.107 1.00 0.00 C ATOM 2520 O GLU B 67 -9.637 11.057 -19.281 1.00 0.00 O ATOM 2521 CB GLU B 67 -11.737 9.431 -21.138 1.00 0.00 C ATOM 2522 CG GLU B 67 -13.041 9.280 -21.938 1.00 0.00 C ATOM 2523 CD GLU B 67 -13.183 7.911 -22.594 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -12.165 7.231 -22.830 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -14.330 7.473 -22.823 1.00 0.00 O ATOM 0 H GLU B 67 -11.136 12.243 -19.945 1.00 0.00 H new ATOM 0 HA GLU B 67 -12.707 9.964 -19.339 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -10.972 9.842 -21.797 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -11.399 8.440 -20.836 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -13.889 9.448 -21.275 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -13.080 10.051 -22.707 1.00 0.00 H new ATOM 2532 N VAL B 68 -10.376 9.187 -18.269 1.00 0.00 N ATOM 2533 CA VAL B 68 -9.189 8.964 -17.463 1.00 0.00 C ATOM 2534 C VAL B 68 -8.167 8.181 -18.289 1.00 0.00 C ATOM 2535 O VAL B 68 -8.463 7.077 -18.759 1.00 0.00 O ATOM 2536 CB VAL B 68 -9.545 8.217 -16.158 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -8.517 8.532 -15.068 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -10.956 8.534 -15.639 1.00 0.00 C ATOM 0 H VAL B 68 -11.098 8.480 -18.133 1.00 0.00 H new ATOM 0 HA VAL B 68 -8.756 9.923 -17.178 1.00 0.00 H new ATOM 0 HB VAL B 68 -9.525 7.155 -16.401 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -8.780 7.999 -14.154 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -7.527 8.217 -15.399 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -8.510 9.604 -14.873 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -11.140 7.976 -14.721 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -11.038 9.602 -15.437 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -11.693 8.249 -16.390 1.00 0.00 H new ATOM 2548 N ASN B 69 -6.973 8.746 -18.474 1.00 0.00 N ATOM 2549 CA ASN B 69 -5.823 8.044 -19.018 1.00 0.00 C ATOM 2550 C ASN B 69 -5.100 7.332 -17.862 1.00 0.00 C ATOM 2551 O ASN B 69 -5.370 7.580 -16.684 1.00 0.00 O ATOM 2552 CB ASN B 69 -4.943 9.012 -19.830 1.00 0.00 C ATOM 2553 CG ASN B 69 -3.483 8.578 -19.894 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -3.148 7.615 -20.579 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -2.617 9.228 -19.129 1.00 0.00 N ATOM 0 H ASN B 69 -6.781 9.721 -18.244 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.120 7.273 -19.729 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -5.338 9.090 -20.843 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -5.002 10.006 -19.387 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -1.641 8.932 -19.098 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -2.926 10.024 -18.572 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.216 6.386 -18.201 1.00 0.00 N ATOM 2563 CA PHE B 70 -3.568 5.524 -17.225 1.00 0.00 C ATOM 2564 C PHE B 70 -2.855 6.338 -16.153 1.00 0.00 C ATOM 2565 O PHE B 70 -2.909 5.977 -14.983 1.00 0.00 O ATOM 2566 CB PHE B 70 -2.573 4.581 -17.903 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.042 3.481 -17.000 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -2.892 2.432 -16.604 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -0.704 3.490 -16.562 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -2.388 1.349 -15.863 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -0.216 2.434 -15.771 1.00 0.00 C ATOM 2572 CZ PHE B 70 -1.049 1.352 -15.440 1.00 0.00 C ATOM 0 H PHE B 70 -3.934 6.202 -19.164 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.349 4.932 -16.749 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.054 4.125 -18.768 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -1.733 5.166 -18.277 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.938 2.459 -16.871 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.052 4.307 -16.833 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -3.030 0.515 -15.619 1.00 0.00 H new ATOM 0 HE2 PHE B 70 0.804 2.455 -15.416 1.00 0.00 H new ATOM 0 HZ PHE B 70 -0.661 0.526 -14.863 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.170 7.416 -16.551 1.00 0.00 N ATOM 2583 CA GLN B 71 -1.388 8.214 -15.623 1.00 0.00 C ATOM 2584 C GLN B 71 -2.285 8.743 -14.504 1.00 0.00 C ATOM 2585 O GLN B 71 -1.997 8.514 -13.333 1.00 0.00 O ATOM 2586 CB GLN B 71 -0.649 9.349 -16.339 1.00 0.00 C ATOM 2587 CG GLN B 71 0.480 9.879 -15.445 1.00 0.00 C ATOM 2588 CD GLN B 71 0.848 11.310 -15.808 1.00 0.00 C ATOM 2589 OE1 GLN B 71 1.711 11.549 -16.644 1.00 0.00 O ATOM 2590 NE2 GLN B 71 0.182 12.277 -15.180 1.00 0.00 N ATOM 0 H GLN B 71 -2.147 7.750 -17.514 1.00 0.00 H new ATOM 0 HA GLN B 71 -0.624 7.576 -15.178 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -0.240 8.990 -17.283 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -1.344 10.154 -16.578 1.00 0.00 H new ATOM 0 HG2 GLN B 71 0.171 9.835 -14.401 1.00 0.00 H new ATOM 0 HG3 GLN B 71 1.357 9.239 -15.545 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -0.530 12.040 -14.489 1.00 0.00 H new ATOM 0 HE22 GLN B 71 0.384 13.255 -15.390 1.00 0.00 H new ATOM 2599 N GLU B 72 -3.370 9.442 -14.835 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.282 9.953 -13.823 1.00 0.00 C ATOM 2601 C GLU B 72 -4.795 8.800 -12.961 1.00 0.00 C ATOM 2602 O GLU B 72 -4.663 8.854 -11.741 1.00 0.00 O ATOM 2603 CB GLU B 72 -5.441 10.752 -14.433 1.00 0.00 C ATOM 2604 CG GLU B 72 -4.985 11.770 -15.483 1.00 0.00 C ATOM 2605 CD GLU B 72 -4.959 11.125 -16.856 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -6.043 11.069 -17.470 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -3.876 10.612 -17.226 1.00 0.00 O ATOM 0 H GLU B 72 -3.635 9.665 -15.794 1.00 0.00 H new ATOM 0 HA GLU B 72 -3.729 10.650 -13.193 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -6.149 10.061 -14.890 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -5.973 11.274 -13.637 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -5.659 12.627 -15.488 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -3.994 12.146 -15.230 1.00 0.00 H new ATOM 2614 N TYR B 73 -5.332 7.749 -13.595 1.00 0.00 N ATOM 2615 CA TYR B 73 -5.826 6.542 -12.931 1.00 0.00 C ATOM 2616 C TYR B 73 -4.832 6.033 -11.874 1.00 0.00 C ATOM 2617 O TYR B 73 -5.190 5.866 -10.708 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.140 5.492 -14.016 1.00 0.00 C ATOM 2619 CG TYR B 73 -6.165 4.027 -13.603 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -5.008 3.237 -13.768 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -7.381 3.404 -13.269 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -5.070 1.844 -13.611 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -7.447 2.003 -13.151 1.00 0.00 C ATOM 2624 CZ TYR B 73 -6.296 1.224 -13.347 1.00 0.00 C ATOM 2625 OH TYR B 73 -6.398 -0.129 -13.459 1.00 0.00 O ATOM 0 H TYR B 73 -5.436 7.717 -14.609 1.00 0.00 H new ATOM 0 HA TYR B 73 -6.741 6.761 -12.380 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.112 5.735 -14.445 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -5.403 5.603 -14.812 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -4.068 3.707 -14.017 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -8.265 4.001 -13.103 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -4.171 1.251 -13.694 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -8.385 1.526 -12.909 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.830 -0.440 -14.195 1.00 0.00 H new ATOM 2635 N ILE B 74 -3.583 5.784 -12.269 1.00 0.00 N ATOM 2636 CA ILE B 74 -2.591 5.173 -11.396 1.00 0.00 C ATOM 2637 C ILE B 74 -2.053 6.177 -10.366 1.00 0.00 C ATOM 2638 O ILE B 74 -1.828 5.805 -9.217 1.00 0.00 O ATOM 2639 CB ILE B 74 -1.502 4.474 -12.230 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -0.613 3.521 -11.420 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -0.599 5.499 -12.905 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -1.367 2.318 -10.846 1.00 0.00 C ATOM 0 H ILE B 74 -3.235 6.001 -13.203 1.00 0.00 H new ATOM 0 HA ILE B 74 -3.066 4.392 -10.802 1.00 0.00 H new ATOM 0 HB ILE B 74 -2.047 3.881 -12.965 1.00 0.00 H new ATOM 0 HG12 ILE B 74 0.195 3.162 -12.057 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -0.152 4.075 -10.602 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.163 4.984 -13.489 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -1.195 6.131 -13.563 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.119 6.117 -12.146 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -0.675 1.689 -10.286 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -2.158 2.667 -10.183 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -1.805 1.741 -11.660 1.00 0.00 H new ATOM 2654 N THR B 75 -1.876 7.450 -10.744 1.00 0.00 N ATOM 2655 CA THR B 75 -1.509 8.524 -9.819 1.00 0.00 C ATOM 2656 C THR B 75 -2.524 8.568 -8.680 1.00 0.00 C ATOM 2657 O THR B 75 -2.184 8.528 -7.500 1.00 0.00 O ATOM 2658 CB THR B 75 -1.491 9.876 -10.559 1.00 0.00 C ATOM 2659 OG1 THR B 75 -0.511 9.858 -11.569 1.00 0.00 O ATOM 2660 CG2 THR B 75 -1.224 11.071 -9.639 1.00 0.00 C ATOM 0 H THR B 75 -1.985 7.763 -11.709 1.00 0.00 H new ATOM 0 HA THR B 75 -0.514 8.334 -9.417 1.00 0.00 H new ATOM 0 HB THR B 75 -2.488 10.003 -10.981 1.00 0.00 H new ATOM 0 HG1 THR B 75 -0.755 9.196 -12.249 1.00 0.00 H new ATOM 0 HG21 THR B 75 -1.225 11.989 -10.226 1.00 0.00 H new ATOM 0 HG22 THR B 75 -2.003 11.126 -8.878 1.00 0.00 H new ATOM 0 HG23 THR B 75 -0.254 10.950 -9.157 1.00 0.00 H new ATOM 2668 N PHE B 76 -3.790 8.658 -9.077 1.00 0.00 N ATOM 2669 CA PHE B 76 -4.957 8.692 -8.222 1.00 0.00 C ATOM 2670 C PHE B 76 -4.994 7.478 -7.296 1.00 0.00 C ATOM 2671 O PHE B 76 -5.019 7.641 -6.073 1.00 0.00 O ATOM 2672 CB PHE B 76 -6.161 8.749 -9.157 1.00 0.00 C ATOM 2673 CG PHE B 76 -7.499 8.442 -8.552 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -8.044 9.332 -7.615 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.310 7.473 -9.169 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -9.431 9.376 -7.433 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -9.701 7.516 -8.979 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.262 8.484 -8.133 1.00 0.00 C ATOM 0 H PHE B 76 -4.036 8.712 -10.065 1.00 0.00 H new ATOM 0 HA PHE B 76 -4.949 9.558 -7.560 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -6.206 9.747 -9.594 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -5.989 8.050 -9.976 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -7.399 9.978 -7.039 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.867 6.703 -9.783 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -9.863 10.096 -6.754 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.338 6.805 -9.484 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.334 8.544 -8.019 1.00 0.00 H new ATOM 2688 N LEU B 77 -4.962 6.270 -7.874 1.00 0.00 N ATOM 2689 CA LEU B 77 -4.842 5.038 -7.103 1.00 0.00 C ATOM 2690 C LEU B 77 -3.711 5.178 -6.085 1.00 0.00 C ATOM 2691 O LEU B 77 -3.908 4.896 -4.910 1.00 0.00 O ATOM 2692 CB LEU B 77 -4.583 3.836 -8.025 1.00 0.00 C ATOM 2693 CG LEU B 77 -5.864 3.271 -8.660 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -5.516 2.429 -9.893 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -6.606 2.378 -7.656 1.00 0.00 C ATOM 0 H LEU B 77 -5.018 6.126 -8.882 1.00 0.00 H new ATOM 0 HA LEU B 77 -5.781 4.863 -6.578 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -3.895 4.135 -8.816 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.090 3.049 -7.455 1.00 0.00 H new ATOM 0 HG LEU B 77 -6.498 4.110 -8.949 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -6.431 2.034 -10.334 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -5.000 3.051 -10.624 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -4.869 1.602 -9.598 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -7.511 1.985 -8.119 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -5.961 1.551 -7.359 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -6.873 2.964 -6.776 1.00 0.00 H new ATOM 2707 N GLY B 78 -2.542 5.645 -6.525 1.00 0.00 N ATOM 2708 CA GLY B 78 -1.397 5.916 -5.675 1.00 0.00 C ATOM 2709 C GLY B 78 -1.747 6.783 -4.469 1.00 0.00 C ATOM 2710 O GLY B 78 -1.551 6.378 -3.322 1.00 0.00 O ATOM 0 H GLY B 78 -2.367 5.848 -7.509 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -0.976 4.972 -5.328 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -0.624 6.413 -6.262 1.00 0.00 H new ATOM 2714 N ALA B 79 -2.241 7.992 -4.744 1.00 0.00 N ATOM 2715 CA ALA B 79 -2.560 8.979 -3.727 1.00 0.00 C ATOM 2716 C ALA B 79 -3.534 8.396 -2.707 1.00 0.00 C ATOM 2717 O ALA B 79 -3.304 8.483 -1.502 1.00 0.00 O ATOM 2718 CB ALA B 79 -3.134 10.232 -4.393 1.00 0.00 C ATOM 0 H ALA B 79 -2.431 8.311 -5.694 1.00 0.00 H new ATOM 0 HA ALA B 79 -1.652 9.257 -3.193 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -3.373 10.972 -3.630 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -2.399 10.646 -5.083 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -4.039 9.970 -4.941 1.00 0.00 H new ATOM 2724 N LEU B 80 -4.625 7.793 -3.185 1.00 0.00 N ATOM 2725 CA LEU B 80 -5.624 7.228 -2.293 1.00 0.00 C ATOM 2726 C LEU B 80 -5.062 6.032 -1.523 1.00 0.00 C ATOM 2727 O LEU B 80 -5.262 5.943 -0.313 1.00 0.00 O ATOM 2728 CB LEU B 80 -6.891 6.859 -3.073 1.00 0.00 C ATOM 2729 CG LEU B 80 -7.608 8.083 -3.672 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -8.809 7.589 -4.478 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -8.111 9.061 -2.601 1.00 0.00 C ATOM 0 H LEU B 80 -4.833 7.687 -4.178 1.00 0.00 H new ATOM 0 HA LEU B 80 -5.896 7.983 -1.556 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -6.629 6.170 -3.876 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -7.577 6.331 -2.411 1.00 0.00 H new ATOM 0 HG LEU B 80 -6.889 8.617 -4.293 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -9.332 8.442 -4.912 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -8.466 6.930 -5.275 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -9.487 7.043 -3.823 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -8.608 9.904 -3.082 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -8.816 8.551 -1.945 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -7.267 9.424 -2.015 1.00 0.00 H new ATOM 2743 N ALA B 81 -4.370 5.115 -2.208 1.00 0.00 N ATOM 2744 CA ALA B 81 -3.869 3.862 -1.650 1.00 0.00 C ATOM 2745 C ALA B 81 -3.139 4.084 -0.331 1.00 0.00 C ATOM 2746 O ALA B 81 -3.425 3.393 0.648 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.964 3.137 -2.649 1.00 0.00 C ATOM 0 H ALA B 81 -4.138 5.231 -3.195 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.735 3.231 -1.449 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -2.605 2.207 -2.207 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -3.527 2.914 -3.555 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.114 3.772 -2.897 1.00 0.00 H new ATOM 2753 N MET B 82 -2.223 5.061 -0.308 1.00 0.00 N ATOM 2754 CA MET B 82 -1.487 5.445 0.892 1.00 0.00 C ATOM 2755 C MET B 82 -2.417 5.561 2.105 1.00 0.00 C ATOM 2756 O MET B 82 -2.064 5.111 3.193 1.00 0.00 O ATOM 2757 CB MET B 82 -0.758 6.779 0.667 1.00 0.00 C ATOM 2758 CG MET B 82 0.415 6.664 -0.313 1.00 0.00 C ATOM 2759 SD MET B 82 1.069 8.245 -0.920 1.00 0.00 S ATOM 2760 CE MET B 82 1.695 8.965 0.613 1.00 0.00 C ATOM 0 H MET B 82 -1.974 5.609 -1.132 1.00 0.00 H new ATOM 0 HA MET B 82 -0.755 4.663 1.096 1.00 0.00 H new ATOM 0 HB2 MET B 82 -1.468 7.515 0.290 1.00 0.00 H new ATOM 0 HB3 MET B 82 -0.390 7.151 1.623 1.00 0.00 H new ATOM 0 HG2 MET B 82 1.223 6.117 0.174 1.00 0.00 H new ATOM 0 HG3 MET B 82 0.097 6.068 -1.168 1.00 0.00 H new ATOM 0 HE1 MET B 82 2.146 9.935 0.402 1.00 0.00 H new ATOM 0 HE2 MET B 82 0.873 9.092 1.317 1.00 0.00 H new ATOM 0 HE3 MET B 82 2.445 8.303 1.046 1.00 0.00 H new ATOM 2770 N ILE B 83 -3.588 6.173 1.912 1.00 0.00 N ATOM 2771 CA ILE B 83 -4.536 6.452 2.975 1.00 0.00 C ATOM 2772 C ILE B 83 -5.516 5.285 3.134 1.00 0.00 C ATOM 2773 O ILE B 83 -5.588 4.673 4.197 1.00 0.00 O ATOM 2774 CB ILE B 83 -5.265 7.780 2.682 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -4.303 8.936 2.342 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -6.182 8.165 3.852 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -3.244 9.217 3.413 1.00 0.00 C ATOM 0 H ILE B 83 -3.902 6.491 0.995 1.00 0.00 H new ATOM 0 HA ILE B 83 -4.006 6.560 3.921 1.00 0.00 H new ATOM 0 HB ILE B 83 -5.872 7.610 1.793 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -3.800 8.709 1.402 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -4.887 9.842 2.180 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -6.686 9.104 3.625 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -6.925 7.382 4.005 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -5.587 8.282 4.757 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -2.612 10.044 3.091 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -3.735 9.479 4.350 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -2.631 8.328 3.561 1.00 0.00 H new ATOM 2789 N TYR B 84 -6.302 4.996 2.091 1.00 0.00 N ATOM 2790 CA TYR B 84 -7.431 4.083 2.208 1.00 0.00 C ATOM 2791 C TYR B 84 -7.000 2.614 2.293 1.00 0.00 C ATOM 2792 O TYR B 84 -7.681 1.828 2.942 1.00 0.00 O ATOM 2793 CB TYR B 84 -8.502 4.358 1.124 1.00 0.00 C ATOM 2794 CG TYR B 84 -8.630 3.311 0.030 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -7.599 3.201 -0.919 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -9.702 2.390 0.011 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -7.577 2.131 -1.828 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -9.640 1.287 -0.865 1.00 0.00 C ATOM 2799 CZ TYR B 84 -8.597 1.169 -1.795 1.00 0.00 C ATOM 2800 OH TYR B 84 -8.609 0.163 -2.715 1.00 0.00 O ATOM 0 H TYR B 84 -6.172 5.385 1.157 1.00 0.00 H new ATOM 0 HA TYR B 84 -7.912 4.286 3.165 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -9.469 4.460 1.616 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -8.279 5.317 0.657 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -6.817 3.946 -0.949 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -10.556 2.529 0.658 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -6.778 2.049 -2.550 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -10.404 0.525 -0.819 1.00 0.00 H new ATOM 0 HH TYR B 84 -9.532 -0.019 -2.989 1.00 0.00 H new ATOM 2810 N ASN B 85 -5.897 2.214 1.646 1.00 0.00 N ATOM 2811 CA ASN B 85 -5.602 0.793 1.487 1.00 0.00 C ATOM 2812 C ASN B 85 -5.348 0.098 2.826 1.00 0.00 C ATOM 2813 O ASN B 85 -6.235 -0.542 3.380 1.00 0.00 O ATOM 2814 CB ASN B 85 -4.483 0.576 0.454 1.00 0.00 C ATOM 2815 CG ASN B 85 -4.469 -0.830 -0.143 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -4.393 -0.966 -1.359 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -4.535 -1.880 0.669 1.00 0.00 N ATOM 0 H ASN B 85 -5.209 2.844 1.233 1.00 0.00 H new ATOM 0 HA ASN B 85 -6.491 0.307 1.085 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -4.596 1.303 -0.351 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -3.520 0.771 0.927 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -4.523 -2.824 0.284 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -4.598 -1.742 1.678 1.00 0.00 H new ATOM 2824 N GLU B 86 -4.107 0.180 3.303 1.00 0.00 N ATOM 2825 CA GLU B 86 -3.622 -0.511 4.496 1.00 0.00 C ATOM 2826 C GLU B 86 -2.435 0.235 5.102 1.00 0.00 C ATOM 2827 O GLU B 86 -1.498 -0.378 5.620 1.00 0.00 O ATOM 2828 CB GLU B 86 -3.240 -1.964 4.146 1.00 0.00 C ATOM 2829 CG GLU B 86 -4.366 -3.004 4.169 1.00 0.00 C ATOM 2830 CD GLU B 86 -3.829 -4.391 3.829 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -2.705 -4.712 4.272 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -4.496 -5.095 3.045 1.00 0.00 O ATOM 0 H GLU B 86 -3.388 0.748 2.855 1.00 0.00 H new ATOM 0 HA GLU B 86 -4.419 -0.533 5.239 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -2.796 -1.967 3.150 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -2.466 -2.288 4.841 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -4.832 -3.021 5.154 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -5.141 -2.724 3.455 1.00 0.00 H new