USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 915 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 88 MET CE :methyl -152:sc= -5.55! (180deg=-8.24!) USER MOD Set 1.2: B 130 CYS SG : rot 59:sc= -3.36! USER MOD Set 2.1: B 43 ASN : amide:sc= -3.05! C(o=-2.7!,f=-2.1!) USER MOD Set 2.2: B 47 SER OG : rot 84:sc= 0.36 USER MOD Set 3.1: B 34 MET CE :methyl -149:sc= -5.68! (180deg=-9.73!) USER MOD Set 3.2: B 38 ASN : amide:sc= -0.764! C(o=-6.4!,f=-19!) USER MOD Set 4.1: B 22 TYR OH : rot 17:sc= 0.0718 USER MOD Set 4.2: B 111 HIS : no HD1:sc= -1.88 K(o=-1.8,f=-0.87) USER MOD Set 5.1: A 14 MET CE :methyl 158:sc=-0.00658 (180deg=-0.0415) USER MOD Set 5.2: B 127 GLN : amide:sc=-0.000534 X(o=-0.0071,f=-0.041) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= -2.38! C(o=-2.4!,f=-2.9!) USER MOD Single : A 16 GLN : amide:sc= -2.24! C(o=-2.2!,f=-3.5!) USER MOD Single : A 17 ASN : amide:sc= -0.928 K(o=-0.93,f=0.08) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : B 16 GLN : amide:sc= -0.352 X(o=-0.35,f=-0.092) USER MOD Single : B 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 21 GLN : amide:sc= 0.241 K(o=0.24,f=-2.2!) USER MOD Single : B 25 MET CE :methyl 160:sc= -0.0141 (180deg=-0.28) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 45 MET CE :methyl -143:sc= -3.78 (180deg=-7.67!) USER MOD Single : B 46 THR OG1 : rot 180:sc= 0 USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 50 LYS NZ :NH3+ -150:sc= 1.52 (180deg=1.21) USER MOD Single : B 55 SER OG : rot 180:sc= 0.0325 USER MOD Single : B 57 ASN : amide:sc= -3.39! C(o=-3.4!,f=-9.4!) USER MOD Single : B 58 MET CE :methyl -147:sc= -0.735 (180deg=-2.46!) USER MOD Single : B 59 ASN : amide:sc= -5.95! C(o=-5.9!,f=-13!) USER MOD Single : B 64 THR OG1 : rot -9:sc= 0.333 USER MOD Single : B 66 THR OG1 : rot 180:sc= -0.675 USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 ASN : amide:sc= 0.385 K(o=0.39,f=-1.5!) USER MOD Single : B 80 CYS SG : rot 146:sc= -6.17! USER MOD Single : B 86 SER OG : rot 100:sc= -0.671 USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 95 HIS : no HD1:sc= -0.109 K(o=-0.11,f=-4.6!) USER MOD Single : B 96 THR OG1 : rot 26:sc= -0.183 USER MOD Single : B 101 MET CE :methyl -177:sc= -0.445 (180deg=-0.489) USER MOD Single : B 110 CYS SG : rot -160:sc= -3.33! USER MOD Single : B 115 CYS SG : rot 130:sc= -1.58 USER MOD Single : B 118 ASN : amide:sc= -3.23! C(o=-3.2!,f=-6.3!) USER MOD Single : B 121 ASN : amide:sc= -0.0276 K(o=-0.028,f=-1.4) USER MOD Single : B 123 SER OG : rot -31:sc= -0.279! USER MOD ----------------------------------------------------------------- ATOM 148 N LEU A 11 11.181 -15.309 2.608 1.00 0.00 N ATOM 149 CA LEU A 11 9.773 -15.143 2.925 1.00 0.00 C ATOM 150 C LEU A 11 9.544 -15.475 4.401 1.00 0.00 C ATOM 151 O LEU A 11 8.796 -14.781 5.088 1.00 0.00 O ATOM 152 CB LEU A 11 8.907 -15.965 1.968 1.00 0.00 C ATOM 153 CG LEU A 11 9.008 -15.595 0.487 1.00 0.00 C ATOM 154 CD1 LEU A 11 7.821 -16.154 -0.300 1.00 0.00 C ATOM 155 CD2 LEU A 11 9.154 -14.083 0.308 1.00 0.00 C ATOM 0 HA LEU A 11 9.470 -14.106 2.780 1.00 0.00 H new ATOM 0 HB2 LEU A 11 9.175 -17.016 2.079 1.00 0.00 H new ATOM 0 HB3 LEU A 11 7.866 -15.867 2.276 1.00 0.00 H new ATOM 0 HG LEU A 11 9.909 -16.055 0.081 1.00 0.00 H new ATOM 0 HD11 LEU A 11 7.917 -15.877 -1.350 1.00 0.00 H new ATOM 0 HD12 LEU A 11 7.805 -17.240 -0.212 1.00 0.00 H new ATOM 0 HD13 LEU A 11 6.894 -15.744 0.100 1.00 0.00 H new ATOM 0 HD21 LEU A 11 9.224 -13.847 -0.754 1.00 0.00 H new ATOM 0 HD22 LEU A 11 8.286 -13.581 0.735 1.00 0.00 H new ATOM 0 HD23 LEU A 11 10.056 -13.742 0.815 1.00 0.00 H new ATOM 167 N SER A 12 10.201 -16.536 4.844 1.00 0.00 N ATOM 168 CA SER A 12 10.079 -16.969 6.226 1.00 0.00 C ATOM 169 C SER A 12 10.330 -15.790 7.168 1.00 0.00 C ATOM 170 O SER A 12 9.902 -15.810 8.321 1.00 0.00 O ATOM 171 CB SER A 12 11.050 -18.110 6.534 1.00 0.00 C ATOM 172 OG SER A 12 10.931 -19.180 5.600 1.00 0.00 O ATOM 0 H SER A 12 10.820 -17.109 4.271 1.00 0.00 H new ATOM 0 HA SER A 12 9.065 -17.339 6.380 1.00 0.00 H new ATOM 0 HB2 SER A 12 12.072 -17.730 6.521 1.00 0.00 H new ATOM 0 HB3 SER A 12 10.862 -18.485 7.540 1.00 0.00 H new ATOM 0 HG SER A 12 11.569 -19.888 5.830 1.00 0.00 H new ATOM 178 N LYS A 13 11.023 -14.791 6.642 1.00 0.00 N ATOM 179 CA LYS A 13 11.336 -13.605 7.421 1.00 0.00 C ATOM 180 C LYS A 13 10.188 -12.601 7.298 1.00 0.00 C ATOM 181 O LYS A 13 9.959 -11.800 8.203 1.00 0.00 O ATOM 182 CB LYS A 13 12.696 -13.038 7.011 1.00 0.00 C ATOM 183 CG LYS A 13 12.543 -11.999 5.897 1.00 0.00 C ATOM 184 CD LYS A 13 12.608 -10.578 6.461 1.00 0.00 C ATOM 185 CE LYS A 13 11.767 -9.616 5.620 1.00 0.00 C ATOM 186 NZ LYS A 13 12.536 -8.391 5.308 1.00 0.00 N ATOM 0 H LYS A 13 11.377 -14.778 5.685 1.00 0.00 H new ATOM 0 HA LYS A 13 11.427 -13.857 8.478 1.00 0.00 H new ATOM 0 HB2 LYS A 13 13.179 -12.582 7.875 1.00 0.00 H new ATOM 0 HB3 LYS A 13 13.344 -13.846 6.673 1.00 0.00 H new ATOM 0 HG2 LYS A 13 13.330 -12.136 5.156 1.00 0.00 H new ATOM 0 HG3 LYS A 13 11.593 -12.148 5.384 1.00 0.00 H new ATOM 0 HD2 LYS A 13 12.250 -10.575 7.491 1.00 0.00 H new ATOM 0 HD3 LYS A 13 13.643 -10.238 6.482 1.00 0.00 H new ATOM 0 HE2 LYS A 13 11.460 -10.105 4.695 1.00 0.00 H new ATOM 0 HE3 LYS A 13 10.857 -9.353 6.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 11.950 -7.749 4.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 12.807 -7.917 6.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 13.392 -8.645 4.775 1.00 0.00 H new ATOM 200 N MET A 14 9.496 -12.677 6.171 1.00 0.00 N ATOM 201 CA MET A 14 8.377 -11.785 5.917 1.00 0.00 C ATOM 202 C MET A 14 7.115 -12.273 6.631 1.00 0.00 C ATOM 203 O MET A 14 6.155 -11.519 6.787 1.00 0.00 O ATOM 204 CB MET A 14 8.116 -11.708 4.412 1.00 0.00 C ATOM 205 CG MET A 14 9.047 -10.694 3.745 1.00 0.00 C ATOM 206 SD MET A 14 8.361 -10.170 2.183 1.00 0.00 S ATOM 207 CE MET A 14 8.442 -8.399 2.387 1.00 0.00 C ATOM 0 H MET A 14 9.689 -13.343 5.423 1.00 0.00 H new ATOM 0 HA MET A 14 8.630 -10.797 6.301 1.00 0.00 H new ATOM 0 HB2 MET A 14 8.262 -12.691 3.963 1.00 0.00 H new ATOM 0 HB3 MET A 14 7.078 -11.427 4.233 1.00 0.00 H new ATOM 0 HG2 MET A 14 9.187 -9.832 4.398 1.00 0.00 H new ATOM 0 HG3 MET A 14 10.030 -11.138 3.589 1.00 0.00 H new ATOM 0 HE1 MET A 14 8.432 -7.919 1.408 1.00 0.00 H new ATOM 0 HE2 MET A 14 7.583 -8.060 2.967 1.00 0.00 H new ATOM 0 HE3 MET A 14 9.361 -8.135 2.911 1.00 0.00 H new ATOM 217 N GLN A 15 7.156 -13.531 7.044 1.00 0.00 N ATOM 218 CA GLN A 15 6.027 -14.128 7.737 1.00 0.00 C ATOM 219 C GLN A 15 5.975 -13.640 9.186 1.00 0.00 C ATOM 220 O GLN A 15 4.937 -13.733 9.840 1.00 0.00 O ATOM 221 CB GLN A 15 6.091 -15.655 7.675 1.00 0.00 C ATOM 222 CG GLN A 15 6.370 -16.135 6.249 1.00 0.00 C ATOM 223 CD GLN A 15 5.761 -17.517 6.006 1.00 0.00 C ATOM 224 OE1 GLN A 15 6.452 -18.509 5.842 1.00 0.00 O ATOM 225 NE2 GLN A 15 4.431 -17.527 5.992 1.00 0.00 N ATOM 0 H GLN A 15 7.953 -14.153 6.912 1.00 0.00 H new ATOM 0 HA GLN A 15 5.111 -13.815 7.236 1.00 0.00 H new ATOM 0 HB2 GLN A 15 6.872 -16.017 8.344 1.00 0.00 H new ATOM 0 HB3 GLN A 15 5.149 -16.077 8.027 1.00 0.00 H new ATOM 0 HG2 GLN A 15 5.959 -15.422 5.535 1.00 0.00 H new ATOM 0 HG3 GLN A 15 7.446 -16.173 6.078 1.00 0.00 H new ATOM 0 HE21 GLN A 15 3.913 -16.660 6.136 1.00 0.00 H new ATOM 0 HE22 GLN A 15 3.929 -18.401 5.837 1.00 0.00 H new ATOM 234 N GLN A 16 7.108 -13.131 9.647 1.00 0.00 N ATOM 235 CA GLN A 16 7.205 -12.628 11.007 1.00 0.00 C ATOM 236 C GLN A 16 7.561 -11.140 10.998 1.00 0.00 C ATOM 237 O GLN A 16 6.686 -10.290 10.844 1.00 0.00 O ATOM 238 CB GLN A 16 8.225 -13.431 11.817 1.00 0.00 C ATOM 239 CG GLN A 16 7.724 -14.854 12.073 1.00 0.00 C ATOM 240 CD GLN A 16 8.224 -15.815 10.992 1.00 0.00 C ATOM 241 OE1 GLN A 16 7.467 -16.550 10.380 1.00 0.00 O ATOM 242 NE2 GLN A 16 9.538 -15.768 10.794 1.00 0.00 N ATOM 0 H GLN A 16 7.967 -13.056 9.103 1.00 0.00 H new ATOM 0 HA GLN A 16 6.234 -12.747 11.488 1.00 0.00 H new ATOM 0 HB2 GLN A 16 9.173 -13.466 11.281 1.00 0.00 H new ATOM 0 HB3 GLN A 16 8.414 -12.932 12.767 1.00 0.00 H new ATOM 0 HG2 GLN A 16 8.065 -15.193 13.051 1.00 0.00 H new ATOM 0 HG3 GLN A 16 6.634 -14.861 12.095 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.114 -15.129 11.342 1.00 0.00 H new ATOM 0 HE22 GLN A 16 9.970 -16.371 10.094 1.00 0.00 H new ATOM 251 N ASN A 17 8.847 -10.871 11.166 1.00 0.00 N ATOM 252 CA ASN A 17 9.330 -9.500 11.180 1.00 0.00 C ATOM 253 C ASN A 17 8.600 -8.697 10.102 1.00 0.00 C ATOM 254 O ASN A 17 8.404 -7.491 10.247 1.00 0.00 O ATOM 255 CB ASN A 17 10.829 -9.441 10.880 1.00 0.00 C ATOM 256 CG ASN A 17 11.626 -10.249 11.906 1.00 0.00 C ATOM 257 OD1 ASN A 17 12.100 -9.736 12.906 1.00 0.00 O ATOM 258 ND2 ASN A 17 11.746 -11.539 11.604 1.00 0.00 N ATOM 0 H ASN A 17 9.570 -11.579 11.294 1.00 0.00 H new ATOM 0 HA ASN A 17 9.145 -9.087 12.171 1.00 0.00 H new ATOM 0 HB2 ASN A 17 11.019 -9.829 9.879 1.00 0.00 H new ATOM 0 HB3 ASN A 17 11.165 -8.404 10.888 1.00 0.00 H new ATOM 0 HD21 ASN A 17 12.260 -12.163 12.226 1.00 0.00 H new ATOM 0 HD22 ASN A 17 11.324 -11.904 10.750 1.00 0.00 H new ATOM 265 N GLY A 18 8.217 -9.397 9.044 1.00 0.00 N ATOM 266 CA GLY A 18 7.513 -8.763 7.942 1.00 0.00 C ATOM 267 C GLY A 18 8.347 -7.632 7.337 1.00 0.00 C ATOM 268 O GLY A 18 9.571 -7.729 7.263 1.00 0.00 O ATOM 0 H GLY A 18 8.381 -10.397 8.927 1.00 0.00 H new ATOM 0 HA2 GLY A 18 7.288 -9.504 7.175 1.00 0.00 H new ATOM 0 HA3 GLY A 18 6.560 -8.369 8.294 1.00 0.00 H new ATOM 272 N TYR A 19 7.650 -6.586 6.918 1.00 0.00 N ATOM 273 CA TYR A 19 8.311 -5.437 6.321 1.00 0.00 C ATOM 274 C TYR A 19 7.467 -4.172 6.488 1.00 0.00 C ATOM 275 O TYR A 19 6.279 -4.167 6.169 1.00 0.00 O ATOM 276 CB TYR A 19 8.444 -5.755 4.831 1.00 0.00 C ATOM 277 CG TYR A 19 9.202 -4.692 4.033 1.00 0.00 C ATOM 278 CD1 TYR A 19 10.574 -4.773 3.906 1.00 0.00 C ATOM 279 CD2 TYR A 19 8.514 -3.652 3.441 1.00 0.00 C ATOM 280 CE1 TYR A 19 11.288 -3.772 3.155 1.00 0.00 C ATOM 281 CE2 TYR A 19 9.228 -2.652 2.690 1.00 0.00 C ATOM 282 CZ TYR A 19 10.579 -2.761 2.585 1.00 0.00 C ATOM 283 OH TYR A 19 11.253 -1.816 1.876 1.00 0.00 O ATOM 0 H TYR A 19 6.635 -6.510 6.980 1.00 0.00 H new ATOM 0 HA TYR A 19 9.275 -5.257 6.797 1.00 0.00 H new ATOM 0 HB2 TYR A 19 8.954 -6.712 4.718 1.00 0.00 H new ATOM 0 HB3 TYR A 19 7.448 -5.873 4.405 1.00 0.00 H new ATOM 0 HD1 TYR A 19 11.112 -5.587 4.369 1.00 0.00 H new ATOM 0 HD2 TYR A 19 7.441 -3.588 3.541 1.00 0.00 H new ATOM 0 HE1 TYR A 19 12.361 -3.823 3.047 1.00 0.00 H new ATOM 0 HE2 TYR A 19 8.702 -1.834 2.221 1.00 0.00 H new ATOM 0 HH TYR A 19 10.619 -1.156 1.525 1.00 0.00 H new ATOM 293 N GLU A 20 8.114 -3.129 6.986 1.00 0.00 N ATOM 294 CA GLU A 20 7.439 -1.860 7.199 1.00 0.00 C ATOM 295 C GLU A 20 8.019 -0.788 6.274 1.00 0.00 C ATOM 296 O GLU A 20 9.019 -0.154 6.605 1.00 0.00 O ATOM 297 CB GLU A 20 7.530 -1.429 8.664 1.00 0.00 C ATOM 298 CG GLU A 20 6.144 -1.382 9.309 1.00 0.00 C ATOM 299 CD GLU A 20 6.157 -0.520 10.574 1.00 0.00 C ATOM 300 OE1 GLU A 20 6.621 -1.042 11.611 1.00 0.00 O ATOM 301 OE2 GLU A 20 5.702 0.640 10.475 1.00 0.00 O ATOM 0 H GLU A 20 9.100 -3.137 7.248 1.00 0.00 H new ATOM 0 HA GLU A 20 6.384 -1.987 6.958 1.00 0.00 H new ATOM 0 HB2 GLU A 20 8.167 -2.123 9.212 1.00 0.00 H new ATOM 0 HB3 GLU A 20 7.999 -0.447 8.729 1.00 0.00 H new ATOM 0 HG2 GLU A 20 5.422 -0.980 8.598 1.00 0.00 H new ATOM 0 HG3 GLU A 20 5.820 -2.393 9.557 1.00 0.00 H new ATOM 691 N VAL B 15 6.934 -2.344 -17.211 1.00 0.00 N ATOM 692 CA VAL B 15 6.529 -2.763 -15.880 1.00 0.00 C ATOM 693 C VAL B 15 6.837 -4.251 -15.703 1.00 0.00 C ATOM 694 O VAL B 15 6.848 -5.006 -16.674 1.00 0.00 O ATOM 695 CB VAL B 15 5.054 -2.427 -15.652 1.00 0.00 C ATOM 696 CG1 VAL B 15 4.562 -2.994 -14.319 1.00 0.00 C ATOM 697 CG2 VAL B 15 4.818 -0.917 -15.726 1.00 0.00 C ATOM 0 HA VAL B 15 7.093 -2.221 -15.121 1.00 0.00 H new ATOM 0 HB VAL B 15 4.477 -2.896 -16.449 1.00 0.00 H new ATOM 0 HG11 VAL B 15 3.511 -2.741 -14.182 1.00 0.00 H new ATOM 0 HG12 VAL B 15 4.677 -4.078 -14.320 1.00 0.00 H new ATOM 0 HG13 VAL B 15 5.147 -2.568 -13.504 1.00 0.00 H new ATOM 0 HG21 VAL B 15 3.762 -0.705 -15.561 1.00 0.00 H new ATOM 0 HG22 VAL B 15 5.412 -0.418 -14.961 1.00 0.00 H new ATOM 0 HG23 VAL B 15 5.112 -0.551 -16.710 1.00 0.00 H new ATOM 707 N GLN B 16 7.080 -4.628 -14.456 1.00 0.00 N ATOM 708 CA GLN B 16 7.387 -6.012 -14.139 1.00 0.00 C ATOM 709 C GLN B 16 6.170 -6.901 -14.405 1.00 0.00 C ATOM 710 O GLN B 16 6.259 -7.872 -15.154 1.00 0.00 O ATOM 711 CB GLN B 16 7.861 -6.151 -12.691 1.00 0.00 C ATOM 712 CG GLN B 16 9.085 -5.272 -12.428 1.00 0.00 C ATOM 713 CD GLN B 16 10.343 -6.124 -12.245 1.00 0.00 C ATOM 714 OE1 GLN B 16 11.366 -5.910 -12.875 1.00 0.00 O ATOM 715 NE2 GLN B 16 10.210 -7.098 -11.350 1.00 0.00 N ATOM 0 H GLN B 16 7.070 -3.999 -13.653 1.00 0.00 H new ATOM 0 HA GLN B 16 8.200 -6.340 -14.786 1.00 0.00 H new ATOM 0 HB2 GLN B 16 7.055 -5.871 -12.012 1.00 0.00 H new ATOM 0 HB3 GLN B 16 8.105 -7.193 -12.483 1.00 0.00 H new ATOM 0 HG2 GLN B 16 9.227 -4.582 -13.260 1.00 0.00 H new ATOM 0 HG3 GLN B 16 8.918 -4.667 -11.537 1.00 0.00 H new ATOM 0 HE21 GLN B 16 9.325 -7.221 -10.858 1.00 0.00 H new ATOM 0 HE22 GLN B 16 10.993 -7.722 -11.155 1.00 0.00 H new ATOM 724 N LYS B 17 5.062 -6.535 -13.777 1.00 0.00 N ATOM 725 CA LYS B 17 3.829 -7.287 -13.937 1.00 0.00 C ATOM 726 C LYS B 17 3.985 -8.659 -13.278 1.00 0.00 C ATOM 727 O LYS B 17 5.071 -9.236 -13.286 1.00 0.00 O ATOM 728 CB LYS B 17 3.430 -7.355 -15.412 1.00 0.00 C ATOM 729 CG LYS B 17 2.507 -6.193 -15.784 1.00 0.00 C ATOM 730 CD LYS B 17 2.497 -5.963 -17.297 1.00 0.00 C ATOM 731 CE LYS B 17 1.516 -4.852 -17.676 1.00 0.00 C ATOM 732 NZ LYS B 17 1.737 -4.421 -19.074 1.00 0.00 N ATOM 0 H LYS B 17 4.992 -5.728 -13.157 1.00 0.00 H new ATOM 0 HA LYS B 17 3.006 -6.781 -13.432 1.00 0.00 H new ATOM 0 HB2 LYS B 17 4.323 -7.329 -16.036 1.00 0.00 H new ATOM 0 HB3 LYS B 17 2.928 -8.302 -15.614 1.00 0.00 H new ATOM 0 HG2 LYS B 17 1.495 -6.403 -15.438 1.00 0.00 H new ATOM 0 HG3 LYS B 17 2.836 -5.286 -15.277 1.00 0.00 H new ATOM 0 HD2 LYS B 17 3.499 -5.699 -17.635 1.00 0.00 H new ATOM 0 HD3 LYS B 17 2.221 -6.886 -17.807 1.00 0.00 H new ATOM 0 HE2 LYS B 17 0.492 -5.206 -17.556 1.00 0.00 H new ATOM 0 HE3 LYS B 17 1.641 -4.003 -17.003 1.00 0.00 H new ATOM 0 HZ1 LYS B 17 1.063 -3.667 -19.315 1.00 0.00 H new ATOM 0 HZ2 LYS B 17 2.708 -4.064 -19.178 1.00 0.00 H new ATOM 0 HZ3 LYS B 17 1.595 -5.229 -19.713 1.00 0.00 H new ATOM 746 N PHE B 18 2.883 -9.143 -12.723 1.00 0.00 N ATOM 747 CA PHE B 18 2.883 -10.436 -12.062 1.00 0.00 C ATOM 748 C PHE B 18 1.476 -11.036 -12.029 1.00 0.00 C ATOM 749 O PHE B 18 0.702 -10.761 -11.113 1.00 0.00 O ATOM 750 CB PHE B 18 3.360 -10.204 -10.626 1.00 0.00 C ATOM 751 CG PHE B 18 4.849 -9.872 -10.511 1.00 0.00 C ATOM 752 CD1 PHE B 18 5.778 -10.854 -10.659 1.00 0.00 C ATOM 753 CD2 PHE B 18 5.243 -8.595 -10.260 1.00 0.00 C ATOM 754 CE1 PHE B 18 7.160 -10.546 -10.552 1.00 0.00 C ATOM 755 CE2 PHE B 18 6.625 -8.287 -10.153 1.00 0.00 C ATOM 756 CZ PHE B 18 7.554 -9.269 -10.302 1.00 0.00 C ATOM 0 H PHE B 18 1.984 -8.662 -12.718 1.00 0.00 H new ATOM 0 HA PHE B 18 3.531 -11.128 -12.600 1.00 0.00 H new ATOM 0 HB2 PHE B 18 2.782 -9.390 -10.189 1.00 0.00 H new ATOM 0 HB3 PHE B 18 3.151 -11.096 -10.036 1.00 0.00 H new ATOM 0 HD1 PHE B 18 5.465 -11.868 -10.858 1.00 0.00 H new ATOM 0 HD2 PHE B 18 4.505 -7.815 -10.142 1.00 0.00 H new ATOM 0 HE1 PHE B 18 7.898 -11.326 -10.669 1.00 0.00 H new ATOM 0 HE2 PHE B 18 6.938 -7.273 -9.953 1.00 0.00 H new ATOM 0 HZ PHE B 18 8.605 -9.034 -10.222 1.00 0.00 H new ATOM 766 N ARG B 19 1.188 -11.844 -13.039 1.00 0.00 N ATOM 767 CA ARG B 19 -0.113 -12.484 -13.137 1.00 0.00 C ATOM 768 C ARG B 19 -0.338 -13.414 -11.943 1.00 0.00 C ATOM 769 O ARG B 19 0.175 -14.532 -11.917 1.00 0.00 O ATOM 770 CB ARG B 19 -0.234 -13.289 -14.432 1.00 0.00 C ATOM 771 CG ARG B 19 -1.694 -13.641 -14.724 1.00 0.00 C ATOM 772 CD ARG B 19 -2.013 -15.070 -14.280 1.00 0.00 C ATOM 773 NE ARG B 19 -1.788 -16.011 -15.400 1.00 0.00 N ATOM 774 CZ ARG B 19 -1.830 -17.345 -15.280 1.00 0.00 C ATOM 775 NH1 ARG B 19 -2.088 -17.903 -14.090 1.00 0.00 N ATOM 776 NH2 ARG B 19 -1.613 -18.121 -16.351 1.00 0.00 N ATOM 0 H ARG B 19 1.833 -12.070 -13.796 1.00 0.00 H new ATOM 0 HA ARG B 19 -0.870 -11.699 -13.138 1.00 0.00 H new ATOM 0 HB2 ARG B 19 0.178 -12.714 -15.261 1.00 0.00 H new ATOM 0 HB3 ARG B 19 0.355 -14.203 -14.353 1.00 0.00 H new ATOM 0 HG2 ARG B 19 -2.351 -12.941 -14.208 1.00 0.00 H new ATOM 0 HG3 ARG B 19 -1.891 -13.535 -15.791 1.00 0.00 H new ATOM 0 HD2 ARG B 19 -1.386 -15.345 -13.432 1.00 0.00 H new ATOM 0 HD3 ARG B 19 -3.048 -15.133 -13.944 1.00 0.00 H new ATOM 0 HE ARG B 19 -1.589 -15.620 -16.321 1.00 0.00 H new ATOM 0 HH11 ARG B 19 -2.253 -17.312 -13.275 1.00 0.00 H new ATOM 0 HH12 ARG B 19 -2.120 -18.918 -13.999 1.00 0.00 H new ATOM 0 HH21 ARG B 19 -1.416 -17.696 -17.257 1.00 0.00 H new ATOM 0 HH22 ARG B 19 -1.645 -19.136 -16.260 1.00 0.00 H new ATOM 790 N VAL B 20 -1.105 -12.919 -10.983 1.00 0.00 N ATOM 791 CA VAL B 20 -1.404 -13.691 -9.790 1.00 0.00 C ATOM 792 C VAL B 20 -2.918 -13.720 -9.572 1.00 0.00 C ATOM 793 O VAL B 20 -3.686 -13.414 -10.483 1.00 0.00 O ATOM 794 CB VAL B 20 -0.638 -13.124 -8.593 1.00 0.00 C ATOM 795 CG1 VAL B 20 0.815 -12.820 -8.966 1.00 0.00 C ATOM 796 CG2 VAL B 20 -1.333 -11.879 -8.037 1.00 0.00 C ATOM 0 H VAL B 20 -1.529 -11.992 -11.008 1.00 0.00 H new ATOM 0 HA VAL B 20 -1.073 -14.723 -9.911 1.00 0.00 H new ATOM 0 HB VAL B 20 -0.632 -13.882 -7.810 1.00 0.00 H new ATOM 0 HG11 VAL B 20 1.337 -12.418 -8.098 1.00 0.00 H new ATOM 0 HG12 VAL B 20 1.306 -13.737 -9.293 1.00 0.00 H new ATOM 0 HG13 VAL B 20 0.838 -12.088 -9.774 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -0.768 -11.496 -7.187 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -1.385 -11.115 -8.812 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -2.342 -12.138 -7.715 1.00 0.00 H new ATOM 806 N GLN B 21 -3.302 -14.090 -8.359 1.00 0.00 N ATOM 807 CA GLN B 21 -4.711 -14.162 -8.009 1.00 0.00 C ATOM 808 C GLN B 21 -5.084 -13.013 -7.070 1.00 0.00 C ATOM 809 O GLN B 21 -4.208 -12.338 -6.531 1.00 0.00 O ATOM 810 CB GLN B 21 -5.052 -15.515 -7.383 1.00 0.00 C ATOM 811 CG GLN B 21 -6.165 -16.216 -8.165 1.00 0.00 C ATOM 812 CD GLN B 21 -6.254 -17.696 -7.785 1.00 0.00 C ATOM 813 OE1 GLN B 21 -5.286 -18.318 -7.379 1.00 0.00 O ATOM 814 NE2 GLN B 21 -7.465 -18.222 -7.940 1.00 0.00 N ATOM 0 H GLN B 21 -2.662 -14.343 -7.606 1.00 0.00 H new ATOM 0 HA GLN B 21 -5.298 -14.064 -8.922 1.00 0.00 H new ATOM 0 HB2 GLN B 21 -4.163 -16.146 -7.364 1.00 0.00 H new ATOM 0 HB3 GLN B 21 -5.364 -15.373 -6.348 1.00 0.00 H new ATOM 0 HG2 GLN B 21 -7.118 -15.727 -7.964 1.00 0.00 H new ATOM 0 HG3 GLN B 21 -5.977 -16.122 -9.235 1.00 0.00 H new ATOM 0 HE21 GLN B 21 -8.232 -17.644 -8.285 1.00 0.00 H new ATOM 0 HE22 GLN B 21 -7.627 -19.203 -7.714 1.00 0.00 H new ATOM 823 N TYR B 22 -6.385 -12.827 -6.902 1.00 0.00 N ATOM 824 CA TYR B 22 -6.885 -11.772 -6.037 1.00 0.00 C ATOM 825 C TYR B 22 -7.804 -12.341 -4.954 1.00 0.00 C ATOM 826 O TYR B 22 -8.872 -12.871 -5.256 1.00 0.00 O ATOM 827 CB TYR B 22 -7.695 -10.837 -6.937 1.00 0.00 C ATOM 828 CG TYR B 22 -8.069 -9.508 -6.278 1.00 0.00 C ATOM 829 CD1 TYR B 22 -7.572 -9.194 -5.029 1.00 0.00 C ATOM 830 CD2 TYR B 22 -8.903 -8.624 -6.931 1.00 0.00 C ATOM 831 CE1 TYR B 22 -7.924 -7.943 -4.408 1.00 0.00 C ATOM 832 CE2 TYR B 22 -9.255 -7.373 -6.311 1.00 0.00 C ATOM 833 CZ TYR B 22 -8.748 -7.094 -5.080 1.00 0.00 C ATOM 834 OH TYR B 22 -9.080 -5.913 -4.494 1.00 0.00 O ATOM 0 H TYR B 22 -7.108 -13.389 -7.350 1.00 0.00 H new ATOM 0 HA TYR B 22 -6.061 -11.262 -5.538 1.00 0.00 H new ATOM 0 HB2 TYR B 22 -7.122 -10.634 -7.842 1.00 0.00 H new ATOM 0 HB3 TYR B 22 -8.607 -11.347 -7.246 1.00 0.00 H new ATOM 0 HD1 TYR B 22 -6.919 -9.886 -4.518 1.00 0.00 H new ATOM 0 HD2 TYR B 22 -9.292 -8.870 -7.908 1.00 0.00 H new ATOM 0 HE1 TYR B 22 -7.543 -7.685 -3.431 1.00 0.00 H new ATOM 0 HE2 TYR B 22 -9.907 -6.672 -6.812 1.00 0.00 H new ATOM 0 HH TYR B 22 -8.458 -5.726 -3.760 1.00 0.00 H new ATOM 844 N LEU B 23 -7.354 -12.212 -3.714 1.00 0.00 N ATOM 845 CA LEU B 23 -8.123 -12.706 -2.584 1.00 0.00 C ATOM 846 C LEU B 23 -9.264 -11.733 -2.284 1.00 0.00 C ATOM 847 O LEU B 23 -10.385 -12.153 -2.000 1.00 0.00 O ATOM 848 CB LEU B 23 -7.207 -12.968 -1.387 1.00 0.00 C ATOM 849 CG LEU B 23 -6.820 -14.428 -1.145 1.00 0.00 C ATOM 850 CD1 LEU B 23 -5.417 -14.720 -1.682 1.00 0.00 C ATOM 851 CD2 LEU B 23 -6.954 -14.793 0.335 1.00 0.00 C ATOM 0 H LEU B 23 -6.467 -11.773 -3.467 1.00 0.00 H new ATOM 0 HA LEU B 23 -8.579 -13.667 -2.824 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -6.294 -12.388 -1.520 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -7.697 -12.589 -0.490 1.00 0.00 H new ATOM 0 HG LEU B 23 -7.515 -15.061 -1.697 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -5.167 -15.765 -1.497 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -5.390 -14.525 -2.754 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -4.694 -14.079 -1.178 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -6.673 -15.836 0.479 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -6.298 -14.155 0.928 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -7.986 -14.648 0.653 1.00 0.00 H new ATOM 863 N GLY B 24 -8.940 -10.450 -2.358 1.00 0.00 N ATOM 864 CA GLY B 24 -9.925 -9.414 -2.098 1.00 0.00 C ATOM 865 C GLY B 24 -9.389 -8.388 -1.097 1.00 0.00 C ATOM 866 O GLY B 24 -8.227 -8.451 -0.699 1.00 0.00 O ATOM 0 H GLY B 24 -8.010 -10.105 -2.594 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -10.188 -8.915 -3.031 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -10.838 -9.864 -1.709 1.00 0.00 H new ATOM 870 N MET B 25 -10.263 -7.466 -0.718 1.00 0.00 N ATOM 871 CA MET B 25 -9.892 -6.428 0.228 1.00 0.00 C ATOM 872 C MET B 25 -10.449 -6.732 1.621 1.00 0.00 C ATOM 873 O MET B 25 -11.626 -7.062 1.764 1.00 0.00 O ATOM 874 CB MET B 25 -10.432 -5.080 -0.254 1.00 0.00 C ATOM 875 CG MET B 25 -9.914 -3.937 0.621 1.00 0.00 C ATOM 876 SD MET B 25 -11.247 -2.817 1.014 1.00 0.00 S ATOM 877 CE MET B 25 -12.155 -3.815 2.184 1.00 0.00 C ATOM 0 H MET B 25 -11.226 -7.417 -1.049 1.00 0.00 H new ATOM 0 HA MET B 25 -8.804 -6.392 0.291 1.00 0.00 H new ATOM 0 HB2 MET B 25 -10.134 -4.914 -1.289 1.00 0.00 H new ATOM 0 HB3 MET B 25 -11.522 -5.093 -0.234 1.00 0.00 H new ATOM 0 HG2 MET B 25 -9.482 -4.337 1.538 1.00 0.00 H new ATOM 0 HG3 MET B 25 -9.119 -3.402 0.101 1.00 0.00 H new ATOM 0 HE1 MET B 25 -12.795 -3.174 2.790 1.00 0.00 H new ATOM 0 HE2 MET B 25 -12.769 -4.537 1.646 1.00 0.00 H new ATOM 0 HE3 MET B 25 -11.455 -4.344 2.831 1.00 0.00 H new ATOM 887 N LEU B 26 -9.578 -6.609 2.611 1.00 0.00 N ATOM 888 CA LEU B 26 -9.968 -6.867 3.987 1.00 0.00 C ATOM 889 C LEU B 26 -9.803 -5.586 4.807 1.00 0.00 C ATOM 890 O LEU B 26 -8.784 -4.905 4.704 1.00 0.00 O ATOM 891 CB LEU B 26 -9.194 -8.061 4.549 1.00 0.00 C ATOM 892 CG LEU B 26 -10.040 -9.194 5.133 1.00 0.00 C ATOM 893 CD1 LEU B 26 -10.436 -8.893 6.580 1.00 0.00 C ATOM 894 CD2 LEU B 26 -11.259 -9.478 4.253 1.00 0.00 C ATOM 0 H LEU B 26 -8.603 -6.334 2.488 1.00 0.00 H new ATOM 0 HA LEU B 26 -11.020 -7.147 4.039 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -8.571 -8.472 3.754 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -8.521 -7.699 5.326 1.00 0.00 H new ATOM 0 HG LEU B 26 -9.434 -10.100 5.146 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -11.037 -9.714 6.971 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -9.538 -8.779 7.187 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -11.016 -7.971 6.614 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -11.843 -10.287 4.691 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -11.875 -8.582 4.185 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -10.928 -9.768 3.256 1.00 0.00 H new ATOM 906 N PRO B 27 -10.849 -5.289 5.625 1.00 0.00 N ATOM 907 CA PRO B 27 -10.830 -4.101 6.463 1.00 0.00 C ATOM 908 C PRO B 27 -9.900 -4.292 7.663 1.00 0.00 C ATOM 909 O PRO B 27 -9.893 -5.354 8.284 1.00 0.00 O ATOM 910 CB PRO B 27 -12.279 -3.879 6.863 1.00 0.00 C ATOM 911 CG PRO B 27 -12.986 -5.203 6.622 1.00 0.00 C ATOM 912 CD PRO B 27 -12.072 -6.072 5.773 1.00 0.00 C ATOM 0 HA PRO B 27 -10.436 -3.227 5.945 1.00 0.00 H new ATOM 0 HB2 PRO B 27 -12.354 -3.581 7.909 1.00 0.00 H new ATOM 0 HB3 PRO B 27 -12.730 -3.082 6.271 1.00 0.00 H new ATOM 0 HG2 PRO B 27 -13.209 -5.695 7.569 1.00 0.00 H new ATOM 0 HG3 PRO B 27 -13.937 -5.041 6.115 1.00 0.00 H new ATOM 0 HD2 PRO B 27 -11.874 -7.029 6.256 1.00 0.00 H new ATOM 0 HD3 PRO B 27 -12.521 -6.291 4.805 1.00 0.00 H new ATOM 920 N VAL B 28 -9.139 -3.248 7.953 1.00 0.00 N ATOM 921 CA VAL B 28 -8.208 -3.287 9.068 1.00 0.00 C ATOM 922 C VAL B 28 -8.234 -1.942 9.797 1.00 0.00 C ATOM 923 O VAL B 28 -8.961 -1.032 9.401 1.00 0.00 O ATOM 924 CB VAL B 28 -6.813 -3.671 8.572 1.00 0.00 C ATOM 925 CG1 VAL B 28 -6.854 -4.975 7.773 1.00 0.00 C ATOM 926 CG2 VAL B 28 -6.195 -2.541 7.745 1.00 0.00 C ATOM 0 H VAL B 28 -9.148 -2.369 7.435 1.00 0.00 H new ATOM 0 HA VAL B 28 -8.505 -4.051 9.786 1.00 0.00 H new ATOM 0 HB VAL B 28 -6.180 -3.833 9.445 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -5.849 -5.225 7.432 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.233 -5.778 8.406 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -7.510 -4.853 6.911 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -5.204 -2.840 7.405 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -6.828 -2.334 6.882 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -6.113 -1.644 8.359 1.00 0.00 H new ATOM 936 N ASP B 29 -7.432 -1.858 10.848 1.00 0.00 N ATOM 937 CA ASP B 29 -7.354 -0.640 11.635 1.00 0.00 C ATOM 938 C ASP B 29 -5.906 -0.148 11.665 1.00 0.00 C ATOM 939 O ASP B 29 -5.636 1.017 11.378 1.00 0.00 O ATOM 940 CB ASP B 29 -7.799 -0.886 13.078 1.00 0.00 C ATOM 941 CG ASP B 29 -9.285 -1.208 13.250 1.00 0.00 C ATOM 942 OD1 ASP B 29 -10.078 -0.676 12.445 1.00 0.00 O ATOM 943 OD2 ASP B 29 -9.594 -1.980 14.184 1.00 0.00 O ATOM 0 H ASP B 29 -6.830 -2.615 11.173 1.00 0.00 H new ATOM 0 HA ASP B 29 -8.011 0.099 11.176 1.00 0.00 H new ATOM 0 HB2 ASP B 29 -7.214 -1.710 13.487 1.00 0.00 H new ATOM 0 HB3 ASP B 29 -7.563 -0.002 13.671 1.00 0.00 H new ATOM 948 N ARG B 30 -5.012 -1.061 12.014 1.00 0.00 N ATOM 949 CA ARG B 30 -3.597 -0.736 12.085 1.00 0.00 C ATOM 950 C ARG B 30 -3.000 -0.658 10.679 1.00 0.00 C ATOM 951 O ARG B 30 -3.261 -1.520 9.841 1.00 0.00 O ATOM 952 CB ARG B 30 -2.832 -1.780 12.901 1.00 0.00 C ATOM 953 CG ARG B 30 -3.515 -2.034 14.246 1.00 0.00 C ATOM 954 CD ARG B 30 -2.518 -2.572 15.274 1.00 0.00 C ATOM 955 NE ARG B 30 -2.984 -2.257 16.643 1.00 0.00 N ATOM 956 CZ ARG B 30 -2.482 -2.813 17.754 1.00 0.00 C ATOM 957 NH1 ARG B 30 -1.495 -3.716 17.665 1.00 0.00 N ATOM 958 NH2 ARG B 30 -2.966 -2.467 18.955 1.00 0.00 N ATOM 0 H ARG B 30 -5.240 -2.027 12.251 1.00 0.00 H new ATOM 0 HA ARG B 30 -3.503 0.232 12.577 1.00 0.00 H new ATOM 0 HB2 ARG B 30 -2.770 -2.712 12.339 1.00 0.00 H new ATOM 0 HB3 ARG B 30 -1.810 -1.439 13.067 1.00 0.00 H new ATOM 0 HG2 ARG B 30 -3.958 -1.108 14.614 1.00 0.00 H new ATOM 0 HG3 ARG B 30 -4.329 -2.747 14.116 1.00 0.00 H new ATOM 0 HD2 ARG B 30 -2.409 -3.650 15.157 1.00 0.00 H new ATOM 0 HD3 ARG B 30 -1.535 -2.132 15.105 1.00 0.00 H new ATOM 0 HE ARG B 30 -3.734 -1.574 16.747 1.00 0.00 H new ATOM 0 HH11 ARG B 30 -1.126 -3.980 16.751 1.00 0.00 H new ATOM 0 HH12 ARG B 30 -1.113 -4.139 18.511 1.00 0.00 H new ATOM 0 HH21 ARG B 30 -3.717 -1.780 19.024 1.00 0.00 H new ATOM 0 HH22 ARG B 30 -2.583 -2.891 19.800 1.00 0.00 H new ATOM 972 N PRO B 31 -2.187 0.410 10.458 1.00 0.00 N ATOM 973 CA PRO B 31 -1.550 0.611 9.168 1.00 0.00 C ATOM 974 C PRO B 31 -0.384 -0.360 8.975 1.00 0.00 C ATOM 975 O PRO B 31 0.088 -0.555 7.855 1.00 0.00 O ATOM 976 CB PRO B 31 -1.117 2.068 9.166 1.00 0.00 C ATOM 977 CG PRO B 31 -1.109 2.502 10.622 1.00 0.00 C ATOM 978 CD PRO B 31 -1.855 1.450 11.427 1.00 0.00 C ATOM 0 HA PRO B 31 -2.219 0.407 8.332 1.00 0.00 H new ATOM 0 HB2 PRO B 31 -0.129 2.181 8.719 1.00 0.00 H new ATOM 0 HB3 PRO B 31 -1.804 2.679 8.580 1.00 0.00 H new ATOM 0 HG2 PRO B 31 -0.086 2.605 10.984 1.00 0.00 H new ATOM 0 HG3 PRO B 31 -1.586 3.476 10.732 1.00 0.00 H new ATOM 0 HD2 PRO B 31 -1.237 1.057 12.234 1.00 0.00 H new ATOM 0 HD3 PRO B 31 -2.752 1.865 11.886 1.00 0.00 H new ATOM 986 N VAL B 32 0.048 -0.943 10.083 1.00 0.00 N ATOM 987 CA VAL B 32 1.151 -1.889 10.050 1.00 0.00 C ATOM 988 C VAL B 32 0.841 -3.060 10.985 1.00 0.00 C ATOM 989 O VAL B 32 -0.215 -3.092 11.616 1.00 0.00 O ATOM 990 CB VAL B 32 2.461 -1.178 10.396 1.00 0.00 C ATOM 991 CG1 VAL B 32 2.690 0.025 9.480 1.00 0.00 C ATOM 992 CG2 VAL B 32 2.485 -0.759 11.868 1.00 0.00 C ATOM 0 H VAL B 32 -0.346 -0.779 11.010 1.00 0.00 H new ATOM 0 HA VAL B 32 1.274 -2.298 9.047 1.00 0.00 H new ATOM 0 HB VAL B 32 3.277 -1.882 10.235 1.00 0.00 H new ATOM 0 HG11 VAL B 32 3.628 0.512 9.747 1.00 0.00 H new ATOM 0 HG12 VAL B 32 2.738 -0.310 8.444 1.00 0.00 H new ATOM 0 HG13 VAL B 32 1.868 0.732 9.595 1.00 0.00 H new ATOM 0 HG21 VAL B 32 3.427 -0.256 12.088 1.00 0.00 H new ATOM 0 HG22 VAL B 32 1.656 -0.080 12.067 1.00 0.00 H new ATOM 0 HG23 VAL B 32 2.390 -1.642 12.499 1.00 0.00 H new ATOM 1002 N GLY B 33 1.780 -3.993 11.044 1.00 0.00 N ATOM 1003 CA GLY B 33 1.620 -5.163 11.891 1.00 0.00 C ATOM 1004 C GLY B 33 1.125 -6.363 11.081 1.00 0.00 C ATOM 1005 O GLY B 33 0.286 -6.213 10.193 1.00 0.00 O ATOM 0 H GLY B 33 2.654 -3.963 10.519 1.00 0.00 H new ATOM 0 HA2 GLY B 33 2.571 -5.407 12.364 1.00 0.00 H new ATOM 0 HA3 GLY B 33 0.913 -4.943 12.691 1.00 0.00 H new ATOM 1009 N MET B 34 1.664 -7.525 11.417 1.00 0.00 N ATOM 1010 CA MET B 34 1.287 -8.750 10.732 1.00 0.00 C ATOM 1011 C MET B 34 -0.038 -9.294 11.269 1.00 0.00 C ATOM 1012 O MET B 34 -0.875 -9.768 10.503 1.00 0.00 O ATOM 1013 CB MET B 34 2.385 -9.800 10.922 1.00 0.00 C ATOM 1014 CG MET B 34 3.741 -9.264 10.461 1.00 0.00 C ATOM 1015 SD MET B 34 3.936 -9.525 8.706 1.00 0.00 S ATOM 1016 CE MET B 34 3.664 -11.287 8.622 1.00 0.00 C ATOM 0 H MET B 34 2.359 -7.645 12.154 1.00 0.00 H new ATOM 0 HA MET B 34 1.163 -8.528 9.672 1.00 0.00 H new ATOM 0 HB2 MET B 34 2.441 -10.087 11.972 1.00 0.00 H new ATOM 0 HB3 MET B 34 2.135 -10.699 10.359 1.00 0.00 H new ATOM 0 HG2 MET B 34 3.818 -8.201 10.690 1.00 0.00 H new ATOM 0 HG3 MET B 34 4.543 -9.765 11.003 1.00 0.00 H new ATOM 0 HE1 MET B 34 4.248 -11.707 7.803 1.00 0.00 H new ATOM 0 HE2 MET B 34 3.972 -11.748 9.561 1.00 0.00 H new ATOM 0 HE3 MET B 34 2.606 -11.484 8.451 1.00 0.00 H new ATOM 1026 N ASP B 35 -0.187 -9.207 12.583 1.00 0.00 N ATOM 1027 CA ASP B 35 -1.396 -9.684 13.232 1.00 0.00 C ATOM 1028 C ASP B 35 -2.618 -9.127 12.499 1.00 0.00 C ATOM 1029 O ASP B 35 -3.644 -9.797 12.395 1.00 0.00 O ATOM 1030 CB ASP B 35 -1.463 -9.215 14.686 1.00 0.00 C ATOM 1031 CG ASP B 35 -1.677 -10.326 15.716 1.00 0.00 C ATOM 1032 OD1 ASP B 35 -2.823 -10.820 15.787 1.00 0.00 O ATOM 1033 OD2 ASP B 35 -0.690 -10.656 16.408 1.00 0.00 O ATOM 0 H ASP B 35 0.510 -8.813 13.215 1.00 0.00 H new ATOM 0 HA ASP B 35 -1.385 -10.774 13.205 1.00 0.00 H new ATOM 0 HB2 ASP B 35 -0.538 -8.692 14.926 1.00 0.00 H new ATOM 0 HB3 ASP B 35 -2.272 -8.491 14.781 1.00 0.00 H new ATOM 1038 N THR B 36 -2.467 -7.905 12.008 1.00 0.00 N ATOM 1039 CA THR B 36 -3.545 -7.249 11.288 1.00 0.00 C ATOM 1040 C THR B 36 -3.525 -7.657 9.813 1.00 0.00 C ATOM 1041 O THR B 36 -4.572 -7.726 9.171 1.00 0.00 O ATOM 1042 CB THR B 36 -3.409 -5.741 11.503 1.00 0.00 C ATOM 1043 OG1 THR B 36 -3.797 -5.547 12.860 1.00 0.00 O ATOM 1044 CG2 THR B 36 -4.438 -4.940 10.703 1.00 0.00 C ATOM 0 H THR B 36 -1.614 -7.352 12.095 1.00 0.00 H new ATOM 0 HA THR B 36 -4.519 -7.558 11.666 1.00 0.00 H new ATOM 0 HB THR B 36 -2.405 -5.424 11.222 1.00 0.00 H new ATOM 0 HG1 THR B 36 -3.736 -4.595 13.085 1.00 0.00 H new ATOM 0 HG21 THR B 36 -4.297 -3.876 10.892 1.00 0.00 H new ATOM 0 HG22 THR B 36 -4.308 -5.140 9.639 1.00 0.00 H new ATOM 0 HG23 THR B 36 -5.443 -5.233 11.007 1.00 0.00 H new ATOM 1052 N LEU B 37 -2.323 -7.916 9.319 1.00 0.00 N ATOM 1053 CA LEU B 37 -2.154 -8.314 7.933 1.00 0.00 C ATOM 1054 C LEU B 37 -2.701 -9.731 7.743 1.00 0.00 C ATOM 1055 O LEU B 37 -3.639 -9.940 6.976 1.00 0.00 O ATOM 1056 CB LEU B 37 -0.694 -8.157 7.504 1.00 0.00 C ATOM 1057 CG LEU B 37 -0.392 -8.443 6.032 1.00 0.00 C ATOM 1058 CD1 LEU B 37 -0.684 -7.218 5.164 1.00 0.00 C ATOM 1059 CD2 LEU B 37 1.044 -8.942 5.854 1.00 0.00 C ATOM 0 H LEU B 37 -1.457 -7.858 9.855 1.00 0.00 H new ATOM 0 HA LEU B 37 -2.727 -7.659 7.277 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -0.378 -7.138 7.728 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -0.083 -8.821 8.115 1.00 0.00 H new ATOM 0 HG LEU B 37 -1.055 -9.241 5.696 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -0.461 -7.449 4.122 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -1.736 -6.947 5.258 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -0.064 -6.384 5.492 1.00 0.00 H new ATOM 0 HD21 LEU B 37 1.233 -9.138 4.799 1.00 0.00 H new ATOM 0 HD22 LEU B 37 1.740 -8.183 6.212 1.00 0.00 H new ATOM 0 HD23 LEU B 37 1.183 -9.861 6.424 1.00 0.00 H new ATOM 1071 N ASN B 38 -2.090 -10.667 8.455 1.00 0.00 N ATOM 1072 CA ASN B 38 -2.504 -12.057 8.375 1.00 0.00 C ATOM 1073 C ASN B 38 -4.018 -12.147 8.580 1.00 0.00 C ATOM 1074 O ASN B 38 -4.708 -12.842 7.836 1.00 0.00 O ATOM 1075 CB ASN B 38 -1.829 -12.896 9.462 1.00 0.00 C ATOM 1076 CG ASN B 38 -0.338 -12.569 9.561 1.00 0.00 C ATOM 1077 OD1 ASN B 38 0.168 -11.660 8.923 1.00 0.00 O ATOM 1078 ND2 ASN B 38 0.335 -13.357 10.394 1.00 0.00 N ATOM 0 H ASN B 38 -1.312 -10.490 9.090 1.00 0.00 H new ATOM 0 HA ASN B 38 -2.217 -12.438 7.395 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -2.310 -12.709 10.422 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -1.959 -13.956 9.241 1.00 0.00 H new ATOM 0 HD21 ASN B 38 1.336 -13.219 10.530 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -0.150 -14.100 10.897 1.00 0.00 H new ATOM 1085 N SER B 39 -4.489 -11.434 9.592 1.00 0.00 N ATOM 1086 CA SER B 39 -5.908 -11.424 9.904 1.00 0.00 C ATOM 1087 C SER B 39 -6.728 -11.395 8.612 1.00 0.00 C ATOM 1088 O SER B 39 -7.685 -12.152 8.463 1.00 0.00 O ATOM 1089 CB SER B 39 -6.269 -10.229 10.789 1.00 0.00 C ATOM 1090 OG SER B 39 -7.661 -10.193 11.095 1.00 0.00 O ATOM 0 H SER B 39 -3.913 -10.859 10.207 1.00 0.00 H new ATOM 0 HA SER B 39 -6.143 -12.334 10.456 1.00 0.00 H new ATOM 0 HB2 SER B 39 -5.695 -10.277 11.715 1.00 0.00 H new ATOM 0 HB3 SER B 39 -5.984 -9.305 10.285 1.00 0.00 H new ATOM 0 HG SER B 39 -7.851 -9.417 11.663 1.00 0.00 H new ATOM 1096 N ALA B 40 -6.322 -10.512 7.711 1.00 0.00 N ATOM 1097 CA ALA B 40 -7.007 -10.374 6.437 1.00 0.00 C ATOM 1098 C ALA B 40 -6.861 -11.673 5.642 1.00 0.00 C ATOM 1099 O ALA B 40 -7.854 -12.327 5.327 1.00 0.00 O ATOM 1100 CB ALA B 40 -6.448 -9.164 5.686 1.00 0.00 C ATOM 0 H ALA B 40 -5.527 -9.885 7.838 1.00 0.00 H new ATOM 0 HA ALA B 40 -8.072 -10.199 6.590 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -6.961 -9.060 4.730 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -6.602 -8.264 6.281 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -5.381 -9.305 5.511 1.00 0.00 H new ATOM 1106 N ILE B 41 -5.615 -12.007 5.339 1.00 0.00 N ATOM 1107 CA ILE B 41 -5.327 -13.216 4.586 1.00 0.00 C ATOM 1108 C ILE B 41 -6.207 -14.356 5.103 1.00 0.00 C ATOM 1109 O ILE B 41 -6.749 -15.131 4.317 1.00 0.00 O ATOM 1110 CB ILE B 41 -3.829 -13.528 4.627 1.00 0.00 C ATOM 1111 CG1 ILE B 41 -3.013 -12.381 4.028 1.00 0.00 C ATOM 1112 CG2 ILE B 41 -3.529 -14.863 3.944 1.00 0.00 C ATOM 1113 CD1 ILE B 41 -1.675 -12.223 4.752 1.00 0.00 C ATOM 0 H ILE B 41 -4.794 -11.462 5.601 1.00 0.00 H new ATOM 0 HA ILE B 41 -5.572 -13.077 3.533 1.00 0.00 H new ATOM 0 HB ILE B 41 -3.529 -13.625 5.670 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -2.837 -12.569 2.969 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -3.580 -11.452 4.097 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -2.458 -15.061 3.987 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -4.067 -15.662 4.455 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -3.848 -14.819 2.903 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -1.115 -11.401 4.306 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -1.854 -12.011 5.806 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -1.101 -13.145 4.660 1.00 0.00 H new ATOM 1125 N GLU B 42 -6.321 -14.421 6.421 1.00 0.00 N ATOM 1126 CA GLU B 42 -7.126 -15.453 7.052 1.00 0.00 C ATOM 1127 C GLU B 42 -8.603 -15.262 6.703 1.00 0.00 C ATOM 1128 O GLU B 42 -9.255 -16.186 6.219 1.00 0.00 O ATOM 1129 CB GLU B 42 -6.917 -15.462 8.568 1.00 0.00 C ATOM 1130 CG GLU B 42 -5.550 -16.045 8.930 1.00 0.00 C ATOM 1131 CD GLU B 42 -5.540 -16.569 10.368 1.00 0.00 C ATOM 1132 OE1 GLU B 42 -5.284 -15.743 11.270 1.00 0.00 O ATOM 1133 OE2 GLU B 42 -5.790 -17.783 10.531 1.00 0.00 O ATOM 0 H GLU B 42 -5.869 -13.776 7.069 1.00 0.00 H new ATOM 0 HA GLU B 42 -6.805 -16.422 6.669 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -6.997 -14.446 8.956 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -7.704 -16.048 9.044 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -5.302 -16.854 8.243 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -4.782 -15.280 8.812 1.00 0.00 H new ATOM 1140 N ASN B 43 -9.088 -14.056 6.963 1.00 0.00 N ATOM 1141 CA ASN B 43 -10.476 -13.732 6.682 1.00 0.00 C ATOM 1142 C ASN B 43 -10.804 -14.119 5.239 1.00 0.00 C ATOM 1143 O ASN B 43 -11.683 -14.946 4.999 1.00 0.00 O ATOM 1144 CB ASN B 43 -10.734 -12.232 6.839 1.00 0.00 C ATOM 1145 CG ASN B 43 -12.047 -11.976 7.582 1.00 0.00 C ATOM 1146 OD1 ASN B 43 -13.036 -12.668 7.403 1.00 0.00 O ATOM 1147 ND2 ASN B 43 -12.002 -10.946 8.422 1.00 0.00 N ATOM 0 H ASN B 43 -8.544 -13.292 7.365 1.00 0.00 H new ATOM 0 HA ASN B 43 -11.100 -14.281 7.387 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -9.909 -11.772 7.383 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -10.770 -11.761 5.857 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -12.828 -10.694 8.964 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -11.141 -10.408 8.524 1.00 0.00 H new ATOM 1154 N LEU B 44 -10.081 -13.503 4.315 1.00 0.00 N ATOM 1155 CA LEU B 44 -10.284 -13.773 2.902 1.00 0.00 C ATOM 1156 C LEU B 44 -10.188 -15.280 2.656 1.00 0.00 C ATOM 1157 O LEU B 44 -11.104 -15.881 2.098 1.00 0.00 O ATOM 1158 CB LEU B 44 -9.314 -12.948 2.054 1.00 0.00 C ATOM 1159 CG LEU B 44 -9.548 -11.436 2.046 1.00 0.00 C ATOM 1160 CD1 LEU B 44 -8.347 -10.698 1.452 1.00 0.00 C ATOM 1161 CD2 LEU B 44 -10.851 -11.087 1.323 1.00 0.00 C ATOM 0 H LEU B 44 -9.353 -12.817 4.518 1.00 0.00 H new ATOM 0 HA LEU B 44 -11.283 -13.463 2.595 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -8.301 -13.137 2.409 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -9.364 -13.309 1.027 1.00 0.00 H new ATOM 0 HG LEU B 44 -9.653 -11.101 3.078 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.540 -9.625 1.458 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.459 -10.911 2.047 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -8.186 -11.032 0.427 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -10.994 -10.006 1.332 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -10.801 -11.438 0.292 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -11.688 -11.567 1.830 1.00 0.00 H new ATOM 1173 N MET B 45 -9.070 -15.847 3.085 1.00 0.00 N ATOM 1174 CA MET B 45 -8.842 -17.272 2.919 1.00 0.00 C ATOM 1175 C MET B 45 -10.137 -18.062 3.121 1.00 0.00 C ATOM 1176 O MET B 45 -10.649 -18.671 2.183 1.00 0.00 O ATOM 1177 CB MET B 45 -7.794 -17.743 3.928 1.00 0.00 C ATOM 1178 CG MET B 45 -6.385 -17.658 3.337 1.00 0.00 C ATOM 1179 SD MET B 45 -5.996 -19.167 2.467 1.00 0.00 S ATOM 1180 CE MET B 45 -4.982 -18.513 1.151 1.00 0.00 C ATOM 0 H MET B 45 -8.312 -15.345 3.547 1.00 0.00 H new ATOM 0 HA MET B 45 -8.486 -17.448 1.904 1.00 0.00 H new ATOM 0 HB2 MET B 45 -7.852 -17.132 4.829 1.00 0.00 H new ATOM 0 HB3 MET B 45 -8.006 -18.770 4.225 1.00 0.00 H new ATOM 0 HG2 MET B 45 -6.318 -16.809 2.657 1.00 0.00 H new ATOM 0 HG3 MET B 45 -5.658 -17.489 4.131 1.00 0.00 H new ATOM 0 HE1 MET B 45 -5.179 -19.064 0.232 1.00 0.00 H new ATOM 0 HE2 MET B 45 -5.217 -17.459 1.000 1.00 0.00 H new ATOM 0 HE3 MET B 45 -3.930 -18.616 1.417 1.00 0.00 H new ATOM 1190 N THR B 46 -10.629 -18.025 4.351 1.00 0.00 N ATOM 1191 CA THR B 46 -11.854 -18.730 4.688 1.00 0.00 C ATOM 1192 C THR B 46 -13.051 -18.086 3.985 1.00 0.00 C ATOM 1193 O THR B 46 -13.807 -18.764 3.291 1.00 0.00 O ATOM 1194 CB THR B 46 -11.984 -18.750 6.212 1.00 0.00 C ATOM 1195 OG1 THR B 46 -13.243 -19.374 6.445 1.00 0.00 O ATOM 1196 CG2 THR B 46 -12.146 -17.349 6.805 1.00 0.00 C ATOM 0 H THR B 46 -10.202 -17.518 5.126 1.00 0.00 H new ATOM 0 HA THR B 46 -11.826 -19.761 4.336 1.00 0.00 H new ATOM 0 HB THR B 46 -11.105 -19.227 6.645 1.00 0.00 H new ATOM 0 HG1 THR B 46 -13.407 -19.429 7.410 1.00 0.00 H new ATOM 0 HG21 THR B 46 -12.234 -17.421 7.889 1.00 0.00 H new ATOM 0 HG22 THR B 46 -11.276 -16.743 6.551 1.00 0.00 H new ATOM 0 HG23 THR B 46 -13.044 -16.883 6.398 1.00 0.00 H new ATOM 1204 N SER B 47 -13.185 -16.783 4.189 1.00 0.00 N ATOM 1205 CA SER B 47 -14.277 -16.040 3.583 1.00 0.00 C ATOM 1206 C SER B 47 -14.576 -16.592 2.188 1.00 0.00 C ATOM 1207 O SER B 47 -15.434 -17.459 2.031 1.00 0.00 O ATOM 1208 CB SER B 47 -13.949 -14.547 3.504 1.00 0.00 C ATOM 1209 OG SER B 47 -14.234 -13.873 4.726 1.00 0.00 O ATOM 0 H SER B 47 -12.556 -16.224 4.765 1.00 0.00 H new ATOM 0 HA SER B 47 -15.161 -16.158 4.210 1.00 0.00 H new ATOM 0 HB2 SER B 47 -12.895 -14.420 3.257 1.00 0.00 H new ATOM 0 HB3 SER B 47 -14.523 -14.092 2.697 1.00 0.00 H new ATOM 0 HG SER B 47 -13.478 -13.976 5.341 1.00 0.00 H new ATOM 1215 N SER B 48 -13.851 -16.068 1.211 1.00 0.00 N ATOM 1216 CA SER B 48 -14.028 -16.498 -0.166 1.00 0.00 C ATOM 1217 C SER B 48 -13.367 -17.862 -0.377 1.00 0.00 C ATOM 1218 O SER B 48 -12.847 -18.456 0.566 1.00 0.00 O ATOM 1219 CB SER B 48 -13.451 -15.471 -1.142 1.00 0.00 C ATOM 1220 OG SER B 48 -14.423 -14.507 -1.538 1.00 0.00 O ATOM 0 H SER B 48 -13.140 -15.349 1.345 1.00 0.00 H new ATOM 0 HA SER B 48 -15.097 -16.585 -0.363 1.00 0.00 H new ATOM 0 HB2 SER B 48 -12.606 -14.964 -0.677 1.00 0.00 H new ATOM 0 HB3 SER B 48 -13.069 -15.984 -2.024 1.00 0.00 H new ATOM 0 HG SER B 48 -14.016 -13.868 -2.160 1.00 0.00 H new ATOM 1226 N SER B 49 -13.407 -18.317 -1.621 1.00 0.00 N ATOM 1227 CA SER B 49 -12.818 -19.599 -1.968 1.00 0.00 C ATOM 1228 C SER B 49 -11.505 -19.384 -2.723 1.00 0.00 C ATOM 1229 O SER B 49 -11.067 -18.249 -2.904 1.00 0.00 O ATOM 1230 CB SER B 49 -13.782 -20.438 -2.809 1.00 0.00 C ATOM 1231 OG SER B 49 -14.951 -20.801 -2.079 1.00 0.00 O ATOM 0 H SER B 49 -13.838 -17.821 -2.401 1.00 0.00 H new ATOM 0 HA SER B 49 -12.615 -20.143 -1.046 1.00 0.00 H new ATOM 0 HB2 SER B 49 -14.070 -19.877 -3.698 1.00 0.00 H new ATOM 0 HB3 SER B 49 -13.274 -21.340 -3.151 1.00 0.00 H new ATOM 0 HG SER B 49 -15.542 -21.334 -2.651 1.00 0.00 H new ATOM 1237 N LYS B 50 -10.913 -20.493 -3.142 1.00 0.00 N ATOM 1238 CA LYS B 50 -9.658 -20.440 -3.873 1.00 0.00 C ATOM 1239 C LYS B 50 -9.948 -20.234 -5.361 1.00 0.00 C ATOM 1240 O LYS B 50 -9.203 -19.541 -6.052 1.00 0.00 O ATOM 1241 CB LYS B 50 -8.813 -21.680 -3.577 1.00 0.00 C ATOM 1242 CG LYS B 50 -7.907 -22.022 -4.762 1.00 0.00 C ATOM 1243 CD LYS B 50 -6.571 -22.594 -4.284 1.00 0.00 C ATOM 1244 CE LYS B 50 -5.444 -21.574 -4.457 1.00 0.00 C ATOM 1245 NZ LYS B 50 -4.509 -22.009 -5.518 1.00 0.00 N ATOM 0 H LYS B 50 -11.279 -21.433 -2.989 1.00 0.00 H new ATOM 0 HA LYS B 50 -9.061 -19.590 -3.544 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -8.206 -21.507 -2.688 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -9.465 -22.525 -3.358 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -8.405 -22.744 -5.409 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -7.731 -21.128 -5.360 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -6.649 -22.881 -3.235 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -6.337 -23.498 -4.845 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -5.863 -20.600 -4.710 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -4.906 -21.455 -3.517 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -3.555 -21.652 -5.308 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -4.489 -23.048 -5.559 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -4.825 -21.633 -6.435 1.00 0.00 H new ATOM 1259 N GLU B 51 -11.032 -20.848 -5.811 1.00 0.00 N ATOM 1260 CA GLU B 51 -11.429 -20.741 -7.204 1.00 0.00 C ATOM 1261 C GLU B 51 -12.112 -19.396 -7.459 1.00 0.00 C ATOM 1262 O GLU B 51 -12.201 -18.948 -8.601 1.00 0.00 O ATOM 1263 CB GLU B 51 -12.340 -21.903 -7.606 1.00 0.00 C ATOM 1264 CG GLU B 51 -11.550 -22.991 -8.337 1.00 0.00 C ATOM 1265 CD GLU B 51 -12.259 -23.409 -9.627 1.00 0.00 C ATOM 1266 OE1 GLU B 51 -13.186 -24.240 -9.522 1.00 0.00 O ATOM 1267 OE2 GLU B 51 -11.856 -22.887 -10.690 1.00 0.00 O ATOM 0 H GLU B 51 -11.648 -21.422 -5.235 1.00 0.00 H new ATOM 0 HA GLU B 51 -10.533 -20.795 -7.822 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -12.811 -22.325 -6.718 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -13.141 -21.537 -8.248 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -10.550 -22.625 -8.569 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -11.430 -23.857 -7.687 1.00 0.00 H new ATOM 1274 N ASP B 52 -12.577 -18.790 -6.377 1.00 0.00 N ATOM 1275 CA ASP B 52 -13.249 -17.505 -6.469 1.00 0.00 C ATOM 1276 C ASP B 52 -12.220 -16.418 -6.788 1.00 0.00 C ATOM 1277 O ASP B 52 -12.501 -15.499 -7.556 1.00 0.00 O ATOM 1278 CB ASP B 52 -13.926 -17.141 -5.146 1.00 0.00 C ATOM 1279 CG ASP B 52 -15.439 -16.933 -5.230 1.00 0.00 C ATOM 1280 OD1 ASP B 52 -16.097 -17.794 -5.854 1.00 0.00 O ATOM 1281 OD2 ASP B 52 -15.904 -15.918 -4.668 1.00 0.00 O ATOM 0 H ASP B 52 -12.502 -19.165 -5.431 1.00 0.00 H new ATOM 0 HA ASP B 52 -14.003 -17.574 -7.253 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -13.722 -17.930 -4.422 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -13.470 -16.229 -4.761 1.00 0.00 H new ATOM 1286 N TRP B 53 -11.050 -16.559 -6.183 1.00 0.00 N ATOM 1287 CA TRP B 53 -9.978 -15.601 -6.393 1.00 0.00 C ATOM 1288 C TRP B 53 -9.728 -15.494 -7.899 1.00 0.00 C ATOM 1289 O TRP B 53 -9.203 -16.422 -8.512 1.00 0.00 O ATOM 1290 CB TRP B 53 -8.728 -15.995 -5.606 1.00 0.00 C ATOM 1291 CG TRP B 53 -8.990 -16.290 -4.128 1.00 0.00 C ATOM 1292 CD1 TRP B 53 -9.897 -15.722 -3.321 1.00 0.00 C ATOM 1293 CD2 TRP B 53 -8.298 -17.255 -3.307 1.00 0.00 C ATOM 1294 NE1 TRP B 53 -9.840 -16.248 -2.046 1.00 0.00 N ATOM 1295 CE2 TRP B 53 -8.837 -17.209 -2.038 1.00 0.00 C ATOM 1296 CE3 TRP B 53 -7.250 -18.136 -3.627 1.00 0.00 C ATOM 1297 CZ2 TRP B 53 -8.393 -18.021 -0.987 1.00 0.00 C ATOM 1298 CZ3 TRP B 53 -6.818 -18.941 -2.566 1.00 0.00 C ATOM 1299 CH2 TRP B 53 -7.350 -18.907 -1.283 1.00 0.00 C ATOM 0 H TRP B 53 -10.821 -17.323 -5.547 1.00 0.00 H new ATOM 0 HA TRP B 53 -10.260 -14.618 -6.016 1.00 0.00 H new ATOM 0 HB2 TRP B 53 -8.283 -16.876 -6.068 1.00 0.00 H new ATOM 0 HB3 TRP B 53 -7.996 -15.191 -5.681 1.00 0.00 H new ATOM 0 HD1 TRP B 53 -10.586 -14.950 -3.630 1.00 0.00 H new ATOM 0 HE1 TRP B 53 -10.426 -15.980 -1.255 1.00 0.00 H new ATOM 0 HE3 TRP B 53 -6.813 -18.188 -4.613 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 -8.831 -17.967 -0.001 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 -6.015 -19.637 -2.758 1.00 0.00 H new ATOM 0 HH2 TRP B 53 -6.961 -19.561 -0.517 1.00 0.00 H new ATOM 1310 N PRO B 54 -10.126 -14.324 -8.466 1.00 0.00 N ATOM 1311 CA PRO B 54 -9.950 -14.084 -9.889 1.00 0.00 C ATOM 1312 C PRO B 54 -8.486 -13.786 -10.217 1.00 0.00 C ATOM 1313 O PRO B 54 -7.740 -13.303 -9.366 1.00 0.00 O ATOM 1314 CB PRO B 54 -10.879 -12.925 -10.210 1.00 0.00 C ATOM 1315 CG PRO B 54 -11.189 -12.258 -8.879 1.00 0.00 C ATOM 1316 CD PRO B 54 -10.751 -13.202 -7.772 1.00 0.00 C ATOM 0 HA PRO B 54 -10.197 -14.955 -10.497 1.00 0.00 H new ATOM 0 HB2 PRO B 54 -10.406 -12.224 -10.897 1.00 0.00 H new ATOM 0 HB3 PRO B 54 -11.791 -13.277 -10.692 1.00 0.00 H new ATOM 0 HG2 PRO B 54 -10.665 -11.306 -8.798 1.00 0.00 H new ATOM 0 HG3 PRO B 54 -12.255 -12.043 -8.798 1.00 0.00 H new ATOM 0 HD2 PRO B 54 -10.050 -12.717 -7.092 1.00 0.00 H new ATOM 0 HD3 PRO B 54 -11.600 -13.531 -7.173 1.00 0.00 H new ATOM 1324 N SER B 55 -8.117 -14.086 -11.454 1.00 0.00 N ATOM 1325 CA SER B 55 -6.756 -13.856 -11.906 1.00 0.00 C ATOM 1326 C SER B 55 -6.562 -12.378 -12.254 1.00 0.00 C ATOM 1327 O SER B 55 -7.383 -11.790 -12.956 1.00 0.00 O ATOM 1328 CB SER B 55 -6.420 -14.734 -13.113 1.00 0.00 C ATOM 1329 OG SER B 55 -7.510 -14.825 -14.027 1.00 0.00 O ATOM 0 H SER B 55 -8.738 -14.487 -12.157 1.00 0.00 H new ATOM 0 HA SER B 55 -6.077 -14.124 -11.096 1.00 0.00 H new ATOM 0 HB2 SER B 55 -5.549 -14.326 -13.627 1.00 0.00 H new ATOM 0 HB3 SER B 55 -6.150 -15.733 -12.771 1.00 0.00 H new ATOM 0 HG SER B 55 -7.255 -15.392 -14.784 1.00 0.00 H new ATOM 1335 N VAL B 56 -5.472 -11.822 -11.747 1.00 0.00 N ATOM 1336 CA VAL B 56 -5.160 -10.425 -11.995 1.00 0.00 C ATOM 1337 C VAL B 56 -3.672 -10.289 -12.323 1.00 0.00 C ATOM 1338 O VAL B 56 -2.915 -11.251 -12.201 1.00 0.00 O ATOM 1339 CB VAL B 56 -5.589 -9.572 -10.800 1.00 0.00 C ATOM 1340 CG1 VAL B 56 -7.097 -9.679 -10.563 1.00 0.00 C ATOM 1341 CG2 VAL B 56 -4.808 -9.959 -9.542 1.00 0.00 C ATOM 0 H VAL B 56 -4.794 -12.314 -11.165 1.00 0.00 H new ATOM 0 HA VAL B 56 -5.718 -10.057 -12.856 1.00 0.00 H new ATOM 0 HB VAL B 56 -5.359 -8.532 -11.031 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -7.376 -9.063 -9.708 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -7.630 -9.333 -11.449 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -7.361 -10.718 -10.364 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -5.132 -9.338 -8.707 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -4.993 -11.007 -9.307 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -3.742 -9.808 -9.714 1.00 0.00 H new ATOM 1351 N ASN B 57 -3.296 -9.086 -12.732 1.00 0.00 N ATOM 1352 CA ASN B 57 -1.911 -8.812 -13.078 1.00 0.00 C ATOM 1353 C ASN B 57 -1.378 -7.693 -12.182 1.00 0.00 C ATOM 1354 O ASN B 57 -1.765 -6.535 -12.332 1.00 0.00 O ATOM 1355 CB ASN B 57 -1.787 -8.353 -14.532 1.00 0.00 C ATOM 1356 CG ASN B 57 -2.180 -9.474 -15.496 1.00 0.00 C ATOM 1357 OD1 ASN B 57 -2.170 -10.647 -15.162 1.00 0.00 O ATOM 1358 ND2 ASN B 57 -2.524 -9.049 -16.709 1.00 0.00 N ATOM 0 H ASN B 57 -3.926 -8.290 -12.832 1.00 0.00 H new ATOM 0 HA ASN B 57 -1.341 -9.731 -12.940 1.00 0.00 H new ATOM 0 HB2 ASN B 57 -2.425 -7.485 -14.699 1.00 0.00 H new ATOM 0 HB3 ASN B 57 -0.763 -8.039 -14.732 1.00 0.00 H new ATOM 0 HD21 ASN B 57 -2.801 -9.720 -17.425 1.00 0.00 H new ATOM 0 HD22 ASN B 57 -2.511 -8.052 -16.923 1.00 0.00 H new ATOM 1365 N MET B 58 -0.498 -8.078 -11.269 1.00 0.00 N ATOM 1366 CA MET B 58 0.092 -7.121 -10.348 1.00 0.00 C ATOM 1367 C MET B 58 1.266 -6.386 -10.999 1.00 0.00 C ATOM 1368 O MET B 58 2.336 -6.963 -11.187 1.00 0.00 O ATOM 1369 CB MET B 58 0.578 -7.851 -9.095 1.00 0.00 C ATOM 1370 CG MET B 58 1.546 -6.979 -8.293 1.00 0.00 C ATOM 1371 SD MET B 58 1.901 -7.747 -6.721 1.00 0.00 S ATOM 1372 CE MET B 58 0.240 -8.042 -6.138 1.00 0.00 C ATOM 0 H MET B 58 -0.179 -9.039 -11.147 1.00 0.00 H new ATOM 0 HA MET B 58 -0.668 -6.387 -10.080 1.00 0.00 H new ATOM 0 HB2 MET B 58 -0.275 -8.120 -8.473 1.00 0.00 H new ATOM 0 HB3 MET B 58 1.071 -8.781 -9.380 1.00 0.00 H new ATOM 0 HG2 MET B 58 2.470 -6.836 -8.854 1.00 0.00 H new ATOM 0 HG3 MET B 58 1.113 -5.991 -8.135 1.00 0.00 H new ATOM 0 HE1 MET B 58 0.214 -7.951 -5.052 1.00 0.00 H new ATOM 0 HE2 MET B 58 -0.436 -7.310 -6.580 1.00 0.00 H new ATOM 0 HE3 MET B 58 -0.074 -9.046 -6.425 1.00 0.00 H new ATOM 1382 N ASN B 59 1.025 -5.125 -11.325 1.00 0.00 N ATOM 1383 CA ASN B 59 2.049 -4.305 -11.951 1.00 0.00 C ATOM 1384 C ASN B 59 2.989 -3.761 -10.873 1.00 0.00 C ATOM 1385 O ASN B 59 2.538 -3.210 -9.871 1.00 0.00 O ATOM 1386 CB ASN B 59 1.430 -3.114 -12.684 1.00 0.00 C ATOM 1387 CG ASN B 59 1.188 -3.442 -14.158 1.00 0.00 C ATOM 1388 OD1 ASN B 59 1.858 -2.945 -15.049 1.00 0.00 O ATOM 1389 ND2 ASN B 59 0.198 -4.305 -14.366 1.00 0.00 N ATOM 0 H ASN B 59 0.136 -4.651 -11.168 1.00 0.00 H new ATOM 0 HA ASN B 59 2.588 -4.926 -12.666 1.00 0.00 H new ATOM 0 HB2 ASN B 59 0.488 -2.840 -12.209 1.00 0.00 H new ATOM 0 HB3 ASN B 59 2.090 -2.250 -12.604 1.00 0.00 H new ATOM 0 HD21 ASN B 59 -0.040 -4.589 -15.316 1.00 0.00 H new ATOM 0 HD22 ASN B 59 -0.323 -4.683 -13.575 1.00 0.00 H new ATOM 1396 N VAL B 60 4.280 -3.934 -11.117 1.00 0.00 N ATOM 1397 CA VAL B 60 5.288 -3.467 -10.180 1.00 0.00 C ATOM 1398 C VAL B 60 6.362 -2.686 -10.940 1.00 0.00 C ATOM 1399 O VAL B 60 7.215 -3.278 -11.599 1.00 0.00 O ATOM 1400 CB VAL B 60 5.855 -4.648 -9.390 1.00 0.00 C ATOM 1401 CG1 VAL B 60 6.817 -4.168 -8.301 1.00 0.00 C ATOM 1402 CG2 VAL B 60 4.731 -5.498 -8.792 1.00 0.00 C ATOM 0 H VAL B 60 4.651 -4.391 -11.950 1.00 0.00 H new ATOM 0 HA VAL B 60 4.846 -2.787 -9.451 1.00 0.00 H new ATOM 0 HB VAL B 60 6.418 -5.275 -10.082 1.00 0.00 H new ATOM 0 HG11 VAL B 60 7.206 -5.027 -7.754 1.00 0.00 H new ATOM 0 HG12 VAL B 60 7.644 -3.625 -8.759 1.00 0.00 H new ATOM 0 HG13 VAL B 60 6.288 -3.509 -7.613 1.00 0.00 H new ATOM 0 HG21 VAL B 60 5.161 -6.331 -8.236 1.00 0.00 H new ATOM 0 HG22 VAL B 60 4.129 -4.885 -8.121 1.00 0.00 H new ATOM 0 HG23 VAL B 60 4.101 -5.884 -9.593 1.00 0.00 H new ATOM 1412 N ALA B 61 6.284 -1.369 -10.824 1.00 0.00 N ATOM 1413 CA ALA B 61 7.239 -0.501 -11.492 1.00 0.00 C ATOM 1414 C ALA B 61 8.255 0.013 -10.471 1.00 0.00 C ATOM 1415 O ALA B 61 8.409 -0.566 -9.396 1.00 0.00 O ATOM 1416 CB ALA B 61 6.492 0.635 -12.194 1.00 0.00 C ATOM 0 H ALA B 61 5.574 -0.881 -10.277 1.00 0.00 H new ATOM 0 HA ALA B 61 7.789 -1.051 -12.256 1.00 0.00 H new ATOM 0 HB1 ALA B 61 7.208 1.286 -12.695 1.00 0.00 H new ATOM 0 HB2 ALA B 61 5.804 0.218 -12.930 1.00 0.00 H new ATOM 0 HB3 ALA B 61 5.931 1.211 -11.458 1.00 0.00 H new ATOM 1422 N ASP B 62 8.923 1.096 -10.842 1.00 0.00 N ATOM 1423 CA ASP B 62 9.921 1.695 -9.971 1.00 0.00 C ATOM 1424 C ASP B 62 9.412 1.672 -8.529 1.00 0.00 C ATOM 1425 O ASP B 62 10.053 1.097 -7.650 1.00 0.00 O ATOM 1426 CB ASP B 62 10.185 3.152 -10.357 1.00 0.00 C ATOM 1427 CG ASP B 62 11.659 3.559 -10.373 1.00 0.00 C ATOM 1428 OD1 ASP B 62 12.236 3.647 -9.267 1.00 0.00 O ATOM 1429 OD2 ASP B 62 12.177 3.775 -11.490 1.00 0.00 O ATOM 0 H ASP B 62 8.793 1.574 -11.734 1.00 0.00 H new ATOM 0 HA ASP B 62 10.843 1.123 -10.071 1.00 0.00 H new ATOM 0 HB2 ASP B 62 9.763 3.332 -11.346 1.00 0.00 H new ATOM 0 HB3 ASP B 62 9.652 3.799 -9.660 1.00 0.00 H new ATOM 1434 N ALA B 63 8.265 2.305 -8.329 1.00 0.00 N ATOM 1435 CA ALA B 63 7.663 2.364 -7.008 1.00 0.00 C ATOM 1436 C ALA B 63 6.147 2.508 -7.149 1.00 0.00 C ATOM 1437 O ALA B 63 5.588 3.560 -6.842 1.00 0.00 O ATOM 1438 CB ALA B 63 8.287 3.515 -6.214 1.00 0.00 C ATOM 0 H ALA B 63 7.737 2.781 -9.060 1.00 0.00 H new ATOM 0 HA ALA B 63 7.857 1.444 -6.456 1.00 0.00 H new ATOM 0 HB1 ALA B 63 7.836 3.560 -5.223 1.00 0.00 H new ATOM 0 HB2 ALA B 63 9.360 3.350 -6.117 1.00 0.00 H new ATOM 0 HB3 ALA B 63 8.110 4.455 -6.736 1.00 0.00 H new ATOM 1444 N THR B 64 5.523 1.435 -7.614 1.00 0.00 N ATOM 1445 CA THR B 64 4.082 1.429 -7.800 1.00 0.00 C ATOM 1446 C THR B 64 3.561 -0.008 -7.878 1.00 0.00 C ATOM 1447 O THR B 64 4.200 -0.872 -8.476 1.00 0.00 O ATOM 1448 CB THR B 64 3.762 2.260 -9.044 1.00 0.00 C ATOM 1449 OG1 THR B 64 4.001 3.604 -8.635 1.00 0.00 O ATOM 1450 CG2 THR B 64 2.273 2.237 -9.396 1.00 0.00 C ATOM 0 H THR B 64 5.989 0.564 -7.867 1.00 0.00 H new ATOM 0 HA THR B 64 3.571 1.881 -6.950 1.00 0.00 H new ATOM 0 HB THR B 64 4.341 1.886 -9.889 1.00 0.00 H new ATOM 0 HG1 THR B 64 4.160 3.628 -7.668 1.00 0.00 H new ATOM 0 HG21 THR B 64 2.100 2.842 -10.286 1.00 0.00 H new ATOM 0 HG22 THR B 64 1.960 1.211 -9.588 1.00 0.00 H new ATOM 0 HG23 THR B 64 1.696 2.642 -8.564 1.00 0.00 H new ATOM 1458 N VAL B 65 2.406 -0.218 -7.265 1.00 0.00 N ATOM 1459 CA VAL B 65 1.791 -1.535 -7.258 1.00 0.00 C ATOM 1460 C VAL B 65 0.339 -1.418 -7.723 1.00 0.00 C ATOM 1461 O VAL B 65 -0.548 -1.107 -6.929 1.00 0.00 O ATOM 1462 CB VAL B 65 1.926 -2.167 -5.871 1.00 0.00 C ATOM 1463 CG1 VAL B 65 1.094 -3.447 -5.770 1.00 0.00 C ATOM 1464 CG2 VAL B 65 3.393 -2.438 -5.532 1.00 0.00 C ATOM 0 H VAL B 65 1.879 0.501 -6.769 1.00 0.00 H new ATOM 0 HA VAL B 65 2.302 -2.199 -7.955 1.00 0.00 H new ATOM 0 HB VAL B 65 1.540 -1.457 -5.140 1.00 0.00 H new ATOM 0 HG11 VAL B 65 1.207 -3.877 -4.775 1.00 0.00 H new ATOM 0 HG12 VAL B 65 0.044 -3.214 -5.947 1.00 0.00 H new ATOM 0 HG13 VAL B 65 1.437 -4.164 -6.516 1.00 0.00 H new ATOM 0 HG21 VAL B 65 3.460 -2.887 -4.541 1.00 0.00 H new ATOM 0 HG22 VAL B 65 3.817 -3.120 -6.269 1.00 0.00 H new ATOM 0 HG23 VAL B 65 3.948 -1.500 -5.544 1.00 0.00 H new ATOM 1474 N THR B 66 0.140 -1.672 -9.008 1.00 0.00 N ATOM 1475 CA THR B 66 -1.190 -1.599 -9.589 1.00 0.00 C ATOM 1476 C THR B 66 -1.663 -2.991 -10.015 1.00 0.00 C ATOM 1477 O THR B 66 -0.927 -3.727 -10.671 1.00 0.00 O ATOM 1478 CB THR B 66 -1.149 -0.593 -10.740 1.00 0.00 C ATOM 1479 OG1 THR B 66 -0.694 0.613 -10.131 1.00 0.00 O ATOM 1480 CG2 THR B 66 -2.544 -0.242 -11.262 1.00 0.00 C ATOM 0 H THR B 66 0.878 -1.929 -9.664 1.00 0.00 H new ATOM 0 HA THR B 66 -1.921 -1.250 -8.860 1.00 0.00 H new ATOM 0 HB THR B 66 -0.548 -0.998 -11.554 1.00 0.00 H new ATOM 0 HG1 THR B 66 -0.636 1.320 -10.808 1.00 0.00 H new ATOM 0 HG21 THR B 66 -2.457 0.475 -12.078 1.00 0.00 H new ATOM 0 HG22 THR B 66 -3.035 -1.145 -11.624 1.00 0.00 H new ATOM 0 HG23 THR B 66 -3.135 0.194 -10.457 1.00 0.00 H new ATOM 1488 N VAL B 67 -2.889 -3.309 -9.624 1.00 0.00 N ATOM 1489 CA VAL B 67 -3.468 -4.599 -9.958 1.00 0.00 C ATOM 1490 C VAL B 67 -4.464 -4.424 -11.106 1.00 0.00 C ATOM 1491 O VAL B 67 -5.603 -4.013 -10.889 1.00 0.00 O ATOM 1492 CB VAL B 67 -4.097 -5.228 -8.713 1.00 0.00 C ATOM 1493 CG1 VAL B 67 -4.749 -6.571 -9.046 1.00 0.00 C ATOM 1494 CG2 VAL B 67 -3.063 -5.383 -7.595 1.00 0.00 C ATOM 0 H VAL B 67 -3.496 -2.696 -9.080 1.00 0.00 H new ATOM 0 HA VAL B 67 -2.695 -5.288 -10.299 1.00 0.00 H new ATOM 0 HB VAL B 67 -4.878 -4.556 -8.357 1.00 0.00 H new ATOM 0 HG11 VAL B 67 -5.188 -6.996 -8.143 1.00 0.00 H new ATOM 0 HG12 VAL B 67 -5.528 -6.422 -9.793 1.00 0.00 H new ATOM 0 HG13 VAL B 67 -3.996 -7.254 -9.439 1.00 0.00 H new ATOM 0 HG21 VAL B 67 -3.536 -5.832 -6.722 1.00 0.00 H new ATOM 0 HG22 VAL B 67 -2.250 -6.024 -7.937 1.00 0.00 H new ATOM 0 HG23 VAL B 67 -2.666 -4.404 -7.329 1.00 0.00 H new ATOM 1504 N ILE B 68 -3.999 -4.746 -12.305 1.00 0.00 N ATOM 1505 CA ILE B 68 -4.834 -4.629 -13.488 1.00 0.00 C ATOM 1506 C ILE B 68 -5.445 -5.994 -13.811 1.00 0.00 C ATOM 1507 O ILE B 68 -4.872 -7.030 -13.478 1.00 0.00 O ATOM 1508 CB ILE B 68 -4.041 -4.021 -14.646 1.00 0.00 C ATOM 1509 CG1 ILE B 68 -3.088 -2.932 -14.146 1.00 0.00 C ATOM 1510 CG2 ILE B 68 -4.977 -3.505 -15.741 1.00 0.00 C ATOM 1511 CD1 ILE B 68 -2.182 -2.437 -15.275 1.00 0.00 C ATOM 0 H ILE B 68 -3.054 -5.088 -12.482 1.00 0.00 H new ATOM 0 HA ILE B 68 -5.661 -3.943 -13.305 1.00 0.00 H new ATOM 0 HB ILE B 68 -3.429 -4.806 -15.090 1.00 0.00 H new ATOM 0 HG12 ILE B 68 -3.662 -2.098 -13.743 1.00 0.00 H new ATOM 0 HG13 ILE B 68 -2.479 -3.323 -13.331 1.00 0.00 H new ATOM 0 HG21 ILE B 68 -4.387 -3.078 -16.552 1.00 0.00 H new ATOM 0 HG22 ILE B 68 -5.578 -4.330 -16.124 1.00 0.00 H new ATOM 0 HG23 ILE B 68 -5.633 -2.739 -15.328 1.00 0.00 H new ATOM 0 HD11 ILE B 68 -1.515 -1.664 -14.894 1.00 0.00 H new ATOM 0 HD12 ILE B 68 -1.592 -3.269 -15.659 1.00 0.00 H new ATOM 0 HD13 ILE B 68 -2.793 -2.025 -16.078 1.00 0.00 H new ATOM 1523 N SER B 69 -6.602 -5.951 -14.456 1.00 0.00 N ATOM 1524 CA SER B 69 -7.298 -7.171 -14.828 1.00 0.00 C ATOM 1525 C SER B 69 -6.423 -8.007 -15.765 1.00 0.00 C ATOM 1526 O SER B 69 -5.807 -7.473 -16.686 1.00 0.00 O ATOM 1527 CB SER B 69 -8.640 -6.859 -15.493 1.00 0.00 C ATOM 1528 OG SER B 69 -9.582 -7.912 -15.313 1.00 0.00 O ATOM 0 H SER B 69 -7.075 -5.090 -14.730 1.00 0.00 H new ATOM 0 HA SER B 69 -7.497 -7.742 -13.921 1.00 0.00 H new ATOM 0 HB2 SER B 69 -9.044 -5.936 -15.078 1.00 0.00 H new ATOM 0 HB3 SER B 69 -8.486 -6.689 -16.559 1.00 0.00 H new ATOM 0 HG SER B 69 -10.426 -7.674 -15.750 1.00 0.00 H new ATOM 1534 N GLU B 70 -6.397 -9.304 -15.497 1.00 0.00 N ATOM 1535 CA GLU B 70 -5.609 -10.219 -16.305 1.00 0.00 C ATOM 1536 C GLU B 70 -5.933 -10.033 -17.788 1.00 0.00 C ATOM 1537 O GLU B 70 -5.043 -9.762 -18.593 1.00 0.00 O ATOM 1538 CB GLU B 70 -5.837 -11.669 -15.872 1.00 0.00 C ATOM 1539 CG GLU B 70 -4.508 -12.414 -15.731 1.00 0.00 C ATOM 1540 CD GLU B 70 -4.583 -13.796 -16.384 1.00 0.00 C ATOM 1541 OE1 GLU B 70 -4.472 -13.842 -17.628 1.00 0.00 O ATOM 1542 OE2 GLU B 70 -4.749 -14.774 -15.624 1.00 0.00 O ATOM 0 H GLU B 70 -6.909 -9.743 -14.732 1.00 0.00 H new ATOM 0 HA GLU B 70 -4.554 -9.990 -16.152 1.00 0.00 H new ATOM 0 HB2 GLU B 70 -6.372 -11.689 -14.922 1.00 0.00 H new ATOM 0 HB3 GLU B 70 -6.467 -12.176 -16.603 1.00 0.00 H new ATOM 0 HG2 GLU B 70 -3.710 -11.832 -16.193 1.00 0.00 H new ATOM 0 HG3 GLU B 70 -4.256 -12.519 -14.676 1.00 0.00 H new ATOM 1549 N LYS B 71 -7.211 -10.185 -18.105 1.00 0.00 N ATOM 1550 CA LYS B 71 -7.664 -10.036 -19.478 1.00 0.00 C ATOM 1551 C LYS B 71 -7.409 -8.601 -19.942 1.00 0.00 C ATOM 1552 O LYS B 71 -6.418 -8.330 -20.618 1.00 0.00 O ATOM 1553 CB LYS B 71 -9.123 -10.476 -19.611 1.00 0.00 C ATOM 1554 CG LYS B 71 -9.232 -11.789 -20.388 1.00 0.00 C ATOM 1555 CD LYS B 71 -10.642 -11.978 -20.951 1.00 0.00 C ATOM 1556 CE LYS B 71 -11.451 -12.949 -20.089 1.00 0.00 C ATOM 1557 NZ LYS B 71 -11.867 -14.126 -20.886 1.00 0.00 N ATOM 0 H LYS B 71 -7.947 -10.410 -17.435 1.00 0.00 H new ATOM 0 HA LYS B 71 -7.096 -10.690 -20.140 1.00 0.00 H new ATOM 0 HB2 LYS B 71 -9.561 -10.598 -18.620 1.00 0.00 H new ATOM 0 HB3 LYS B 71 -9.695 -9.700 -20.119 1.00 0.00 H new ATOM 0 HG2 LYS B 71 -8.508 -11.795 -21.202 1.00 0.00 H new ATOM 0 HG3 LYS B 71 -8.983 -12.625 -19.734 1.00 0.00 H new ATOM 0 HD2 LYS B 71 -11.151 -11.015 -20.996 1.00 0.00 H new ATOM 0 HD3 LYS B 71 -10.582 -12.355 -21.972 1.00 0.00 H new ATOM 0 HE2 LYS B 71 -10.854 -13.272 -19.236 1.00 0.00 H new ATOM 0 HE3 LYS B 71 -12.330 -12.444 -19.689 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 -12.415 -14.775 -20.286 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 -12.454 -13.814 -21.685 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 -11.024 -14.617 -21.247 1.00 0.00 H new ATOM 1571 N ASN B 72 -8.322 -7.719 -19.561 1.00 0.00 N ATOM 1572 CA ASN B 72 -8.208 -6.318 -19.930 1.00 0.00 C ATOM 1573 C ASN B 72 -6.949 -5.727 -19.291 1.00 0.00 C ATOM 1574 O ASN B 72 -6.795 -5.757 -18.071 1.00 0.00 O ATOM 1575 CB ASN B 72 -9.412 -5.518 -19.429 1.00 0.00 C ATOM 1576 CG ASN B 72 -10.629 -5.737 -20.330 1.00 0.00 C ATOM 1577 OD1 ASN B 72 -10.517 -6.026 -21.510 1.00 0.00 O ATOM 1578 ND2 ASN B 72 -11.796 -5.585 -19.709 1.00 0.00 N ATOM 0 H ASN B 72 -9.143 -7.947 -19.001 1.00 0.00 H new ATOM 0 HA ASN B 72 -8.161 -6.258 -21.017 1.00 0.00 H new ATOM 0 HB2 ASN B 72 -9.652 -5.816 -18.408 1.00 0.00 H new ATOM 0 HB3 ASN B 72 -9.162 -4.457 -19.401 1.00 0.00 H new ATOM 0 HD21 ASN B 72 -12.668 -5.711 -20.223 1.00 0.00 H new ATOM 0 HD22 ASN B 72 -11.819 -5.342 -18.719 1.00 0.00 H new ATOM 1585 N GLU B 73 -6.081 -5.204 -20.145 1.00 0.00 N ATOM 1586 CA GLU B 73 -4.841 -4.608 -19.680 1.00 0.00 C ATOM 1587 C GLU B 73 -5.055 -3.130 -19.348 1.00 0.00 C ATOM 1588 O GLU B 73 -4.200 -2.499 -18.728 1.00 0.00 O ATOM 1589 CB GLU B 73 -3.727 -4.782 -20.714 1.00 0.00 C ATOM 1590 CG GLU B 73 -2.351 -4.762 -20.046 1.00 0.00 C ATOM 1591 CD GLU B 73 -1.927 -6.170 -19.621 1.00 0.00 C ATOM 1592 OE1 GLU B 73 -2.728 -6.812 -18.908 1.00 0.00 O ATOM 1593 OE2 GLU B 73 -0.812 -6.572 -20.019 1.00 0.00 O ATOM 0 H GLU B 73 -6.213 -5.181 -21.156 1.00 0.00 H new ATOM 0 HA GLU B 73 -4.531 -5.124 -18.771 1.00 0.00 H new ATOM 0 HB2 GLU B 73 -3.863 -5.724 -21.246 1.00 0.00 H new ATOM 0 HB3 GLU B 73 -3.787 -3.986 -21.456 1.00 0.00 H new ATOM 0 HG2 GLU B 73 -1.614 -4.349 -20.735 1.00 0.00 H new ATOM 0 HG3 GLU B 73 -2.375 -4.107 -19.175 1.00 0.00 H new ATOM 1600 N GLU B 74 -6.201 -2.620 -19.775 1.00 0.00 N ATOM 1601 CA GLU B 74 -6.537 -1.228 -19.531 1.00 0.00 C ATOM 1602 C GLU B 74 -7.666 -1.127 -18.503 1.00 0.00 C ATOM 1603 O GLU B 74 -8.483 -0.209 -18.560 1.00 0.00 O ATOM 1604 CB GLU B 74 -6.917 -0.519 -20.833 1.00 0.00 C ATOM 1605 CG GLU B 74 -8.126 -1.189 -21.490 1.00 0.00 C ATOM 1606 CD GLU B 74 -7.790 -1.655 -22.908 1.00 0.00 C ATOM 1607 OE1 GLU B 74 -6.864 -2.486 -23.028 1.00 0.00 O ATOM 1608 OE2 GLU B 74 -8.468 -1.171 -23.840 1.00 0.00 O ATOM 0 H GLU B 74 -6.908 -3.146 -20.288 1.00 0.00 H new ATOM 0 HA GLU B 74 -5.657 -0.728 -19.127 1.00 0.00 H new ATOM 0 HB2 GLU B 74 -7.143 0.528 -20.629 1.00 0.00 H new ATOM 0 HB3 GLU B 74 -6.071 -0.534 -21.520 1.00 0.00 H new ATOM 0 HG2 GLU B 74 -8.445 -2.041 -20.889 1.00 0.00 H new ATOM 0 HG3 GLU B 74 -8.962 -0.490 -21.521 1.00 0.00 H new ATOM 1615 N GLU B 75 -7.675 -2.084 -17.587 1.00 0.00 N ATOM 1616 CA GLU B 75 -8.690 -2.114 -16.547 1.00 0.00 C ATOM 1617 C GLU B 75 -8.039 -2.300 -15.175 1.00 0.00 C ATOM 1618 O GLU B 75 -7.857 -3.427 -14.718 1.00 0.00 O ATOM 1619 CB GLU B 75 -9.720 -3.213 -16.818 1.00 0.00 C ATOM 1620 CG GLU B 75 -11.053 -2.895 -16.138 1.00 0.00 C ATOM 1621 CD GLU B 75 -12.215 -3.576 -16.864 1.00 0.00 C ATOM 1622 OE1 GLU B 75 -12.255 -4.825 -16.824 1.00 0.00 O ATOM 1623 OE2 GLU B 75 -13.037 -2.832 -17.441 1.00 0.00 O ATOM 0 H GLU B 75 -6.996 -2.844 -17.543 1.00 0.00 H new ATOM 0 HA GLU B 75 -9.216 -1.159 -16.552 1.00 0.00 H new ATOM 0 HB2 GLU B 75 -9.872 -3.317 -17.892 1.00 0.00 H new ATOM 0 HB3 GLU B 75 -9.341 -4.169 -16.455 1.00 0.00 H new ATOM 0 HG2 GLU B 75 -11.024 -3.226 -15.100 1.00 0.00 H new ATOM 0 HG3 GLU B 75 -11.210 -1.816 -16.124 1.00 0.00 H new ATOM 1630 N VAL B 76 -7.707 -1.176 -14.556 1.00 0.00 N ATOM 1631 CA VAL B 76 -7.080 -1.201 -13.246 1.00 0.00 C ATOM 1632 C VAL B 76 -8.063 -1.778 -12.226 1.00 0.00 C ATOM 1633 O VAL B 76 -9.277 -1.667 -12.396 1.00 0.00 O ATOM 1634 CB VAL B 76 -6.587 0.199 -12.875 1.00 0.00 C ATOM 1635 CG1 VAL B 76 -7.716 1.226 -12.988 1.00 0.00 C ATOM 1636 CG2 VAL B 76 -5.972 0.211 -11.474 1.00 0.00 C ATOM 0 H VAL B 76 -7.861 -0.243 -14.938 1.00 0.00 H new ATOM 0 HA VAL B 76 -6.203 -1.848 -13.255 1.00 0.00 H new ATOM 0 HB VAL B 76 -5.808 0.479 -13.584 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -7.339 2.213 -12.719 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -8.088 1.247 -14.012 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -8.527 0.951 -12.313 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -5.630 1.218 -11.235 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -6.721 -0.100 -10.745 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -5.127 -0.477 -11.442 1.00 0.00 H new ATOM 1646 N LEU B 77 -7.504 -2.381 -11.187 1.00 0.00 N ATOM 1647 CA LEU B 77 -8.316 -2.975 -10.139 1.00 0.00 C ATOM 1648 C LEU B 77 -7.946 -2.347 -8.794 1.00 0.00 C ATOM 1649 O LEU B 77 -8.817 -1.886 -8.059 1.00 0.00 O ATOM 1650 CB LEU B 77 -8.188 -4.500 -10.162 1.00 0.00 C ATOM 1651 CG LEU B 77 -8.201 -5.153 -11.546 1.00 0.00 C ATOM 1652 CD1 LEU B 77 -7.974 -6.662 -11.441 1.00 0.00 C ATOM 1653 CD2 LEU B 77 -9.490 -4.818 -12.298 1.00 0.00 C ATOM 0 H LEU B 77 -6.497 -2.471 -11.049 1.00 0.00 H new ATOM 0 HA LEU B 77 -9.372 -2.764 -10.309 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -7.260 -4.775 -9.661 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -9.004 -4.922 -9.575 1.00 0.00 H new ATOM 0 HG LEU B 77 -7.375 -4.742 -12.126 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -7.988 -7.102 -12.438 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -7.008 -6.853 -10.973 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -8.764 -7.108 -10.837 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -9.474 -5.294 -13.278 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -10.347 -5.183 -11.732 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -9.569 -3.738 -12.421 1.00 0.00 H new ATOM 1665 N VAL B 78 -6.651 -2.350 -8.513 1.00 0.00 N ATOM 1666 CA VAL B 78 -6.154 -1.786 -7.269 1.00 0.00 C ATOM 1667 C VAL B 78 -4.825 -1.076 -7.531 1.00 0.00 C ATOM 1668 O VAL B 78 -3.883 -1.681 -8.040 1.00 0.00 O ATOM 1669 CB VAL B 78 -6.048 -2.880 -6.204 1.00 0.00 C ATOM 1670 CG1 VAL B 78 -4.883 -2.605 -5.251 1.00 0.00 C ATOM 1671 CG2 VAL B 78 -7.363 -3.026 -5.436 1.00 0.00 C ATOM 0 H VAL B 78 -5.931 -2.734 -9.125 1.00 0.00 H new ATOM 0 HA VAL B 78 -6.850 -1.041 -6.883 1.00 0.00 H new ATOM 0 HB VAL B 78 -5.850 -3.824 -6.711 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -4.829 -3.397 -4.504 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -3.951 -2.575 -5.815 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -5.038 -1.647 -4.754 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -7.261 -3.810 -4.685 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -7.605 -2.083 -4.946 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -8.162 -3.289 -6.129 1.00 0.00 H new ATOM 1681 N GLU B 79 -4.790 0.199 -7.171 1.00 0.00 N ATOM 1682 CA GLU B 79 -3.592 0.998 -7.361 1.00 0.00 C ATOM 1683 C GLU B 79 -2.940 1.306 -6.012 1.00 0.00 C ATOM 1684 O GLU B 79 -3.303 2.278 -5.350 1.00 0.00 O ATOM 1685 CB GLU B 79 -3.907 2.286 -8.124 1.00 0.00 C ATOM 1686 CG GLU B 79 -2.813 2.600 -9.147 1.00 0.00 C ATOM 1687 CD GLU B 79 -3.181 3.825 -9.986 1.00 0.00 C ATOM 1688 OE1 GLU B 79 -4.387 4.153 -10.012 1.00 0.00 O ATOM 1689 OE2 GLU B 79 -2.248 4.405 -10.583 1.00 0.00 O ATOM 0 H GLU B 79 -5.573 0.698 -6.749 1.00 0.00 H new ATOM 0 HA GLU B 79 -2.887 0.423 -7.961 1.00 0.00 H new ATOM 0 HB2 GLU B 79 -4.866 2.187 -8.632 1.00 0.00 H new ATOM 0 HB3 GLU B 79 -4.002 3.115 -7.422 1.00 0.00 H new ATOM 0 HG2 GLU B 79 -1.869 2.778 -8.632 1.00 0.00 H new ATOM 0 HG3 GLU B 79 -2.663 1.740 -9.799 1.00 0.00 H new ATOM 1696 N CYS B 80 -1.989 0.460 -5.643 1.00 0.00 N ATOM 1697 CA CYS B 80 -1.283 0.630 -4.385 1.00 0.00 C ATOM 1698 C CYS B 80 0.032 1.359 -4.666 1.00 0.00 C ATOM 1699 O CYS B 80 1.006 0.745 -5.098 1.00 0.00 O ATOM 1700 CB CYS B 80 -1.054 -0.709 -3.680 1.00 0.00 C ATOM 1701 SG CYS B 80 -0.481 -0.423 -1.966 1.00 0.00 S ATOM 0 H CYS B 80 -1.691 -0.345 -6.194 1.00 0.00 H new ATOM 0 HA CYS B 80 -1.889 1.227 -3.703 1.00 0.00 H new ATOM 0 HB2 CYS B 80 -1.978 -1.288 -3.672 1.00 0.00 H new ATOM 0 HB3 CYS B 80 -0.315 -1.295 -4.226 1.00 0.00 H new ATOM 0 HG CYS B 80 -0.947 -1.357 -1.191 1.00 0.00 H new ATOM 1707 N ARG B 81 0.018 2.659 -4.410 1.00 0.00 N ATOM 1708 CA ARG B 81 1.198 3.478 -4.630 1.00 0.00 C ATOM 1709 C ARG B 81 2.244 3.204 -3.547 1.00 0.00 C ATOM 1710 O ARG B 81 2.014 3.485 -2.372 1.00 0.00 O ATOM 1711 CB ARG B 81 0.844 4.966 -4.623 1.00 0.00 C ATOM 1712 CG ARG B 81 0.109 5.361 -5.905 1.00 0.00 C ATOM 1713 CD ARG B 81 -1.100 4.454 -6.146 1.00 0.00 C ATOM 1714 NE ARG B 81 -1.930 4.998 -7.244 1.00 0.00 N ATOM 1715 CZ ARG B 81 -2.888 5.920 -7.075 1.00 0.00 C ATOM 1716 NH1 ARG B 81 -3.142 6.406 -5.853 1.00 0.00 N ATOM 1717 NH2 ARG B 81 -3.591 6.355 -8.129 1.00 0.00 N ATOM 0 H ARG B 81 -0.792 3.165 -4.052 1.00 0.00 H new ATOM 0 HA ARG B 81 1.605 3.218 -5.607 1.00 0.00 H new ATOM 0 HB2 ARG B 81 0.220 5.191 -3.758 1.00 0.00 H new ATOM 0 HB3 ARG B 81 1.753 5.559 -4.523 1.00 0.00 H new ATOM 0 HG2 ARG B 81 -0.218 6.398 -5.836 1.00 0.00 H new ATOM 0 HG3 ARG B 81 0.790 5.298 -6.753 1.00 0.00 H new ATOM 0 HD2 ARG B 81 -0.766 3.447 -6.396 1.00 0.00 H new ATOM 0 HD3 ARG B 81 -1.693 4.375 -5.235 1.00 0.00 H new ATOM 0 HE ARG B 81 -1.763 4.650 -8.188 1.00 0.00 H new ATOM 0 HH11 ARG B 81 -2.606 6.074 -5.051 1.00 0.00 H new ATOM 0 HH12 ARG B 81 -3.871 7.108 -5.725 1.00 0.00 H new ATOM 0 HH21 ARG B 81 -3.397 5.985 -9.059 1.00 0.00 H new ATOM 0 HH22 ARG B 81 -4.320 7.057 -8.001 1.00 0.00 H new ATOM 1731 N VAL B 82 3.370 2.659 -3.982 1.00 0.00 N ATOM 1732 CA VAL B 82 4.452 2.345 -3.065 1.00 0.00 C ATOM 1733 C VAL B 82 4.631 3.501 -2.079 1.00 0.00 C ATOM 1734 O VAL B 82 5.094 3.298 -0.957 1.00 0.00 O ATOM 1735 CB VAL B 82 5.726 2.024 -3.849 1.00 0.00 C ATOM 1736 CG1 VAL B 82 6.837 3.025 -3.523 1.00 0.00 C ATOM 1737 CG2 VAL B 82 6.187 0.589 -3.585 1.00 0.00 C ATOM 0 H VAL B 82 3.557 2.427 -4.958 1.00 0.00 H new ATOM 0 HA VAL B 82 4.213 1.455 -2.482 1.00 0.00 H new ATOM 0 HB VAL B 82 5.496 2.111 -4.911 1.00 0.00 H new ATOM 0 HG11 VAL B 82 7.731 2.774 -4.093 1.00 0.00 H new ATOM 0 HG12 VAL B 82 6.509 4.031 -3.786 1.00 0.00 H new ATOM 0 HG13 VAL B 82 7.063 2.984 -2.457 1.00 0.00 H new ATOM 0 HG21 VAL B 82 7.094 0.388 -4.155 1.00 0.00 H new ATOM 0 HG22 VAL B 82 6.390 0.462 -2.522 1.00 0.00 H new ATOM 0 HG23 VAL B 82 5.405 -0.106 -3.890 1.00 0.00 H new ATOM 1747 N ARG B 83 4.256 4.687 -2.533 1.00 0.00 N ATOM 1748 CA ARG B 83 4.370 5.876 -1.705 1.00 0.00 C ATOM 1749 C ARG B 83 3.349 5.829 -0.566 1.00 0.00 C ATOM 1750 O ARG B 83 3.688 6.087 0.588 1.00 0.00 O ATOM 1751 CB ARG B 83 4.146 7.145 -2.529 1.00 0.00 C ATOM 1752 CG ARG B 83 5.291 7.364 -3.520 1.00 0.00 C ATOM 1753 CD ARG B 83 6.406 8.202 -2.893 1.00 0.00 C ATOM 1754 NE ARG B 83 7.491 8.418 -3.876 1.00 0.00 N ATOM 1755 CZ ARG B 83 8.741 8.773 -3.550 1.00 0.00 C ATOM 1756 NH1 ARG B 83 9.072 8.954 -2.264 1.00 0.00 N ATOM 1757 NH2 ARG B 83 9.661 8.946 -4.509 1.00 0.00 N ATOM 0 H ARG B 83 3.873 4.851 -3.464 1.00 0.00 H new ATOM 0 HA ARG B 83 5.379 5.898 -1.293 1.00 0.00 H new ATOM 0 HB2 ARG B 83 3.202 7.070 -3.069 1.00 0.00 H new ATOM 0 HB3 ARG B 83 4.066 8.005 -1.864 1.00 0.00 H new ATOM 0 HG2 ARG B 83 5.690 6.401 -3.838 1.00 0.00 H new ATOM 0 HG3 ARG B 83 4.914 7.863 -4.412 1.00 0.00 H new ATOM 0 HD2 ARG B 83 6.008 9.161 -2.561 1.00 0.00 H new ATOM 0 HD3 ARG B 83 6.799 7.697 -2.010 1.00 0.00 H new ATOM 0 HE ARG B 83 7.273 8.288 -4.864 1.00 0.00 H new ATOM 0 HH11 ARG B 83 8.372 8.821 -1.534 1.00 0.00 H new ATOM 0 HH12 ARG B 83 10.024 9.224 -2.015 1.00 0.00 H new ATOM 0 HH21 ARG B 83 9.410 8.807 -5.488 1.00 0.00 H new ATOM 0 HH22 ARG B 83 10.613 9.216 -4.260 1.00 0.00 H new ATOM 1771 N PHE B 84 2.119 5.497 -0.930 1.00 0.00 N ATOM 1772 CA PHE B 84 1.046 5.413 0.047 1.00 0.00 C ATOM 1773 C PHE B 84 1.166 4.138 0.884 1.00 0.00 C ATOM 1774 O PHE B 84 0.849 4.140 2.073 1.00 0.00 O ATOM 1775 CB PHE B 84 -0.268 5.374 -0.735 1.00 0.00 C ATOM 1776 CG PHE B 84 -0.664 6.715 -1.356 1.00 0.00 C ATOM 1777 CD1 PHE B 84 -0.379 7.876 -0.706 1.00 0.00 C ATOM 1778 CD2 PHE B 84 -1.299 6.747 -2.558 1.00 0.00 C ATOM 1779 CE1 PHE B 84 -0.746 9.120 -1.283 1.00 0.00 C ATOM 1780 CE2 PHE B 84 -1.666 7.992 -3.134 1.00 0.00 C ATOM 1781 CZ PHE B 84 -1.382 9.152 -2.484 1.00 0.00 C ATOM 0 H PHE B 84 1.841 5.283 -1.888 1.00 0.00 H new ATOM 0 HA PHE B 84 1.091 6.266 0.724 1.00 0.00 H new ATOM 0 HB2 PHE B 84 -0.186 4.629 -1.527 1.00 0.00 H new ATOM 0 HB3 PHE B 84 -1.065 5.044 -0.069 1.00 0.00 H new ATOM 0 HD1 PHE B 84 0.126 7.851 0.248 1.00 0.00 H new ATOM 0 HD2 PHE B 84 -1.524 5.826 -3.075 1.00 0.00 H new ATOM 0 HE1 PHE B 84 -0.520 10.042 -0.767 1.00 0.00 H new ATOM 0 HE2 PHE B 84 -2.171 8.017 -4.088 1.00 0.00 H new ATOM 0 HZ PHE B 84 -1.662 10.099 -2.922 1.00 0.00 H new ATOM 1791 N LEU B 85 1.625 3.081 0.231 1.00 0.00 N ATOM 1792 CA LEU B 85 1.791 1.802 0.901 1.00 0.00 C ATOM 1793 C LEU B 85 2.403 2.031 2.284 1.00 0.00 C ATOM 1794 O LEU B 85 3.176 2.968 2.477 1.00 0.00 O ATOM 1795 CB LEU B 85 2.594 0.838 0.025 1.00 0.00 C ATOM 1796 CG LEU B 85 2.174 -0.632 0.086 1.00 0.00 C ATOM 1797 CD1 LEU B 85 2.353 -1.310 -1.274 1.00 0.00 C ATOM 1798 CD2 LEU B 85 2.923 -1.370 1.197 1.00 0.00 C ATOM 0 H LEU B 85 1.887 3.084 -0.755 1.00 0.00 H new ATOM 0 HA LEU B 85 0.823 1.325 1.055 1.00 0.00 H new ATOM 0 HB2 LEU B 85 2.522 1.173 -1.010 1.00 0.00 H new ATOM 0 HB3 LEU B 85 3.644 0.908 0.311 1.00 0.00 H new ATOM 0 HG LEU B 85 1.112 -0.674 0.330 1.00 0.00 H new ATOM 0 HD11 LEU B 85 2.047 -2.354 -1.203 1.00 0.00 H new ATOM 0 HD12 LEU B 85 1.739 -0.802 -2.018 1.00 0.00 H new ATOM 0 HD13 LEU B 85 3.400 -1.258 -1.571 1.00 0.00 H new ATOM 0 HD21 LEU B 85 2.606 -2.413 1.219 1.00 0.00 H new ATOM 0 HD22 LEU B 85 3.995 -1.321 1.008 1.00 0.00 H new ATOM 0 HD23 LEU B 85 2.702 -0.903 2.157 1.00 0.00 H new ATOM 1810 N SER B 86 2.034 1.160 3.212 1.00 0.00 N ATOM 1811 CA SER B 86 2.537 1.255 4.571 1.00 0.00 C ATOM 1812 C SER B 86 3.249 -0.043 4.958 1.00 0.00 C ATOM 1813 O SER B 86 4.448 -0.039 5.235 1.00 0.00 O ATOM 1814 CB SER B 86 1.407 1.555 5.557 1.00 0.00 C ATOM 1815 OG SER B 86 0.531 0.442 5.720 1.00 0.00 O ATOM 0 H SER B 86 1.392 0.385 3.049 1.00 0.00 H new ATOM 0 HA SER B 86 3.249 2.079 4.615 1.00 0.00 H new ATOM 0 HB2 SER B 86 1.832 1.827 6.523 1.00 0.00 H new ATOM 0 HB3 SER B 86 0.838 2.416 5.205 1.00 0.00 H new ATOM 0 HG SER B 86 0.757 -0.034 6.546 1.00 0.00 H new ATOM 1821 N PHE B 87 2.480 -1.122 4.966 1.00 0.00 N ATOM 1822 CA PHE B 87 3.022 -2.424 5.314 1.00 0.00 C ATOM 1823 C PHE B 87 2.809 -3.428 4.180 1.00 0.00 C ATOM 1824 O PHE B 87 1.987 -3.204 3.293 1.00 0.00 O ATOM 1825 CB PHE B 87 2.267 -2.906 6.554 1.00 0.00 C ATOM 1826 CG PHE B 87 2.957 -4.050 7.299 1.00 0.00 C ATOM 1827 CD1 PHE B 87 4.007 -3.789 8.124 1.00 0.00 C ATOM 1828 CD2 PHE B 87 2.522 -5.328 7.136 1.00 0.00 C ATOM 1829 CE1 PHE B 87 4.648 -4.852 8.814 1.00 0.00 C ATOM 1830 CE2 PHE B 87 3.164 -6.390 7.826 1.00 0.00 C ATOM 1831 CZ PHE B 87 4.213 -6.130 8.651 1.00 0.00 C ATOM 0 H PHE B 87 1.486 -1.121 4.737 1.00 0.00 H new ATOM 0 HA PHE B 87 4.094 -2.344 5.496 1.00 0.00 H new ATOM 0 HB2 PHE B 87 2.139 -2.067 7.237 1.00 0.00 H new ATOM 0 HB3 PHE B 87 1.270 -3.230 6.256 1.00 0.00 H new ATOM 0 HD1 PHE B 87 4.353 -2.774 8.254 1.00 0.00 H new ATOM 0 HD2 PHE B 87 1.688 -5.535 6.482 1.00 0.00 H new ATOM 0 HE1 PHE B 87 5.482 -4.645 9.469 1.00 0.00 H new ATOM 0 HE2 PHE B 87 2.819 -7.405 7.695 1.00 0.00 H new ATOM 0 HZ PHE B 87 4.700 -6.938 9.176 1.00 0.00 H new ATOM 1841 N MET B 88 3.565 -4.515 4.245 1.00 0.00 N ATOM 1842 CA MET B 88 3.469 -5.554 3.234 1.00 0.00 C ATOM 1843 C MET B 88 4.246 -6.803 3.656 1.00 0.00 C ATOM 1844 O MET B 88 5.457 -6.744 3.864 1.00 0.00 O ATOM 1845 CB MET B 88 4.026 -5.030 1.908 1.00 0.00 C ATOM 1846 CG MET B 88 5.452 -4.505 2.082 1.00 0.00 C ATOM 1847 SD MET B 88 6.575 -5.436 1.053 1.00 0.00 S ATOM 1848 CE MET B 88 7.267 -4.113 0.074 1.00 0.00 C ATOM 0 H MET B 88 4.246 -4.698 4.982 1.00 0.00 H new ATOM 0 HA MET B 88 2.420 -5.824 3.116 1.00 0.00 H new ATOM 0 HB2 MET B 88 4.016 -5.827 1.165 1.00 0.00 H new ATOM 0 HB3 MET B 88 3.385 -4.234 1.529 1.00 0.00 H new ATOM 0 HG2 MET B 88 5.494 -3.448 1.817 1.00 0.00 H new ATOM 0 HG3 MET B 88 5.753 -4.584 3.127 1.00 0.00 H new ATOM 0 HE1 MET B 88 7.576 -4.502 -0.896 1.00 0.00 H new ATOM 0 HE2 MET B 88 6.517 -3.335 -0.069 1.00 0.00 H new ATOM 0 HE3 MET B 88 8.131 -3.693 0.589 1.00 0.00 H new ATOM 1858 N GLY B 89 3.517 -7.904 3.770 1.00 0.00 N ATOM 1859 CA GLY B 89 4.123 -9.165 4.163 1.00 0.00 C ATOM 1860 C GLY B 89 3.208 -10.342 3.822 1.00 0.00 C ATOM 1861 O GLY B 89 2.297 -10.210 3.006 1.00 0.00 O ATOM 0 H GLY B 89 2.513 -7.949 3.597 1.00 0.00 H new ATOM 0 HA2 GLY B 89 5.081 -9.286 3.657 1.00 0.00 H new ATOM 0 HA3 GLY B 89 4.327 -9.157 5.234 1.00 0.00 H new ATOM 1865 N VAL B 90 3.482 -11.469 4.464 1.00 0.00 N ATOM 1866 CA VAL B 90 2.695 -12.669 4.239 1.00 0.00 C ATOM 1867 C VAL B 90 2.078 -13.125 5.562 1.00 0.00 C ATOM 1868 O VAL B 90 2.390 -12.577 6.618 1.00 0.00 O ATOM 1869 CB VAL B 90 3.560 -13.746 3.580 1.00 0.00 C ATOM 1870 CG1 VAL B 90 4.943 -13.197 3.224 1.00 0.00 C ATOM 1871 CG2 VAL B 90 3.674 -14.981 4.475 1.00 0.00 C ATOM 0 H VAL B 90 4.238 -11.576 5.140 1.00 0.00 H new ATOM 0 HA VAL B 90 1.874 -12.464 3.552 1.00 0.00 H new ATOM 0 HB VAL B 90 3.071 -14.048 2.654 1.00 0.00 H new ATOM 0 HG11 VAL B 90 5.537 -13.983 2.757 1.00 0.00 H new ATOM 0 HG12 VAL B 90 4.836 -12.363 2.531 1.00 0.00 H new ATOM 0 HG13 VAL B 90 5.443 -12.854 4.130 1.00 0.00 H new ATOM 0 HG21 VAL B 90 4.294 -15.731 3.983 1.00 0.00 H new ATOM 0 HG22 VAL B 90 4.129 -14.701 5.425 1.00 0.00 H new ATOM 0 HG23 VAL B 90 2.681 -15.393 4.655 1.00 0.00 H new ATOM 1881 N GLY B 91 1.213 -14.123 5.462 1.00 0.00 N ATOM 1882 CA GLY B 91 0.549 -14.659 6.638 1.00 0.00 C ATOM 1883 C GLY B 91 1.121 -16.027 7.016 1.00 0.00 C ATOM 1884 O GLY B 91 2.315 -16.152 7.282 1.00 0.00 O ATOM 0 H GLY B 91 0.956 -14.575 4.584 1.00 0.00 H new ATOM 0 HA2 GLY B 91 0.667 -13.968 7.473 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -0.520 -14.748 6.447 1.00 0.00 H new ATOM 1888 N LYS B 92 0.242 -17.018 7.026 1.00 0.00 N ATOM 1889 CA LYS B 92 0.645 -18.372 7.367 1.00 0.00 C ATOM 1890 C LYS B 92 1.443 -18.969 6.206 1.00 0.00 C ATOM 1891 O LYS B 92 2.463 -19.621 6.420 1.00 0.00 O ATOM 1892 CB LYS B 92 -0.572 -19.208 7.770 1.00 0.00 C ATOM 1893 CG LYS B 92 -1.235 -19.839 6.545 1.00 0.00 C ATOM 1894 CD LYS B 92 -2.321 -20.833 6.960 1.00 0.00 C ATOM 1895 CE LYS B 92 -2.488 -21.933 5.910 1.00 0.00 C ATOM 1896 NZ LYS B 92 -3.848 -22.514 5.979 1.00 0.00 N ATOM 0 H LYS B 92 -0.748 -16.911 6.804 1.00 0.00 H new ATOM 0 HA LYS B 92 1.302 -18.366 8.237 1.00 0.00 H new ATOM 0 HB2 LYS B 92 -0.266 -19.990 8.465 1.00 0.00 H new ATOM 0 HB3 LYS B 92 -1.292 -18.579 8.294 1.00 0.00 H new ATOM 0 HG2 LYS B 92 -1.671 -19.059 5.921 1.00 0.00 H new ATOM 0 HG3 LYS B 92 -0.483 -20.348 5.942 1.00 0.00 H new ATOM 0 HD2 LYS B 92 -2.063 -21.279 7.921 1.00 0.00 H new ATOM 0 HD3 LYS B 92 -3.267 -20.308 7.096 1.00 0.00 H new ATOM 0 HE2 LYS B 92 -2.311 -21.524 4.915 1.00 0.00 H new ATOM 0 HE3 LYS B 92 -1.744 -22.713 6.071 1.00 0.00 H new ATOM 0 HZ1 LYS B 92 -3.944 -23.259 5.260 1.00 0.00 H new ATOM 0 HZ2 LYS B 92 -4.004 -22.922 6.923 1.00 0.00 H new ATOM 0 HZ3 LYS B 92 -4.553 -21.770 5.803 1.00 0.00 H new ATOM 1910 N ASP B 93 0.947 -18.725 5.001 1.00 0.00 N ATOM 1911 CA ASP B 93 1.601 -19.230 3.806 1.00 0.00 C ATOM 1912 C ASP B 93 2.196 -18.059 3.022 1.00 0.00 C ATOM 1913 O ASP B 93 1.588 -16.994 2.932 1.00 0.00 O ATOM 1914 CB ASP B 93 0.605 -19.951 2.896 1.00 0.00 C ATOM 1915 CG ASP B 93 0.767 -21.471 2.835 1.00 0.00 C ATOM 1916 OD1 ASP B 93 1.927 -21.923 2.946 1.00 0.00 O ATOM 1917 OD2 ASP B 93 -0.273 -22.147 2.678 1.00 0.00 O ATOM 0 H ASP B 93 0.100 -18.184 4.827 1.00 0.00 H new ATOM 0 HA ASP B 93 2.377 -19.929 4.116 1.00 0.00 H new ATOM 0 HB2 ASP B 93 -0.405 -19.722 3.235 1.00 0.00 H new ATOM 0 HB3 ASP B 93 0.701 -19.550 1.887 1.00 0.00 H new ATOM 1922 N VAL B 94 3.379 -18.296 2.474 1.00 0.00 N ATOM 1923 CA VAL B 94 4.064 -17.274 1.701 1.00 0.00 C ATOM 1924 C VAL B 94 3.355 -17.099 0.356 1.00 0.00 C ATOM 1925 O VAL B 94 3.294 -15.992 -0.178 1.00 0.00 O ATOM 1926 CB VAL B 94 5.544 -17.632 1.554 1.00 0.00 C ATOM 1927 CG1 VAL B 94 6.134 -18.081 2.893 1.00 0.00 C ATOM 1928 CG2 VAL B 94 5.746 -18.702 0.480 1.00 0.00 C ATOM 0 H VAL B 94 3.880 -19.181 2.550 1.00 0.00 H new ATOM 0 HA VAL B 94 4.026 -16.315 2.217 1.00 0.00 H new ATOM 0 HB VAL B 94 6.076 -16.735 1.236 1.00 0.00 H new ATOM 0 HG11 VAL B 94 7.187 -18.330 2.761 1.00 0.00 H new ATOM 0 HG12 VAL B 94 6.040 -17.275 3.621 1.00 0.00 H new ATOM 0 HG13 VAL B 94 5.596 -18.958 3.252 1.00 0.00 H new ATOM 0 HG21 VAL B 94 6.807 -18.938 0.396 1.00 0.00 H new ATOM 0 HG22 VAL B 94 5.195 -19.602 0.754 1.00 0.00 H new ATOM 0 HG23 VAL B 94 5.380 -18.330 -0.477 1.00 0.00 H new ATOM 1938 N HIS B 95 2.838 -18.207 -0.153 1.00 0.00 N ATOM 1939 CA HIS B 95 2.136 -18.190 -1.425 1.00 0.00 C ATOM 1940 C HIS B 95 1.224 -16.963 -1.492 1.00 0.00 C ATOM 1941 O HIS B 95 0.931 -16.461 -2.576 1.00 0.00 O ATOM 1942 CB HIS B 95 1.381 -19.502 -1.647 1.00 0.00 C ATOM 1943 CG HIS B 95 2.154 -20.732 -1.235 1.00 0.00 C ATOM 1944 ND1 HIS B 95 2.315 -21.108 0.087 1.00 0.00 N ATOM 1945 CD2 HIS B 95 2.807 -21.667 -1.983 1.00 0.00 C ATOM 1946 CE1 HIS B 95 3.034 -22.220 0.121 1.00 0.00 C ATOM 1947 NE2 HIS B 95 3.339 -22.565 -1.163 1.00 0.00 N ATOM 0 H HIS B 95 2.891 -19.123 0.292 1.00 0.00 H new ATOM 0 HA HIS B 95 2.856 -18.110 -2.240 1.00 0.00 H new ATOM 0 HB2 HIS B 95 0.445 -19.470 -1.089 1.00 0.00 H new ATOM 0 HB3 HIS B 95 1.121 -19.585 -2.702 1.00 0.00 H new ATOM 0 HD2 HIS B 95 2.879 -21.675 -3.061 1.00 0.00 H new ATOM 0 HE1 HIS B 95 3.327 -22.759 1.010 1.00 0.00 H new ATOM 0 HE2 HIS B 95 3.885 -23.378 -1.446 1.00 0.00 H new ATOM 1955 N THR B 96 0.801 -16.516 -0.319 1.00 0.00 N ATOM 1956 CA THR B 96 -0.072 -15.357 -0.230 1.00 0.00 C ATOM 1957 C THR B 96 0.733 -14.111 0.144 1.00 0.00 C ATOM 1958 O THR B 96 1.626 -14.174 0.987 1.00 0.00 O ATOM 1959 CB THR B 96 -1.187 -15.681 0.766 1.00 0.00 C ATOM 1960 OG1 THR B 96 -0.500 -16.204 1.899 1.00 0.00 O ATOM 1961 CG2 THR B 96 -2.072 -16.839 0.298 1.00 0.00 C ATOM 0 H THR B 96 1.046 -16.935 0.578 1.00 0.00 H new ATOM 0 HA THR B 96 -0.531 -15.132 -1.193 1.00 0.00 H new ATOM 0 HB THR B 96 -1.802 -14.795 0.923 1.00 0.00 H new ATOM 0 HG1 THR B 96 0.414 -15.852 1.918 1.00 0.00 H new ATOM 0 HG21 THR B 96 -2.847 -17.028 1.041 1.00 0.00 H new ATOM 0 HG22 THR B 96 -2.537 -16.580 -0.653 1.00 0.00 H new ATOM 0 HG23 THR B 96 -1.463 -17.735 0.173 1.00 0.00 H new ATOM 1969 N PHE B 97 0.388 -13.007 -0.503 1.00 0.00 N ATOM 1970 CA PHE B 97 1.068 -11.748 -0.250 1.00 0.00 C ATOM 1971 C PHE B 97 0.064 -10.602 -0.108 1.00 0.00 C ATOM 1972 O PHE B 97 -0.604 -10.234 -1.074 1.00 0.00 O ATOM 1973 CB PHE B 97 1.968 -11.475 -1.456 1.00 0.00 C ATOM 1974 CG PHE B 97 2.630 -10.096 -1.439 1.00 0.00 C ATOM 1975 CD1 PHE B 97 3.613 -9.824 -0.539 1.00 0.00 C ATOM 1976 CD2 PHE B 97 2.235 -9.141 -2.323 1.00 0.00 C ATOM 1977 CE1 PHE B 97 4.227 -8.544 -0.523 1.00 0.00 C ATOM 1978 CE2 PHE B 97 2.849 -7.861 -2.307 1.00 0.00 C ATOM 1979 CZ PHE B 97 3.833 -7.589 -1.408 1.00 0.00 C ATOM 0 H PHE B 97 -0.353 -12.958 -1.202 1.00 0.00 H new ATOM 0 HA PHE B 97 1.638 -11.813 0.677 1.00 0.00 H new ATOM 0 HB2 PHE B 97 2.744 -12.239 -1.497 1.00 0.00 H new ATOM 0 HB3 PHE B 97 1.377 -11.572 -2.367 1.00 0.00 H new ATOM 0 HD1 PHE B 97 3.926 -10.582 0.164 1.00 0.00 H new ATOM 0 HD2 PHE B 97 1.454 -9.356 -3.037 1.00 0.00 H new ATOM 0 HE1 PHE B 97 5.007 -8.328 0.192 1.00 0.00 H new ATOM 0 HE2 PHE B 97 2.535 -7.103 -3.009 1.00 0.00 H new ATOM 0 HZ PHE B 97 4.301 -6.616 -1.397 1.00 0.00 H new ATOM 1989 N ALA B 98 -0.012 -10.070 1.103 1.00 0.00 N ATOM 1990 CA ALA B 98 -0.923 -8.974 1.383 1.00 0.00 C ATOM 1991 C ALA B 98 -0.120 -7.687 1.584 1.00 0.00 C ATOM 1992 O ALA B 98 1.106 -7.725 1.681 1.00 0.00 O ATOM 1993 CB ALA B 98 -1.781 -9.322 2.601 1.00 0.00 C ATOM 0 H ALA B 98 0.543 -10.378 1.902 1.00 0.00 H new ATOM 0 HA ALA B 98 -1.599 -8.813 0.543 1.00 0.00 H new ATOM 0 HB1 ALA B 98 -2.465 -8.500 2.811 1.00 0.00 H new ATOM 0 HB2 ALA B 98 -2.354 -10.227 2.396 1.00 0.00 H new ATOM 0 HB3 ALA B 98 -1.137 -9.488 3.464 1.00 0.00 H new ATOM 1999 N PHE B 99 -0.843 -6.579 1.642 1.00 0.00 N ATOM 2000 CA PHE B 99 -0.213 -5.283 1.830 1.00 0.00 C ATOM 2001 C PHE B 99 -1.242 -4.227 2.239 1.00 0.00 C ATOM 2002 O PHE B 99 -2.384 -4.259 1.784 1.00 0.00 O ATOM 2003 CB PHE B 99 0.402 -4.885 0.487 1.00 0.00 C ATOM 2004 CG PHE B 99 -0.628 -4.544 -0.592 1.00 0.00 C ATOM 2005 CD1 PHE B 99 -1.376 -3.414 -0.485 1.00 0.00 C ATOM 2006 CD2 PHE B 99 -0.795 -5.371 -1.659 1.00 0.00 C ATOM 2007 CE1 PHE B 99 -2.332 -3.097 -1.486 1.00 0.00 C ATOM 2008 CE2 PHE B 99 -1.751 -5.055 -2.660 1.00 0.00 C ATOM 2009 CZ PHE B 99 -2.499 -3.924 -2.553 1.00 0.00 C ATOM 0 H PHE B 99 -1.859 -6.551 1.562 1.00 0.00 H new ATOM 0 HA PHE B 99 0.537 -5.345 2.618 1.00 0.00 H new ATOM 0 HB2 PHE B 99 1.053 -4.024 0.638 1.00 0.00 H new ATOM 0 HB3 PHE B 99 1.030 -5.701 0.130 1.00 0.00 H new ATOM 0 HD1 PHE B 99 -1.243 -2.757 0.362 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -0.200 -6.268 -1.745 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -2.926 -2.199 -1.400 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -1.884 -5.713 -3.506 1.00 0.00 H new ATOM 0 HZ PHE B 99 -3.225 -3.683 -3.315 1.00 0.00 H new ATOM 2019 N ILE B 100 -0.800 -3.316 3.093 1.00 0.00 N ATOM 2020 CA ILE B 100 -1.668 -2.252 3.569 1.00 0.00 C ATOM 2021 C ILE B 100 -1.461 -1.006 2.705 1.00 0.00 C ATOM 2022 O ILE B 100 -0.327 -0.615 2.434 1.00 0.00 O ATOM 2023 CB ILE B 100 -1.447 -2.008 5.063 1.00 0.00 C ATOM 2024 CG1 ILE B 100 -1.977 -3.178 5.894 1.00 0.00 C ATOM 2025 CG2 ILE B 100 -2.058 -0.674 5.496 1.00 0.00 C ATOM 2026 CD1 ILE B 100 -0.981 -3.570 6.987 1.00 0.00 C ATOM 0 H ILE B 100 0.148 -3.292 3.468 1.00 0.00 H new ATOM 0 HA ILE B 100 -2.714 -2.540 3.468 1.00 0.00 H new ATOM 0 HB ILE B 100 -0.374 -1.945 5.244 1.00 0.00 H new ATOM 0 HG12 ILE B 100 -2.930 -2.905 6.347 1.00 0.00 H new ATOM 0 HG13 ILE B 100 -2.166 -4.033 5.245 1.00 0.00 H new ATOM 0 HG21 ILE B 100 -1.887 -0.525 6.562 1.00 0.00 H new ATOM 0 HG22 ILE B 100 -1.593 0.138 4.937 1.00 0.00 H new ATOM 0 HG23 ILE B 100 -3.130 -0.683 5.298 1.00 0.00 H new ATOM 0 HD11 ILE B 100 -1.382 -4.404 7.563 1.00 0.00 H new ATOM 0 HD12 ILE B 100 -0.037 -3.866 6.530 1.00 0.00 H new ATOM 0 HD13 ILE B 100 -0.813 -2.720 7.648 1.00 0.00 H new ATOM 2038 N MET B 101 -2.575 -0.417 2.296 1.00 0.00 N ATOM 2039 CA MET B 101 -2.531 0.776 1.468 1.00 0.00 C ATOM 2040 C MET B 101 -3.504 1.838 1.983 1.00 0.00 C ATOM 2041 O MET B 101 -4.596 1.511 2.447 1.00 0.00 O ATOM 2042 CB MET B 101 -2.890 0.411 0.026 1.00 0.00 C ATOM 2043 CG MET B 101 -4.404 0.283 -0.146 1.00 0.00 C ATOM 2044 SD MET B 101 -4.795 -0.107 -1.844 1.00 0.00 S ATOM 2045 CE MET B 101 -4.608 1.507 -2.584 1.00 0.00 C ATOM 0 H MET B 101 -3.514 -0.744 2.523 1.00 0.00 H new ATOM 0 HA MET B 101 -1.522 1.185 1.508 1.00 0.00 H new ATOM 0 HB2 MET B 101 -2.507 1.173 -0.652 1.00 0.00 H new ATOM 0 HB3 MET B 101 -2.409 -0.529 -0.246 1.00 0.00 H new ATOM 0 HG2 MET B 101 -4.788 -0.496 0.512 1.00 0.00 H new ATOM 0 HG3 MET B 101 -4.891 1.214 0.143 1.00 0.00 H new ATOM 0 HE1 MET B 101 -4.869 1.455 -3.641 1.00 0.00 H new ATOM 0 HE2 MET B 101 -5.266 2.216 -2.082 1.00 0.00 H new ATOM 0 HE3 MET B 101 -3.574 1.837 -2.481 1.00 0.00 H new ATOM 2055 N ASP B 102 -3.074 3.087 1.885 1.00 0.00 N ATOM 2056 CA ASP B 102 -3.894 4.199 2.336 1.00 0.00 C ATOM 2057 C ASP B 102 -4.913 4.548 1.250 1.00 0.00 C ATOM 2058 O ASP B 102 -4.542 4.809 0.106 1.00 0.00 O ATOM 2059 CB ASP B 102 -3.040 5.441 2.601 1.00 0.00 C ATOM 2060 CG ASP B 102 -3.821 6.678 3.048 1.00 0.00 C ATOM 2061 OD1 ASP B 102 -4.445 6.595 4.128 1.00 0.00 O ATOM 2062 OD2 ASP B 102 -3.775 7.679 2.300 1.00 0.00 O ATOM 0 H ASP B 102 -2.168 3.354 1.500 1.00 0.00 H new ATOM 0 HA ASP B 102 -4.391 3.900 3.259 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -2.302 5.200 3.366 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -2.490 5.686 1.693 1.00 0.00 H new ATOM 2143 N PHE B 108 -7.096 2.669 5.736 1.00 0.00 N ATOM 2144 CA PHE B 108 -6.132 1.654 5.350 1.00 0.00 C ATOM 2145 C PHE B 108 -6.835 0.405 4.814 1.00 0.00 C ATOM 2146 O PHE B 108 -7.713 -0.148 5.474 1.00 0.00 O ATOM 2147 CB PHE B 108 -5.345 1.282 6.608 1.00 0.00 C ATOM 2148 CG PHE B 108 -4.785 2.484 7.370 1.00 0.00 C ATOM 2149 CD1 PHE B 108 -4.168 3.491 6.695 1.00 0.00 C ATOM 2150 CD2 PHE B 108 -4.904 2.547 8.724 1.00 0.00 C ATOM 2151 CE1 PHE B 108 -3.649 4.607 7.402 1.00 0.00 C ATOM 2152 CE2 PHE B 108 -4.384 3.663 9.431 1.00 0.00 C ATOM 2153 CZ PHE B 108 -3.768 4.670 8.755 1.00 0.00 C ATOM 0 HA PHE B 108 -5.483 2.038 4.563 1.00 0.00 H new ATOM 0 HB2 PHE B 108 -5.993 0.712 7.274 1.00 0.00 H new ATOM 0 HB3 PHE B 108 -4.521 0.626 6.328 1.00 0.00 H new ATOM 0 HD1 PHE B 108 -4.073 3.441 5.620 1.00 0.00 H new ATOM 0 HD2 PHE B 108 -5.394 1.748 9.261 1.00 0.00 H new ATOM 0 HE1 PHE B 108 -3.160 5.406 6.865 1.00 0.00 H new ATOM 0 HE2 PHE B 108 -4.478 3.712 10.506 1.00 0.00 H new ATOM 0 HZ PHE B 108 -3.374 5.519 9.293 1.00 0.00 H new ATOM 2163 N GLU B 109 -6.422 -0.002 3.623 1.00 0.00 N ATOM 2164 CA GLU B 109 -7.002 -1.176 2.991 1.00 0.00 C ATOM 2165 C GLU B 109 -5.948 -2.276 2.847 1.00 0.00 C ATOM 2166 O GLU B 109 -4.894 -2.057 2.253 1.00 0.00 O ATOM 2167 CB GLU B 109 -7.614 -0.822 1.634 1.00 0.00 C ATOM 2168 CG GLU B 109 -8.891 0.003 1.807 1.00 0.00 C ATOM 2169 CD GLU B 109 -9.538 0.302 0.454 1.00 0.00 C ATOM 2170 OE1 GLU B 109 -9.173 -0.397 -0.516 1.00 0.00 O ATOM 2171 OE2 GLU B 109 -10.384 1.222 0.419 1.00 0.00 O ATOM 0 H GLU B 109 -5.693 0.459 3.079 1.00 0.00 H new ATOM 0 HA GLU B 109 -7.804 -1.549 3.628 1.00 0.00 H new ATOM 0 HB2 GLU B 109 -6.892 -0.261 1.041 1.00 0.00 H new ATOM 0 HB3 GLU B 109 -7.839 -1.735 1.083 1.00 0.00 H new ATOM 0 HG2 GLU B 109 -9.595 -0.538 2.439 1.00 0.00 H new ATOM 0 HG3 GLU B 109 -8.658 0.938 2.317 1.00 0.00 H new ATOM 2178 N CYS B 110 -6.270 -3.436 3.401 1.00 0.00 N ATOM 2179 CA CYS B 110 -5.365 -4.570 3.342 1.00 0.00 C ATOM 2180 C CYS B 110 -5.841 -5.507 2.229 1.00 0.00 C ATOM 2181 O CYS B 110 -6.974 -5.984 2.257 1.00 0.00 O ATOM 2182 CB CYS B 110 -5.269 -5.288 4.690 1.00 0.00 C ATOM 2183 SG CYS B 110 -3.971 -6.577 4.621 1.00 0.00 S ATOM 0 H CYS B 110 -7.146 -3.614 3.893 1.00 0.00 H new ATOM 0 HA CYS B 110 -4.357 -4.223 3.117 1.00 0.00 H new ATOM 0 HB2 CYS B 110 -5.039 -4.571 5.478 1.00 0.00 H new ATOM 0 HB3 CYS B 110 -6.229 -5.740 4.940 1.00 0.00 H new ATOM 0 HG CYS B 110 -4.166 -7.441 5.572 1.00 0.00 H new ATOM 2189 N HIS B 111 -4.950 -5.742 1.277 1.00 0.00 N ATOM 2190 CA HIS B 111 -5.265 -6.613 0.157 1.00 0.00 C ATOM 2191 C HIS B 111 -4.460 -7.909 0.273 1.00 0.00 C ATOM 2192 O HIS B 111 -3.485 -7.974 1.020 1.00 0.00 O ATOM 2193 CB HIS B 111 -5.038 -5.892 -1.173 1.00 0.00 C ATOM 2194 CG HIS B 111 -5.957 -4.715 -1.398 1.00 0.00 C ATOM 2195 ND1 HIS B 111 -7.250 -4.854 -1.872 1.00 0.00 N ATOM 2196 CD2 HIS B 111 -5.758 -3.379 -1.208 1.00 0.00 C ATOM 2197 CE1 HIS B 111 -7.794 -3.649 -1.961 1.00 0.00 C ATOM 2198 NE2 HIS B 111 -6.868 -2.736 -1.549 1.00 0.00 N ATOM 0 H HIS B 111 -4.011 -5.345 1.258 1.00 0.00 H new ATOM 0 HA HIS B 111 -6.322 -6.878 0.184 1.00 0.00 H new ATOM 0 HB2 HIS B 111 -4.005 -5.547 -1.216 1.00 0.00 H new ATOM 0 HB3 HIS B 111 -5.170 -6.604 -1.988 1.00 0.00 H new ATOM 0 HD2 HIS B 111 -4.851 -2.922 -0.842 1.00 0.00 H new ATOM 0 HE1 HIS B 111 -8.795 -3.428 -2.300 1.00 0.00 H new ATOM 0 HE2 HIS B 111 -7.006 -1.726 -1.510 1.00 0.00 H new ATOM 2206 N VAL B 112 -4.898 -8.909 -0.477 1.00 0.00 N ATOM 2207 CA VAL B 112 -4.231 -10.200 -0.468 1.00 0.00 C ATOM 2208 C VAL B 112 -4.256 -10.793 -1.879 1.00 0.00 C ATOM 2209 O VAL B 112 -5.130 -10.463 -2.679 1.00 0.00 O ATOM 2210 CB VAL B 112 -4.875 -11.115 0.576 1.00 0.00 C ATOM 2211 CG1 VAL B 112 -4.007 -12.347 0.835 1.00 0.00 C ATOM 2212 CG2 VAL B 112 -5.151 -10.355 1.875 1.00 0.00 C ATOM 0 H VAL B 112 -5.707 -8.851 -1.095 1.00 0.00 H new ATOM 0 HA VAL B 112 -3.185 -10.087 -0.181 1.00 0.00 H new ATOM 0 HB VAL B 112 -5.831 -11.457 0.178 1.00 0.00 H new ATOM 0 HG11 VAL B 112 -4.488 -12.980 1.581 1.00 0.00 H new ATOM 0 HG12 VAL B 112 -3.884 -12.907 -0.092 1.00 0.00 H new ATOM 0 HG13 VAL B 112 -3.030 -12.033 1.201 1.00 0.00 H new ATOM 0 HG21 VAL B 112 -5.609 -11.028 2.600 1.00 0.00 H new ATOM 0 HG22 VAL B 112 -4.214 -9.971 2.278 1.00 0.00 H new ATOM 0 HG23 VAL B 112 -5.827 -9.524 1.674 1.00 0.00 H new ATOM 2222 N PHE B 113 -3.287 -11.657 -2.140 1.00 0.00 N ATOM 2223 CA PHE B 113 -3.186 -12.298 -3.440 1.00 0.00 C ATOM 2224 C PHE B 113 -2.619 -13.713 -3.311 1.00 0.00 C ATOM 2225 O PHE B 113 -2.128 -14.094 -2.250 1.00 0.00 O ATOM 2226 CB PHE B 113 -2.230 -11.452 -4.284 1.00 0.00 C ATOM 2227 CG PHE B 113 -2.716 -10.022 -4.529 1.00 0.00 C ATOM 2228 CD1 PHE B 113 -2.735 -9.126 -3.507 1.00 0.00 C ATOM 2229 CD2 PHE B 113 -3.128 -9.648 -5.770 1.00 0.00 C ATOM 2230 CE1 PHE B 113 -3.186 -7.799 -3.735 1.00 0.00 C ATOM 2231 CE2 PHE B 113 -3.579 -8.321 -5.998 1.00 0.00 C ATOM 2232 CZ PHE B 113 -3.598 -7.424 -4.976 1.00 0.00 C ATOM 0 H PHE B 113 -2.564 -11.928 -1.473 1.00 0.00 H new ATOM 0 HA PHE B 113 -4.173 -12.372 -3.896 1.00 0.00 H new ATOM 0 HB2 PHE B 113 -1.260 -11.415 -3.789 1.00 0.00 H new ATOM 0 HB3 PHE B 113 -2.079 -11.943 -5.245 1.00 0.00 H new ATOM 0 HD1 PHE B 113 -2.407 -9.423 -2.522 1.00 0.00 H new ATOM 0 HD2 PHE B 113 -3.112 -10.360 -6.582 1.00 0.00 H new ATOM 0 HE1 PHE B 113 -3.202 -7.087 -2.923 1.00 0.00 H new ATOM 0 HE2 PHE B 113 -3.907 -8.024 -6.983 1.00 0.00 H new ATOM 0 HZ PHE B 113 -3.940 -6.414 -5.150 1.00 0.00 H new ATOM 2242 N TRP B 114 -2.704 -14.452 -4.407 1.00 0.00 N ATOM 2243 CA TRP B 114 -2.205 -15.817 -4.430 1.00 0.00 C ATOM 2244 C TRP B 114 -1.206 -15.936 -5.584 1.00 0.00 C ATOM 2245 O TRP B 114 -1.589 -15.860 -6.750 1.00 0.00 O ATOM 2246 CB TRP B 114 -3.356 -16.820 -4.530 1.00 0.00 C ATOM 2247 CG TRP B 114 -2.911 -18.283 -4.488 1.00 0.00 C ATOM 2248 CD1 TRP B 114 -2.466 -19.040 -5.500 1.00 0.00 C ATOM 2249 CD2 TRP B 114 -2.886 -19.141 -3.328 1.00 0.00 C ATOM 2250 NE1 TRP B 114 -2.158 -20.318 -5.080 1.00 0.00 N ATOM 2251 CE2 TRP B 114 -2.421 -20.381 -3.716 1.00 0.00 C ATOM 2252 CE3 TRP B 114 -3.244 -18.878 -1.994 1.00 0.00 C ATOM 2253 CZ2 TRP B 114 -2.271 -21.456 -2.832 1.00 0.00 C ATOM 2254 CZ3 TRP B 114 -3.089 -19.963 -1.122 1.00 0.00 C ATOM 2255 CH2 TRP B 114 -2.622 -21.217 -1.497 1.00 0.00 C ATOM 0 H TRP B 114 -3.111 -14.132 -5.286 1.00 0.00 H new ATOM 0 HA TRP B 114 -1.691 -16.056 -3.499 1.00 0.00 H new ATOM 0 HB2 TRP B 114 -4.054 -16.639 -3.712 1.00 0.00 H new ATOM 0 HB3 TRP B 114 -3.900 -16.643 -5.458 1.00 0.00 H new ATOM 0 HD1 TRP B 114 -2.361 -18.693 -6.517 1.00 0.00 H new ATOM 0 HE1 TRP B 114 -1.803 -21.076 -5.663 1.00 0.00 H new ATOM 0 HE3 TRP B 114 -3.610 -17.916 -1.668 1.00 0.00 H new ATOM 0 HZ2 TRP B 114 -1.905 -22.417 -3.161 1.00 0.00 H new ATOM 0 HZ3 TRP B 114 -3.351 -19.815 -0.085 1.00 0.00 H new ATOM 0 HH2 TRP B 114 -2.530 -22.004 -0.763 1.00 0.00 H new ATOM 2266 N CYS B 115 0.053 -16.119 -5.217 1.00 0.00 N ATOM 2267 CA CYS B 115 1.109 -16.250 -6.206 1.00 0.00 C ATOM 2268 C CYS B 115 1.633 -17.686 -6.164 1.00 0.00 C ATOM 2269 O CYS B 115 1.460 -18.385 -5.166 1.00 0.00 O ATOM 2270 CB CYS B 115 2.226 -15.228 -5.980 1.00 0.00 C ATOM 2271 SG CYS B 115 1.512 -13.628 -5.452 1.00 0.00 S ATOM 0 H CYS B 115 0.366 -16.180 -4.248 1.00 0.00 H new ATOM 0 HA CYS B 115 0.709 -16.040 -7.198 1.00 0.00 H new ATOM 0 HB2 CYS B 115 2.918 -15.595 -5.222 1.00 0.00 H new ATOM 0 HB3 CYS B 115 2.800 -15.095 -6.897 1.00 0.00 H new ATOM 0 HG CYS B 115 2.128 -13.208 -4.387 1.00 0.00 H new ATOM 2277 N GLU B 116 2.264 -18.085 -7.259 1.00 0.00 N ATOM 2278 CA GLU B 116 2.814 -19.426 -7.359 1.00 0.00 C ATOM 2279 C GLU B 116 4.228 -19.377 -7.942 1.00 0.00 C ATOM 2280 O GLU B 116 4.467 -18.706 -8.944 1.00 0.00 O ATOM 2281 CB GLU B 116 1.907 -20.330 -8.196 1.00 0.00 C ATOM 2282 CG GLU B 116 0.606 -20.640 -7.453 1.00 0.00 C ATOM 2283 CD GLU B 116 -0.134 -21.808 -8.108 1.00 0.00 C ATOM 2284 OE1 GLU B 116 0.566 -22.705 -8.626 1.00 0.00 O ATOM 2285 OE2 GLU B 116 -1.383 -21.778 -8.076 1.00 0.00 O ATOM 0 H GLU B 116 2.406 -17.503 -8.084 1.00 0.00 H new ATOM 0 HA GLU B 116 2.869 -19.851 -6.357 1.00 0.00 H new ATOM 0 HB2 GLU B 116 1.681 -19.845 -9.146 1.00 0.00 H new ATOM 0 HB3 GLU B 116 2.428 -21.259 -8.428 1.00 0.00 H new ATOM 0 HG2 GLU B 116 0.826 -20.881 -6.413 1.00 0.00 H new ATOM 0 HG3 GLU B 116 -0.033 -19.757 -7.447 1.00 0.00 H new ATOM 2292 N PRO B 117 5.152 -20.116 -7.271 1.00 0.00 N ATOM 2293 CA PRO B 117 4.785 -20.882 -6.092 1.00 0.00 C ATOM 2294 C PRO B 117 4.589 -19.966 -4.882 1.00 0.00 C ATOM 2295 O PRO B 117 3.528 -19.973 -4.259 1.00 0.00 O ATOM 2296 CB PRO B 117 5.916 -21.880 -5.904 1.00 0.00 C ATOM 2297 CG PRO B 117 7.091 -21.334 -6.699 1.00 0.00 C ATOM 2298 CD PRO B 117 6.565 -20.242 -7.616 1.00 0.00 C ATOM 0 HA PRO B 117 3.831 -21.397 -6.205 1.00 0.00 H new ATOM 0 HB2 PRO B 117 6.173 -21.985 -4.850 1.00 0.00 H new ATOM 0 HB3 PRO B 117 5.628 -22.868 -6.262 1.00 0.00 H new ATOM 0 HG2 PRO B 117 7.853 -20.936 -6.029 1.00 0.00 H new ATOM 0 HG3 PRO B 117 7.560 -22.128 -7.280 1.00 0.00 H new ATOM 0 HD2 PRO B 117 7.096 -19.303 -7.459 1.00 0.00 H new ATOM 0 HD3 PRO B 117 6.694 -20.510 -8.665 1.00 0.00 H new ATOM 2306 N ASN B 118 5.628 -19.199 -4.586 1.00 0.00 N ATOM 2307 CA ASN B 118 5.583 -18.279 -3.462 1.00 0.00 C ATOM 2308 C ASN B 118 5.457 -16.847 -3.985 1.00 0.00 C ATOM 2309 O ASN B 118 5.449 -16.623 -5.195 1.00 0.00 O ATOM 2310 CB ASN B 118 6.863 -18.367 -2.627 1.00 0.00 C ATOM 2311 CG ASN B 118 8.087 -17.982 -3.459 1.00 0.00 C ATOM 2312 OD1 ASN B 118 8.001 -17.687 -4.640 1.00 0.00 O ATOM 2313 ND2 ASN B 118 9.231 -18.002 -2.780 1.00 0.00 N ATOM 0 H ASN B 118 6.506 -19.196 -5.105 1.00 0.00 H new ATOM 0 HA ASN B 118 4.728 -18.547 -2.841 1.00 0.00 H new ATOM 0 HB2 ASN B 118 6.784 -17.707 -1.763 1.00 0.00 H new ATOM 0 HB3 ASN B 118 6.983 -19.381 -2.244 1.00 0.00 H new ATOM 0 HD21 ASN B 118 10.105 -17.761 -3.247 1.00 0.00 H new ATOM 0 HD22 ASN B 118 9.234 -18.258 -1.793 1.00 0.00 H new ATOM 2320 N ALA B 119 5.362 -15.915 -3.049 1.00 0.00 N ATOM 2321 CA ALA B 119 5.237 -14.511 -3.400 1.00 0.00 C ATOM 2322 C ALA B 119 6.607 -13.838 -3.291 1.00 0.00 C ATOM 2323 O ALA B 119 6.710 -12.704 -2.825 1.00 0.00 O ATOM 2324 CB ALA B 119 4.190 -13.851 -2.501 1.00 0.00 C ATOM 0 H ALA B 119 5.369 -16.105 -2.047 1.00 0.00 H new ATOM 0 HA ALA B 119 4.897 -14.402 -4.430 1.00 0.00 H new ATOM 0 HB1 ALA B 119 4.096 -12.797 -2.764 1.00 0.00 H new ATOM 0 HB2 ALA B 119 3.229 -14.346 -2.638 1.00 0.00 H new ATOM 0 HB3 ALA B 119 4.498 -13.938 -1.459 1.00 0.00 H new ATOM 2330 N ALA B 120 7.624 -14.565 -3.728 1.00 0.00 N ATOM 2331 CA ALA B 120 8.983 -14.053 -3.685 1.00 0.00 C ATOM 2332 C ALA B 120 9.149 -12.970 -4.753 1.00 0.00 C ATOM 2333 O ALA B 120 9.361 -11.802 -4.430 1.00 0.00 O ATOM 2334 CB ALA B 120 9.970 -15.208 -3.868 1.00 0.00 C ATOM 0 H ALA B 120 7.534 -15.505 -4.114 1.00 0.00 H new ATOM 0 HA ALA B 120 9.191 -13.597 -2.717 1.00 0.00 H new ATOM 0 HB1 ALA B 120 10.990 -14.824 -3.836 1.00 0.00 H new ATOM 0 HB2 ALA B 120 9.831 -15.936 -3.068 1.00 0.00 H new ATOM 0 HB3 ALA B 120 9.794 -15.688 -4.830 1.00 0.00 H new ATOM 2340 N ASN B 121 9.047 -13.396 -6.004 1.00 0.00 N ATOM 2341 CA ASN B 121 9.183 -12.477 -7.121 1.00 0.00 C ATOM 2342 C ASN B 121 8.157 -11.352 -6.978 1.00 0.00 C ATOM 2343 O ASN B 121 8.306 -10.290 -7.581 1.00 0.00 O ATOM 2344 CB ASN B 121 8.926 -13.186 -8.452 1.00 0.00 C ATOM 2345 CG ASN B 121 10.137 -14.022 -8.872 1.00 0.00 C ATOM 2346 OD1 ASN B 121 11.160 -14.055 -8.208 1.00 0.00 O ATOM 2347 ND2 ASN B 121 9.964 -14.692 -10.007 1.00 0.00 N ATOM 0 H ASN B 121 8.872 -14.365 -6.268 1.00 0.00 H new ATOM 0 HA ASN B 121 10.200 -12.084 -7.113 1.00 0.00 H new ATOM 0 HB2 ASN B 121 8.050 -13.828 -8.363 1.00 0.00 H new ATOM 0 HB3 ASN B 121 8.703 -12.449 -9.224 1.00 0.00 H new ATOM 0 HD21 ASN B 121 10.714 -15.279 -10.372 1.00 0.00 H new ATOM 0 HD22 ASN B 121 9.081 -14.619 -10.513 1.00 0.00 H new ATOM 2354 N VAL B 122 7.137 -11.623 -6.177 1.00 0.00 N ATOM 2355 CA VAL B 122 6.085 -10.646 -5.948 1.00 0.00 C ATOM 2356 C VAL B 122 6.492 -9.727 -4.794 1.00 0.00 C ATOM 2357 O VAL B 122 6.649 -8.522 -4.981 1.00 0.00 O ATOM 2358 CB VAL B 122 4.753 -11.358 -5.704 1.00 0.00 C ATOM 2359 CG1 VAL B 122 3.877 -10.565 -4.733 1.00 0.00 C ATOM 2360 CG2 VAL B 122 4.019 -11.614 -7.022 1.00 0.00 C ATOM 0 H VAL B 122 7.016 -12.505 -5.678 1.00 0.00 H new ATOM 0 HA VAL B 122 5.946 -10.020 -6.830 1.00 0.00 H new ATOM 0 HB VAL B 122 4.968 -12.324 -5.247 1.00 0.00 H new ATOM 0 HG11 VAL B 122 2.936 -11.093 -4.577 1.00 0.00 H new ATOM 0 HG12 VAL B 122 4.395 -10.458 -3.780 1.00 0.00 H new ATOM 0 HG13 VAL B 122 3.674 -9.578 -5.149 1.00 0.00 H new ATOM 0 HG21 VAL B 122 3.075 -12.121 -6.820 1.00 0.00 H new ATOM 0 HG22 VAL B 122 3.822 -10.664 -7.519 1.00 0.00 H new ATOM 0 HG23 VAL B 122 4.636 -12.239 -7.667 1.00 0.00 H new ATOM 2370 N SER B 123 6.651 -10.332 -3.626 1.00 0.00 N ATOM 2371 CA SER B 123 7.036 -9.584 -2.442 1.00 0.00 C ATOM 2372 C SER B 123 8.360 -8.859 -2.688 1.00 0.00 C ATOM 2373 O SER B 123 8.596 -7.785 -2.138 1.00 0.00 O ATOM 2374 CB SER B 123 7.152 -10.502 -1.223 1.00 0.00 C ATOM 2375 OG SER B 123 5.879 -10.963 -0.779 1.00 0.00 O ATOM 0 H SER B 123 6.520 -11.332 -3.475 1.00 0.00 H new ATOM 0 HA SER B 123 6.259 -8.848 -2.236 1.00 0.00 H new ATOM 0 HB2 SER B 123 7.781 -11.357 -1.472 1.00 0.00 H new ATOM 0 HB3 SER B 123 7.647 -9.967 -0.412 1.00 0.00 H new ATOM 0 HG SER B 123 5.200 -10.284 -0.972 1.00 0.00 H new ATOM 2381 N GLU B 124 9.190 -9.476 -3.517 1.00 0.00 N ATOM 2382 CA GLU B 124 10.485 -8.903 -3.843 1.00 0.00 C ATOM 2383 C GLU B 124 10.311 -7.672 -4.736 1.00 0.00 C ATOM 2384 O GLU B 124 10.741 -6.576 -4.380 1.00 0.00 O ATOM 2385 CB GLU B 124 11.391 -9.940 -4.509 1.00 0.00 C ATOM 2386 CG GLU B 124 12.639 -9.279 -5.098 1.00 0.00 C ATOM 2387 CD GLU B 124 13.629 -10.331 -5.603 1.00 0.00 C ATOM 2388 OE1 GLU B 124 13.160 -11.282 -6.265 1.00 0.00 O ATOM 2389 OE2 GLU B 124 14.834 -10.160 -5.316 1.00 0.00 O ATOM 0 H GLU B 124 8.991 -10.367 -3.972 1.00 0.00 H new ATOM 0 HA GLU B 124 10.966 -8.590 -2.916 1.00 0.00 H new ATOM 0 HB2 GLU B 124 11.685 -10.694 -3.779 1.00 0.00 H new ATOM 0 HB3 GLU B 124 10.842 -10.456 -5.297 1.00 0.00 H new ATOM 0 HG2 GLU B 124 12.353 -8.620 -5.918 1.00 0.00 H new ATOM 0 HG3 GLU B 124 13.118 -8.658 -4.341 1.00 0.00 H new ATOM 2396 N ALA B 125 9.680 -7.895 -5.879 1.00 0.00 N ATOM 2397 CA ALA B 125 9.444 -6.818 -6.826 1.00 0.00 C ATOM 2398 C ALA B 125 8.787 -5.642 -6.101 1.00 0.00 C ATOM 2399 O ALA B 125 8.856 -4.505 -6.564 1.00 0.00 O ATOM 2400 CB ALA B 125 8.592 -7.336 -7.987 1.00 0.00 C ATOM 0 H ALA B 125 9.325 -8.805 -6.171 1.00 0.00 H new ATOM 0 HA ALA B 125 10.385 -6.463 -7.245 1.00 0.00 H new ATOM 0 HB1 ALA B 125 8.415 -6.528 -8.697 1.00 0.00 H new ATOM 0 HB2 ALA B 125 9.115 -8.151 -8.487 1.00 0.00 H new ATOM 0 HB3 ALA B 125 7.638 -7.698 -7.605 1.00 0.00 H new ATOM 2406 N VAL B 126 8.163 -5.957 -4.974 1.00 0.00 N ATOM 2407 CA VAL B 126 7.495 -4.940 -4.181 1.00 0.00 C ATOM 2408 C VAL B 126 8.458 -4.417 -3.113 1.00 0.00 C ATOM 2409 O VAL B 126 8.423 -3.238 -2.764 1.00 0.00 O ATOM 2410 CB VAL B 126 6.199 -5.503 -3.592 1.00 0.00 C ATOM 2411 CG1 VAL B 126 5.374 -4.400 -2.927 1.00 0.00 C ATOM 2412 CG2 VAL B 126 5.382 -6.230 -4.662 1.00 0.00 C ATOM 0 H VAL B 126 8.107 -6.901 -4.593 1.00 0.00 H new ATOM 0 HA VAL B 126 7.212 -4.093 -4.807 1.00 0.00 H new ATOM 0 HB VAL B 126 6.467 -6.229 -2.824 1.00 0.00 H new ATOM 0 HG11 VAL B 126 4.459 -4.827 -2.517 1.00 0.00 H new ATOM 0 HG12 VAL B 126 5.954 -3.946 -2.124 1.00 0.00 H new ATOM 0 HG13 VAL B 126 5.120 -3.640 -3.666 1.00 0.00 H new ATOM 0 HG21 VAL B 126 4.466 -6.621 -4.218 1.00 0.00 H new ATOM 0 HG22 VAL B 126 5.129 -5.534 -5.462 1.00 0.00 H new ATOM 0 HG23 VAL B 126 5.968 -7.054 -5.070 1.00 0.00 H new ATOM 2422 N GLN B 127 9.295 -5.320 -2.624 1.00 0.00 N ATOM 2423 CA GLN B 127 10.267 -4.964 -1.603 1.00 0.00 C ATOM 2424 C GLN B 127 11.257 -3.934 -2.149 1.00 0.00 C ATOM 2425 O GLN B 127 11.614 -2.983 -1.455 1.00 0.00 O ATOM 2426 CB GLN B 127 10.996 -6.205 -1.085 1.00 0.00 C ATOM 2427 CG GLN B 127 11.895 -5.856 0.103 1.00 0.00 C ATOM 2428 CD GLN B 127 12.519 -7.116 0.707 1.00 0.00 C ATOM 2429 OE1 GLN B 127 13.506 -7.645 0.221 1.00 0.00 O ATOM 2430 NE2 GLN B 127 11.892 -7.565 1.790 1.00 0.00 N ATOM 0 H GLN B 127 9.321 -6.297 -2.915 1.00 0.00 H new ATOM 0 HA GLN B 127 9.736 -4.518 -0.762 1.00 0.00 H new ATOM 0 HB2 GLN B 127 10.269 -6.960 -0.786 1.00 0.00 H new ATOM 0 HB3 GLN B 127 11.596 -6.639 -1.885 1.00 0.00 H new ATOM 0 HG2 GLN B 127 12.682 -5.175 -0.220 1.00 0.00 H new ATOM 0 HG3 GLN B 127 11.313 -5.334 0.863 1.00 0.00 H new ATOM 0 HE21 GLN B 127 11.071 -7.074 2.144 1.00 0.00 H new ATOM 0 HE22 GLN B 127 12.232 -8.400 2.267 1.00 0.00 H new ATOM 2439 N ALA B 128 11.673 -4.157 -3.387 1.00 0.00 N ATOM 2440 CA ALA B 128 12.615 -3.260 -4.034 1.00 0.00 C ATOM 2441 C ALA B 128 11.879 -2.000 -4.495 1.00 0.00 C ATOM 2442 O ALA B 128 12.499 -0.963 -4.725 1.00 0.00 O ATOM 2443 CB ALA B 128 13.303 -3.989 -5.190 1.00 0.00 C ATOM 0 H ALA B 128 11.375 -4.947 -3.959 1.00 0.00 H new ATOM 0 HA ALA B 128 13.392 -2.951 -3.335 1.00 0.00 H new ATOM 0 HB1 ALA B 128 14.010 -3.316 -5.675 1.00 0.00 H new ATOM 0 HB2 ALA B 128 13.836 -4.859 -4.806 1.00 0.00 H new ATOM 0 HB3 ALA B 128 12.554 -4.312 -5.913 1.00 0.00 H new ATOM 2449 N ALA B 129 10.566 -2.132 -4.617 1.00 0.00 N ATOM 2450 CA ALA B 129 9.738 -1.018 -5.046 1.00 0.00 C ATOM 2451 C ALA B 129 9.649 0.010 -3.917 1.00 0.00 C ATOM 2452 O ALA B 129 9.999 1.175 -4.103 1.00 0.00 O ATOM 2453 CB ALA B 129 8.364 -1.537 -5.472 1.00 0.00 C ATOM 0 H ALA B 129 10.055 -2.994 -4.426 1.00 0.00 H new ATOM 0 HA ALA B 129 10.180 -0.521 -5.910 1.00 0.00 H new ATOM 0 HB1 ALA B 129 7.743 -0.701 -5.794 1.00 0.00 H new ATOM 0 HB2 ALA B 129 8.480 -2.241 -6.296 1.00 0.00 H new ATOM 0 HB3 ALA B 129 7.888 -2.040 -4.630 1.00 0.00 H new ATOM 2459 N CYS B 130 9.178 -0.457 -2.770 1.00 0.00 N ATOM 2460 CA CYS B 130 9.038 0.407 -1.610 1.00 0.00 C ATOM 2461 C CYS B 130 10.377 1.104 -1.366 1.00 0.00 C ATOM 2462 O CYS B 130 10.451 2.332 -1.362 1.00 0.00 O ATOM 2463 CB CYS B 130 8.566 -0.369 -0.379 1.00 0.00 C ATOM 2464 SG CYS B 130 6.745 -0.547 -0.411 1.00 0.00 S ATOM 0 H CYS B 130 8.888 -1.423 -2.619 1.00 0.00 H new ATOM 0 HA CYS B 130 8.269 1.155 -1.802 1.00 0.00 H new ATOM 0 HB2 CYS B 130 9.035 -1.353 -0.357 1.00 0.00 H new ATOM 0 HB3 CYS B 130 8.873 0.151 0.528 1.00 0.00 H new ATOM 0 HG CYS B 130 6.389 -1.170 -1.495 1.00 0.00 H new