USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 884 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 59 HIS : no HE2:sc= -2.8! C(o=-5.7!,f=-13!) USER MOD Set 1.2: A 112 LYS NZ :NH3+ -164:sc= -2.92! (180deg=-4!) USER MOD Set 1.3: A 118 THR OG1 : rot 128:sc= 0.00664 USER MOD Set 2.1: A 53 THR OG1 : rot 163:sc= 1.45 USER MOD Set 2.2: A 86 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 48 SER OG : rot -162:sc= -0.0994 USER MOD Set 3.2: A 51 THR OG1 : rot -87:sc= -3.82! USER MOD Set 4.1: A 15 LYS NZ :NH3+ -124:sc= -1.87! (180deg=-4.15!) USER MOD Set 4.2: A 18 MET CE :methyl -162:sc= -0.0385 (180deg=-0.496) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 ASN : amide:sc= -4.27! K(o=-4.3!,f=-0.94) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 MET CE :methyl -166:sc= -3.5! (180deg=-4.23!) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc=0.000759 USER MOD Single : A 60 THR OG1 : rot 110:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 LYS NZ :NH3+ 164:sc= -4.45! (180deg=-5.61!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 180:sc=-0.00433 USER MOD Single : A 88 ASN : amide:sc=-0.00909 K(o=-0.0091,f=-1.9!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 167:sc= 0.0127 USER MOD Single : A 92 THR OG1 : rot 170:sc= -1.6 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -0.145 X(o=-0.14,f=-0.13) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 THR OG1 : rot -159:sc= 1.12 USER MOD Single : A 102 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 107 THR OG1 : rot -36:sc= -2.43! USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 THR OG1 : rot -170:sc= -1.42 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.0058 USER MOD Single : A 135 TYR OH : rot 70:sc= -2.87! USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 THR OG1 : rot 180:sc= -0.0498 USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 SER OG : rot 31:sc= 0.253 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 140 N LYS A 11 27.075 -9.477 6.755 1.00 0.00 N ATOM 141 CA LYS A 11 27.922 -8.380 7.207 1.00 0.00 C ATOM 142 C LYS A 11 27.070 -7.239 7.757 1.00 0.00 C ATOM 143 O LYS A 11 25.979 -6.971 7.253 1.00 0.00 O ATOM 144 CB LYS A 11 28.770 -7.863 6.043 1.00 0.00 C ATOM 145 CG LYS A 11 29.780 -6.831 6.554 1.00 0.00 C ATOM 146 CD LYS A 11 30.851 -7.533 7.394 1.00 0.00 C ATOM 147 CE LYS A 11 32.073 -6.623 7.532 1.00 0.00 C ATOM 148 NZ LYS A 11 31.830 -5.624 8.611 1.00 0.00 N ATOM 0 HA LYS A 11 28.574 -8.751 7.998 1.00 0.00 H new ATOM 0 HB2 LYS A 11 29.293 -8.692 5.566 1.00 0.00 H new ATOM 0 HB3 LYS A 11 28.128 -7.413 5.286 1.00 0.00 H new ATOM 0 HG2 LYS A 11 30.243 -6.314 5.714 1.00 0.00 H new ATOM 0 HG3 LYS A 11 29.272 -6.075 7.152 1.00 0.00 H new ATOM 0 HD2 LYS A 11 30.453 -7.776 8.379 1.00 0.00 H new ATOM 0 HD3 LYS A 11 31.137 -8.474 6.924 1.00 0.00 H new ATOM 0 HE2 LYS A 11 32.957 -7.217 7.764 1.00 0.00 H new ATOM 0 HE3 LYS A 11 32.269 -6.114 6.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 32.661 -5.005 8.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 30.996 -5.050 8.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 31.663 -6.118 9.511 1.00 0.00 H new ATOM 162 N GLU A 12 27.576 -6.567 8.784 1.00 0.00 N ATOM 163 CA GLU A 12 26.852 -5.452 9.386 1.00 0.00 C ATOM 164 C GLU A 12 26.588 -4.367 8.345 1.00 0.00 C ATOM 165 O GLU A 12 27.435 -4.083 7.498 1.00 0.00 O ATOM 166 CB GLU A 12 27.674 -4.866 10.537 1.00 0.00 C ATOM 167 CG GLU A 12 27.720 -5.871 11.690 1.00 0.00 C ATOM 168 CD GLU A 12 28.637 -5.356 12.794 1.00 0.00 C ATOM 169 OE1 GLU A 12 29.216 -4.298 12.611 1.00 0.00 O ATOM 170 OE2 GLU A 12 28.745 -6.027 13.809 1.00 0.00 O ATOM 0 H GLU A 12 28.477 -6.772 9.215 1.00 0.00 H new ATOM 0 HA GLU A 12 25.898 -5.817 9.766 1.00 0.00 H new ATOM 0 HB2 GLU A 12 28.685 -4.638 10.198 1.00 0.00 H new ATOM 0 HB3 GLU A 12 27.232 -3.929 10.874 1.00 0.00 H new ATOM 0 HG2 GLU A 12 26.716 -6.031 12.084 1.00 0.00 H new ATOM 0 HG3 GLU A 12 28.078 -6.835 11.329 1.00 0.00 H new ATOM 177 N GLY A 13 25.404 -3.768 8.412 1.00 0.00 N ATOM 178 CA GLY A 13 25.028 -2.719 7.473 1.00 0.00 C ATOM 179 C GLY A 13 24.421 -3.306 6.209 1.00 0.00 C ATOM 180 O GLY A 13 24.280 -2.618 5.200 1.00 0.00 O ATOM 0 H GLY A 13 24.690 -3.991 9.105 1.00 0.00 H new ATOM 0 HA2 GLY A 13 24.313 -2.045 7.944 1.00 0.00 H new ATOM 0 HA3 GLY A 13 25.905 -2.125 7.217 1.00 0.00 H new ATOM 184 N GLU A 14 24.065 -4.580 6.265 1.00 0.00 N ATOM 185 CA GLU A 14 23.480 -5.234 5.118 1.00 0.00 C ATOM 186 C GLU A 14 22.082 -5.735 5.451 1.00 0.00 C ATOM 187 O GLU A 14 21.835 -6.221 6.553 1.00 0.00 O ATOM 188 CB GLU A 14 24.354 -6.411 4.701 1.00 0.00 C ATOM 189 CG GLU A 14 25.742 -5.898 4.321 1.00 0.00 C ATOM 190 CD GLU A 14 25.642 -4.932 3.144 1.00 0.00 C ATOM 191 OE1 GLU A 14 24.634 -4.964 2.460 1.00 0.00 O ATOM 192 OE2 GLU A 14 26.574 -4.169 2.951 1.00 0.00 O ATOM 0 H GLU A 14 24.172 -5.173 7.088 1.00 0.00 H new ATOM 0 HA GLU A 14 23.414 -4.517 4.300 1.00 0.00 H new ATOM 0 HB2 GLU A 14 24.430 -7.130 5.517 1.00 0.00 H new ATOM 0 HB3 GLU A 14 23.903 -6.933 3.857 1.00 0.00 H new ATOM 0 HG2 GLU A 14 26.199 -5.397 5.174 1.00 0.00 H new ATOM 0 HG3 GLU A 14 26.388 -6.736 4.060 1.00 0.00 H new ATOM 199 N LYS A 15 21.176 -5.618 4.492 1.00 0.00 N ATOM 200 CA LYS A 15 19.804 -6.071 4.692 1.00 0.00 C ATOM 201 C LYS A 15 19.776 -7.572 4.944 1.00 0.00 C ATOM 202 O LYS A 15 20.074 -8.369 4.054 1.00 0.00 O ATOM 203 CB LYS A 15 18.968 -5.739 3.454 1.00 0.00 C ATOM 204 CG LYS A 15 17.481 -5.669 3.813 1.00 0.00 C ATOM 205 CD LYS A 15 16.899 -7.084 3.887 1.00 0.00 C ATOM 206 CE LYS A 15 15.383 -7.009 4.096 1.00 0.00 C ATOM 207 NZ LYS A 15 14.816 -8.388 4.117 1.00 0.00 N ATOM 0 H LYS A 15 21.362 -5.216 3.573 1.00 0.00 H new ATOM 0 HA LYS A 15 19.386 -5.561 5.560 1.00 0.00 H new ATOM 0 HB2 LYS A 15 19.292 -4.787 3.034 1.00 0.00 H new ATOM 0 HB3 LYS A 15 19.127 -6.496 2.687 1.00 0.00 H new ATOM 0 HG2 LYS A 15 17.352 -5.162 4.769 1.00 0.00 H new ATOM 0 HG3 LYS A 15 16.944 -5.083 3.067 1.00 0.00 H new ATOM 0 HD2 LYS A 15 17.123 -7.628 2.969 1.00 0.00 H new ATOM 0 HD3 LYS A 15 17.362 -7.636 4.705 1.00 0.00 H new ATOM 0 HE2 LYS A 15 15.159 -6.498 5.032 1.00 0.00 H new ATOM 0 HE3 LYS A 15 14.923 -6.427 3.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 14.073 -8.469 3.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 15.570 -9.076 3.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 14.409 -8.582 5.054 1.00 0.00 H new ATOM 221 N VAL A 16 19.414 -7.950 6.164 1.00 0.00 N ATOM 222 CA VAL A 16 19.347 -9.358 6.528 1.00 0.00 C ATOM 223 C VAL A 16 17.906 -9.779 6.791 1.00 0.00 C ATOM 224 O VAL A 16 17.471 -10.844 6.355 1.00 0.00 O ATOM 225 CB VAL A 16 20.185 -9.615 7.779 1.00 0.00 C ATOM 226 CG1 VAL A 16 21.667 -9.456 7.441 1.00 0.00 C ATOM 227 CG2 VAL A 16 19.791 -8.615 8.868 1.00 0.00 C ATOM 0 H VAL A 16 19.164 -7.305 6.913 1.00 0.00 H new ATOM 0 HA VAL A 16 19.740 -9.944 5.697 1.00 0.00 H new ATOM 0 HB VAL A 16 20.006 -10.628 8.138 1.00 0.00 H new ATOM 0 HG11 VAL A 16 22.265 -9.639 8.333 1.00 0.00 H new ATOM 0 HG12 VAL A 16 21.942 -10.172 6.666 1.00 0.00 H new ATOM 0 HG13 VAL A 16 21.852 -8.444 7.082 1.00 0.00 H new ATOM 0 HG21 VAL A 16 20.388 -8.797 9.762 1.00 0.00 H new ATOM 0 HG22 VAL A 16 19.970 -7.600 8.512 1.00 0.00 H new ATOM 0 HG23 VAL A 16 18.734 -8.735 9.107 1.00 0.00 H new ATOM 237 N ALA A 17 17.173 -8.937 7.515 1.00 0.00 N ATOM 238 CA ALA A 17 15.783 -9.236 7.839 1.00 0.00 C ATOM 239 C ALA A 17 14.883 -8.057 7.495 1.00 0.00 C ATOM 240 O ALA A 17 15.353 -6.933 7.322 1.00 0.00 O ATOM 241 CB ALA A 17 15.649 -9.559 9.330 1.00 0.00 C ATOM 0 H ALA A 17 17.515 -8.050 7.885 1.00 0.00 H new ATOM 0 HA ALA A 17 15.475 -10.099 7.249 1.00 0.00 H new ATOM 0 HB1 ALA A 17 14.607 -9.781 9.562 1.00 0.00 H new ATOM 0 HB2 ALA A 17 16.267 -10.424 9.572 1.00 0.00 H new ATOM 0 HB3 ALA A 17 15.977 -8.702 9.919 1.00 0.00 H new ATOM 247 N MET A 18 13.587 -8.324 7.397 1.00 0.00 N ATOM 248 CA MET A 18 12.624 -7.278 7.075 1.00 0.00 C ATOM 249 C MET A 18 11.519 -7.228 8.124 1.00 0.00 C ATOM 250 O MET A 18 11.081 -8.261 8.629 1.00 0.00 O ATOM 251 CB MET A 18 12.005 -7.541 5.700 1.00 0.00 C ATOM 252 CG MET A 18 11.092 -6.372 5.319 1.00 0.00 C ATOM 253 SD MET A 18 10.125 -6.812 3.852 1.00 0.00 S ATOM 254 CE MET A 18 11.479 -6.777 2.653 1.00 0.00 C ATOM 0 H MET A 18 13.180 -9.249 7.535 1.00 0.00 H new ATOM 0 HA MET A 18 13.147 -6.322 7.063 1.00 0.00 H new ATOM 0 HB2 MET A 18 12.790 -7.662 4.953 1.00 0.00 H new ATOM 0 HB3 MET A 18 11.436 -8.470 5.717 1.00 0.00 H new ATOM 0 HG2 MET A 18 10.426 -6.132 6.148 1.00 0.00 H new ATOM 0 HG3 MET A 18 11.688 -5.481 5.121 1.00 0.00 H new ATOM 0 HE1 MET A 18 11.071 -6.704 1.645 1.00 0.00 H new ATOM 0 HE2 MET A 18 12.117 -5.915 2.849 1.00 0.00 H new ATOM 0 HE3 MET A 18 12.067 -7.691 2.741 1.00 0.00 H new ATOM 264 N LEU A 19 11.068 -6.019 8.436 1.00 0.00 N ATOM 265 CA LEU A 19 10.007 -5.828 9.421 1.00 0.00 C ATOM 266 C LEU A 19 8.705 -5.439 8.731 1.00 0.00 C ATOM 267 O LEU A 19 8.671 -4.498 7.939 1.00 0.00 O ATOM 268 CB LEU A 19 10.401 -4.723 10.405 1.00 0.00 C ATOM 269 CG LEU A 19 9.167 -4.252 11.194 1.00 0.00 C ATOM 270 CD1 LEU A 19 8.581 -5.410 12.002 1.00 0.00 C ATOM 271 CD2 LEU A 19 9.567 -3.127 12.153 1.00 0.00 C ATOM 0 H LEU A 19 11.419 -5.156 8.022 1.00 0.00 H new ATOM 0 HA LEU A 19 9.863 -6.766 9.958 1.00 0.00 H new ATOM 0 HB2 LEU A 19 11.162 -5.092 11.092 1.00 0.00 H new ATOM 0 HB3 LEU A 19 10.839 -3.884 9.865 1.00 0.00 H new ATOM 0 HG LEU A 19 8.419 -3.890 10.488 1.00 0.00 H new ATOM 0 HD11 LEU A 19 7.709 -5.063 12.555 1.00 0.00 H new ATOM 0 HD12 LEU A 19 8.286 -6.213 11.326 1.00 0.00 H new ATOM 0 HD13 LEU A 19 9.330 -5.781 12.701 1.00 0.00 H new ATOM 0 HD21 LEU A 19 8.691 -2.795 12.710 1.00 0.00 H new ATOM 0 HD22 LEU A 19 10.322 -3.493 12.848 1.00 0.00 H new ATOM 0 HD23 LEU A 19 9.973 -2.291 11.584 1.00 0.00 H new ATOM 283 N ASN A 20 7.638 -6.164 9.037 1.00 0.00 N ATOM 284 CA ASN A 20 6.340 -5.876 8.438 1.00 0.00 C ATOM 285 C ASN A 20 5.277 -5.653 9.513 1.00 0.00 C ATOM 286 O ASN A 20 5.072 -6.500 10.380 1.00 0.00 O ATOM 287 CB ASN A 20 5.914 -7.038 7.540 1.00 0.00 C ATOM 288 CG ASN A 20 4.915 -6.555 6.492 1.00 0.00 C ATOM 289 OD1 ASN A 20 4.606 -7.281 5.547 1.00 0.00 O ATOM 290 ND2 ASN A 20 4.388 -5.364 6.601 1.00 0.00 N ATOM 0 H ASN A 20 7.643 -6.948 9.689 1.00 0.00 H new ATOM 0 HA ASN A 20 6.434 -4.965 7.847 1.00 0.00 H new ATOM 0 HB2 ASN A 20 6.788 -7.467 7.050 1.00 0.00 H new ATOM 0 HB3 ASN A 20 5.466 -7.828 8.143 1.00 0.00 H new ATOM 0 HD21 ASN A 20 3.721 -5.036 5.903 1.00 0.00 H new ATOM 0 HD22 ASN A 20 4.644 -4.763 7.384 1.00 0.00 H new ATOM 297 N ILE A 21 4.593 -4.513 9.438 1.00 0.00 N ATOM 298 CA ILE A 21 3.537 -4.199 10.401 1.00 0.00 C ATOM 299 C ILE A 21 2.162 -4.378 9.746 1.00 0.00 C ATOM 300 O ILE A 21 1.854 -3.717 8.752 1.00 0.00 O ATOM 301 CB ILE A 21 3.692 -2.763 10.909 1.00 0.00 C ATOM 302 CG1 ILE A 21 5.111 -2.577 11.453 1.00 0.00 C ATOM 303 CG2 ILE A 21 2.680 -2.497 12.028 1.00 0.00 C ATOM 304 CD1 ILE A 21 5.669 -1.225 10.998 1.00 0.00 C ATOM 0 H ILE A 21 4.748 -3.797 8.728 1.00 0.00 H new ATOM 0 HA ILE A 21 3.620 -4.881 11.248 1.00 0.00 H new ATOM 0 HB ILE A 21 3.513 -2.065 10.091 1.00 0.00 H new ATOM 0 HG12 ILE A 21 5.103 -2.629 12.542 1.00 0.00 H new ATOM 0 HG13 ILE A 21 5.754 -3.383 11.100 1.00 0.00 H new ATOM 0 HG21 ILE A 21 2.794 -1.474 12.386 1.00 0.00 H new ATOM 0 HG22 ILE A 21 1.669 -2.637 11.645 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.856 -3.191 12.850 1.00 0.00 H new ATOM 0 HD11 ILE A 21 6.679 -1.098 11.388 1.00 0.00 H new ATOM 0 HD12 ILE A 21 5.694 -1.189 9.909 1.00 0.00 H new ATOM 0 HD13 ILE A 21 5.032 -0.424 11.373 1.00 0.00 H new ATOM 316 N PRO A 22 1.341 -5.258 10.272 1.00 0.00 N ATOM 317 CA PRO A 22 -0.017 -5.528 9.712 1.00 0.00 C ATOM 318 C PRO A 22 -1.031 -4.443 10.063 1.00 0.00 C ATOM 319 O PRO A 22 -1.761 -3.960 9.198 1.00 0.00 O ATOM 320 CB PRO A 22 -0.411 -6.862 10.355 1.00 0.00 C ATOM 321 CG PRO A 22 0.338 -6.920 11.647 1.00 0.00 C ATOM 322 CD PRO A 22 1.611 -6.085 11.460 1.00 0.00 C ATOM 0 HA PRO A 22 -0.004 -5.551 8.622 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -1.487 -6.914 10.523 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -0.148 -7.701 9.711 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -0.267 -6.524 12.463 1.00 0.00 H new ATOM 0 HG3 PRO A 22 0.586 -7.950 11.904 1.00 0.00 H new ATOM 0 HD2 PRO A 22 1.812 -5.468 12.335 1.00 0.00 H new ATOM 0 HD3 PRO A 22 2.484 -6.721 11.311 1.00 0.00 H new ATOM 330 N LYS A 23 -1.079 -4.071 11.336 1.00 0.00 N ATOM 331 CA LYS A 23 -2.020 -3.054 11.788 1.00 0.00 C ATOM 332 C LYS A 23 -1.792 -1.737 11.058 1.00 0.00 C ATOM 333 O LYS A 23 -2.743 -1.082 10.629 1.00 0.00 O ATOM 334 CB LYS A 23 -1.865 -2.843 13.293 1.00 0.00 C ATOM 335 CG LYS A 23 -2.925 -1.854 13.778 1.00 0.00 C ATOM 336 CD LYS A 23 -4.228 -2.606 14.050 1.00 0.00 C ATOM 337 CE LYS A 23 -5.294 -1.628 14.541 1.00 0.00 C ATOM 338 NZ LYS A 23 -6.005 -1.040 13.370 1.00 0.00 N ATOM 0 H LYS A 23 -0.482 -4.455 12.069 1.00 0.00 H new ATOM 0 HA LYS A 23 -3.031 -3.398 11.567 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -1.971 -3.793 13.817 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.868 -2.464 13.518 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -2.584 -1.353 14.684 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -3.088 -1.080 13.028 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -4.568 -3.104 13.142 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -4.062 -3.383 14.796 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -6.003 -2.142 15.190 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -4.833 -0.838 15.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -6.731 -0.374 13.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -5.323 -0.536 12.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -6.457 -1.799 12.821 1.00 0.00 H new ATOM 352 N LEU A 24 -0.529 -1.353 10.919 1.00 0.00 N ATOM 353 CA LEU A 24 -0.193 -0.113 10.237 1.00 0.00 C ATOM 354 C LEU A 24 0.173 -0.389 8.787 1.00 0.00 C ATOM 355 O LEU A 24 0.467 0.530 8.024 1.00 0.00 O ATOM 356 CB LEU A 24 0.971 0.585 10.943 1.00 0.00 C ATOM 357 CG LEU A 24 0.539 1.036 12.338 1.00 0.00 C ATOM 358 CD1 LEU A 24 -0.669 1.966 12.204 1.00 0.00 C ATOM 359 CD2 LEU A 24 0.158 -0.186 13.181 1.00 0.00 C ATOM 0 H LEU A 24 0.273 -1.879 11.267 1.00 0.00 H new ATOM 0 HA LEU A 24 -1.065 0.541 10.263 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.821 -0.093 11.018 1.00 0.00 H new ATOM 0 HB3 LEU A 24 1.299 1.445 10.359 1.00 0.00 H new ATOM 0 HG LEU A 24 1.359 1.562 12.827 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -0.987 2.295 13.194 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -0.395 2.834 11.604 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -1.487 1.433 11.719 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.149 0.139 14.175 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.665 -0.716 12.702 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.017 -0.851 13.267 1.00 0.00 H new ATOM 371 N LYS A 25 0.138 -1.661 8.406 1.00 0.00 N ATOM 372 CA LYS A 25 0.452 -2.033 7.037 1.00 0.00 C ATOM 373 C LYS A 25 1.746 -1.361 6.580 1.00 0.00 C ATOM 374 O LYS A 25 1.870 -0.961 5.423 1.00 0.00 O ATOM 375 CB LYS A 25 -0.699 -1.599 6.129 1.00 0.00 C ATOM 376 CG LYS A 25 -1.867 -2.582 6.265 1.00 0.00 C ATOM 377 CD LYS A 25 -3.031 -1.888 6.973 1.00 0.00 C ATOM 378 CE LYS A 25 -4.198 -2.864 7.121 1.00 0.00 C ATOM 379 NZ LYS A 25 -5.206 -2.593 6.058 1.00 0.00 N ATOM 0 H LYS A 25 -0.102 -2.441 9.018 1.00 0.00 H new ATOM 0 HA LYS A 25 0.587 -3.113 6.983 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -1.025 -0.594 6.395 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -0.362 -1.561 5.093 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -2.181 -2.931 5.281 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -1.554 -3.460 6.830 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -2.714 -1.534 7.954 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -3.346 -1.013 6.404 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -3.840 -3.891 7.045 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -4.653 -2.757 8.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -6.001 -3.256 6.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -5.555 -1.618 6.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -4.767 -2.716 5.123 1.00 0.00 H new ATOM 393 N LYS A 26 2.710 -1.259 7.491 1.00 0.00 N ATOM 394 CA LYS A 26 3.996 -0.648 7.168 1.00 0.00 C ATOM 395 C LYS A 26 5.080 -1.705 7.080 1.00 0.00 C ATOM 396 O LYS A 26 4.955 -2.785 7.653 1.00 0.00 O ATOM 397 CB LYS A 26 4.398 0.385 8.218 1.00 0.00 C ATOM 398 CG LYS A 26 4.157 1.789 7.660 1.00 0.00 C ATOM 399 CD LYS A 26 4.474 2.834 8.729 1.00 0.00 C ATOM 400 CE LYS A 26 3.368 2.844 9.781 1.00 0.00 C ATOM 401 NZ LYS A 26 3.567 3.995 10.706 1.00 0.00 N ATOM 0 H LYS A 26 2.626 -1.589 8.452 1.00 0.00 H new ATOM 0 HA LYS A 26 3.886 -0.151 6.204 1.00 0.00 H new ATOM 0 HB2 LYS A 26 3.819 0.239 9.130 1.00 0.00 H new ATOM 0 HB3 LYS A 26 5.448 0.262 8.484 1.00 0.00 H new ATOM 0 HG2 LYS A 26 4.782 1.953 6.782 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.121 1.889 7.337 1.00 0.00 H new ATOM 0 HD2 LYS A 26 5.433 2.610 9.197 1.00 0.00 H new ATOM 0 HD3 LYS A 26 4.564 3.820 8.273 1.00 0.00 H new ATOM 0 HE2 LYS A 26 2.394 2.917 9.298 1.00 0.00 H new ATOM 0 HE3 LYS A 26 3.377 1.909 10.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 2.812 4.000 11.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 4.490 3.906 11.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 3.538 4.883 10.166 1.00 0.00 H new ATOM 415 N LYS A 27 6.148 -1.392 6.363 1.00 0.00 N ATOM 416 CA LYS A 27 7.246 -2.337 6.221 1.00 0.00 C ATOM 417 C LYS A 27 8.585 -1.619 6.290 1.00 0.00 C ATOM 418 O LYS A 27 8.723 -0.488 5.824 1.00 0.00 O ATOM 419 CB LYS A 27 7.132 -3.080 4.891 1.00 0.00 C ATOM 420 CG LYS A 27 5.685 -3.032 4.410 1.00 0.00 C ATOM 421 CD LYS A 27 5.578 -3.620 3.002 1.00 0.00 C ATOM 422 CE LYS A 27 5.737 -5.140 3.060 1.00 0.00 C ATOM 423 NZ LYS A 27 4.919 -5.759 1.978 1.00 0.00 N ATOM 0 H LYS A 27 6.278 -0.505 5.877 1.00 0.00 H new ATOM 0 HA LYS A 27 7.188 -3.053 7.041 1.00 0.00 H new ATOM 0 HB2 LYS A 27 7.789 -2.625 4.150 1.00 0.00 H new ATOM 0 HB3 LYS A 27 7.454 -4.115 5.010 1.00 0.00 H new ATOM 0 HG2 LYS A 27 5.047 -3.591 5.095 1.00 0.00 H new ATOM 0 HG3 LYS A 27 5.328 -2.002 4.410 1.00 0.00 H new ATOM 0 HD2 LYS A 27 4.614 -3.363 2.563 1.00 0.00 H new ATOM 0 HD3 LYS A 27 6.346 -3.189 2.359 1.00 0.00 H new ATOM 0 HE2 LYS A 27 6.786 -5.413 2.941 1.00 0.00 H new ATOM 0 HE3 LYS A 27 5.418 -5.514 4.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 5.023 -6.793 2.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 3.919 -5.507 2.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 5.244 -5.409 1.054 1.00 0.00 H new ATOM 437 N PHE A 28 9.571 -2.292 6.865 1.00 0.00 N ATOM 438 CA PHE A 28 10.907 -1.718 6.982 1.00 0.00 C ATOM 439 C PHE A 28 11.977 -2.791 6.806 1.00 0.00 C ATOM 440 O PHE A 28 11.756 -3.957 7.125 1.00 0.00 O ATOM 441 CB PHE A 28 11.075 -1.046 8.343 1.00 0.00 C ATOM 442 CG PHE A 28 10.093 0.092 8.461 1.00 0.00 C ATOM 443 CD1 PHE A 28 10.286 1.261 7.716 1.00 0.00 C ATOM 444 CD2 PHE A 28 8.988 -0.021 9.313 1.00 0.00 C ATOM 445 CE1 PHE A 28 9.373 2.316 7.822 1.00 0.00 C ATOM 446 CE2 PHE A 28 8.076 1.034 9.419 1.00 0.00 C ATOM 447 CZ PHE A 28 8.268 2.203 8.673 1.00 0.00 C ATOM 0 H PHE A 28 9.475 -3.229 7.256 1.00 0.00 H new ATOM 0 HA PHE A 28 11.025 -0.974 6.194 1.00 0.00 H new ATOM 0 HB2 PHE A 28 10.909 -1.769 9.142 1.00 0.00 H new ATOM 0 HB3 PHE A 28 12.094 -0.675 8.455 1.00 0.00 H new ATOM 0 HD1 PHE A 28 11.139 1.349 7.060 1.00 0.00 H new ATOM 0 HD2 PHE A 28 8.840 -0.923 9.888 1.00 0.00 H new ATOM 0 HE1 PHE A 28 9.521 3.218 7.247 1.00 0.00 H new ATOM 0 HE2 PHE A 28 7.224 0.947 10.076 1.00 0.00 H new ATOM 0 HZ PHE A 28 7.563 3.017 8.754 1.00 0.00 H new ATOM 457 N SER A 29 13.138 -2.389 6.300 1.00 0.00 N ATOM 458 CA SER A 29 14.232 -3.332 6.092 1.00 0.00 C ATOM 459 C SER A 29 15.241 -3.251 7.235 1.00 0.00 C ATOM 460 O SER A 29 15.882 -2.221 7.437 1.00 0.00 O ATOM 461 CB SER A 29 14.943 -3.029 4.773 1.00 0.00 C ATOM 462 OG SER A 29 13.977 -2.865 3.744 1.00 0.00 O ATOM 0 H SER A 29 13.345 -1.428 6.029 1.00 0.00 H new ATOM 0 HA SER A 29 13.811 -4.337 6.060 1.00 0.00 H new ATOM 0 HB2 SER A 29 15.544 -2.125 4.870 1.00 0.00 H new ATOM 0 HB3 SER A 29 15.626 -3.840 4.520 1.00 0.00 H new ATOM 0 HG SER A 29 14.431 -2.669 2.898 1.00 0.00 H new ATOM 468 N ILE A 30 15.376 -4.344 7.979 1.00 0.00 N ATOM 469 CA ILE A 30 16.311 -4.380 9.097 1.00 0.00 C ATOM 470 C ILE A 30 17.708 -4.769 8.623 1.00 0.00 C ATOM 471 O ILE A 30 17.902 -5.835 8.034 1.00 0.00 O ATOM 472 CB ILE A 30 15.827 -5.384 10.144 1.00 0.00 C ATOM 473 CG1 ILE A 30 14.767 -4.726 11.028 1.00 0.00 C ATOM 474 CG2 ILE A 30 17.006 -5.830 11.014 1.00 0.00 C ATOM 475 CD1 ILE A 30 13.599 -4.245 10.163 1.00 0.00 C ATOM 0 H ILE A 30 14.855 -5.208 7.830 1.00 0.00 H new ATOM 0 HA ILE A 30 16.358 -3.384 9.538 1.00 0.00 H new ATOM 0 HB ILE A 30 15.399 -6.251 9.641 1.00 0.00 H new ATOM 0 HG12 ILE A 30 14.411 -5.436 11.775 1.00 0.00 H new ATOM 0 HG13 ILE A 30 15.202 -3.885 11.569 1.00 0.00 H new ATOM 0 HG21 ILE A 30 16.658 -6.545 11.759 1.00 0.00 H new ATOM 0 HG22 ILE A 30 17.764 -6.299 10.387 1.00 0.00 H new ATOM 0 HG23 ILE A 30 17.436 -4.963 11.516 1.00 0.00 H new ATOM 0 HD11 ILE A 30 12.846 -3.777 10.797 1.00 0.00 H new ATOM 0 HD12 ILE A 30 13.961 -3.521 9.433 1.00 0.00 H new ATOM 0 HD13 ILE A 30 13.158 -5.095 9.642 1.00 0.00 H new ATOM 487 N TYR A 31 18.681 -3.900 8.893 1.00 0.00 N ATOM 488 CA TYR A 31 20.061 -4.166 8.496 1.00 0.00 C ATOM 489 C TYR A 31 20.860 -4.724 9.666 1.00 0.00 C ATOM 490 O TYR A 31 20.718 -4.267 10.799 1.00 0.00 O ATOM 491 CB TYR A 31 20.726 -2.880 8.006 1.00 0.00 C ATOM 492 CG TYR A 31 20.411 -2.675 6.546 1.00 0.00 C ATOM 493 CD1 TYR A 31 19.143 -2.997 6.048 1.00 0.00 C ATOM 494 CD2 TYR A 31 21.393 -2.169 5.689 1.00 0.00 C ATOM 495 CE1 TYR A 31 18.859 -2.812 4.690 1.00 0.00 C ATOM 496 CE2 TYR A 31 21.110 -1.982 4.333 1.00 0.00 C ATOM 497 CZ TYR A 31 19.843 -2.303 3.832 1.00 0.00 C ATOM 498 OH TYR A 31 19.566 -2.123 2.493 1.00 0.00 O ATOM 0 H TYR A 31 18.541 -3.015 9.380 1.00 0.00 H new ATOM 0 HA TYR A 31 20.044 -4.901 7.691 1.00 0.00 H new ATOM 0 HB2 TYR A 31 20.371 -2.030 8.588 1.00 0.00 H new ATOM 0 HB3 TYR A 31 21.805 -2.938 8.152 1.00 0.00 H new ATOM 0 HD1 TYR A 31 18.385 -3.388 6.711 1.00 0.00 H new ATOM 0 HD2 TYR A 31 22.371 -1.922 6.075 1.00 0.00 H new ATOM 0 HE1 TYR A 31 17.882 -3.061 4.304 1.00 0.00 H new ATOM 0 HE2 TYR A 31 21.869 -1.590 3.672 1.00 0.00 H new ATOM 0 HH TYR A 31 20.357 -1.761 2.041 1.00 0.00 H new ATOM 508 N TRP A 32 21.699 -5.716 9.386 1.00 0.00 N ATOM 509 CA TRP A 32 22.510 -6.325 10.432 1.00 0.00 C ATOM 510 C TRP A 32 23.428 -5.288 11.074 1.00 0.00 C ATOM 511 O TRP A 32 24.156 -4.575 10.388 1.00 0.00 O ATOM 512 CB TRP A 32 23.341 -7.478 9.849 1.00 0.00 C ATOM 513 CG TRP A 32 24.191 -8.089 10.921 1.00 0.00 C ATOM 514 CD1 TRP A 32 25.535 -8.241 10.855 1.00 0.00 C ATOM 515 CD2 TRP A 32 23.784 -8.633 12.210 1.00 0.00 C ATOM 516 NE1 TRP A 32 25.978 -8.829 12.026 1.00 0.00 N ATOM 517 CE2 TRP A 32 24.936 -9.088 12.893 1.00 0.00 C ATOM 518 CE3 TRP A 32 22.540 -8.769 12.849 1.00 0.00 C ATOM 519 CZ2 TRP A 32 24.856 -9.655 14.165 1.00 0.00 C ATOM 520 CZ3 TRP A 32 22.456 -9.339 14.129 1.00 0.00 C ATOM 521 CH2 TRP A 32 23.613 -9.779 14.786 1.00 0.00 C ATOM 0 H TRP A 32 21.834 -6.111 8.455 1.00 0.00 H new ATOM 0 HA TRP A 32 21.845 -6.719 11.201 1.00 0.00 H new ATOM 0 HB2 TRP A 32 22.681 -8.233 9.422 1.00 0.00 H new ATOM 0 HB3 TRP A 32 23.971 -7.110 9.039 1.00 0.00 H new ATOM 0 HD1 TRP A 32 26.160 -7.950 10.023 1.00 0.00 H new ATOM 0 HE1 TRP A 32 26.955 -9.045 12.224 1.00 0.00 H new ATOM 0 HE3 TRP A 32 21.642 -8.433 12.352 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 25.750 -9.996 14.666 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 21.494 -9.439 14.610 1.00 0.00 H new ATOM 0 HH2 TRP A 32 23.542 -10.214 15.772 1.00 0.00 H new ATOM 532 N GLY A 33 23.374 -5.210 12.400 1.00 0.00 N ATOM 533 CA GLY A 33 24.194 -4.257 13.137 1.00 0.00 C ATOM 534 C GLY A 33 23.612 -2.860 13.056 1.00 0.00 C ATOM 535 O GLY A 33 22.633 -2.617 12.352 1.00 0.00 O ATOM 0 H GLY A 33 22.774 -5.793 12.983 1.00 0.00 H new ATOM 0 HA2 GLY A 33 24.266 -4.565 14.180 1.00 0.00 H new ATOM 0 HA3 GLY A 33 25.207 -4.256 12.734 1.00 0.00 H new ATOM 539 N ALA A 34 24.230 -1.937 13.774 1.00 0.00 N ATOM 540 CA ALA A 34 23.767 -0.567 13.758 1.00 0.00 C ATOM 541 C ALA A 34 24.917 0.399 14.026 1.00 0.00 C ATOM 542 O ALA A 34 25.424 0.480 15.144 1.00 0.00 O ATOM 543 CB ALA A 34 22.667 -0.372 14.803 1.00 0.00 C ATOM 0 H ALA A 34 25.042 -2.111 14.366 1.00 0.00 H new ATOM 0 HA ALA A 34 23.363 -0.355 12.768 1.00 0.00 H new ATOM 0 HB1 ALA A 34 22.325 0.663 14.783 1.00 0.00 H new ATOM 0 HB2 ALA A 34 21.831 -1.035 14.579 1.00 0.00 H new ATOM 0 HB3 ALA A 34 23.060 -0.605 15.793 1.00 0.00 H new ATOM 683 N GLY A 44 18.431 -0.604 12.195 1.00 0.00 N ATOM 684 CA GLY A 44 19.516 -1.571 12.298 1.00 0.00 C ATOM 685 C GLY A 44 19.300 -2.520 13.471 1.00 0.00 C ATOM 686 O GLY A 44 18.609 -2.188 14.435 1.00 0.00 O ATOM 0 HA2 GLY A 44 19.586 -2.143 11.373 1.00 0.00 H new ATOM 0 HA3 GLY A 44 20.464 -1.046 12.421 1.00 0.00 H new ATOM 690 N MET A 45 19.897 -3.703 13.379 1.00 0.00 N ATOM 691 CA MET A 45 19.769 -4.697 14.438 1.00 0.00 C ATOM 692 C MET A 45 21.018 -4.700 15.310 1.00 0.00 C ATOM 693 O MET A 45 22.138 -4.743 14.803 1.00 0.00 O ATOM 694 CB MET A 45 19.580 -6.087 13.833 1.00 0.00 C ATOM 695 CG MET A 45 18.711 -6.937 14.766 1.00 0.00 C ATOM 696 SD MET A 45 19.259 -6.711 16.479 1.00 0.00 S ATOM 697 CE MET A 45 19.630 -8.444 16.850 1.00 0.00 C ATOM 0 H MET A 45 20.470 -3.996 12.588 1.00 0.00 H new ATOM 0 HA MET A 45 18.901 -4.442 15.047 1.00 0.00 H new ATOM 0 HB2 MET A 45 19.110 -6.008 12.853 1.00 0.00 H new ATOM 0 HB3 MET A 45 20.548 -6.565 13.684 1.00 0.00 H new ATOM 0 HG2 MET A 45 17.664 -6.649 14.667 1.00 0.00 H new ATOM 0 HG3 MET A 45 18.780 -7.988 14.487 1.00 0.00 H new ATOM 0 HE1 MET A 45 19.747 -8.569 17.926 1.00 0.00 H new ATOM 0 HE2 MET A 45 18.813 -9.074 16.499 1.00 0.00 H new ATOM 0 HE3 MET A 45 20.553 -8.734 16.349 1.00 0.00 H new ATOM 707 N PHE A 46 20.820 -4.657 16.619 1.00 0.00 N ATOM 708 CA PHE A 46 21.942 -4.655 17.548 1.00 0.00 C ATOM 709 C PHE A 46 22.703 -5.974 17.476 1.00 0.00 C ATOM 710 O PHE A 46 22.105 -7.050 17.496 1.00 0.00 O ATOM 711 CB PHE A 46 21.435 -4.445 18.972 1.00 0.00 C ATOM 712 CG PHE A 46 22.489 -3.753 19.799 1.00 0.00 C ATOM 713 CD1 PHE A 46 23.735 -4.357 20.010 1.00 0.00 C ATOM 714 CD2 PHE A 46 22.213 -2.505 20.364 1.00 0.00 C ATOM 715 CE1 PHE A 46 24.703 -3.707 20.785 1.00 0.00 C ATOM 716 CE2 PHE A 46 23.179 -1.858 21.140 1.00 0.00 C ATOM 717 CZ PHE A 46 24.425 -2.458 21.351 1.00 0.00 C ATOM 0 H PHE A 46 19.901 -4.623 17.060 1.00 0.00 H new ATOM 0 HA PHE A 46 22.614 -3.843 17.272 1.00 0.00 H new ATOM 0 HB2 PHE A 46 20.523 -3.848 18.958 1.00 0.00 H new ATOM 0 HB3 PHE A 46 21.181 -5.405 19.421 1.00 0.00 H new ATOM 0 HD1 PHE A 46 23.949 -5.322 19.576 1.00 0.00 H new ATOM 0 HD2 PHE A 46 21.252 -2.040 20.201 1.00 0.00 H new ATOM 0 HE1 PHE A 46 25.665 -4.170 20.946 1.00 0.00 H new ATOM 0 HE2 PHE A 46 22.963 -0.894 21.577 1.00 0.00 H new ATOM 0 HZ PHE A 46 25.171 -1.958 21.950 1.00 0.00 H new ATOM 727 N VAL A 47 24.024 -5.879 17.395 1.00 0.00 N ATOM 728 CA VAL A 47 24.862 -7.068 17.328 1.00 0.00 C ATOM 729 C VAL A 47 25.869 -7.073 18.475 1.00 0.00 C ATOM 730 O VAL A 47 26.745 -6.211 18.551 1.00 0.00 O ATOM 731 CB VAL A 47 25.600 -7.106 15.987 1.00 0.00 C ATOM 732 CG1 VAL A 47 26.169 -5.723 15.670 1.00 0.00 C ATOM 733 CG2 VAL A 47 26.750 -8.112 16.058 1.00 0.00 C ATOM 0 H VAL A 47 24.535 -4.997 17.374 1.00 0.00 H new ATOM 0 HA VAL A 47 24.228 -7.950 17.416 1.00 0.00 H new ATOM 0 HB VAL A 47 24.899 -7.403 15.207 1.00 0.00 H new ATOM 0 HG11 VAL A 47 26.693 -5.755 14.715 1.00 0.00 H new ATOM 0 HG12 VAL A 47 25.356 -4.999 15.613 1.00 0.00 H new ATOM 0 HG13 VAL A 47 26.864 -5.427 16.456 1.00 0.00 H new ATOM 0 HG21 VAL A 47 27.272 -8.136 15.102 1.00 0.00 H new ATOM 0 HG22 VAL A 47 27.445 -7.815 16.844 1.00 0.00 H new ATOM 0 HG23 VAL A 47 26.353 -9.103 16.279 1.00 0.00 H new ATOM 743 N SER A 48 25.731 -8.047 19.367 1.00 0.00 N ATOM 744 CA SER A 48 26.625 -8.162 20.513 1.00 0.00 C ATOM 745 C SER A 48 26.625 -9.587 21.052 1.00 0.00 C ATOM 746 O SER A 48 25.847 -10.430 20.606 1.00 0.00 O ATOM 747 CB SER A 48 26.204 -7.193 21.619 1.00 0.00 C ATOM 748 OG SER A 48 24.810 -7.327 21.858 1.00 0.00 O ATOM 0 H SER A 48 25.010 -8.767 19.319 1.00 0.00 H new ATOM 0 HA SER A 48 27.633 -7.909 20.183 1.00 0.00 H new ATOM 0 HB2 SER A 48 26.762 -7.401 22.532 1.00 0.00 H new ATOM 0 HB3 SER A 48 26.438 -6.169 21.329 1.00 0.00 H new ATOM 0 HG SER A 48 24.483 -6.538 22.339 1.00 0.00 H new ATOM 754 N ASP A 49 27.508 -9.851 22.008 1.00 0.00 N ATOM 755 CA ASP A 49 27.605 -11.180 22.597 1.00 0.00 C ATOM 756 C ASP A 49 26.276 -11.586 23.228 1.00 0.00 C ATOM 757 O ASP A 49 26.059 -12.757 23.535 1.00 0.00 O ATOM 758 CB ASP A 49 28.704 -11.196 23.663 1.00 0.00 C ATOM 759 CG ASP A 49 29.046 -12.634 24.040 1.00 0.00 C ATOM 760 OD1 ASP A 49 29.454 -13.376 23.163 1.00 0.00 O ATOM 761 OD2 ASP A 49 28.895 -12.972 25.204 1.00 0.00 O ATOM 0 H ASP A 49 28.162 -9.168 22.389 1.00 0.00 H new ATOM 0 HA ASP A 49 27.851 -11.891 21.808 1.00 0.00 H new ATOM 0 HB2 ASP A 49 29.593 -10.689 23.288 1.00 0.00 H new ATOM 0 HB3 ASP A 49 28.373 -10.649 24.546 1.00 0.00 H new ATOM 766 N VAL A 50 25.389 -10.611 23.418 1.00 0.00 N ATOM 767 CA VAL A 50 24.085 -10.890 24.012 1.00 0.00 C ATOM 768 C VAL A 50 22.974 -10.732 22.978 1.00 0.00 C ATOM 769 O VAL A 50 22.015 -11.504 22.963 1.00 0.00 O ATOM 770 CB VAL A 50 23.828 -9.945 25.186 1.00 0.00 C ATOM 771 CG1 VAL A 50 25.036 -9.941 26.119 1.00 0.00 C ATOM 772 CG2 VAL A 50 23.601 -8.529 24.665 1.00 0.00 C ATOM 0 H VAL A 50 25.547 -9.634 23.173 1.00 0.00 H new ATOM 0 HA VAL A 50 24.088 -11.920 24.369 1.00 0.00 H new ATOM 0 HB VAL A 50 22.946 -10.285 25.728 1.00 0.00 H new ATOM 0 HG11 VAL A 50 24.848 -9.266 26.954 1.00 0.00 H new ATOM 0 HG12 VAL A 50 25.206 -10.949 26.498 1.00 0.00 H new ATOM 0 HG13 VAL A 50 25.917 -9.605 25.572 1.00 0.00 H new ATOM 0 HG21 VAL A 50 23.418 -7.858 25.504 1.00 0.00 H new ATOM 0 HG22 VAL A 50 24.484 -8.196 24.120 1.00 0.00 H new ATOM 0 HG23 VAL A 50 22.738 -8.520 23.999 1.00 0.00 H new ATOM 782 N THR A 51 23.110 -9.727 22.120 1.00 0.00 N ATOM 783 CA THR A 51 22.111 -9.471 21.088 1.00 0.00 C ATOM 784 C THR A 51 22.265 -10.457 19.936 1.00 0.00 C ATOM 785 O THR A 51 23.380 -10.794 19.539 1.00 0.00 O ATOM 786 CB THR A 51 22.259 -8.040 20.560 1.00 0.00 C ATOM 787 OG1 THR A 51 23.581 -7.851 20.075 1.00 0.00 O ATOM 788 CG2 THR A 51 21.982 -7.046 21.689 1.00 0.00 C ATOM 0 H THR A 51 23.898 -9.079 22.118 1.00 0.00 H new ATOM 0 HA THR A 51 21.122 -9.596 21.529 1.00 0.00 H new ATOM 0 HB THR A 51 21.547 -7.875 19.751 1.00 0.00 H new ATOM 0 HG1 THR A 51 24.163 -7.569 20.812 1.00 0.00 H new ATOM 0 HG21 THR A 51 22.088 -6.029 21.312 1.00 0.00 H new ATOM 0 HG22 THR A 51 20.968 -7.192 22.061 1.00 0.00 H new ATOM 0 HG23 THR A 51 22.693 -7.208 22.499 1.00 0.00 H new ATOM 796 N THR A 52 21.139 -10.919 19.405 1.00 0.00 N ATOM 797 CA THR A 52 21.162 -11.867 18.299 1.00 0.00 C ATOM 798 C THR A 52 19.997 -11.602 17.353 1.00 0.00 C ATOM 799 O THR A 52 19.072 -10.860 17.684 1.00 0.00 O ATOM 800 CB THR A 52 21.078 -13.299 18.829 1.00 0.00 C ATOM 801 OG1 THR A 52 21.749 -14.172 17.931 1.00 0.00 O ATOM 802 CG2 THR A 52 19.612 -13.718 18.940 1.00 0.00 C ATOM 0 H THR A 52 20.205 -10.655 19.720 1.00 0.00 H new ATOM 0 HA THR A 52 22.098 -11.742 17.755 1.00 0.00 H new ATOM 0 HB THR A 52 21.546 -13.351 19.812 1.00 0.00 H new ATOM 0 HG1 THR A 52 21.699 -15.091 18.269 1.00 0.00 H new ATOM 0 HG21 THR A 52 19.553 -14.739 19.318 1.00 0.00 H new ATOM 0 HG22 THR A 52 19.093 -13.047 19.624 1.00 0.00 H new ATOM 0 HG23 THR A 52 19.144 -13.667 17.957 1.00 0.00 H new ATOM 810 N THR A 53 20.047 -12.211 16.175 1.00 0.00 N ATOM 811 CA THR A 53 18.989 -12.032 15.190 1.00 0.00 C ATOM 812 C THR A 53 17.847 -13.010 15.441 1.00 0.00 C ATOM 813 O THR A 53 18.040 -14.056 16.062 1.00 0.00 O ATOM 814 CB THR A 53 19.546 -12.248 13.785 1.00 0.00 C ATOM 815 OG1 THR A 53 18.934 -13.394 13.209 1.00 0.00 O ATOM 816 CG2 THR A 53 21.058 -12.459 13.868 1.00 0.00 C ATOM 0 H THR A 53 20.803 -12.829 15.880 1.00 0.00 H new ATOM 0 HA THR A 53 18.605 -11.016 15.279 1.00 0.00 H new ATOM 0 HB THR A 53 19.336 -11.375 13.166 1.00 0.00 H new ATOM 0 HG1 THR A 53 19.077 -13.389 12.239 1.00 0.00 H new ATOM 0 HG21 THR A 53 21.459 -12.614 12.866 1.00 0.00 H new ATOM 0 HG22 THR A 53 21.524 -11.580 14.314 1.00 0.00 H new ATOM 0 HG23 THR A 53 21.270 -13.334 14.483 1.00 0.00 H new ATOM 824 N PRO A 54 16.670 -12.692 14.971 1.00 0.00 N ATOM 825 CA PRO A 54 15.474 -13.563 15.149 1.00 0.00 C ATOM 826 C PRO A 54 15.462 -14.736 14.177 1.00 0.00 C ATOM 827 O PRO A 54 14.833 -14.678 13.119 1.00 0.00 O ATOM 828 CB PRO A 54 14.304 -12.619 14.887 1.00 0.00 C ATOM 829 CG PRO A 54 14.837 -11.575 13.959 1.00 0.00 C ATOM 830 CD PRO A 54 16.345 -11.467 14.220 1.00 0.00 C ATOM 0 HA PRO A 54 15.444 -14.023 16.137 1.00 0.00 H new ATOM 0 HB2 PRO A 54 13.463 -13.150 14.440 1.00 0.00 H new ATOM 0 HB3 PRO A 54 13.943 -12.174 15.814 1.00 0.00 H new ATOM 0 HG2 PRO A 54 14.644 -11.847 12.921 1.00 0.00 H new ATOM 0 HG3 PRO A 54 14.346 -10.618 14.134 1.00 0.00 H new ATOM 0 HD2 PRO A 54 16.907 -11.410 13.288 1.00 0.00 H new ATOM 0 HD3 PRO A 54 16.587 -10.572 14.793 1.00 0.00 H new ATOM 838 N SER A 55 16.161 -15.800 14.544 1.00 0.00 N ATOM 839 CA SER A 55 16.226 -16.984 13.702 1.00 0.00 C ATOM 840 C SER A 55 15.568 -18.169 14.390 1.00 0.00 C ATOM 841 O SER A 55 15.464 -19.255 13.820 1.00 0.00 O ATOM 842 CB SER A 55 17.682 -17.307 13.390 1.00 0.00 C ATOM 843 OG SER A 55 18.447 -17.210 14.583 1.00 0.00 O ATOM 0 H SER A 55 16.688 -15.867 15.415 1.00 0.00 H new ATOM 0 HA SER A 55 15.690 -16.785 12.774 1.00 0.00 H new ATOM 0 HB2 SER A 55 17.763 -18.310 12.972 1.00 0.00 H new ATOM 0 HB3 SER A 55 18.067 -16.617 12.639 1.00 0.00 H new ATOM 0 HG SER A 55 19.385 -17.419 14.388 1.00 0.00 H new ATOM 849 N GLY A 56 15.120 -17.949 15.616 1.00 0.00 N ATOM 850 CA GLY A 56 14.461 -19.003 16.374 1.00 0.00 C ATOM 851 C GLY A 56 14.859 -18.963 17.847 1.00 0.00 C ATOM 852 O GLY A 56 15.842 -19.585 18.250 1.00 0.00 O ATOM 0 H GLY A 56 15.199 -17.058 16.105 1.00 0.00 H new ATOM 0 HA2 GLY A 56 13.380 -18.896 16.285 1.00 0.00 H new ATOM 0 HA3 GLY A 56 14.721 -19.974 15.952 1.00 0.00 H new ATOM 856 N GLY A 57 14.088 -18.233 18.649 1.00 0.00 N ATOM 857 CA GLY A 57 14.375 -18.130 20.075 1.00 0.00 C ATOM 858 C GLY A 57 15.688 -17.390 20.311 1.00 0.00 C ATOM 859 O GLY A 57 16.732 -18.011 20.515 1.00 0.00 O ATOM 0 H GLY A 57 13.269 -17.710 18.339 1.00 0.00 H new ATOM 0 HA2 GLY A 57 13.562 -17.606 20.577 1.00 0.00 H new ATOM 0 HA3 GLY A 57 14.430 -19.127 20.512 1.00 0.00 H new ATOM 863 N GLY A 58 15.632 -16.064 20.276 1.00 0.00 N ATOM 864 CA GLY A 58 16.819 -15.250 20.481 1.00 0.00 C ATOM 865 C GLY A 58 16.438 -13.810 20.798 1.00 0.00 C ATOM 866 O GLY A 58 15.316 -13.381 20.527 1.00 0.00 O ATOM 0 H GLY A 58 14.778 -15.532 20.108 1.00 0.00 H new ATOM 0 HA2 GLY A 58 17.412 -15.662 21.297 1.00 0.00 H new ATOM 0 HA3 GLY A 58 17.443 -15.278 19.588 1.00 0.00 H new ATOM 870 N HIS A 59 17.386 -13.070 21.356 1.00 0.00 N ATOM 871 CA HIS A 59 17.157 -11.667 21.690 1.00 0.00 C ATOM 872 C HIS A 59 17.380 -10.803 20.456 1.00 0.00 C ATOM 873 O HIS A 59 18.483 -10.762 19.911 1.00 0.00 O ATOM 874 CB HIS A 59 18.133 -11.207 22.771 1.00 0.00 C ATOM 875 CG HIS A 59 17.692 -9.872 23.318 1.00 0.00 C ATOM 876 ND1 HIS A 59 18.529 -9.071 24.084 1.00 0.00 N ATOM 877 CD2 HIS A 59 16.512 -9.175 23.205 1.00 0.00 C ATOM 878 CE1 HIS A 59 17.847 -7.953 24.399 1.00 0.00 C ATOM 879 NE2 HIS A 59 16.613 -7.966 23.887 1.00 0.00 N ATOM 0 H HIS A 59 18.318 -13.414 21.587 1.00 0.00 H new ATOM 0 HA HIS A 59 16.133 -11.567 22.050 1.00 0.00 H new ATOM 0 HB2 HIS A 59 18.176 -11.944 23.573 1.00 0.00 H new ATOM 0 HB3 HIS A 59 19.138 -11.127 22.357 1.00 0.00 H new ATOM 0 HD1 HIS A 59 19.487 -9.290 24.358 1.00 0.00 H new ATOM 0 HD2 HIS A 59 15.639 -9.515 22.668 1.00 0.00 H new ATOM 0 HE1 HIS A 59 18.248 -7.145 24.993 1.00 0.00 H new ATOM 887 N THR A 60 16.340 -10.110 20.028 1.00 0.00 N ATOM 888 CA THR A 60 16.447 -9.245 18.862 1.00 0.00 C ATOM 889 C THR A 60 16.194 -7.797 19.261 1.00 0.00 C ATOM 890 O THR A 60 15.169 -7.485 19.864 1.00 0.00 O ATOM 891 CB THR A 60 15.419 -9.660 17.815 1.00 0.00 C ATOM 892 OG1 THR A 60 15.636 -11.015 17.449 1.00 0.00 O ATOM 893 CG2 THR A 60 15.555 -8.767 16.585 1.00 0.00 C ATOM 0 H THR A 60 15.418 -10.127 20.464 1.00 0.00 H new ATOM 0 HA THR A 60 17.451 -9.338 18.448 1.00 0.00 H new ATOM 0 HB THR A 60 14.416 -9.554 18.228 1.00 0.00 H new ATOM 0 HG1 THR A 60 14.905 -11.568 17.795 1.00 0.00 H new ATOM 0 HG21 THR A 60 14.820 -9.064 15.837 1.00 0.00 H new ATOM 0 HG22 THR A 60 15.385 -7.728 16.869 1.00 0.00 H new ATOM 0 HG23 THR A 60 16.558 -8.870 16.170 1.00 0.00 H new ATOM 901 N VAL A 61 17.124 -6.914 18.919 1.00 0.00 N ATOM 902 CA VAL A 61 16.972 -5.505 19.254 1.00 0.00 C ATOM 903 C VAL A 61 16.880 -4.672 17.980 1.00 0.00 C ATOM 904 O VAL A 61 17.676 -4.834 17.056 1.00 0.00 O ATOM 905 CB VAL A 61 18.162 -5.034 20.093 1.00 0.00 C ATOM 906 CG1 VAL A 61 18.112 -3.515 20.275 1.00 0.00 C ATOM 907 CG2 VAL A 61 18.129 -5.709 21.465 1.00 0.00 C ATOM 0 H VAL A 61 17.981 -7.145 18.416 1.00 0.00 H new ATOM 0 HA VAL A 61 16.056 -5.378 19.831 1.00 0.00 H new ATOM 0 HB VAL A 61 19.083 -5.303 19.575 1.00 0.00 H new ATOM 0 HG11 VAL A 61 18.964 -3.192 20.874 1.00 0.00 H new ATOM 0 HG12 VAL A 61 18.149 -3.030 19.299 1.00 0.00 H new ATOM 0 HG13 VAL A 61 17.187 -3.240 20.782 1.00 0.00 H new ATOM 0 HG21 VAL A 61 18.979 -5.370 22.058 1.00 0.00 H new ATOM 0 HG22 VAL A 61 17.202 -5.448 21.977 1.00 0.00 H new ATOM 0 HG23 VAL A 61 18.183 -6.790 21.340 1.00 0.00 H new ATOM 917 N LEU A 62 15.900 -3.786 17.939 1.00 0.00 N ATOM 918 CA LEU A 62 15.699 -2.933 16.781 1.00 0.00 C ATOM 919 C LEU A 62 15.989 -1.483 17.125 1.00 0.00 C ATOM 920 O LEU A 62 15.562 -0.980 18.161 1.00 0.00 O ATOM 921 CB LEU A 62 14.263 -3.061 16.280 1.00 0.00 C ATOM 922 CG LEU A 62 14.144 -4.258 15.339 1.00 0.00 C ATOM 923 CD1 LEU A 62 14.706 -3.880 13.969 1.00 0.00 C ATOM 924 CD2 LEU A 62 14.920 -5.455 15.898 1.00 0.00 C ATOM 0 H LEU A 62 15.231 -3.639 18.695 1.00 0.00 H new ATOM 0 HA LEU A 62 16.387 -3.252 15.998 1.00 0.00 H new ATOM 0 HB2 LEU A 62 13.584 -3.182 17.124 1.00 0.00 H new ATOM 0 HB3 LEU A 62 13.967 -2.149 15.761 1.00 0.00 H new ATOM 0 HG LEU A 62 13.094 -4.534 15.246 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.623 -4.732 13.294 1.00 0.00 H new ATOM 0 HD12 LEU A 62 14.142 -3.040 13.564 1.00 0.00 H new ATOM 0 HD13 LEU A 62 15.754 -3.599 14.071 1.00 0.00 H new ATOM 0 HD21 LEU A 62 14.826 -6.300 15.216 1.00 0.00 H new ATOM 0 HD22 LEU A 62 15.972 -5.190 16.003 1.00 0.00 H new ATOM 0 HD23 LEU A 62 14.515 -5.728 16.873 1.00 0.00 H new ATOM 936 N SER A 63 16.713 -0.817 16.239 1.00 0.00 N ATOM 937 CA SER A 63 17.061 0.585 16.444 1.00 0.00 C ATOM 938 C SER A 63 16.461 1.454 15.342 1.00 0.00 C ATOM 939 O SER A 63 16.565 1.124 14.158 1.00 0.00 O ATOM 940 CB SER A 63 18.579 0.749 16.449 1.00 0.00 C ATOM 941 OG SER A 63 18.899 2.134 16.439 1.00 0.00 O ATOM 0 H SER A 63 17.071 -1.221 15.373 1.00 0.00 H new ATOM 0 HA SER A 63 16.656 0.903 17.405 1.00 0.00 H new ATOM 0 HB2 SER A 63 19.006 0.271 17.331 1.00 0.00 H new ATOM 0 HB3 SER A 63 19.013 0.257 15.579 1.00 0.00 H new ATOM 0 HG SER A 63 19.873 2.245 16.444 1.00 0.00 H new ATOM 947 N GLY A 64 15.831 2.560 15.742 1.00 0.00 N ATOM 948 CA GLY A 64 15.215 3.472 14.783 1.00 0.00 C ATOM 949 C GLY A 64 15.523 4.932 15.118 1.00 0.00 C ATOM 950 O GLY A 64 15.355 5.374 16.262 1.00 0.00 O ATOM 0 H GLY A 64 15.735 2.843 16.717 1.00 0.00 H new ATOM 0 HA2 GLY A 64 15.576 3.244 13.780 1.00 0.00 H new ATOM 0 HA3 GLY A 64 14.136 3.319 14.776 1.00 0.00 H new ATOM 1102 N GLY A 74 -0.179 2.932 16.441 1.00 0.00 N ATOM 1103 CA GLY A 74 0.870 2.499 15.533 1.00 0.00 C ATOM 1104 C GLY A 74 1.811 1.514 16.205 1.00 0.00 C ATOM 1105 O GLY A 74 2.098 0.446 15.665 1.00 0.00 O ATOM 0 HA2 GLY A 74 0.424 2.036 14.653 1.00 0.00 H new ATOM 0 HA3 GLY A 74 1.434 3.365 15.186 1.00 0.00 H new ATOM 1109 N GLN A 75 2.297 1.884 17.379 1.00 0.00 N ATOM 1110 CA GLN A 75 3.216 1.020 18.108 1.00 0.00 C ATOM 1111 C GLN A 75 2.911 1.025 19.600 1.00 0.00 C ATOM 1112 O GLN A 75 3.388 0.164 20.339 1.00 0.00 O ATOM 1113 CB GLN A 75 4.654 1.488 17.887 1.00 0.00 C ATOM 1114 CG GLN A 75 4.969 1.438 16.395 1.00 0.00 C ATOM 1115 CD GLN A 75 6.424 1.826 16.154 1.00 0.00 C ATOM 1116 OE1 GLN A 75 6.815 2.963 16.419 1.00 0.00 O ATOM 1117 NE2 GLN A 75 7.254 0.947 15.661 1.00 0.00 N ATOM 0 H GLN A 75 2.075 2.764 17.844 1.00 0.00 H new ATOM 0 HA GLN A 75 3.092 0.005 17.731 1.00 0.00 H new ATOM 0 HB2 GLN A 75 4.782 2.502 18.265 1.00 0.00 H new ATOM 0 HB3 GLN A 75 5.346 0.852 18.439 1.00 0.00 H new ATOM 0 HG2 GLN A 75 4.783 0.436 16.009 1.00 0.00 H new ATOM 0 HG3 GLN A 75 4.309 2.115 15.853 1.00 0.00 H new ATOM 0 HE21 GLN A 75 6.929 0.005 15.442 1.00 0.00 H new ATOM 0 HE22 GLN A 75 8.228 1.202 15.495 1.00 0.00 H new ATOM 1126 N LEU A 76 2.132 2.007 20.043 1.00 0.00 N ATOM 1127 CA LEU A 76 1.795 2.110 21.453 1.00 0.00 C ATOM 1128 C LEU A 76 0.510 1.351 21.762 1.00 0.00 C ATOM 1129 O LEU A 76 -0.471 1.931 22.225 1.00 0.00 O ATOM 1130 CB LEU A 76 1.623 3.574 21.841 1.00 0.00 C ATOM 1131 CG LEU A 76 2.588 4.437 21.024 1.00 0.00 C ATOM 1132 CD1 LEU A 76 2.536 5.880 21.526 1.00 0.00 C ATOM 1133 CD2 LEU A 76 4.012 3.897 21.169 1.00 0.00 C ATOM 0 H LEU A 76 1.728 2.733 19.452 1.00 0.00 H new ATOM 0 HA LEU A 76 2.609 1.670 22.029 1.00 0.00 H new ATOM 0 HB2 LEU A 76 0.595 3.890 21.662 1.00 0.00 H new ATOM 0 HB3 LEU A 76 1.815 3.704 22.906 1.00 0.00 H new ATOM 0 HG LEU A 76 2.296 4.407 19.974 1.00 0.00 H new ATOM 0 HD11 LEU A 76 3.224 6.493 20.943 1.00 0.00 H new ATOM 0 HD12 LEU A 76 1.523 6.267 21.416 1.00 0.00 H new ATOM 0 HD13 LEU A 76 2.824 5.910 22.577 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.696 4.514 20.586 1.00 0.00 H new ATOM 0 HD22 LEU A 76 4.305 3.922 22.218 1.00 0.00 H new ATOM 0 HD23 LEU A 76 4.050 2.870 20.806 1.00 0.00 H new ATOM 1145 N LYS A 77 0.537 0.052 21.513 1.00 0.00 N ATOM 1146 CA LYS A 77 -0.613 -0.801 21.779 1.00 0.00 C ATOM 1147 C LYS A 77 -0.193 -2.270 21.774 1.00 0.00 C ATOM 1148 O LYS A 77 0.661 -2.677 20.986 1.00 0.00 O ATOM 1149 CB LYS A 77 -1.710 -0.561 20.740 1.00 0.00 C ATOM 1150 CG LYS A 77 -1.308 -1.176 19.401 1.00 0.00 C ATOM 1151 CD LYS A 77 -2.462 -1.018 18.415 1.00 0.00 C ATOM 1152 CE LYS A 77 -2.262 -1.984 17.252 1.00 0.00 C ATOM 1153 NZ LYS A 77 -1.134 -1.517 16.396 1.00 0.00 N ATOM 0 H LYS A 77 1.344 -0.437 21.126 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.009 -0.552 22.764 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -2.648 -0.998 21.083 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -1.881 0.509 20.621 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -0.414 -0.687 19.015 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -1.064 -2.231 19.529 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.411 -1.219 18.912 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.505 0.008 18.048 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -2.053 -2.985 17.630 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -3.176 -2.051 16.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -0.824 -2.293 15.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.449 -0.715 15.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -0.342 -1.217 16.999 1.00 0.00 H new ATOM 1167 N GLU A 78 -0.805 -3.055 22.654 1.00 0.00 N ATOM 1168 CA GLU A 78 -0.505 -4.479 22.755 1.00 0.00 C ATOM 1169 C GLU A 78 -1.145 -5.231 21.604 1.00 0.00 C ATOM 1170 O GLU A 78 -0.752 -6.350 21.276 1.00 0.00 O ATOM 1171 CB GLU A 78 -1.013 -5.041 24.085 1.00 0.00 C ATOM 1172 CG GLU A 78 -0.104 -4.583 25.229 1.00 0.00 C ATOM 1173 CD GLU A 78 -0.667 -5.062 26.565 1.00 0.00 C ATOM 1174 OE1 GLU A 78 -1.711 -5.696 26.553 1.00 0.00 O ATOM 1175 OE2 GLU A 78 -0.048 -4.787 27.578 1.00 0.00 O ATOM 0 H GLU A 78 -1.514 -2.728 23.310 1.00 0.00 H new ATOM 0 HA GLU A 78 0.577 -4.607 22.709 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.034 -4.705 24.265 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.038 -6.130 24.043 1.00 0.00 H new ATOM 0 HG2 GLU A 78 0.902 -4.978 25.086 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.023 -3.496 25.228 1.00 0.00 H new ATOM 1182 N LYS A 79 -2.129 -4.604 20.992 1.00 0.00 N ATOM 1183 CA LYS A 79 -2.823 -5.210 19.871 1.00 0.00 C ATOM 1184 C LYS A 79 -1.908 -5.238 18.650 1.00 0.00 C ATOM 1185 O LYS A 79 -2.177 -5.942 17.675 1.00 0.00 O ATOM 1186 CB LYS A 79 -4.094 -4.421 19.558 1.00 0.00 C ATOM 1187 CG LYS A 79 -4.882 -4.204 20.843 1.00 0.00 C ATOM 1188 CD LYS A 79 -6.169 -3.457 20.509 1.00 0.00 C ATOM 1189 CE LYS A 79 -7.002 -3.304 21.774 1.00 0.00 C ATOM 1190 NZ LYS A 79 -6.505 -2.140 22.559 1.00 0.00 N ATOM 0 H LYS A 79 -2.467 -3.677 21.250 1.00 0.00 H new ATOM 0 HA LYS A 79 -3.098 -6.232 20.130 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -3.839 -3.462 19.108 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -4.702 -4.961 18.832 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -5.112 -5.161 21.311 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -4.289 -3.634 21.558 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -5.937 -2.477 20.091 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -6.733 -4.001 19.751 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -8.051 -3.161 21.516 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -6.942 -4.212 22.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -7.074 -2.036 23.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -5.509 -2.295 22.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -6.584 -1.276 21.986 1.00 0.00 H new ATOM 1204 N ASP A 80 -0.829 -4.455 18.709 1.00 0.00 N ATOM 1205 CA ASP A 80 0.118 -4.388 17.594 1.00 0.00 C ATOM 1206 C ASP A 80 0.885 -5.698 17.443 1.00 0.00 C ATOM 1207 O ASP A 80 1.091 -6.429 18.411 1.00 0.00 O ATOM 1208 CB ASP A 80 1.104 -3.245 17.820 1.00 0.00 C ATOM 1209 CG ASP A 80 2.138 -3.209 16.700 1.00 0.00 C ATOM 1210 OD1 ASP A 80 2.734 -4.239 16.437 1.00 0.00 O ATOM 1211 OD2 ASP A 80 2.323 -2.148 16.126 1.00 0.00 O ATOM 0 H ASP A 80 -0.591 -3.865 19.506 1.00 0.00 H new ATOM 0 HA ASP A 80 -0.449 -4.212 16.680 1.00 0.00 H new ATOM 0 HB2 ASP A 80 0.569 -2.296 17.860 1.00 0.00 H new ATOM 0 HB3 ASP A 80 1.603 -3.371 18.781 1.00 0.00 H new ATOM 1216 N THR A 81 1.314 -5.984 16.218 1.00 0.00 N ATOM 1217 CA THR A 81 2.061 -7.190 15.946 1.00 0.00 C ATOM 1218 C THR A 81 3.157 -6.908 14.947 1.00 0.00 C ATOM 1219 O THR A 81 2.900 -6.454 13.837 1.00 0.00 O ATOM 1220 CB THR A 81 1.134 -8.266 15.407 1.00 0.00 C ATOM 1221 OG1 THR A 81 0.057 -7.651 14.717 1.00 0.00 O ATOM 1222 CG2 THR A 81 0.599 -9.094 16.567 1.00 0.00 C ATOM 0 H THR A 81 1.153 -5.392 15.403 1.00 0.00 H new ATOM 0 HA THR A 81 2.511 -7.541 16.875 1.00 0.00 H new ATOM 0 HB THR A 81 1.678 -8.916 14.721 1.00 0.00 H new ATOM 0 HG1 THR A 81 -0.543 -8.341 14.366 1.00 0.00 H new ATOM 0 HG21 THR A 81 -0.067 -9.868 16.185 1.00 0.00 H new ATOM 0 HG22 THR A 81 1.431 -9.560 17.096 1.00 0.00 H new ATOM 0 HG23 THR A 81 0.050 -8.448 17.252 1.00 0.00 H new ATOM 1230 N LEU A 82 4.382 -7.180 15.343 1.00 0.00 N ATOM 1231 CA LEU A 82 5.507 -6.941 14.465 1.00 0.00 C ATOM 1232 C LEU A 82 5.929 -8.246 13.810 1.00 0.00 C ATOM 1233 O LEU A 82 6.326 -9.189 14.493 1.00 0.00 O ATOM 1234 CB LEU A 82 6.665 -6.366 15.270 1.00 0.00 C ATOM 1235 CG LEU A 82 6.197 -5.155 16.083 1.00 0.00 C ATOM 1236 CD1 LEU A 82 7.365 -4.619 16.916 1.00 0.00 C ATOM 1237 CD2 LEU A 82 5.703 -4.060 15.136 1.00 0.00 C ATOM 0 H LEU A 82 4.623 -7.563 16.257 1.00 0.00 H new ATOM 0 HA LEU A 82 5.220 -6.230 13.690 1.00 0.00 H new ATOM 0 HB2 LEU A 82 7.066 -7.128 15.938 1.00 0.00 H new ATOM 0 HB3 LEU A 82 7.473 -6.072 14.600 1.00 0.00 H new ATOM 0 HG LEU A 82 5.384 -5.455 16.744 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.034 -3.757 17.495 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.717 -5.398 17.593 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.177 -4.320 16.254 1.00 0.00 H new ATOM 0 HD21 LEU A 82 5.371 -3.200 15.717 1.00 0.00 H new ATOM 0 HD22 LEU A 82 6.514 -3.759 14.473 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.872 -4.440 14.542 1.00 0.00 H new ATOM 1249 N VAL A 83 5.830 -8.306 12.488 1.00 0.00 N ATOM 1250 CA VAL A 83 6.198 -9.515 11.770 1.00 0.00 C ATOM 1251 C VAL A 83 7.584 -9.363 11.168 1.00 0.00 C ATOM 1252 O VAL A 83 7.841 -8.441 10.397 1.00 0.00 O ATOM 1253 CB VAL A 83 5.184 -9.775 10.666 1.00 0.00 C ATOM 1254 CG1 VAL A 83 5.508 -11.095 9.961 1.00 0.00 C ATOM 1255 CG2 VAL A 83 3.774 -9.826 11.266 1.00 0.00 C ATOM 0 H VAL A 83 5.502 -7.541 11.899 1.00 0.00 H new ATOM 0 HA VAL A 83 6.206 -10.356 12.464 1.00 0.00 H new ATOM 0 HB VAL A 83 5.230 -8.968 9.935 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.778 -11.275 9.172 1.00 0.00 H new ATOM 0 HG12 VAL A 83 6.506 -11.040 9.526 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.471 -11.911 10.682 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.048 -10.012 10.474 1.00 0.00 H new ATOM 0 HG22 VAL A 83 3.721 -10.627 12.003 1.00 0.00 H new ATOM 0 HG23 VAL A 83 3.549 -8.875 11.748 1.00 0.00 H new ATOM 1265 N LEU A 84 8.479 -10.263 11.544 1.00 0.00 N ATOM 1266 CA LEU A 84 9.850 -10.215 11.060 1.00 0.00 C ATOM 1267 C LEU A 84 10.133 -11.350 10.091 1.00 0.00 C ATOM 1268 O LEU A 84 9.833 -12.508 10.375 1.00 0.00 O ATOM 1269 CB LEU A 84 10.801 -10.330 12.245 1.00 0.00 C ATOM 1270 CG LEU A 84 10.965 -8.963 12.901 1.00 0.00 C ATOM 1271 CD1 LEU A 84 11.776 -8.043 11.986 1.00 0.00 C ATOM 1272 CD2 LEU A 84 9.585 -8.361 13.152 1.00 0.00 C ATOM 0 H LEU A 84 8.281 -11.034 12.182 1.00 0.00 H new ATOM 0 HA LEU A 84 9.996 -9.269 10.538 1.00 0.00 H new ATOM 0 HB2 LEU A 84 10.413 -11.048 12.968 1.00 0.00 H new ATOM 0 HB3 LEU A 84 11.769 -10.704 11.913 1.00 0.00 H new ATOM 0 HG LEU A 84 11.493 -9.072 13.848 1.00 0.00 H new ATOM 0 HD11 LEU A 84 11.890 -7.068 12.459 1.00 0.00 H new ATOM 0 HD12 LEU A 84 12.760 -8.479 11.811 1.00 0.00 H new ATOM 0 HD13 LEU A 84 11.257 -7.926 11.035 1.00 0.00 H new ATOM 0 HD21 LEU A 84 9.694 -7.383 13.621 1.00 0.00 H new ATOM 0 HD22 LEU A 84 9.058 -8.252 12.204 1.00 0.00 H new ATOM 0 HD23 LEU A 84 9.016 -9.017 13.810 1.00 0.00 H new ATOM 1284 N GLU A 85 10.727 -11.011 8.954 1.00 0.00 N ATOM 1285 CA GLU A 85 11.067 -12.015 7.950 1.00 0.00 C ATOM 1286 C GLU A 85 12.553 -12.343 7.994 1.00 0.00 C ATOM 1287 O GLU A 85 13.399 -11.456 7.868 1.00 0.00 O ATOM 1288 CB GLU A 85 10.707 -11.512 6.554 1.00 0.00 C ATOM 1289 CG GLU A 85 9.188 -11.498 6.378 1.00 0.00 C ATOM 1290 CD GLU A 85 8.593 -10.247 7.016 1.00 0.00 C ATOM 1291 OE1 GLU A 85 9.340 -9.506 7.632 1.00 0.00 O ATOM 1292 OE2 GLU A 85 7.397 -10.046 6.874 1.00 0.00 O ATOM 0 H GLU A 85 10.983 -10.056 8.703 1.00 0.00 H new ATOM 0 HA GLU A 85 10.496 -12.917 8.172 1.00 0.00 H new ATOM 0 HB2 GLU A 85 11.108 -10.509 6.405 1.00 0.00 H new ATOM 0 HB3 GLU A 85 11.163 -12.153 5.799 1.00 0.00 H new ATOM 0 HG2 GLU A 85 8.938 -11.528 5.318 1.00 0.00 H new ATOM 0 HG3 GLU A 85 8.754 -12.388 6.833 1.00 0.00 H new ATOM 1299 N TYR A 86 12.857 -13.622 8.181 1.00 0.00 N ATOM 1300 CA TYR A 86 14.242 -14.066 8.248 1.00 0.00 C ATOM 1301 C TYR A 86 14.407 -15.439 7.591 1.00 0.00 C ATOM 1302 O TYR A 86 13.815 -16.413 8.034 1.00 0.00 O ATOM 1303 CB TYR A 86 14.667 -14.152 9.715 1.00 0.00 C ATOM 1304 CG TYR A 86 16.169 -14.185 9.798 1.00 0.00 C ATOM 1305 CD1 TYR A 86 16.868 -15.299 9.328 1.00 0.00 C ATOM 1306 CD2 TYR A 86 16.861 -13.094 10.330 1.00 0.00 C ATOM 1307 CE1 TYR A 86 18.268 -15.324 9.391 1.00 0.00 C ATOM 1308 CE2 TYR A 86 18.259 -13.115 10.392 1.00 0.00 C ATOM 1309 CZ TYR A 86 18.962 -14.230 9.922 1.00 0.00 C ATOM 1310 OH TYR A 86 20.340 -14.250 9.982 1.00 0.00 O ATOM 0 H TYR A 86 12.167 -14.365 8.288 1.00 0.00 H new ATOM 0 HA TYR A 86 14.867 -13.350 7.714 1.00 0.00 H new ATOM 0 HB2 TYR A 86 14.280 -13.296 10.268 1.00 0.00 H new ATOM 0 HB3 TYR A 86 14.246 -15.046 10.175 1.00 0.00 H new ATOM 0 HD1 TYR A 86 16.330 -16.140 8.916 1.00 0.00 H new ATOM 0 HD2 TYR A 86 16.317 -12.235 10.693 1.00 0.00 H new ATOM 0 HE1 TYR A 86 18.810 -16.186 9.031 1.00 0.00 H new ATOM 0 HE2 TYR A 86 18.795 -12.272 10.802 1.00 0.00 H new ATOM 0 HH TYR A 86 20.662 -13.413 10.377 1.00 0.00 H new ATOM 1320 N ASP A 87 15.229 -15.519 6.543 1.00 0.00 N ATOM 1321 CA ASP A 87 15.461 -16.795 5.864 1.00 0.00 C ATOM 1322 C ASP A 87 14.159 -17.410 5.355 1.00 0.00 C ATOM 1323 O ASP A 87 13.872 -18.578 5.617 1.00 0.00 O ATOM 1324 CB ASP A 87 16.142 -17.779 6.815 1.00 0.00 C ATOM 1325 CG ASP A 87 16.534 -19.042 6.056 1.00 0.00 C ATOM 1326 OD1 ASP A 87 17.426 -18.958 5.227 1.00 0.00 O ATOM 1327 OD2 ASP A 87 15.933 -20.072 6.311 1.00 0.00 O ATOM 0 H ASP A 87 15.739 -14.728 6.150 1.00 0.00 H new ATOM 0 HA ASP A 87 16.105 -16.596 5.007 1.00 0.00 H new ATOM 0 HB2 ASP A 87 17.026 -17.320 7.257 1.00 0.00 H new ATOM 0 HB3 ASP A 87 15.470 -18.030 7.636 1.00 0.00 H new ATOM 1332 N ASN A 88 13.379 -16.621 4.629 1.00 0.00 N ATOM 1333 CA ASN A 88 12.115 -17.096 4.084 1.00 0.00 C ATOM 1334 C ASN A 88 11.163 -17.486 5.200 1.00 0.00 C ATOM 1335 O ASN A 88 10.085 -18.025 4.945 1.00 0.00 O ATOM 1336 CB ASN A 88 12.340 -18.297 3.161 1.00 0.00 C ATOM 1337 CG ASN A 88 13.016 -17.842 1.873 1.00 0.00 C ATOM 1338 OD1 ASN A 88 13.350 -16.667 1.728 1.00 0.00 O ATOM 1339 ND2 ASN A 88 13.222 -18.704 0.915 1.00 0.00 N ATOM 0 H ASN A 88 13.599 -15.651 4.404 1.00 0.00 H new ATOM 0 HA ASN A 88 11.674 -16.283 3.508 1.00 0.00 H new ATOM 0 HB2 ASN A 88 12.958 -19.042 3.663 1.00 0.00 H new ATOM 0 HB3 ASN A 88 11.387 -18.775 2.933 1.00 0.00 H new ATOM 0 HD21 ASN A 88 13.661 -18.404 0.044 1.00 0.00 H new ATOM 0 HD22 ASN A 88 12.944 -19.678 1.037 1.00 0.00 H new ATOM 1346 N LYS A 89 11.549 -17.193 6.435 1.00 0.00 N ATOM 1347 CA LYS A 89 10.688 -17.505 7.562 1.00 0.00 C ATOM 1348 C LYS A 89 10.091 -16.225 8.124 1.00 0.00 C ATOM 1349 O LYS A 89 10.747 -15.184 8.160 1.00 0.00 O ATOM 1350 CB LYS A 89 11.448 -18.240 8.663 1.00 0.00 C ATOM 1351 CG LYS A 89 11.861 -19.625 8.171 1.00 0.00 C ATOM 1352 CD LYS A 89 12.578 -20.388 9.292 1.00 0.00 C ATOM 1353 CE LYS A 89 13.973 -19.799 9.526 1.00 0.00 C ATOM 1354 NZ LYS A 89 14.725 -20.673 10.474 1.00 0.00 N ATOM 0 H LYS A 89 12.435 -16.749 6.677 1.00 0.00 H new ATOM 0 HA LYS A 89 9.894 -18.160 7.204 1.00 0.00 H new ATOM 0 HB2 LYS A 89 12.330 -17.669 8.952 1.00 0.00 H new ATOM 0 HB3 LYS A 89 10.822 -18.331 9.551 1.00 0.00 H new ATOM 0 HG2 LYS A 89 10.982 -20.181 7.846 1.00 0.00 H new ATOM 0 HG3 LYS A 89 12.517 -19.532 7.306 1.00 0.00 H new ATOM 0 HD2 LYS A 89 11.994 -20.333 10.210 1.00 0.00 H new ATOM 0 HD3 LYS A 89 12.660 -21.443 9.029 1.00 0.00 H new ATOM 0 HE2 LYS A 89 14.511 -19.721 8.581 1.00 0.00 H new ATOM 0 HE3 LYS A 89 13.891 -18.790 9.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 15.673 -20.276 10.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 14.213 -20.726 11.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 14.814 -21.627 10.070 1.00 0.00 H new ATOM 1368 N THR A 90 8.839 -16.306 8.549 1.00 0.00 N ATOM 1369 CA THR A 90 8.162 -15.138 9.094 1.00 0.00 C ATOM 1370 C THR A 90 7.875 -15.326 10.576 1.00 0.00 C ATOM 1371 O THR A 90 7.224 -16.290 10.970 1.00 0.00 O ATOM 1372 CB THR A 90 6.838 -14.909 8.358 1.00 0.00 C ATOM 1373 OG1 THR A 90 6.923 -15.464 7.054 1.00 0.00 O ATOM 1374 CG2 THR A 90 6.549 -13.416 8.245 1.00 0.00 C ATOM 0 H THR A 90 8.277 -17.157 8.528 1.00 0.00 H new ATOM 0 HA THR A 90 8.815 -14.275 8.961 1.00 0.00 H new ATOM 0 HB THR A 90 6.035 -15.389 8.918 1.00 0.00 H new ATOM 0 HG1 THR A 90 6.077 -15.320 6.582 1.00 0.00 H new ATOM 0 HG21 THR A 90 5.605 -13.267 7.720 1.00 0.00 H new ATOM 0 HG22 THR A 90 6.482 -12.982 9.243 1.00 0.00 H new ATOM 0 HG23 THR A 90 7.353 -12.931 7.692 1.00 0.00 H new ATOM 1382 N TYR A 91 8.356 -14.393 11.385 1.00 0.00 N ATOM 1383 CA TYR A 91 8.138 -14.447 12.826 1.00 0.00 C ATOM 1384 C TYR A 91 7.118 -13.395 13.242 1.00 0.00 C ATOM 1385 O TYR A 91 7.245 -12.224 12.890 1.00 0.00 O ATOM 1386 CB TYR A 91 9.452 -14.193 13.551 1.00 0.00 C ATOM 1387 CG TYR A 91 10.350 -15.383 13.354 1.00 0.00 C ATOM 1388 CD1 TYR A 91 10.865 -15.646 12.085 1.00 0.00 C ATOM 1389 CD2 TYR A 91 10.671 -16.218 14.430 1.00 0.00 C ATOM 1390 CE1 TYR A 91 11.701 -16.743 11.885 1.00 0.00 C ATOM 1391 CE2 TYR A 91 11.511 -17.321 14.230 1.00 0.00 C ATOM 1392 CZ TYR A 91 12.026 -17.583 12.955 1.00 0.00 C ATOM 1393 OH TYR A 91 12.856 -18.668 12.750 1.00 0.00 O ATOM 0 H TYR A 91 8.900 -13.590 11.070 1.00 0.00 H new ATOM 0 HA TYR A 91 7.759 -15.435 13.089 1.00 0.00 H new ATOM 0 HB2 TYR A 91 9.929 -13.292 13.165 1.00 0.00 H new ATOM 0 HB3 TYR A 91 9.272 -14.028 14.613 1.00 0.00 H new ATOM 0 HD1 TYR A 91 10.616 -14.999 11.257 1.00 0.00 H new ATOM 0 HD2 TYR A 91 10.272 -16.013 15.412 1.00 0.00 H new ATOM 0 HE1 TYR A 91 12.099 -16.945 10.901 1.00 0.00 H new ATOM 0 HE2 TYR A 91 11.761 -17.968 15.058 1.00 0.00 H new ATOM 0 HH TYR A 91 13.150 -19.023 13.615 1.00 0.00 H new ATOM 1403 N THR A 92 6.104 -13.820 13.983 1.00 0.00 N ATOM 1404 CA THR A 92 5.063 -12.906 14.426 1.00 0.00 C ATOM 1405 C THR A 92 5.287 -12.473 15.870 1.00 0.00 C ATOM 1406 O THR A 92 5.219 -13.288 16.788 1.00 0.00 O ATOM 1407 CB THR A 92 3.701 -13.599 14.315 1.00 0.00 C ATOM 1408 OG1 THR A 92 3.844 -14.804 13.579 1.00 0.00 O ATOM 1409 CG2 THR A 92 2.717 -12.684 13.595 1.00 0.00 C ATOM 0 H THR A 92 5.981 -14.786 14.288 1.00 0.00 H new ATOM 0 HA THR A 92 5.092 -12.020 13.792 1.00 0.00 H new ATOM 0 HB THR A 92 3.326 -13.820 15.314 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.017 -15.326 13.643 1.00 0.00 H new ATOM 0 HG21 THR A 92 1.749 -13.180 13.518 1.00 0.00 H new ATOM 0 HG22 THR A 92 2.606 -11.756 14.156 1.00 0.00 H new ATOM 0 HG23 THR A 92 3.092 -12.461 12.596 1.00 0.00 H new ATOM 1417 N TYR A 93 5.538 -11.181 16.059 1.00 0.00 N ATOM 1418 CA TYR A 93 5.754 -10.633 17.394 1.00 0.00 C ATOM 1419 C TYR A 93 4.586 -9.752 17.807 1.00 0.00 C ATOM 1420 O TYR A 93 3.901 -9.182 16.962 1.00 0.00 O ATOM 1421 CB TYR A 93 7.032 -9.806 17.419 1.00 0.00 C ATOM 1422 CG TYR A 93 8.219 -10.712 17.296 1.00 0.00 C ATOM 1423 CD1 TYR A 93 8.810 -11.239 18.446 1.00 0.00 C ATOM 1424 CD2 TYR A 93 8.732 -11.022 16.035 1.00 0.00 C ATOM 1425 CE1 TYR A 93 9.918 -12.080 18.337 1.00 0.00 C ATOM 1426 CE2 TYR A 93 9.840 -11.863 15.921 1.00 0.00 C ATOM 1427 CZ TYR A 93 10.436 -12.393 17.074 1.00 0.00 C ATOM 1428 OH TYR A 93 11.533 -13.224 16.964 1.00 0.00 O ATOM 0 H TYR A 93 5.597 -10.495 15.306 1.00 0.00 H new ATOM 0 HA TYR A 93 5.840 -11.465 18.092 1.00 0.00 H new ATOM 0 HB2 TYR A 93 7.026 -9.084 16.602 1.00 0.00 H new ATOM 0 HB3 TYR A 93 7.091 -9.237 18.347 1.00 0.00 H new ATOM 0 HD1 TYR A 93 8.410 -10.996 19.419 1.00 0.00 H new ATOM 0 HD2 TYR A 93 8.272 -10.611 15.148 1.00 0.00 H new ATOM 0 HE1 TYR A 93 10.376 -12.489 19.226 1.00 0.00 H new ATOM 0 HE2 TYR A 93 10.238 -12.105 14.946 1.00 0.00 H new ATOM 0 HH TYR A 93 11.763 -13.339 16.018 1.00 0.00 H new ATOM 1438 N GLU A 94 4.372 -9.642 19.113 1.00 0.00 N ATOM 1439 CA GLU A 94 3.289 -8.819 19.637 1.00 0.00 C ATOM 1440 C GLU A 94 3.816 -7.831 20.665 1.00 0.00 C ATOM 1441 O GLU A 94 4.669 -8.170 21.486 1.00 0.00 O ATOM 1442 CB GLU A 94 2.219 -9.710 20.268 1.00 0.00 C ATOM 1443 CG GLU A 94 1.408 -8.904 21.284 1.00 0.00 C ATOM 1444 CD GLU A 94 0.144 -9.670 21.661 1.00 0.00 C ATOM 1445 OE1 GLU A 94 0.232 -10.876 21.826 1.00 0.00 O ATOM 1446 OE2 GLU A 94 -0.895 -9.041 21.771 1.00 0.00 O ATOM 0 H GLU A 94 4.932 -10.110 19.826 1.00 0.00 H new ATOM 0 HA GLU A 94 2.849 -8.257 18.813 1.00 0.00 H new ATOM 0 HB2 GLU A 94 1.560 -10.106 19.495 1.00 0.00 H new ATOM 0 HB3 GLU A 94 2.686 -10.565 20.757 1.00 0.00 H new ATOM 0 HG2 GLU A 94 2.008 -8.714 22.174 1.00 0.00 H new ATOM 0 HG3 GLU A 94 1.144 -7.933 20.865 1.00 0.00 H new ATOM 1453 N ILE A 95 3.310 -6.603 20.619 1.00 0.00 N ATOM 1454 CA ILE A 95 3.761 -5.592 21.559 1.00 0.00 C ATOM 1455 C ILE A 95 3.437 -6.016 22.979 1.00 0.00 C ATOM 1456 O ILE A 95 2.275 -6.221 23.334 1.00 0.00 O ATOM 1457 CB ILE A 95 3.082 -4.260 21.259 1.00 0.00 C ATOM 1458 CG1 ILE A 95 3.772 -3.588 20.074 1.00 0.00 C ATOM 1459 CG2 ILE A 95 3.159 -3.345 22.477 1.00 0.00 C ATOM 1460 CD1 ILE A 95 5.239 -3.291 20.404 1.00 0.00 C ATOM 0 H ILE A 95 2.602 -6.291 19.954 1.00 0.00 H new ATOM 0 HA ILE A 95 4.840 -5.478 21.456 1.00 0.00 H new ATOM 0 HB ILE A 95 2.035 -4.444 21.017 1.00 0.00 H new ATOM 0 HG12 ILE A 95 3.714 -4.234 19.198 1.00 0.00 H new ATOM 0 HG13 ILE A 95 3.255 -2.662 19.822 1.00 0.00 H new ATOM 0 HG21 ILE A 95 2.671 -2.397 22.251 1.00 0.00 H new ATOM 0 HG22 ILE A 95 2.658 -3.819 23.321 1.00 0.00 H new ATOM 0 HG23 ILE A 95 4.204 -3.164 22.731 1.00 0.00 H new ATOM 0 HD11 ILE A 95 5.715 -2.812 19.548 1.00 0.00 H new ATOM 0 HD12 ILE A 95 5.291 -2.627 21.266 1.00 0.00 H new ATOM 0 HD13 ILE A 95 5.756 -4.223 20.632 1.00 0.00 H new ATOM 1472 N GLN A 96 4.479 -6.144 23.780 1.00 0.00 N ATOM 1473 CA GLN A 96 4.321 -6.548 25.171 1.00 0.00 C ATOM 1474 C GLN A 96 4.101 -5.333 26.058 1.00 0.00 C ATOM 1475 O GLN A 96 3.023 -5.153 26.623 1.00 0.00 O ATOM 1476 CB GLN A 96 5.561 -7.302 25.646 1.00 0.00 C ATOM 1477 CG GLN A 96 5.672 -8.623 24.887 1.00 0.00 C ATOM 1478 CD GLN A 96 5.194 -9.775 25.768 1.00 0.00 C ATOM 1479 OE1 GLN A 96 5.846 -10.113 26.755 1.00 0.00 O ATOM 1480 NE2 GLN A 96 4.086 -10.396 25.472 1.00 0.00 N ATOM 0 H GLN A 96 5.444 -5.975 23.495 1.00 0.00 H new ATOM 0 HA GLN A 96 3.451 -7.201 25.238 1.00 0.00 H new ATOM 0 HB2 GLN A 96 6.453 -6.698 25.480 1.00 0.00 H new ATOM 0 HB3 GLN A 96 5.498 -7.490 26.718 1.00 0.00 H new ATOM 0 HG2 GLN A 96 5.075 -8.579 23.976 1.00 0.00 H new ATOM 0 HG3 GLN A 96 6.705 -8.791 24.583 1.00 0.00 H new ATOM 0 HE21 GLN A 96 3.547 -10.114 24.653 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.759 -11.163 26.059 1.00 0.00 H new ATOM 1489 N LYS A 97 5.127 -4.498 26.181 1.00 0.00 N ATOM 1490 CA LYS A 97 5.019 -3.306 27.008 1.00 0.00 C ATOM 1491 C LYS A 97 5.891 -2.193 26.446 1.00 0.00 C ATOM 1492 O LYS A 97 7.032 -2.426 26.042 1.00 0.00 O ATOM 1493 CB LYS A 97 5.449 -3.623 28.441 1.00 0.00 C ATOM 1494 CG LYS A 97 4.962 -2.523 29.388 1.00 0.00 C ATOM 1495 CD LYS A 97 3.482 -2.742 29.707 1.00 0.00 C ATOM 1496 CE LYS A 97 3.080 -1.871 30.900 1.00 0.00 C ATOM 1497 NZ LYS A 97 1.621 -2.026 31.159 1.00 0.00 N ATOM 0 H LYS A 97 6.031 -4.623 25.725 1.00 0.00 H new ATOM 0 HA LYS A 97 3.980 -2.976 27.009 1.00 0.00 H new ATOM 0 HB2 LYS A 97 5.040 -4.586 28.748 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.535 -3.706 28.494 1.00 0.00 H new ATOM 0 HG2 LYS A 97 5.548 -2.534 30.307 1.00 0.00 H new ATOM 0 HG3 LYS A 97 5.105 -1.544 28.930 1.00 0.00 H new ATOM 0 HD2 LYS A 97 2.872 -2.492 28.839 1.00 0.00 H new ATOM 0 HD3 LYS A 97 3.300 -3.793 29.933 1.00 0.00 H new ATOM 0 HE2 LYS A 97 3.650 -2.160 31.783 1.00 0.00 H new ATOM 0 HE3 LYS A 97 3.315 -0.826 30.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 1.348 -1.434 31.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 1.086 -1.730 30.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 1.410 -3.022 31.371 1.00 0.00 H new ATOM 1511 N ILE A 98 5.345 -0.986 26.412 1.00 0.00 N ATOM 1512 CA ILE A 98 6.084 0.151 25.886 1.00 0.00 C ATOM 1513 C ILE A 98 6.505 1.096 27.002 1.00 0.00 C ATOM 1514 O ILE A 98 5.715 1.416 27.890 1.00 0.00 O ATOM 1515 CB ILE A 98 5.234 0.924 24.887 1.00 0.00 C ATOM 1516 CG1 ILE A 98 4.524 -0.055 23.947 1.00 0.00 C ATOM 1517 CG2 ILE A 98 6.143 1.852 24.082 1.00 0.00 C ATOM 1518 CD1 ILE A 98 3.058 -0.180 24.362 1.00 0.00 C ATOM 0 H ILE A 98 4.403 -0.770 26.739 1.00 0.00 H new ATOM 0 HA ILE A 98 6.973 -0.240 25.392 1.00 0.00 H new ATOM 0 HB ILE A 98 4.483 1.512 25.415 1.00 0.00 H new ATOM 0 HG12 ILE A 98 4.594 0.296 22.917 1.00 0.00 H new ATOM 0 HG13 ILE A 98 5.009 -1.030 23.985 1.00 0.00 H new ATOM 0 HG21 ILE A 98 5.546 2.412 23.362 1.00 0.00 H new ATOM 0 HG22 ILE A 98 6.643 2.547 24.757 1.00 0.00 H new ATOM 0 HG23 ILE A 98 6.889 1.260 23.552 1.00 0.00 H new ATOM 0 HD11 ILE A 98 2.549 -0.876 23.695 1.00 0.00 H new ATOM 0 HD12 ILE A 98 3.000 -0.550 25.386 1.00 0.00 H new ATOM 0 HD13 ILE A 98 2.578 0.797 24.301 1.00 0.00 H new ATOM 1530 N TRP A 99 7.757 1.538 26.953 1.00 0.00 N ATOM 1531 CA TRP A 99 8.260 2.448 27.968 1.00 0.00 C ATOM 1532 C TRP A 99 9.509 3.184 27.483 1.00 0.00 C ATOM 1533 O TRP A 99 9.956 2.993 26.353 1.00 0.00 O ATOM 1534 CB TRP A 99 8.577 1.671 29.236 1.00 0.00 C ATOM 1535 CG TRP A 99 9.803 0.857 29.019 1.00 0.00 C ATOM 1536 CD1 TRP A 99 11.065 1.324 29.110 1.00 0.00 C ATOM 1537 CD2 TRP A 99 9.907 -0.552 28.671 1.00 0.00 C ATOM 1538 NE1 TRP A 99 11.943 0.288 28.863 1.00 0.00 N ATOM 1539 CE2 TRP A 99 11.277 -0.892 28.586 1.00 0.00 C ATOM 1540 CE3 TRP A 99 8.954 -1.558 28.432 1.00 0.00 C ATOM 1541 CZ2 TRP A 99 11.689 -2.188 28.276 1.00 0.00 C ATOM 1542 CZ3 TRP A 99 9.366 -2.863 28.117 1.00 0.00 C ATOM 1543 CH2 TRP A 99 10.729 -3.178 28.042 1.00 0.00 C ATOM 0 H TRP A 99 8.432 1.284 26.231 1.00 0.00 H new ATOM 0 HA TRP A 99 7.490 3.191 28.174 1.00 0.00 H new ATOM 0 HB2 TRP A 99 8.725 2.357 30.070 1.00 0.00 H new ATOM 0 HB3 TRP A 99 7.739 1.025 29.500 1.00 0.00 H new ATOM 0 HD1 TRP A 99 11.343 2.342 29.339 1.00 0.00 H new ATOM 0 HE1 TRP A 99 12.959 0.381 28.882 1.00 0.00 H new ATOM 0 HE3 TRP A 99 7.901 -1.326 28.491 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 12.741 -2.425 28.217 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 8.627 -3.629 27.931 1.00 0.00 H new ATOM 0 HH2 TRP A 99 11.038 -4.185 27.804 1.00 0.00 H new ATOM 1554 N ILE A 100 10.068 4.029 28.347 1.00 0.00 N ATOM 1555 CA ILE A 100 11.264 4.790 27.993 1.00 0.00 C ATOM 1556 C ILE A 100 12.357 4.573 29.034 1.00 0.00 C ATOM 1557 O ILE A 100 12.104 4.641 30.236 1.00 0.00 O ATOM 1558 CB ILE A 100 10.937 6.279 27.899 1.00 0.00 C ATOM 1559 CG1 ILE A 100 9.528 6.454 27.341 1.00 0.00 C ATOM 1560 CG2 ILE A 100 11.923 6.957 26.952 1.00 0.00 C ATOM 1561 CD1 ILE A 100 8.507 6.168 28.442 1.00 0.00 C ATOM 0 H ILE A 100 9.716 4.203 29.288 1.00 0.00 H new ATOM 0 HA ILE A 100 11.619 4.440 27.024 1.00 0.00 H new ATOM 0 HB ILE A 100 11.005 6.725 28.891 1.00 0.00 H new ATOM 0 HG12 ILE A 100 9.398 7.468 26.964 1.00 0.00 H new ATOM 0 HG13 ILE A 100 9.371 5.778 26.500 1.00 0.00 H new ATOM 0 HG21 ILE A 100 11.690 8.020 26.884 1.00 0.00 H new ATOM 0 HG22 ILE A 100 12.937 6.831 27.331 1.00 0.00 H new ATOM 0 HG23 ILE A 100 11.847 6.505 25.963 1.00 0.00 H new ATOM 0 HD11 ILE A 100 7.499 6.293 28.045 1.00 0.00 H new ATOM 0 HD12 ILE A 100 8.633 5.146 28.798 1.00 0.00 H new ATOM 0 HD13 ILE A 100 8.660 6.862 29.269 1.00 0.00 H new ATOM 1573 N THR A 101 13.571 4.299 28.569 1.00 0.00 N ATOM 1574 CA THR A 101 14.684 4.062 29.481 1.00 0.00 C ATOM 1575 C THR A 101 15.940 4.792 29.009 1.00 0.00 C ATOM 1576 O THR A 101 15.950 5.407 27.944 1.00 0.00 O ATOM 1577 CB THR A 101 14.966 2.563 29.574 1.00 0.00 C ATOM 1578 OG1 THR A 101 15.566 2.272 30.828 1.00 0.00 O ATOM 1579 CG2 THR A 101 15.912 2.163 28.447 1.00 0.00 C ATOM 0 H THR A 101 13.808 4.236 27.579 1.00 0.00 H new ATOM 0 HA THR A 101 14.410 4.445 30.464 1.00 0.00 H new ATOM 0 HB THR A 101 14.034 2.005 29.484 1.00 0.00 H new ATOM 0 HG1 THR A 101 16.038 1.415 30.774 1.00 0.00 H new ATOM 0 HG21 THR A 101 16.118 1.094 28.507 1.00 0.00 H new ATOM 0 HG22 THR A 101 15.450 2.390 27.486 1.00 0.00 H new ATOM 0 HG23 THR A 101 16.845 2.718 28.541 1.00 0.00 H new ATOM 1587 N HIS A 102 17.000 4.723 29.811 1.00 0.00 N ATOM 1588 CA HIS A 102 18.256 5.383 29.464 1.00 0.00 C ATOM 1589 C HIS A 102 19.007 4.596 28.393 1.00 0.00 C ATOM 1590 O HIS A 102 18.879 3.377 28.300 1.00 0.00 O ATOM 1591 CB HIS A 102 19.140 5.525 30.705 1.00 0.00 C ATOM 1592 CG HIS A 102 18.598 6.614 31.588 1.00 0.00 C ATOM 1593 ND1 HIS A 102 17.638 6.374 32.558 1.00 0.00 N ATOM 1594 CD2 HIS A 102 18.872 7.957 31.656 1.00 0.00 C ATOM 1595 CE1 HIS A 102 17.372 7.545 33.165 1.00 0.00 C ATOM 1596 NE2 HIS A 102 18.098 8.544 32.653 1.00 0.00 N ATOM 0 H HIS A 102 17.015 4.221 30.699 1.00 0.00 H new ATOM 0 HA HIS A 102 18.019 6.372 29.072 1.00 0.00 H new ATOM 0 HB2 HIS A 102 19.172 4.582 31.251 1.00 0.00 H new ATOM 0 HB3 HIS A 102 20.163 5.757 30.410 1.00 0.00 H new ATOM 0 HD2 HIS A 102 19.581 8.479 31.031 1.00 0.00 H new ATOM 0 HE1 HIS A 102 16.659 7.663 33.968 1.00 0.00 H new ATOM 0 HE2 HIS A 102 18.087 9.525 32.933 1.00 0.00 H new ATOM 1604 N ALA A 103 19.790 5.305 27.588 1.00 0.00 N ATOM 1605 CA ALA A 103 20.558 4.667 26.525 1.00 0.00 C ATOM 1606 C ALA A 103 21.624 3.742 27.107 1.00 0.00 C ATOM 1607 O ALA A 103 22.148 2.870 26.414 1.00 0.00 O ATOM 1608 CB ALA A 103 21.211 5.737 25.647 1.00 0.00 C ATOM 0 H ALA A 103 19.910 6.316 27.650 1.00 0.00 H new ATOM 0 HA ALA A 103 19.881 4.066 25.918 1.00 0.00 H new ATOM 0 HB1 ALA A 103 21.784 5.257 24.854 1.00 0.00 H new ATOM 0 HB2 ALA A 103 20.439 6.367 25.206 1.00 0.00 H new ATOM 0 HB3 ALA A 103 21.876 6.350 26.255 1.00 0.00 H new ATOM 1614 N ASP A 104 21.944 3.941 28.383 1.00 0.00 N ATOM 1615 CA ASP A 104 22.954 3.122 29.050 1.00 0.00 C ATOM 1616 C ASP A 104 22.309 1.947 29.788 1.00 0.00 C ATOM 1617 O ASP A 104 22.926 1.335 30.662 1.00 0.00 O ATOM 1618 CB ASP A 104 23.748 3.978 30.041 1.00 0.00 C ATOM 1619 CG ASP A 104 24.846 3.141 30.688 1.00 0.00 C ATOM 1620 OD1 ASP A 104 25.681 2.632 29.961 1.00 0.00 O ATOM 1621 OD2 ASP A 104 24.834 3.022 31.903 1.00 0.00 O ATOM 0 H ASP A 104 21.522 4.658 28.973 1.00 0.00 H new ATOM 0 HA ASP A 104 23.626 2.725 28.289 1.00 0.00 H new ATOM 0 HB2 ASP A 104 24.186 4.833 29.526 1.00 0.00 H new ATOM 0 HB3 ASP A 104 23.082 4.374 30.807 1.00 0.00 H new ATOM 1626 N ASP A 105 21.063 1.643 29.434 1.00 0.00 N ATOM 1627 CA ASP A 105 20.336 0.547 30.068 1.00 0.00 C ATOM 1628 C ASP A 105 20.528 -0.752 29.292 1.00 0.00 C ATOM 1629 O ASP A 105 19.871 -0.982 28.278 1.00 0.00 O ATOM 1630 CB ASP A 105 18.848 0.893 30.125 1.00 0.00 C ATOM 1631 CG ASP A 105 18.056 -0.289 30.664 1.00 0.00 C ATOM 1632 OD1 ASP A 105 18.529 -1.402 30.521 1.00 0.00 O ATOM 1633 OD2 ASP A 105 16.993 -0.063 31.218 1.00 0.00 O ATOM 0 H ASP A 105 20.537 2.138 28.714 1.00 0.00 H new ATOM 0 HA ASP A 105 20.725 0.407 31.077 1.00 0.00 H new ATOM 0 HB2 ASP A 105 18.694 1.764 30.761 1.00 0.00 H new ATOM 0 HB3 ASP A 105 18.490 1.157 29.130 1.00 0.00 H new ATOM 1638 N ARG A 106 21.420 -1.602 29.788 1.00 0.00 N ATOM 1639 CA ARG A 106 21.682 -2.886 29.147 1.00 0.00 C ATOM 1640 C ARG A 106 20.477 -3.810 29.302 1.00 0.00 C ATOM 1641 O ARG A 106 20.193 -4.634 28.430 1.00 0.00 O ATOM 1642 CB ARG A 106 22.914 -3.544 29.767 1.00 0.00 C ATOM 1643 CG ARG A 106 22.885 -3.363 31.286 1.00 0.00 C ATOM 1644 CD ARG A 106 23.454 -4.618 31.951 1.00 0.00 C ATOM 1645 NE ARG A 106 24.799 -4.889 31.454 1.00 0.00 N ATOM 1646 CZ ARG A 106 25.873 -4.420 32.079 1.00 0.00 C ATOM 1647 NH1 ARG A 106 25.740 -3.708 33.164 1.00 0.00 N ATOM 1648 NH2 ARG A 106 27.064 -4.675 31.608 1.00 0.00 N ATOM 0 H ARG A 106 21.972 -1.427 30.628 1.00 0.00 H new ATOM 0 HA ARG A 106 21.864 -2.712 28.087 1.00 0.00 H new ATOM 0 HB2 ARG A 106 22.936 -4.605 29.518 1.00 0.00 H new ATOM 0 HB3 ARG A 106 23.821 -3.101 29.355 1.00 0.00 H new ATOM 0 HG2 ARG A 106 23.469 -2.488 31.572 1.00 0.00 H new ATOM 0 HG3 ARG A 106 21.864 -3.188 31.624 1.00 0.00 H new ATOM 0 HD2 ARG A 106 23.479 -4.485 33.033 1.00 0.00 H new ATOM 0 HD3 ARG A 106 22.806 -5.471 31.749 1.00 0.00 H new ATOM 0 HE ARG A 106 24.917 -5.450 30.610 1.00 0.00 H new ATOM 0 HH11 ARG A 106 24.810 -3.511 33.534 1.00 0.00 H new ATOM 0 HH12 ARG A 106 26.566 -3.349 33.643 1.00 0.00 H new ATOM 0 HH21 ARG A 106 27.169 -5.234 30.761 1.00 0.00 H new ATOM 0 HH22 ARG A 106 27.890 -4.315 32.087 1.00 0.00 H new ATOM 1662 N THR A 107 19.777 -3.664 30.425 1.00 0.00 N ATOM 1663 CA THR A 107 18.601 -4.480 30.703 1.00 0.00 C ATOM 1664 C THR A 107 17.803 -4.713 29.425 1.00 0.00 C ATOM 1665 O THR A 107 16.999 -5.642 29.342 1.00 0.00 O ATOM 1666 CB THR A 107 17.714 -3.775 31.733 1.00 0.00 C ATOM 1667 OG1 THR A 107 16.945 -2.770 31.092 1.00 0.00 O ATOM 1668 CG2 THR A 107 18.595 -3.141 32.816 1.00 0.00 C ATOM 0 H THR A 107 20.005 -2.989 31.155 1.00 0.00 H new ATOM 0 HA THR A 107 18.929 -5.441 31.098 1.00 0.00 H new ATOM 0 HB THR A 107 17.043 -4.501 32.192 1.00 0.00 H new ATOM 0 HG1 THR A 107 17.476 -2.356 30.380 1.00 0.00 H new ATOM 0 HG21 THR A 107 17.965 -2.639 33.550 1.00 0.00 H new ATOM 0 HG22 THR A 107 19.179 -3.917 33.310 1.00 0.00 H new ATOM 0 HG23 THR A 107 19.268 -2.416 32.359 1.00 0.00 H new ATOM 1676 N VAL A 108 18.026 -3.854 28.435 1.00 0.00 N ATOM 1677 CA VAL A 108 17.319 -3.959 27.164 1.00 0.00 C ATOM 1678 C VAL A 108 18.232 -4.515 26.074 1.00 0.00 C ATOM 1679 O VAL A 108 17.759 -5.008 25.051 1.00 0.00 O ATOM 1680 CB VAL A 108 16.799 -2.582 26.757 1.00 0.00 C ATOM 1681 CG1 VAL A 108 15.866 -2.725 25.553 1.00 0.00 C ATOM 1682 CG2 VAL A 108 16.034 -1.965 27.933 1.00 0.00 C ATOM 0 H VAL A 108 18.688 -3.080 28.488 1.00 0.00 H new ATOM 0 HA VAL A 108 16.482 -4.646 27.287 1.00 0.00 H new ATOM 0 HB VAL A 108 17.636 -1.937 26.488 1.00 0.00 H new ATOM 0 HG11 VAL A 108 15.494 -1.743 25.262 1.00 0.00 H new ATOM 0 HG12 VAL A 108 16.412 -3.168 24.720 1.00 0.00 H new ATOM 0 HG13 VAL A 108 15.026 -3.367 25.818 1.00 0.00 H new ATOM 0 HG21 VAL A 108 15.660 -0.981 27.648 1.00 0.00 H new ATOM 0 HG22 VAL A 108 15.196 -2.609 28.199 1.00 0.00 H new ATOM 0 HG23 VAL A 108 16.701 -1.866 28.789 1.00 0.00 H new ATOM 1692 N ILE A 109 19.539 -4.433 26.300 1.00 0.00 N ATOM 1693 CA ILE A 109 20.507 -4.935 25.335 1.00 0.00 C ATOM 1694 C ILE A 109 21.260 -6.138 25.898 1.00 0.00 C ATOM 1695 O ILE A 109 22.402 -6.394 25.527 1.00 0.00 O ATOM 1696 CB ILE A 109 21.497 -3.835 24.971 1.00 0.00 C ATOM 1697 CG1 ILE A 109 20.715 -2.601 24.509 1.00 0.00 C ATOM 1698 CG2 ILE A 109 22.417 -4.325 23.849 1.00 0.00 C ATOM 1699 CD1 ILE A 109 19.823 -2.967 23.318 1.00 0.00 C ATOM 0 H ILE A 109 19.950 -4.025 27.140 1.00 0.00 H new ATOM 0 HA ILE A 109 19.968 -5.249 24.441 1.00 0.00 H new ATOM 0 HB ILE A 109 22.106 -3.577 25.837 1.00 0.00 H new ATOM 0 HG12 ILE A 109 20.105 -2.218 25.327 1.00 0.00 H new ATOM 0 HG13 ILE A 109 21.406 -1.806 24.227 1.00 0.00 H new ATOM 0 HG21 ILE A 109 23.125 -3.538 23.589 1.00 0.00 H new ATOM 0 HG22 ILE A 109 22.962 -5.207 24.185 1.00 0.00 H new ATOM 0 HG23 ILE A 109 21.820 -4.579 22.974 1.00 0.00 H new ATOM 0 HD11 ILE A 109 19.269 -2.086 22.994 1.00 0.00 H new ATOM 0 HD12 ILE A 109 20.442 -3.329 22.497 1.00 0.00 H new ATOM 0 HD13 ILE A 109 19.122 -3.747 23.615 1.00 0.00 H new ATOM 1711 N ILE A 110 20.612 -6.867 26.802 1.00 0.00 N ATOM 1712 CA ILE A 110 21.226 -8.045 27.412 1.00 0.00 C ATOM 1713 C ILE A 110 20.898 -9.303 26.616 1.00 0.00 C ATOM 1714 O ILE A 110 20.385 -9.228 25.500 1.00 0.00 O ATOM 1715 CB ILE A 110 20.736 -8.218 28.851 1.00 0.00 C ATOM 1716 CG1 ILE A 110 19.286 -8.703 28.870 1.00 0.00 C ATOM 1717 CG2 ILE A 110 20.818 -6.889 29.580 1.00 0.00 C ATOM 1718 CD1 ILE A 110 18.418 -7.729 28.082 1.00 0.00 C ATOM 0 H ILE A 110 19.667 -6.665 27.128 1.00 0.00 H new ATOM 0 HA ILE A 110 22.306 -7.895 27.411 1.00 0.00 H new ATOM 0 HB ILE A 110 21.368 -8.957 29.344 1.00 0.00 H new ATOM 0 HG12 ILE A 110 19.219 -9.701 28.436 1.00 0.00 H new ATOM 0 HG13 ILE A 110 18.929 -8.777 29.897 1.00 0.00 H new ATOM 0 HG21 ILE A 110 20.469 -7.014 30.605 1.00 0.00 H new ATOM 0 HG22 ILE A 110 21.851 -6.542 29.589 1.00 0.00 H new ATOM 0 HG23 ILE A 110 20.193 -6.155 29.071 1.00 0.00 H new ATOM 0 HD11 ILE A 110 17.383 -8.072 28.094 1.00 0.00 H new ATOM 0 HD12 ILE A 110 18.477 -6.740 28.536 1.00 0.00 H new ATOM 0 HD13 ILE A 110 18.772 -7.678 27.052 1.00 0.00 H new ATOM 1730 N LYS A 111 21.206 -10.460 27.197 1.00 0.00 N ATOM 1731 CA LYS A 111 20.948 -11.734 26.533 1.00 0.00 C ATOM 1732 C LYS A 111 19.629 -12.339 27.017 1.00 0.00 C ATOM 1733 O LYS A 111 19.246 -12.163 28.174 1.00 0.00 O ATOM 1734 CB LYS A 111 22.084 -12.719 26.824 1.00 0.00 C ATOM 1735 CG LYS A 111 22.044 -13.851 25.799 1.00 0.00 C ATOM 1736 CD LYS A 111 22.931 -15.003 26.274 1.00 0.00 C ATOM 1737 CE LYS A 111 24.389 -14.543 26.322 1.00 0.00 C ATOM 1738 NZ LYS A 111 25.271 -15.716 26.571 1.00 0.00 N ATOM 0 H LYS A 111 21.632 -10.541 28.120 1.00 0.00 H new ATOM 0 HA LYS A 111 20.885 -11.549 25.461 1.00 0.00 H new ATOM 0 HB2 LYS A 111 23.045 -12.207 26.780 1.00 0.00 H new ATOM 0 HB3 LYS A 111 21.983 -13.122 27.832 1.00 0.00 H new ATOM 0 HG2 LYS A 111 21.020 -14.198 25.665 1.00 0.00 H new ATOM 0 HG3 LYS A 111 22.387 -13.490 24.829 1.00 0.00 H new ATOM 0 HD2 LYS A 111 22.612 -15.337 27.261 1.00 0.00 H new ATOM 0 HD3 LYS A 111 22.830 -15.854 25.601 1.00 0.00 H new ATOM 0 HE2 LYS A 111 24.661 -14.063 25.382 1.00 0.00 H new ATOM 0 HE3 LYS A 111 24.522 -13.801 27.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 26.263 -15.404 26.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 25.016 -16.156 27.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 25.151 -16.409 25.805 1.00 0.00 H new ATOM 1752 N LYS A 112 18.946 -13.062 26.128 1.00 0.00 N ATOM 1753 CA LYS A 112 17.678 -13.700 26.483 1.00 0.00 C ATOM 1754 C LYS A 112 17.678 -15.162 26.061 1.00 0.00 C ATOM 1755 O LYS A 112 18.398 -15.554 25.143 1.00 0.00 O ATOM 1756 CB LYS A 112 16.507 -12.994 25.810 1.00 0.00 C ATOM 1757 CG LYS A 112 16.389 -11.591 26.380 1.00 0.00 C ATOM 1758 CD LYS A 112 15.220 -10.862 25.727 1.00 0.00 C ATOM 1759 CE LYS A 112 15.117 -9.461 26.323 1.00 0.00 C ATOM 1760 NZ LYS A 112 13.969 -8.743 25.706 1.00 0.00 N ATOM 0 H LYS A 112 19.246 -13.219 25.166 1.00 0.00 H new ATOM 0 HA LYS A 112 17.567 -13.631 27.565 1.00 0.00 H new ATOM 0 HB2 LYS A 112 16.661 -12.952 24.732 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.584 -13.549 25.979 1.00 0.00 H new ATOM 0 HG2 LYS A 112 16.242 -11.639 27.459 1.00 0.00 H new ATOM 0 HG3 LYS A 112 17.314 -11.040 26.208 1.00 0.00 H new ATOM 0 HD2 LYS A 112 15.367 -10.803 24.649 1.00 0.00 H new ATOM 0 HD3 LYS A 112 14.293 -11.411 25.893 1.00 0.00 H new ATOM 0 HE2 LYS A 112 14.983 -9.523 27.403 1.00 0.00 H new ATOM 0 HE3 LYS A 112 16.041 -8.910 26.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.054 -7.724 25.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.970 -8.904 24.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.079 -9.098 26.111 1.00 0.00 H new ATOM 1774 N GLU A 113 16.861 -15.964 26.731 1.00 0.00 N ATOM 1775 CA GLU A 113 16.774 -17.379 26.405 1.00 0.00 C ATOM 1776 C GLU A 113 15.518 -17.658 25.591 1.00 0.00 C ATOM 1777 O GLU A 113 15.118 -18.812 25.425 1.00 0.00 O ATOM 1778 CB GLU A 113 16.764 -18.216 27.679 1.00 0.00 C ATOM 1779 CG GLU A 113 18.100 -18.032 28.397 1.00 0.00 C ATOM 1780 CD GLU A 113 19.241 -18.524 27.513 1.00 0.00 C ATOM 1781 OE1 GLU A 113 18.973 -19.296 26.607 1.00 0.00 O ATOM 1782 OE2 GLU A 113 20.368 -18.123 27.757 1.00 0.00 O ATOM 0 H GLU A 113 16.256 -15.663 27.495 1.00 0.00 H new ATOM 0 HA GLU A 113 17.647 -17.651 25.811 1.00 0.00 H new ATOM 0 HB2 GLU A 113 15.942 -17.909 28.326 1.00 0.00 H new ATOM 0 HB3 GLU A 113 16.606 -19.267 27.439 1.00 0.00 H new ATOM 0 HG2 GLU A 113 18.248 -16.981 28.643 1.00 0.00 H new ATOM 0 HG3 GLU A 113 18.095 -18.582 29.338 1.00 0.00 H new ATOM 1789 N GLU A 114 14.892 -16.595 25.090 1.00 0.00 N ATOM 1790 CA GLU A 114 13.674 -16.751 24.300 1.00 0.00 C ATOM 1791 C GLU A 114 13.619 -15.722 23.170 1.00 0.00 C ATOM 1792 O GLU A 114 14.414 -14.782 23.130 1.00 0.00 O ATOM 1793 CB GLU A 114 12.449 -16.590 25.202 1.00 0.00 C ATOM 1794 CG GLU A 114 12.905 -16.260 26.625 1.00 0.00 C ATOM 1795 CD GLU A 114 11.698 -16.158 27.552 1.00 0.00 C ATOM 1796 OE1 GLU A 114 10.956 -15.199 27.423 1.00 0.00 O ATOM 1797 OE2 GLU A 114 11.537 -17.040 28.380 1.00 0.00 O ATOM 0 H GLU A 114 15.202 -15.631 25.214 1.00 0.00 H new ATOM 0 HA GLU A 114 13.677 -17.748 23.859 1.00 0.00 H new ATOM 0 HB2 GLU A 114 11.805 -15.797 24.822 1.00 0.00 H new ATOM 0 HB3 GLU A 114 11.860 -17.507 25.201 1.00 0.00 H new ATOM 0 HG2 GLU A 114 13.586 -17.031 26.985 1.00 0.00 H new ATOM 0 HG3 GLU A 114 13.457 -15.320 26.629 1.00 0.00 H new ATOM 1804 N PRO A 115 12.693 -15.889 22.259 1.00 0.00 N ATOM 1805 CA PRO A 115 12.510 -14.969 21.100 1.00 0.00 C ATOM 1806 C PRO A 115 11.759 -13.704 21.477 1.00 0.00 C ATOM 1807 O PRO A 115 10.521 -13.668 21.493 1.00 0.00 O ATOM 1808 CB PRO A 115 11.697 -15.781 20.106 1.00 0.00 C ATOM 1809 CG PRO A 115 10.963 -16.792 20.922 1.00 0.00 C ATOM 1810 CD PRO A 115 11.718 -16.982 22.239 1.00 0.00 C ATOM 0 HA PRO A 115 13.469 -14.632 20.707 1.00 0.00 H new ATOM 0 HB2 PRO A 115 11.005 -15.146 19.553 1.00 0.00 H new ATOM 0 HB3 PRO A 115 12.343 -16.263 19.372 1.00 0.00 H new ATOM 0 HG2 PRO A 115 9.943 -16.458 21.113 1.00 0.00 H new ATOM 0 HG3 PRO A 115 10.894 -17.737 20.384 1.00 0.00 H new ATOM 0 HD2 PRO A 115 11.045 -16.930 23.095 1.00 0.00 H new ATOM 0 HD3 PRO A 115 12.209 -17.954 22.279 1.00 0.00 H new ATOM 1818 N ILE A 116 12.525 -12.674 21.769 1.00 0.00 N ATOM 1819 CA ILE A 116 11.967 -11.387 22.144 1.00 0.00 C ATOM 1820 C ILE A 116 12.530 -10.283 21.262 1.00 0.00 C ATOM 1821 O ILE A 116 13.746 -10.151 21.120 1.00 0.00 O ATOM 1822 CB ILE A 116 12.303 -11.092 23.599 1.00 0.00 C ATOM 1823 CG1 ILE A 116 11.727 -12.203 24.474 1.00 0.00 C ATOM 1824 CG2 ILE A 116 11.700 -9.746 24.008 1.00 0.00 C ATOM 1825 CD1 ILE A 116 10.205 -12.261 24.298 1.00 0.00 C ATOM 0 H ILE A 116 13.545 -12.702 21.754 1.00 0.00 H new ATOM 0 HA ILE A 116 10.885 -11.424 22.013 1.00 0.00 H new ATOM 0 HB ILE A 116 13.385 -11.046 23.725 1.00 0.00 H new ATOM 0 HG12 ILE A 116 12.171 -13.161 24.202 1.00 0.00 H new ATOM 0 HG13 ILE A 116 11.975 -12.022 25.520 1.00 0.00 H new ATOM 0 HG21 ILE A 116 11.944 -9.540 25.050 1.00 0.00 H new ATOM 0 HG22 ILE A 116 12.109 -8.957 23.377 1.00 0.00 H new ATOM 0 HG23 ILE A 116 10.617 -9.781 23.889 1.00 0.00 H new ATOM 0 HD11 ILE A 116 9.796 -13.055 24.923 1.00 0.00 H new ATOM 0 HD12 ILE A 116 9.768 -11.306 24.591 1.00 0.00 H new ATOM 0 HD13 ILE A 116 9.967 -12.463 23.254 1.00 0.00 H new ATOM 1837 N LEU A 117 11.639 -9.487 20.687 1.00 0.00 N ATOM 1838 CA LEU A 117 12.053 -8.383 19.833 1.00 0.00 C ATOM 1839 C LEU A 117 11.895 -7.070 20.574 1.00 0.00 C ATOM 1840 O LEU A 117 10.799 -6.716 21.009 1.00 0.00 O ATOM 1841 CB LEU A 117 11.220 -8.367 18.546 1.00 0.00 C ATOM 1842 CG LEU A 117 11.519 -7.100 17.726 1.00 0.00 C ATOM 1843 CD1 LEU A 117 11.080 -7.330 16.279 1.00 0.00 C ATOM 1844 CD2 LEU A 117 10.753 -5.902 18.307 1.00 0.00 C ATOM 0 H LEU A 117 10.629 -9.584 20.796 1.00 0.00 H new ATOM 0 HA LEU A 117 13.102 -8.516 19.567 1.00 0.00 H new ATOM 0 HB2 LEU A 117 11.442 -9.253 17.951 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.159 -8.406 18.792 1.00 0.00 H new ATOM 0 HG LEU A 117 12.588 -6.888 17.764 1.00 0.00 H new ATOM 0 HD11 LEU A 117 11.288 -6.437 15.689 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.628 -8.175 15.863 1.00 0.00 H new ATOM 0 HD13 LEU A 117 10.011 -7.542 16.252 1.00 0.00 H new ATOM 0 HD21 LEU A 117 10.972 -5.011 17.719 1.00 0.00 H new ATOM 0 HD22 LEU A 117 9.682 -6.104 18.275 1.00 0.00 H new ATOM 0 HD23 LEU A 117 11.060 -5.740 19.340 1.00 0.00 H new ATOM 1856 N THR A 118 13.002 -6.354 20.716 1.00 0.00 N ATOM 1857 CA THR A 118 12.987 -5.075 21.413 1.00 0.00 C ATOM 1858 C THR A 118 13.341 -3.946 20.455 1.00 0.00 C ATOM 1859 O THR A 118 14.363 -3.993 19.782 1.00 0.00 O ATOM 1860 CB THR A 118 13.987 -5.091 22.569 1.00 0.00 C ATOM 1861 OG1 THR A 118 13.666 -6.154 23.456 1.00 0.00 O ATOM 1862 CG2 THR A 118 13.917 -3.760 23.320 1.00 0.00 C ATOM 0 H THR A 118 13.916 -6.634 20.361 1.00 0.00 H new ATOM 0 HA THR A 118 11.984 -4.911 21.806 1.00 0.00 H new ATOM 0 HB THR A 118 14.994 -5.235 22.179 1.00 0.00 H new ATOM 0 HG1 THR A 118 14.464 -6.702 23.613 1.00 0.00 H new ATOM 0 HG21 THR A 118 14.630 -3.770 24.145 1.00 0.00 H new ATOM 0 HG22 THR A 118 14.161 -2.945 22.639 1.00 0.00 H new ATOM 0 HG23 THR A 118 12.910 -3.616 23.712 1.00 0.00 H new ATOM 1870 N LEU A 119 12.489 -2.936 20.396 1.00 0.00 N ATOM 1871 CA LEU A 119 12.724 -1.805 19.510 1.00 0.00 C ATOM 1872 C LEU A 119 13.023 -0.536 20.288 1.00 0.00 C ATOM 1873 O LEU A 119 12.266 -0.140 21.167 1.00 0.00 O ATOM 1874 CB LEU A 119 11.506 -1.595 18.599 1.00 0.00 C ATOM 1875 CG LEU A 119 11.363 -0.109 18.234 1.00 0.00 C ATOM 1876 CD1 LEU A 119 12.628 0.373 17.520 1.00 0.00 C ATOM 1877 CD2 LEU A 119 10.149 0.073 17.321 1.00 0.00 C ATOM 0 H LEU A 119 11.633 -2.875 20.947 1.00 0.00 H new ATOM 0 HA LEU A 119 13.599 -2.031 18.901 1.00 0.00 H new ATOM 0 HB2 LEU A 119 11.614 -2.190 17.692 1.00 0.00 H new ATOM 0 HB3 LEU A 119 10.603 -1.942 19.102 1.00 0.00 H new ATOM 0 HG LEU A 119 11.224 0.477 19.142 1.00 0.00 H new ATOM 0 HD11 LEU A 119 12.522 1.427 17.263 1.00 0.00 H new ATOM 0 HD12 LEU A 119 13.488 0.245 18.177 1.00 0.00 H new ATOM 0 HD13 LEU A 119 12.776 -0.209 16.610 1.00 0.00 H new ATOM 0 HD21 LEU A 119 10.045 1.126 17.060 1.00 0.00 H new ATOM 0 HD22 LEU A 119 10.286 -0.514 16.413 1.00 0.00 H new ATOM 0 HD23 LEU A 119 9.251 -0.263 17.839 1.00 0.00 H new ATOM 1889 N THR A 120 14.126 0.105 19.933 1.00 0.00 N ATOM 1890 CA THR A 120 14.513 1.342 20.581 1.00 0.00 C ATOM 1891 C THR A 120 14.645 2.472 19.568 1.00 0.00 C ATOM 1892 O THR A 120 15.316 2.329 18.545 1.00 0.00 O ATOM 1893 CB THR A 120 15.830 1.163 21.326 1.00 0.00 C ATOM 1894 OG1 THR A 120 16.873 1.807 20.607 1.00 0.00 O ATOM 1895 CG2 THR A 120 16.145 -0.325 21.473 1.00 0.00 C ATOM 0 H THR A 120 14.764 -0.211 19.203 1.00 0.00 H new ATOM 0 HA THR A 120 13.731 1.604 21.294 1.00 0.00 H new ATOM 0 HB THR A 120 15.746 1.608 22.318 1.00 0.00 H new ATOM 0 HG1 THR A 120 17.738 1.561 20.996 1.00 0.00 H new ATOM 0 HG21 THR A 120 17.088 -0.446 22.006 1.00 0.00 H new ATOM 0 HG22 THR A 120 15.346 -0.812 22.032 1.00 0.00 H new ATOM 0 HG23 THR A 120 16.226 -0.779 20.485 1.00 0.00 H new ATOM 1903 N THR A 121 13.995 3.594 19.857 1.00 0.00 N ATOM 1904 CA THR A 121 14.043 4.739 18.959 1.00 0.00 C ATOM 1905 C THR A 121 14.278 6.025 19.706 1.00 0.00 C ATOM 1906 O THR A 121 14.114 6.095 20.923 1.00 0.00 O ATOM 1907 CB THR A 121 12.738 4.859 18.196 1.00 0.00 C ATOM 1908 OG1 THR A 121 11.670 5.101 19.102 1.00 0.00 O ATOM 1909 CG2 THR A 121 12.516 3.558 17.465 1.00 0.00 C ATOM 0 H THR A 121 13.434 3.734 20.698 1.00 0.00 H new ATOM 0 HA THR A 121 14.873 4.574 18.272 1.00 0.00 H new ATOM 0 HB THR A 121 12.779 5.689 17.490 1.00 0.00 H new ATOM 0 HG1 THR A 121 10.830 5.179 18.604 1.00 0.00 H new ATOM 0 HG21 THR A 121 11.583 3.610 16.904 1.00 0.00 H new ATOM 0 HG22 THR A 121 13.343 3.381 16.777 1.00 0.00 H new ATOM 0 HG23 THR A 121 12.461 2.741 18.185 1.00 0.00 H new ATOM 2078 N ASP A 133 16.473 10.301 27.213 1.00 0.00 N ATOM 2079 CA ASP A 133 15.911 8.960 27.343 1.00 0.00 C ATOM 2080 C ASP A 133 15.648 8.354 25.968 1.00 0.00 C ATOM 2081 O ASP A 133 15.504 9.072 24.978 1.00 0.00 O ATOM 2082 CB ASP A 133 14.607 9.016 28.141 1.00 0.00 C ATOM 2083 CG ASP A 133 14.908 9.254 29.617 1.00 0.00 C ATOM 2084 OD1 ASP A 133 16.046 9.050 30.009 1.00 0.00 O ATOM 2085 OD2 ASP A 133 14.000 9.639 30.334 1.00 0.00 O ATOM 0 HA ASP A 133 16.630 8.333 27.870 1.00 0.00 H new ATOM 0 HB2 ASP A 133 13.971 9.814 27.758 1.00 0.00 H new ATOM 0 HB3 ASP A 133 14.056 8.083 28.020 1.00 0.00 H new ATOM 2090 N ARG A 134 15.586 7.028 25.910 1.00 0.00 N ATOM 2091 CA ARG A 134 15.339 6.345 24.651 1.00 0.00 C ATOM 2092 C ARG A 134 14.053 5.530 24.735 1.00 0.00 C ATOM 2093 O ARG A 134 13.811 4.833 25.723 1.00 0.00 O ATOM 2094 CB ARG A 134 16.527 5.445 24.302 1.00 0.00 C ATOM 2095 CG ARG A 134 16.279 4.777 22.951 1.00 0.00 C ATOM 2096 CD ARG A 134 17.615 4.336 22.355 1.00 0.00 C ATOM 2097 NE ARG A 134 18.394 5.510 21.977 1.00 0.00 N ATOM 2098 CZ ARG A 134 19.687 5.419 21.694 1.00 0.00 C ATOM 2099 NH1 ARG A 134 20.289 4.264 21.757 1.00 0.00 N ATOM 2100 NH2 ARG A 134 20.354 6.487 21.353 1.00 0.00 N ATOM 0 H ARG A 134 15.703 6.411 26.714 1.00 0.00 H new ATOM 0 HA ARG A 134 15.222 7.088 23.862 1.00 0.00 H new ATOM 0 HB2 ARG A 134 17.444 6.033 24.266 1.00 0.00 H new ATOM 0 HB3 ARG A 134 16.663 4.688 25.075 1.00 0.00 H new ATOM 0 HG2 ARG A 134 15.620 3.917 23.073 1.00 0.00 H new ATOM 0 HG3 ARG A 134 15.777 5.470 22.276 1.00 0.00 H new ATOM 0 HD2 ARG A 134 18.168 3.738 23.079 1.00 0.00 H new ATOM 0 HD3 ARG A 134 17.445 3.704 21.483 1.00 0.00 H new ATOM 0 HE ARG A 134 17.935 6.420 21.929 1.00 0.00 H new ATOM 0 HH11 ARG A 134 19.766 3.430 22.024 1.00 0.00 H new ATOM 0 HH12 ARG A 134 21.283 4.194 21.539 1.00 0.00 H new ATOM 0 HH21 ARG A 134 19.881 7.390 21.304 1.00 0.00 H new ATOM 0 HH22 ARG A 134 21.348 6.419 21.135 1.00 0.00 H new ATOM 2114 N TYR A 135 13.221 5.635 23.704 1.00 0.00 N ATOM 2115 CA TYR A 135 11.950 4.907 23.693 1.00 0.00 C ATOM 2116 C TYR A 135 12.209 3.408 23.571 1.00 0.00 C ATOM 2117 O TYR A 135 13.007 2.986 22.744 1.00 0.00 O ATOM 2118 CB TYR A 135 11.089 5.374 22.518 1.00 0.00 C ATOM 2119 CG TYR A 135 9.636 5.150 22.849 1.00 0.00 C ATOM 2120 CD1 TYR A 135 9.062 5.853 23.911 1.00 0.00 C ATOM 2121 CD2 TYR A 135 8.860 4.253 22.099 1.00 0.00 C ATOM 2122 CE1 TYR A 135 7.716 5.665 24.230 1.00 0.00 C ATOM 2123 CE2 TYR A 135 7.507 4.065 22.419 1.00 0.00 C ATOM 2124 CZ TYR A 135 6.936 4.773 23.486 1.00 0.00 C ATOM 2125 OH TYR A 135 5.607 4.592 23.803 1.00 0.00 O ATOM 0 H TYR A 135 13.396 6.206 22.877 1.00 0.00 H new ATOM 0 HA TYR A 135 11.423 5.107 24.626 1.00 0.00 H new ATOM 0 HB2 TYR A 135 11.270 6.430 22.316 1.00 0.00 H new ATOM 0 HB3 TYR A 135 11.357 4.826 21.615 1.00 0.00 H new ATOM 0 HD1 TYR A 135 9.661 6.543 24.486 1.00 0.00 H new ATOM 0 HD2 TYR A 135 9.303 3.709 21.278 1.00 0.00 H new ATOM 0 HE1 TYR A 135 7.276 6.209 25.053 1.00 0.00 H new ATOM 0 HE2 TYR A 135 6.906 3.376 21.844 1.00 0.00 H new ATOM 0 HH TYR A 135 5.103 5.400 23.572 1.00 0.00 H new ATOM 2135 N ILE A 136 11.546 2.605 24.403 1.00 0.00 N ATOM 2136 CA ILE A 136 11.748 1.158 24.360 1.00 0.00 C ATOM 2137 C ILE A 136 10.451 0.433 24.018 1.00 0.00 C ATOM 2138 O ILE A 136 9.501 0.445 24.801 1.00 0.00 O ATOM 2139 CB ILE A 136 12.234 0.662 25.722 1.00 0.00 C ATOM 2140 CG1 ILE A 136 13.473 1.453 26.160 1.00 0.00 C ATOM 2141 CG2 ILE A 136 12.578 -0.828 25.629 1.00 0.00 C ATOM 2142 CD1 ILE A 136 14.632 1.204 25.189 1.00 0.00 C ATOM 0 H ILE A 136 10.876 2.925 25.103 1.00 0.00 H new ATOM 0 HA ILE A 136 12.490 0.948 23.590 1.00 0.00 H new ATOM 0 HB ILE A 136 11.444 0.808 26.459 1.00 0.00 H new ATOM 0 HG12 ILE A 136 13.240 2.517 26.194 1.00 0.00 H new ATOM 0 HG13 ILE A 136 13.764 1.158 27.168 1.00 0.00 H new ATOM 0 HG21 ILE A 136 12.925 -1.183 26.600 1.00 0.00 H new ATOM 0 HG22 ILE A 136 11.691 -1.388 25.334 1.00 0.00 H new ATOM 0 HG23 ILE A 136 13.363 -0.974 24.888 1.00 0.00 H new ATOM 0 HD11 ILE A 136 15.505 1.771 25.511 1.00 0.00 H new ATOM 0 HD12 ILE A 136 14.874 0.141 25.176 1.00 0.00 H new ATOM 0 HD13 ILE A 136 14.342 1.522 24.187 1.00 0.00 H new ATOM 2154 N ILE A 137 10.427 -0.227 22.867 1.00 0.00 N ATOM 2155 CA ILE A 137 9.249 -0.979 22.464 1.00 0.00 C ATOM 2156 C ILE A 137 9.539 -2.475 22.576 1.00 0.00 C ATOM 2157 O ILE A 137 10.311 -3.032 21.796 1.00 0.00 O ATOM 2158 CB ILE A 137 8.893 -0.621 21.027 1.00 0.00 C ATOM 2159 CG1 ILE A 137 8.114 0.694 21.008 1.00 0.00 C ATOM 2160 CG2 ILE A 137 8.045 -1.732 20.410 1.00 0.00 C ATOM 2161 CD1 ILE A 137 6.633 0.410 21.239 1.00 0.00 C ATOM 0 H ILE A 137 11.201 -0.256 22.204 1.00 0.00 H new ATOM 0 HA ILE A 137 8.410 -0.730 23.114 1.00 0.00 H new ATOM 0 HB ILE A 137 9.808 -0.509 20.446 1.00 0.00 H new ATOM 0 HG12 ILE A 137 8.492 1.364 21.780 1.00 0.00 H new ATOM 0 HG13 ILE A 137 8.254 1.198 20.052 1.00 0.00 H new ATOM 0 HG21 ILE A 137 7.794 -1.470 19.382 1.00 0.00 H new ATOM 0 HG22 ILE A 137 8.607 -2.666 20.419 1.00 0.00 H new ATOM 0 HG23 ILE A 137 7.129 -1.854 20.988 1.00 0.00 H new ATOM 0 HD11 ILE A 137 6.076 1.347 21.226 1.00 0.00 H new ATOM 0 HD12 ILE A 137 6.261 -0.244 20.451 1.00 0.00 H new ATOM 0 HD13 ILE A 137 6.502 -0.076 22.206 1.00 0.00 H new ATOM 2173 N GLU A 138 8.929 -3.115 23.565 1.00 0.00 N ATOM 2174 CA GLU A 138 9.141 -4.538 23.785 1.00 0.00 C ATOM 2175 C GLU A 138 8.113 -5.364 23.034 1.00 0.00 C ATOM 2176 O GLU A 138 6.964 -4.955 22.875 1.00 0.00 O ATOM 2177 CB GLU A 138 9.057 -4.862 25.280 1.00 0.00 C ATOM 2178 CG GLU A 138 9.312 -6.356 25.497 1.00 0.00 C ATOM 2179 CD GLU A 138 9.235 -6.686 26.984 1.00 0.00 C ATOM 2180 OE1 GLU A 138 8.799 -5.831 27.737 1.00 0.00 O ATOM 2181 OE2 GLU A 138 9.608 -7.789 27.347 1.00 0.00 O ATOM 0 H GLU A 138 8.287 -2.674 24.224 1.00 0.00 H new ATOM 0 HA GLU A 138 10.134 -4.789 23.412 1.00 0.00 H new ATOM 0 HB2 GLU A 138 9.790 -4.274 25.832 1.00 0.00 H new ATOM 0 HB3 GLU A 138 8.075 -4.591 25.667 1.00 0.00 H new ATOM 0 HG2 GLU A 138 8.576 -6.943 24.947 1.00 0.00 H new ATOM 0 HG3 GLU A 138 10.293 -6.627 25.106 1.00 0.00 H new ATOM 2188 N ALA A 139 8.537 -6.533 22.580 1.00 0.00 N ATOM 2189 CA ALA A 139 7.640 -7.421 21.849 1.00 0.00 C ATOM 2190 C ALA A 139 8.059 -8.881 21.996 1.00 0.00 C ATOM 2191 O ALA A 139 9.245 -9.203 22.021 1.00 0.00 O ATOM 2192 CB ALA A 139 7.614 -7.032 20.372 1.00 0.00 C ATOM 0 H ALA A 139 9.485 -6.888 22.702 1.00 0.00 H new ATOM 0 HA ALA A 139 6.641 -7.314 22.272 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.942 -7.699 19.832 1.00 0.00 H new ATOM 0 HB2 ALA A 139 7.263 -6.005 20.272 1.00 0.00 H new ATOM 0 HB3 ALA A 139 8.618 -7.114 19.956 1.00 0.00 H new ATOM 2198 N LYS A 140 7.064 -9.758 22.086 1.00 0.00 N ATOM 2199 CA LYS A 140 7.315 -11.188 22.228 1.00 0.00 C ATOM 2200 C LYS A 140 6.802 -11.957 21.022 1.00 0.00 C ATOM 2201 O LYS A 140 5.827 -11.558 20.384 1.00 0.00 O ATOM 2202 CB LYS A 140 6.621 -11.723 23.481 1.00 0.00 C ATOM 2203 CG LYS A 140 6.695 -13.252 23.492 1.00 0.00 C ATOM 2204 CD LYS A 140 6.020 -13.780 24.758 1.00 0.00 C ATOM 2205 CE LYS A 140 6.101 -15.306 24.778 1.00 0.00 C ATOM 2206 NZ LYS A 140 5.400 -15.828 25.986 1.00 0.00 N ATOM 0 H LYS A 140 6.077 -9.504 22.063 1.00 0.00 H new ATOM 0 HA LYS A 140 8.393 -11.327 22.308 1.00 0.00 H new ATOM 0 HB2 LYS A 140 7.097 -11.319 24.374 1.00 0.00 H new ATOM 0 HB3 LYS A 140 5.581 -11.398 23.500 1.00 0.00 H new ATOM 0 HG2 LYS A 140 6.204 -13.658 22.608 1.00 0.00 H new ATOM 0 HG3 LYS A 140 7.735 -13.578 23.457 1.00 0.00 H new ATOM 0 HD2 LYS A 140 6.507 -13.367 25.642 1.00 0.00 H new ATOM 0 HD3 LYS A 140 4.979 -13.460 24.789 1.00 0.00 H new ATOM 0 HE2 LYS A 140 5.647 -15.716 23.876 1.00 0.00 H new ATOM 0 HE3 LYS A 140 7.143 -15.625 24.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 5.456 -16.866 25.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 5.852 -15.447 26.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 4.402 -15.535 25.962 1.00 0.00 H new ATOM 2220 N LEU A 141 7.457 -13.074 20.726 1.00 0.00 N ATOM 2221 CA LEU A 141 7.042 -13.901 19.604 1.00 0.00 C ATOM 2222 C LEU A 141 5.816 -14.723 19.977 1.00 0.00 C ATOM 2223 O LEU A 141 5.832 -15.486 20.945 1.00 0.00 O ATOM 2224 CB LEU A 141 8.166 -14.846 19.198 1.00 0.00 C ATOM 2225 CG LEU A 141 7.733 -15.665 17.980 1.00 0.00 C ATOM 2226 CD1 LEU A 141 8.103 -14.919 16.699 1.00 0.00 C ATOM 2227 CD2 LEU A 141 8.443 -17.017 18.010 1.00 0.00 C ATOM 0 H LEU A 141 8.266 -13.422 21.240 1.00 0.00 H new ATOM 0 HA LEU A 141 6.800 -13.243 18.770 1.00 0.00 H new ATOM 0 HB2 LEU A 141 9.066 -14.278 18.965 1.00 0.00 H new ATOM 0 HB3 LEU A 141 8.413 -15.510 20.026 1.00 0.00 H new ATOM 0 HG LEU A 141 6.654 -15.816 18.005 1.00 0.00 H new ATOM 0 HD11 LEU A 141 7.793 -15.505 15.834 1.00 0.00 H new ATOM 0 HD12 LEU A 141 7.599 -13.953 16.682 1.00 0.00 H new ATOM 0 HD13 LEU A 141 9.182 -14.766 16.666 1.00 0.00 H new ATOM 0 HD21 LEU A 141 8.139 -17.607 17.145 1.00 0.00 H new ATOM 0 HD22 LEU A 141 9.522 -16.862 17.983 1.00 0.00 H new ATOM 0 HD23 LEU A 141 8.175 -17.548 18.923 1.00 0.00 H new ATOM 2239 N THR A 142 4.762 -14.561 19.196 1.00 0.00 N ATOM 2240 CA THR A 142 3.523 -15.289 19.430 1.00 0.00 C ATOM 2241 C THR A 142 3.317 -16.366 18.367 1.00 0.00 C ATOM 2242 O THR A 142 2.872 -17.473 18.672 1.00 0.00 O ATOM 2243 CB THR A 142 2.339 -14.323 19.403 1.00 0.00 C ATOM 2244 OG1 THR A 142 1.588 -14.538 18.218 1.00 0.00 O ATOM 2245 CG2 THR A 142 2.847 -12.882 19.431 1.00 0.00 C ATOM 0 H THR A 142 4.738 -13.932 18.393 1.00 0.00 H new ATOM 0 HA THR A 142 3.589 -15.766 20.408 1.00 0.00 H new ATOM 0 HB THR A 142 1.708 -14.497 20.275 1.00 0.00 H new ATOM 0 HG1 THR A 142 0.826 -13.922 18.197 1.00 0.00 H new ATOM 0 HG21 THR A 142 1.999 -12.197 19.412 1.00 0.00 H new ATOM 0 HG22 THR A 142 3.426 -12.718 20.340 1.00 0.00 H new ATOM 0 HG23 THR A 142 3.479 -12.702 18.561 1.00 0.00 H new ATOM 2253 N GLY A 143 3.636 -16.036 17.117 1.00 0.00 N ATOM 2254 CA GLY A 143 3.474 -16.990 16.023 1.00 0.00 C ATOM 2255 C GLY A 143 4.677 -16.959 15.089 1.00 0.00 C ATOM 2256 O GLY A 143 5.477 -16.025 15.123 1.00 0.00 O ATOM 0 H GLY A 143 4.004 -15.126 16.839 1.00 0.00 H new ATOM 0 HA2 GLY A 143 3.349 -17.994 16.427 1.00 0.00 H new ATOM 0 HA3 GLY A 143 2.568 -16.756 15.463 1.00 0.00 H new ATOM 2260 N SER A 144 4.805 -17.984 14.256 1.00 0.00 N ATOM 2261 CA SER A 144 5.919 -18.053 13.320 1.00 0.00 C ATOM 2262 C SER A 144 5.517 -18.833 12.072 1.00 0.00 C ATOM 2263 O SER A 144 4.643 -19.697 12.123 1.00 0.00 O ATOM 2264 CB SER A 144 7.115 -18.730 13.986 1.00 0.00 C ATOM 2265 OG SER A 144 6.797 -20.089 14.251 1.00 0.00 O ATOM 0 H SER A 144 4.158 -18.771 14.209 1.00 0.00 H new ATOM 0 HA SER A 144 6.193 -17.039 13.029 1.00 0.00 H new ATOM 0 HB2 SER A 144 7.989 -18.669 13.338 1.00 0.00 H new ATOM 0 HB3 SER A 144 7.369 -18.216 14.913 1.00 0.00 H new ATOM 0 HG SER A 144 7.563 -20.527 14.677 1.00 0.00 H new ATOM 2271 N TYR A 145 6.158 -18.517 10.953 1.00 0.00 N ATOM 2272 CA TYR A 145 5.858 -19.185 9.693 1.00 0.00 C ATOM 2273 C TYR A 145 7.145 -19.533 8.954 1.00 0.00 C ATOM 2274 O TYR A 145 8.176 -18.890 9.150 1.00 0.00 O ATOM 2275 CB TYR A 145 5.008 -18.267 8.817 1.00 0.00 C ATOM 2276 CG TYR A 145 3.718 -17.946 9.532 1.00 0.00 C ATOM 2277 CD1 TYR A 145 3.665 -16.866 10.419 1.00 0.00 C ATOM 2278 CD2 TYR A 145 2.577 -18.730 9.311 1.00 0.00 C ATOM 2279 CE1 TYR A 145 2.472 -16.566 11.086 1.00 0.00 C ATOM 2280 CE2 TYR A 145 1.384 -18.430 9.981 1.00 0.00 C ATOM 2281 CZ TYR A 145 1.332 -17.347 10.868 1.00 0.00 C ATOM 2282 OH TYR A 145 0.156 -17.052 11.528 1.00 0.00 O ATOM 0 H TYR A 145 6.886 -17.805 10.892 1.00 0.00 H new ATOM 0 HA TYR A 145 5.312 -20.104 9.907 1.00 0.00 H new ATOM 0 HB2 TYR A 145 5.553 -17.349 8.597 1.00 0.00 H new ATOM 0 HB3 TYR A 145 4.797 -18.749 7.862 1.00 0.00 H new ATOM 0 HD1 TYR A 145 4.545 -16.263 10.589 1.00 0.00 H new ATOM 0 HD2 TYR A 145 2.618 -19.564 8.626 1.00 0.00 H new ATOM 0 HE1 TYR A 145 2.431 -15.731 11.770 1.00 0.00 H new ATOM 0 HE2 TYR A 145 0.504 -19.034 9.814 1.00 0.00 H new ATOM 0 HH TYR A 145 -0.538 -17.691 11.262 1.00 0.00 H new ATOM 2292 N SER A 146 7.078 -20.549 8.100 1.00 0.00 N ATOM 2293 CA SER A 146 8.247 -20.959 7.337 1.00 0.00 C ATOM 2294 C SER A 146 7.844 -21.397 5.932 1.00 0.00 C ATOM 2295 O SER A 146 6.988 -22.265 5.764 1.00 0.00 O ATOM 2296 CB SER A 146 8.958 -22.108 8.052 1.00 0.00 C ATOM 2297 OG SER A 146 8.026 -23.154 8.292 1.00 0.00 O ATOM 0 H SER A 146 6.236 -21.097 7.921 1.00 0.00 H new ATOM 0 HA SER A 146 8.924 -20.109 7.257 1.00 0.00 H new ATOM 0 HB2 SER A 146 9.786 -22.474 7.445 1.00 0.00 H new ATOM 0 HB3 SER A 146 9.383 -21.760 8.993 1.00 0.00 H new ATOM 0 HG SER A 146 7.351 -23.160 7.582 1.00 0.00 H new ATOM 2303 N LYS A 147 8.468 -20.789 4.927 1.00 0.00 N ATOM 2304 CA LYS A 147 8.162 -21.124 3.540 1.00 0.00 C ATOM 2305 C LYS A 147 9.116 -22.198 3.025 1.00 0.00 C ATOM 2306 O LYS A 147 9.751 -22.841 3.845 1.00 0.00 O ATOM 2307 CB LYS A 147 8.271 -19.874 2.664 1.00 0.00 C ATOM 2308 CG LYS A 147 7.348 -20.019 1.453 1.00 0.00 C ATOM 2309 CD LYS A 147 7.336 -18.709 0.661 1.00 0.00 C ATOM 2310 CE LYS A 147 6.398 -18.845 -0.539 1.00 0.00 C ATOM 2311 NZ LYS A 147 6.365 -17.559 -1.291 1.00 0.00 N ATOM 2312 OXT LYS A 147 9.195 -22.362 1.819 1.00 0.00 O ATOM 0 H LYS A 147 9.181 -20.069 5.045 1.00 0.00 H new ATOM 0 HA LYS A 147 7.143 -21.509 3.494 1.00 0.00 H new ATOM 0 HB2 LYS A 147 7.998 -18.989 3.239 1.00 0.00 H new ATOM 0 HB3 LYS A 147 9.301 -19.736 2.335 1.00 0.00 H new ATOM 0 HG2 LYS A 147 7.689 -20.837 0.818 1.00 0.00 H new ATOM 0 HG3 LYS A 147 6.338 -20.268 1.780 1.00 0.00 H new ATOM 0 HD2 LYS A 147 7.009 -17.889 1.300 1.00 0.00 H new ATOM 0 HD3 LYS A 147 8.344 -18.467 0.323 1.00 0.00 H new ATOM 0 HE2 LYS A 147 6.737 -19.651 -1.190 1.00 0.00 H new ATOM 0 HE3 LYS A 147 5.395 -19.108 -0.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 5.727 -17.651 -2.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 6.022 -16.801 -0.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 7.323 -17.327 -1.624 1.00 0.00 H new