USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=34 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 177:sc= -6.05! (180deg=-5.65!) USER MOD Set 1.2: B 130 CYS SG : rot -170:sc= -1.6 USER MOD Set 2.1: B 22 TYR OH : rot 22:sc= 0.39 USER MOD Set 2.2: B 111 HIS : no HD1:sc= -2.27 X(o=-1.9,f=-1.7) USER MOD Set 3.1: A 16 GLN : amide:sc= -1.04 K(o=-1.1,f=-5.1) USER MOD Set 3.2: A 17 ASN : amide:sc= -0.0454 K(o=-1.1,f=-7) 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 14 MET CE :methyl -136:sc= -5.21 (180deg=-12.2!) USER MOD Single : A 15 GLN : amide:sc= -3.17! C(o=-3.2!,f=-2.8!) USER MOD Single : A 19 TYR OH : rot 30:sc= 0 USER MOD Single : B 16 GLN :FLIP amide:sc= -0.0857 F(o=-0.64,f=-0.086) USER MOD Single : B 17 LYS NZ :NH3+ -176:sc= 0.0261 (180deg=0.00139) USER MOD Single : B 21 GLN : amide:sc= 0.0492 K(o=0.049,f=-2.1!) USER MOD Single : B 25 MET CE :methyl 163:sc= -0.0394 (180deg=-0.591) USER MOD Single : B 34 MET CE :methyl -128:sc= -0.475 (180deg=-2.74!) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0 USER MOD Single : B 38 ASN : amide:sc= -2.84! C(o=-2.8!,f=-5.6!) USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 43 ASN : amide:sc= -0.956 X(o=-0.96,f=-0.96) USER MOD Single : B 45 MET CE :methyl -137:sc= -1.77 (180deg=-3.95!) USER MOD Single : B 46 THR OG1 : rot 180:sc= 0 USER MOD Single : B 47 SER OG : 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= 1.04 (180deg=0.732) USER MOD Single : B 55 SER OG : rot 132:sc= 0.702 USER MOD Single : B 57 ASN : amide:sc= -2.93! C(o=-2.9!,f=-7.9!) USER MOD Single : B 58 MET CE :methyl -150:sc= -0.66 (180deg=-2.6!) USER MOD Single : B 59 ASN :FLIP amide:sc= -1.83 F(o=-2.7!,f=-1.8) USER MOD Single : B 64 THR OG1 : rot -24:sc= 0.266 USER MOD Single : B 66 THR OG1 : rot 180:sc= -0.386 USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 71 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0475) USER MOD Single : B 72 ASN : amide:sc= 0.114 K(o=0.11,f=-1.2) USER MOD Single : B 80 CYS SG : rot 130:sc= -10.1! USER MOD Single : B 86 SER OG : rot 97:sc= 0.398 USER MOD Single : B 92 LYS NZ :NH3+ 143:sc= 0.386 (180deg=0.0194) USER MOD Single : B 95 HIS :FLIP no HE2:sc= -3! C(o=-3.7!,f=-3!) USER MOD Single : B 96 THR OG1 : rot -72:sc= 0.443 USER MOD Single : B 101 MET CE :methyl -163:sc= -1.97 (180deg=-3.49!) USER MOD Single : B 110 CYS SG : rot 180:sc= -5.28! USER MOD Single : B 115 CYS SG : rot 79:sc= -1.81 USER MOD Single : B 118 ASN : amide:sc= 0.23 K(o=0.23,f=-4.5!) USER MOD Single : B 121 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 123 SER OG : rot -8:sc= -0.295! USER MOD Single : B 127 GLN : amide:sc= -0.226 K(o=-0.23,f=-1.6!) USER MOD ----------------------------------------------------------------- ATOM 148 N LEU A 11 11.285 -14.129 2.201 1.00 0.00 N ATOM 149 CA LEU A 11 9.956 -14.579 2.577 1.00 0.00 C ATOM 150 C LEU A 11 9.903 -14.787 4.092 1.00 0.00 C ATOM 151 O LEU A 11 9.065 -14.198 4.774 1.00 0.00 O ATOM 152 CB LEU A 11 9.562 -15.819 1.773 1.00 0.00 C ATOM 153 CG LEU A 11 9.347 -15.605 0.273 1.00 0.00 C ATOM 154 CD1 LEU A 11 9.012 -16.924 -0.426 1.00 0.00 C ATOM 155 CD2 LEU A 11 8.283 -14.535 0.019 1.00 0.00 C ATOM 0 HA LEU A 11 9.214 -13.820 2.332 1.00 0.00 H new ATOM 0 HB2 LEU A 11 10.337 -16.574 1.905 1.00 0.00 H new ATOM 0 HB3 LEU A 11 8.644 -16.226 2.197 1.00 0.00 H new ATOM 0 HG LEU A 11 10.280 -15.240 -0.158 1.00 0.00 H new ATOM 0 HD11 LEU A 11 8.864 -16.744 -1.491 1.00 0.00 H new ATOM 0 HD12 LEU A 11 9.833 -17.628 -0.288 1.00 0.00 H new ATOM 0 HD13 LEU A 11 8.100 -17.341 0.002 1.00 0.00 H new ATOM 0 HD21 LEU A 11 8.149 -14.402 -1.055 1.00 0.00 H new ATOM 0 HD22 LEU A 11 7.339 -14.847 0.466 1.00 0.00 H new ATOM 0 HD23 LEU A 11 8.601 -13.592 0.464 1.00 0.00 H new ATOM 167 N SER A 12 10.807 -15.626 4.575 1.00 0.00 N ATOM 168 CA SER A 12 10.874 -15.918 5.997 1.00 0.00 C ATOM 169 C SER A 12 10.823 -14.618 6.801 1.00 0.00 C ATOM 170 O SER A 12 10.424 -14.619 7.965 1.00 0.00 O ATOM 171 CB SER A 12 12.140 -16.705 6.339 1.00 0.00 C ATOM 172 OG SER A 12 11.886 -18.102 6.457 1.00 0.00 O ATOM 0 H SER A 12 11.500 -16.113 4.007 1.00 0.00 H new ATOM 0 HA SER A 12 10.014 -16.534 6.260 1.00 0.00 H new ATOM 0 HB2 SER A 12 12.891 -16.537 5.567 1.00 0.00 H new ATOM 0 HB3 SER A 12 12.557 -16.332 7.275 1.00 0.00 H new ATOM 0 HG SER A 12 12.720 -18.569 6.674 1.00 0.00 H new ATOM 178 N LYS A 13 11.233 -13.540 6.150 1.00 0.00 N ATOM 179 CA LYS A 13 11.239 -12.235 6.790 1.00 0.00 C ATOM 180 C LYS A 13 9.818 -11.668 6.796 1.00 0.00 C ATOM 181 O LYS A 13 9.191 -11.568 7.850 1.00 0.00 O ATOM 182 CB LYS A 13 12.265 -11.316 6.124 1.00 0.00 C ATOM 183 CG LYS A 13 12.420 -10.010 6.905 1.00 0.00 C ATOM 184 CD LYS A 13 13.498 -9.122 6.280 1.00 0.00 C ATOM 185 CE LYS A 13 12.919 -7.771 5.857 1.00 0.00 C ATOM 186 NZ LYS A 13 13.999 -6.771 5.697 1.00 0.00 N ATOM 0 H LYS A 13 11.564 -13.543 5.185 1.00 0.00 H new ATOM 0 HA LYS A 13 11.552 -12.323 7.830 1.00 0.00 H new ATOM 0 HB2 LYS A 13 13.228 -11.824 6.063 1.00 0.00 H new ATOM 0 HB3 LYS A 13 11.954 -11.098 5.102 1.00 0.00 H new ATOM 0 HG2 LYS A 13 11.469 -9.477 6.922 1.00 0.00 H new ATOM 0 HG3 LYS A 13 12.680 -10.230 7.940 1.00 0.00 H new ATOM 0 HD2 LYS A 13 14.306 -8.967 6.995 1.00 0.00 H new ATOM 0 HD3 LYS A 13 13.930 -9.624 5.414 1.00 0.00 H new ATOM 0 HE2 LYS A 13 12.374 -7.880 4.919 1.00 0.00 H new ATOM 0 HE3 LYS A 13 12.203 -7.426 6.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 13.589 -5.860 5.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 14.501 -6.655 6.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 14.667 -7.095 4.969 1.00 0.00 H new ATOM 200 N MET A 14 9.352 -11.312 5.608 1.00 0.00 N ATOM 201 CA MET A 14 8.017 -10.758 5.464 1.00 0.00 C ATOM 202 C MET A 14 6.968 -11.686 6.080 1.00 0.00 C ATOM 203 O MET A 14 5.837 -11.272 6.329 1.00 0.00 O ATOM 204 CB MET A 14 7.707 -10.552 3.980 1.00 0.00 C ATOM 205 CG MET A 14 8.432 -9.320 3.435 1.00 0.00 C ATOM 206 SD MET A 14 7.260 -8.213 2.668 1.00 0.00 S ATOM 207 CE MET A 14 8.360 -6.902 2.159 1.00 0.00 C ATOM 0 H MET A 14 9.875 -11.396 4.737 1.00 0.00 H new ATOM 0 HA MET A 14 7.982 -9.803 5.988 1.00 0.00 H new ATOM 0 HB2 MET A 14 8.008 -11.435 3.416 1.00 0.00 H new ATOM 0 HB3 MET A 14 6.632 -10.437 3.842 1.00 0.00 H new ATOM 0 HG2 MET A 14 8.954 -8.808 4.243 1.00 0.00 H new ATOM 0 HG3 MET A 14 9.187 -9.623 2.710 1.00 0.00 H new ATOM 0 HE1 MET A 14 7.911 -5.938 2.396 1.00 0.00 H new ATOM 0 HE2 MET A 14 9.310 -6.999 2.685 1.00 0.00 H new ATOM 0 HE3 MET A 14 8.532 -6.968 1.085 1.00 0.00 H new ATOM 217 N GLN A 15 7.381 -12.924 6.309 1.00 0.00 N ATOM 218 CA GLN A 15 6.492 -13.914 6.892 1.00 0.00 C ATOM 219 C GLN A 15 6.077 -13.491 8.302 1.00 0.00 C ATOM 220 O GLN A 15 4.967 -13.787 8.742 1.00 0.00 O ATOM 221 CB GLN A 15 7.145 -15.298 6.904 1.00 0.00 C ATOM 222 CG GLN A 15 6.890 -16.036 5.589 1.00 0.00 C ATOM 223 CD GLN A 15 6.304 -17.427 5.845 1.00 0.00 C ATOM 224 OE1 GLN A 15 7.011 -18.412 5.974 1.00 0.00 O ATOM 225 NE2 GLN A 15 4.976 -17.450 5.910 1.00 0.00 N ATOM 0 H GLN A 15 8.320 -13.264 6.101 1.00 0.00 H new ATOM 0 HA GLN A 15 5.596 -13.977 6.275 1.00 0.00 H new ATOM 0 HB2 GLN A 15 8.218 -15.196 7.066 1.00 0.00 H new ATOM 0 HB3 GLN A 15 6.751 -15.883 7.735 1.00 0.00 H new ATOM 0 HG2 GLN A 15 6.205 -15.457 4.970 1.00 0.00 H new ATOM 0 HG3 GLN A 15 7.823 -16.127 5.032 1.00 0.00 H new ATOM 0 HE21 GLN A 15 4.445 -16.587 5.793 1.00 0.00 H new ATOM 0 HE22 GLN A 15 4.489 -18.330 6.077 1.00 0.00 H new ATOM 234 N GLN A 16 6.991 -12.805 8.972 1.00 0.00 N ATOM 235 CA GLN A 16 6.734 -12.337 10.324 1.00 0.00 C ATOM 236 C GLN A 16 7.394 -10.975 10.549 1.00 0.00 C ATOM 237 O GLN A 16 6.768 -10.058 11.078 1.00 0.00 O ATOM 238 CB GLN A 16 7.216 -13.357 11.357 1.00 0.00 C ATOM 239 CG GLN A 16 8.474 -14.079 10.870 1.00 0.00 C ATOM 240 CD GLN A 16 9.735 -13.293 11.239 1.00 0.00 C ATOM 241 OE1 GLN A 16 9.876 -12.774 12.333 1.00 0.00 O ATOM 242 NE2 GLN A 16 10.640 -13.236 10.266 1.00 0.00 N ATOM 0 H GLN A 16 7.911 -12.562 8.604 1.00 0.00 H new ATOM 0 HA GLN A 16 5.657 -12.222 10.450 1.00 0.00 H new ATOM 0 HB2 GLN A 16 7.424 -12.853 12.301 1.00 0.00 H new ATOM 0 HB3 GLN A 16 6.427 -14.084 11.551 1.00 0.00 H new ATOM 0 HG2 GLN A 16 8.520 -15.075 11.311 1.00 0.00 H new ATOM 0 HG3 GLN A 16 8.427 -14.211 9.789 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.458 -13.693 9.373 1.00 0.00 H new ATOM 0 HE22 GLN A 16 11.516 -12.735 10.413 1.00 0.00 H new ATOM 251 N ASN A 17 8.649 -10.886 10.135 1.00 0.00 N ATOM 252 CA ASN A 17 9.400 -9.651 10.285 1.00 0.00 C ATOM 253 C ASN A 17 8.685 -8.529 9.530 1.00 0.00 C ATOM 254 O ASN A 17 8.880 -7.352 9.830 1.00 0.00 O ATOM 255 CB ASN A 17 10.809 -9.789 9.703 1.00 0.00 C ATOM 256 CG ASN A 17 11.756 -10.444 10.710 1.00 0.00 C ATOM 257 OD1 ASN A 17 12.424 -11.425 10.425 1.00 0.00 O ATOM 258 ND2 ASN A 17 11.777 -9.850 11.899 1.00 0.00 N ATOM 0 H ASN A 17 9.165 -11.649 9.696 1.00 0.00 H new ATOM 0 HA ASN A 17 9.469 -9.426 11.349 1.00 0.00 H new ATOM 0 HB2 ASN A 17 10.773 -10.385 8.791 1.00 0.00 H new ATOM 0 HB3 ASN A 17 11.190 -8.806 9.426 1.00 0.00 H new ATOM 0 HD21 ASN A 17 12.378 -10.212 12.640 1.00 0.00 H new ATOM 0 HD22 ASN A 17 11.192 -9.032 12.071 1.00 0.00 H new ATOM 265 N GLY A 18 7.871 -8.933 8.566 1.00 0.00 N ATOM 266 CA GLY A 18 7.125 -7.977 7.766 1.00 0.00 C ATOM 267 C GLY A 18 8.052 -6.907 7.185 1.00 0.00 C ATOM 268 O GLY A 18 9.256 -7.126 7.058 1.00 0.00 O ATOM 0 H GLY A 18 7.712 -9.910 8.321 1.00 0.00 H new ATOM 0 HA2 GLY A 18 6.611 -8.497 6.957 1.00 0.00 H new ATOM 0 HA3 GLY A 18 6.358 -7.505 8.379 1.00 0.00 H new ATOM 272 N TYR A 19 7.456 -5.772 6.849 1.00 0.00 N ATOM 273 CA TYR A 19 8.214 -4.668 6.284 1.00 0.00 C ATOM 274 C TYR A 19 7.419 -3.363 6.360 1.00 0.00 C ATOM 275 O TYR A 19 6.226 -3.340 6.060 1.00 0.00 O ATOM 276 CB TYR A 19 8.448 -5.025 4.815 1.00 0.00 C ATOM 277 CG TYR A 19 9.141 -3.924 4.010 1.00 0.00 C ATOM 278 CD1 TYR A 19 10.519 -3.838 4.004 1.00 0.00 C ATOM 279 CD2 TYR A 19 8.390 -3.017 3.291 1.00 0.00 C ATOM 280 CE1 TYR A 19 11.172 -2.802 3.246 1.00 0.00 C ATOM 281 CE2 TYR A 19 9.043 -1.981 2.534 1.00 0.00 C ATOM 282 CZ TYR A 19 10.402 -1.924 2.549 1.00 0.00 C ATOM 283 OH TYR A 19 11.018 -0.946 1.834 1.00 0.00 O ATOM 0 H TYR A 19 6.458 -5.593 6.957 1.00 0.00 H new ATOM 0 HA TYR A 19 9.145 -4.521 6.831 1.00 0.00 H new ATOM 0 HB2 TYR A 19 9.050 -5.932 4.764 1.00 0.00 H new ATOM 0 HB3 TYR A 19 7.489 -5.252 4.350 1.00 0.00 H new ATOM 0 HD1 TYR A 19 11.107 -4.547 4.567 1.00 0.00 H new ATOM 0 HD2 TYR A 19 7.312 -3.084 3.296 1.00 0.00 H new ATOM 0 HE1 TYR A 19 12.249 -2.724 3.231 1.00 0.00 H new ATOM 0 HE2 TYR A 19 8.467 -1.265 1.967 1.00 0.00 H new ATOM 0 HH TYR A 19 11.895 -1.264 1.533 1.00 0.00 H new ATOM 293 N GLU A 20 8.112 -2.308 6.762 1.00 0.00 N ATOM 294 CA GLU A 20 7.485 -1.002 6.880 1.00 0.00 C ATOM 295 C GLU A 20 8.191 0.009 5.974 1.00 0.00 C ATOM 296 O GLU A 20 9.326 0.400 6.239 1.00 0.00 O ATOM 297 CB GLU A 20 7.481 -0.526 8.334 1.00 0.00 C ATOM 298 CG GLU A 20 6.059 -0.219 8.807 1.00 0.00 C ATOM 299 CD GLU A 20 6.073 0.716 10.018 1.00 0.00 C ATOM 300 OE1 GLU A 20 6.386 0.214 11.119 1.00 0.00 O ATOM 301 OE2 GLU A 20 5.770 1.912 9.815 1.00 0.00 O ATOM 0 H GLU A 20 9.101 -2.331 7.010 1.00 0.00 H new ATOM 0 HA GLU A 20 6.447 -1.087 6.557 1.00 0.00 H new ATOM 0 HB2 GLU A 20 7.923 -1.291 8.972 1.00 0.00 H new ATOM 0 HB3 GLU A 20 8.100 0.366 8.430 1.00 0.00 H new ATOM 0 HG2 GLU A 20 5.493 0.239 7.996 1.00 0.00 H new ATOM 0 HG3 GLU A 20 5.550 -1.147 9.066 1.00 0.00 H new ATOM 691 N VAL B 15 7.227 -2.069 -17.000 1.00 0.00 N ATOM 692 CA VAL B 15 6.724 -2.670 -15.776 1.00 0.00 C ATOM 693 C VAL B 15 7.109 -4.150 -15.744 1.00 0.00 C ATOM 694 O VAL B 15 7.318 -4.763 -16.789 1.00 0.00 O ATOM 695 CB VAL B 15 5.216 -2.441 -15.662 1.00 0.00 C ATOM 696 CG1 VAL B 15 4.627 -3.239 -14.497 1.00 0.00 C ATOM 697 CG2 VAL B 15 4.896 -0.951 -15.523 1.00 0.00 C ATOM 0 HA VAL B 15 7.177 -2.198 -14.904 1.00 0.00 H new ATOM 0 HB VAL B 15 4.753 -2.799 -16.582 1.00 0.00 H new ATOM 0 HG11 VAL B 15 3.554 -3.058 -14.438 1.00 0.00 H new ATOM 0 HG12 VAL B 15 4.808 -4.302 -14.656 1.00 0.00 H new ATOM 0 HG13 VAL B 15 5.099 -2.926 -13.566 1.00 0.00 H new ATOM 0 HG21 VAL B 15 3.817 -0.816 -15.444 1.00 0.00 H new ATOM 0 HG22 VAL B 15 5.378 -0.557 -14.628 1.00 0.00 H new ATOM 0 HG23 VAL B 15 5.265 -0.416 -16.398 1.00 0.00 H new ATOM 707 N GLN B 16 7.189 -4.682 -14.533 1.00 0.00 N ATOM 708 CA GLN B 16 7.545 -6.079 -14.351 1.00 0.00 C ATOM 709 C GLN B 16 6.312 -6.967 -14.526 1.00 0.00 C ATOM 710 O GLN B 16 6.398 -8.047 -15.109 1.00 0.00 O ATOM 711 CB GLN B 16 8.195 -6.306 -12.985 1.00 0.00 C ATOM 712 CG GLN B 16 9.260 -5.245 -12.701 1.00 0.00 C ATOM 713 CD GLN B 16 10.594 -5.894 -12.327 1.00 0.00 C ATOM 714 OE1 GLN B 16 10.478 -6.939 -11.513 1.00 0.00 O flip ATOM 715 NE2 GLN B 16 11.659 -5.474 -12.750 1.00 0.00 N flip ATOM 0 H GLN B 16 7.013 -4.171 -13.668 1.00 0.00 H new ATOM 0 HA GLN B 16 8.276 -6.350 -15.113 1.00 0.00 H new ATOM 0 HB2 GLN B 16 7.433 -6.278 -12.207 1.00 0.00 H new ATOM 0 HB3 GLN B 16 8.647 -7.297 -12.954 1.00 0.00 H new ATOM 0 HG2 GLN B 16 9.392 -4.613 -13.579 1.00 0.00 H new ATOM 0 HG3 GLN B 16 8.926 -4.598 -11.890 1.00 0.00 H new ATOM 0 HE21 GLN B 16 11.678 -4.666 -13.373 1.00 0.00 H new ATOM 0 HE22 GLN B 16 12.530 -5.931 -12.481 1.00 0.00 H new ATOM 724 N LYS B 17 5.193 -6.480 -14.011 1.00 0.00 N ATOM 725 CA LYS B 17 3.943 -7.217 -14.103 1.00 0.00 C ATOM 726 C LYS B 17 4.066 -8.520 -13.311 1.00 0.00 C ATOM 727 O LYS B 17 5.157 -9.072 -13.181 1.00 0.00 O ATOM 728 CB LYS B 17 3.548 -7.421 -15.567 1.00 0.00 C ATOM 729 CG LYS B 17 2.772 -6.214 -16.098 1.00 0.00 C ATOM 730 CD LYS B 17 3.385 -5.698 -17.401 1.00 0.00 C ATOM 731 CE LYS B 17 4.901 -5.540 -17.269 1.00 0.00 C ATOM 732 NZ LYS B 17 5.601 -6.457 -18.195 1.00 0.00 N ATOM 0 H LYS B 17 5.125 -5.584 -13.528 1.00 0.00 H new ATOM 0 HA LYS B 17 3.130 -6.647 -13.655 1.00 0.00 H new ATOM 0 HB2 LYS B 17 4.442 -7.577 -16.170 1.00 0.00 H new ATOM 0 HB3 LYS B 17 2.939 -8.320 -15.661 1.00 0.00 H new ATOM 0 HG2 LYS B 17 1.731 -6.492 -16.266 1.00 0.00 H new ATOM 0 HG3 LYS B 17 2.773 -5.420 -15.352 1.00 0.00 H new ATOM 0 HD2 LYS B 17 3.157 -6.389 -18.213 1.00 0.00 H new ATOM 0 HD3 LYS B 17 2.937 -4.739 -17.663 1.00 0.00 H new ATOM 0 HE2 LYS B 17 5.185 -4.510 -17.484 1.00 0.00 H new ATOM 0 HE3 LYS B 17 5.206 -5.747 -16.243 1.00 0.00 H new ATOM 0 HZ1 LYS B 17 6.628 -6.386 -18.044 1.00 0.00 H new ATOM 0 HZ2 LYS B 17 5.292 -7.434 -18.016 1.00 0.00 H new ATOM 0 HZ3 LYS B 17 5.376 -6.197 -19.177 1.00 0.00 H new ATOM 746 N PHE B 18 2.930 -8.976 -12.803 1.00 0.00 N ATOM 747 CA PHE B 18 2.896 -10.204 -12.028 1.00 0.00 C ATOM 748 C PHE B 18 1.480 -10.782 -11.978 1.00 0.00 C ATOM 749 O PHE B 18 0.698 -10.442 -11.090 1.00 0.00 O ATOM 750 CB PHE B 18 3.340 -9.849 -10.608 1.00 0.00 C ATOM 751 CG PHE B 18 4.846 -9.616 -10.467 1.00 0.00 C ATOM 752 CD1 PHE B 18 5.696 -10.676 -10.418 1.00 0.00 C ATOM 753 CD2 PHE B 18 5.333 -8.349 -10.391 1.00 0.00 C ATOM 754 CE1 PHE B 18 7.094 -10.459 -10.287 1.00 0.00 C ATOM 755 CE2 PHE B 18 6.730 -8.132 -10.260 1.00 0.00 C ATOM 756 CZ PHE B 18 7.581 -9.192 -10.211 1.00 0.00 C ATOM 0 H PHE B 18 2.026 -8.516 -12.913 1.00 0.00 H new ATOM 0 HA PHE B 18 3.548 -10.950 -12.483 1.00 0.00 H new ATOM 0 HB2 PHE B 18 2.812 -8.951 -10.287 1.00 0.00 H new ATOM 0 HB3 PHE B 18 3.042 -10.652 -9.934 1.00 0.00 H new ATOM 0 HD1 PHE B 18 5.309 -11.682 -10.479 1.00 0.00 H new ATOM 0 HD2 PHE B 18 4.657 -7.507 -10.430 1.00 0.00 H new ATOM 0 HE1 PHE B 18 7.770 -11.301 -10.248 1.00 0.00 H new ATOM 0 HE2 PHE B 18 7.117 -7.126 -10.199 1.00 0.00 H new ATOM 0 HZ PHE B 18 8.644 -9.027 -10.112 1.00 0.00 H new ATOM 766 N ARG B 19 1.192 -11.644 -12.941 1.00 0.00 N ATOM 767 CA ARG B 19 -0.116 -12.272 -13.018 1.00 0.00 C ATOM 768 C ARG B 19 -0.318 -13.223 -11.836 1.00 0.00 C ATOM 769 O ARG B 19 0.245 -14.317 -11.811 1.00 0.00 O ATOM 770 CB ARG B 19 -0.277 -13.052 -14.324 1.00 0.00 C ATOM 771 CG ARG B 19 -1.755 -13.257 -14.661 1.00 0.00 C ATOM 772 CD ARG B 19 -2.204 -14.679 -14.315 1.00 0.00 C ATOM 773 NE ARG B 19 -1.982 -15.575 -15.472 1.00 0.00 N ATOM 774 CZ ARG B 19 -2.036 -16.912 -15.407 1.00 0.00 C ATOM 775 NH1 ARG B 19 -2.306 -17.516 -14.242 1.00 0.00 N ATOM 776 NH2 ARG B 19 -1.821 -17.646 -16.508 1.00 0.00 N ATOM 0 H ARG B 19 1.843 -11.923 -13.675 1.00 0.00 H new ATOM 0 HA ARG B 19 -0.866 -11.481 -12.986 1.00 0.00 H new ATOM 0 HB2 ARG B 19 0.214 -12.515 -15.136 1.00 0.00 H new ATOM 0 HB3 ARG B 19 0.218 -14.019 -14.237 1.00 0.00 H new ATOM 0 HG2 ARG B 19 -2.360 -12.537 -14.111 1.00 0.00 H new ATOM 0 HG3 ARG B 19 -1.920 -13.068 -15.722 1.00 0.00 H new ATOM 0 HD2 ARG B 19 -1.650 -15.044 -13.450 1.00 0.00 H new ATOM 0 HD3 ARG B 19 -3.259 -14.680 -14.041 1.00 0.00 H new ATOM 0 HE ARG B 19 -1.775 -15.148 -16.375 1.00 0.00 H new ATOM 0 HH11 ARG B 19 -2.471 -16.958 -13.404 1.00 0.00 H new ATOM 0 HH12 ARG B 19 -2.347 -18.534 -14.193 1.00 0.00 H new ATOM 0 HH21 ARG B 19 -1.616 -17.187 -17.395 1.00 0.00 H new ATOM 0 HH22 ARG B 19 -1.862 -18.664 -16.458 1.00 0.00 H new ATOM 790 N VAL B 20 -1.124 -12.772 -10.886 1.00 0.00 N ATOM 791 CA VAL B 20 -1.407 -13.569 -9.704 1.00 0.00 C ATOM 792 C VAL B 20 -2.920 -13.628 -9.486 1.00 0.00 C ATOM 793 O VAL B 20 -3.694 -13.310 -10.387 1.00 0.00 O ATOM 794 CB VAL B 20 -0.650 -13.006 -8.499 1.00 0.00 C ATOM 795 CG1 VAL B 20 0.812 -12.729 -8.852 1.00 0.00 C ATOM 796 CG2 VAL B 20 -1.334 -11.747 -7.962 1.00 0.00 C ATOM 0 H VAL B 20 -1.590 -11.865 -10.911 1.00 0.00 H new ATOM 0 HA VAL B 20 -1.058 -14.592 -9.840 1.00 0.00 H new ATOM 0 HB VAL B 20 -0.667 -13.758 -7.710 1.00 0.00 H new ATOM 0 HG11 VAL B 20 1.328 -12.330 -7.979 1.00 0.00 H new ATOM 0 HG12 VAL B 20 1.293 -13.656 -9.165 1.00 0.00 H new ATOM 0 HG13 VAL B 20 0.859 -12.004 -9.664 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -0.776 -11.367 -7.106 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -1.363 -10.987 -8.743 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -2.351 -11.989 -7.654 1.00 0.00 H new ATOM 806 N GLN B 21 -3.297 -14.038 -8.283 1.00 0.00 N ATOM 807 CA GLN B 21 -4.703 -14.143 -7.934 1.00 0.00 C ATOM 808 C GLN B 21 -5.108 -12.992 -7.010 1.00 0.00 C ATOM 809 O GLN B 21 -4.257 -12.238 -6.543 1.00 0.00 O ATOM 810 CB GLN B 21 -5.009 -15.497 -7.291 1.00 0.00 C ATOM 811 CG GLN B 21 -6.137 -16.214 -8.034 1.00 0.00 C ATOM 812 CD GLN B 21 -6.160 -17.705 -7.690 1.00 0.00 C ATOM 813 OE1 GLN B 21 -5.161 -18.297 -7.314 1.00 0.00 O ATOM 814 NE2 GLN B 21 -7.351 -18.277 -7.838 1.00 0.00 N ATOM 0 H GLN B 21 -2.652 -14.301 -7.538 1.00 0.00 H new ATOM 0 HA GLN B 21 -5.291 -14.072 -8.849 1.00 0.00 H new ATOM 0 HB2 GLN B 21 -4.113 -16.117 -7.297 1.00 0.00 H new ATOM 0 HB3 GLN B 21 -5.290 -15.353 -6.248 1.00 0.00 H new ATOM 0 HG2 GLN B 21 -7.094 -15.762 -7.773 1.00 0.00 H new ATOM 0 HG3 GLN B 21 -6.007 -16.087 -9.109 1.00 0.00 H new ATOM 0 HE21 GLN B 21 -8.146 -17.724 -8.157 1.00 0.00 H new ATOM 0 HE22 GLN B 21 -7.469 -19.269 -7.633 1.00 0.00 H new ATOM 823 N TYR B 22 -6.408 -12.895 -6.775 1.00 0.00 N ATOM 824 CA TYR B 22 -6.937 -11.849 -5.915 1.00 0.00 C ATOM 825 C TYR B 22 -7.840 -12.437 -4.829 1.00 0.00 C ATOM 826 O TYR B 22 -8.945 -12.895 -5.116 1.00 0.00 O ATOM 827 CB TYR B 22 -7.772 -10.941 -6.819 1.00 0.00 C ATOM 828 CG TYR B 22 -8.098 -9.579 -6.203 1.00 0.00 C ATOM 829 CD1 TYR B 22 -7.609 -9.251 -4.955 1.00 0.00 C ATOM 830 CD2 TYR B 22 -8.882 -8.678 -6.896 1.00 0.00 C ATOM 831 CE1 TYR B 22 -7.916 -7.969 -4.375 1.00 0.00 C ATOM 832 CE2 TYR B 22 -9.189 -7.397 -6.316 1.00 0.00 C ATOM 833 CZ TYR B 22 -8.691 -7.105 -5.084 1.00 0.00 C ATOM 834 OH TYR B 22 -8.981 -5.895 -4.537 1.00 0.00 O ATOM 0 H TYR B 22 -7.111 -13.523 -7.165 1.00 0.00 H new ATOM 0 HA TYR B 22 -6.127 -11.314 -5.419 1.00 0.00 H new ATOM 0 HB2 TYR B 22 -7.236 -10.786 -7.755 1.00 0.00 H new ATOM 0 HB3 TYR B 22 -8.704 -11.449 -7.066 1.00 0.00 H new ATOM 0 HD1 TYR B 22 -6.996 -9.956 -4.413 1.00 0.00 H new ATOM 0 HD2 TYR B 22 -9.265 -8.934 -7.873 1.00 0.00 H new ATOM 0 HE1 TYR B 22 -7.539 -7.700 -3.399 1.00 0.00 H new ATOM 0 HE2 TYR B 22 -9.801 -6.683 -6.847 1.00 0.00 H new ATOM 0 HH TYR B 22 -8.314 -5.677 -3.852 1.00 0.00 H new ATOM 844 N LEU B 23 -7.336 -12.405 -3.604 1.00 0.00 N ATOM 845 CA LEU B 23 -8.084 -12.929 -2.473 1.00 0.00 C ATOM 846 C LEU B 23 -9.242 -11.982 -2.150 1.00 0.00 C ATOM 847 O LEU B 23 -10.313 -12.424 -1.738 1.00 0.00 O ATOM 848 CB LEU B 23 -7.152 -13.187 -1.288 1.00 0.00 C ATOM 849 CG LEU B 23 -6.744 -14.644 -1.060 1.00 0.00 C ATOM 850 CD1 LEU B 23 -5.354 -14.921 -1.636 1.00 0.00 C ATOM 851 CD2 LEU B 23 -6.834 -15.013 0.422 1.00 0.00 C ATOM 0 H LEU B 23 -6.419 -12.025 -3.370 1.00 0.00 H new ATOM 0 HA LEU B 23 -8.522 -13.896 -2.721 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -6.248 -12.595 -1.427 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -7.637 -12.821 -0.383 1.00 0.00 H new ATOM 0 HG LEU B 23 -7.447 -15.283 -1.594 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -5.089 -15.963 -1.460 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -5.358 -14.723 -2.708 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -4.623 -14.274 -1.151 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -6.539 -16.054 0.556 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -6.169 -14.370 0.998 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -7.859 -14.879 0.769 1.00 0.00 H new ATOM 863 N GLY B 24 -8.987 -10.698 -2.350 1.00 0.00 N ATOM 864 CA GLY B 24 -9.995 -9.685 -2.085 1.00 0.00 C ATOM 865 C GLY B 24 -9.444 -8.590 -1.170 1.00 0.00 C ATOM 866 O GLY B 24 -8.245 -8.545 -0.901 1.00 0.00 O ATOM 0 H GLY B 24 -8.097 -10.335 -2.692 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -10.329 -9.245 -3.025 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -10.867 -10.147 -1.621 1.00 0.00 H new ATOM 870 N MET B 25 -10.347 -7.732 -0.716 1.00 0.00 N ATOM 871 CA MET B 25 -9.967 -6.640 0.163 1.00 0.00 C ATOM 872 C MET B 25 -10.478 -6.878 1.586 1.00 0.00 C ATOM 873 O MET B 25 -11.668 -7.111 1.791 1.00 0.00 O ATOM 874 CB MET B 25 -10.543 -5.328 -0.374 1.00 0.00 C ATOM 875 CG MET B 25 -10.004 -4.131 0.412 1.00 0.00 C ATOM 876 SD MET B 25 -11.341 -3.025 0.832 1.00 0.00 S ATOM 877 CE MET B 25 -12.069 -3.921 2.193 1.00 0.00 C ATOM 0 H MET B 25 -11.341 -7.772 -0.941 1.00 0.00 H new ATOM 0 HA MET B 25 -8.879 -6.584 0.193 1.00 0.00 H new ATOM 0 HB2 MET B 25 -10.289 -5.220 -1.428 1.00 0.00 H new ATOM 0 HB3 MET B 25 -11.631 -5.350 -0.309 1.00 0.00 H new ATOM 0 HG2 MET B 25 -9.507 -4.475 1.319 1.00 0.00 H new ATOM 0 HG3 MET B 25 -9.257 -3.603 -0.180 1.00 0.00 H new ATOM 0 HE1 MET B 25 -12.714 -3.253 2.765 1.00 0.00 H new ATOM 0 HE2 MET B 25 -12.659 -4.753 1.807 1.00 0.00 H new ATOM 0 HE3 MET B 25 -11.280 -4.305 2.840 1.00 0.00 H new ATOM 887 N LEU B 26 -9.552 -6.811 2.531 1.00 0.00 N ATOM 888 CA LEU B 26 -9.894 -7.016 3.929 1.00 0.00 C ATOM 889 C LEU B 26 -9.701 -5.706 4.694 1.00 0.00 C ATOM 890 O LEU B 26 -8.683 -5.034 4.534 1.00 0.00 O ATOM 891 CB LEU B 26 -9.101 -8.190 4.507 1.00 0.00 C ATOM 892 CG LEU B 26 -9.928 -9.315 5.134 1.00 0.00 C ATOM 893 CD1 LEU B 26 -10.317 -8.973 6.574 1.00 0.00 C ATOM 894 CD2 LEU B 26 -11.150 -9.642 4.273 1.00 0.00 C ATOM 0 H LEU B 26 -8.566 -6.618 2.357 1.00 0.00 H new ATOM 0 HA LEU B 26 -10.944 -7.291 4.029 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -8.489 -8.616 3.712 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -8.418 -7.804 5.263 1.00 0.00 H new ATOM 0 HG LEU B 26 -9.311 -10.212 5.172 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -10.904 -9.789 6.996 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -9.416 -8.828 7.170 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -10.909 -8.058 6.583 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -11.720 -10.444 4.741 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -11.778 -8.756 4.181 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -10.823 -9.959 3.283 1.00 0.00 H new ATOM 906 N PRO B 27 -10.720 -5.374 5.532 1.00 0.00 N ATOM 907 CA PRO B 27 -10.671 -4.156 6.323 1.00 0.00 C ATOM 908 C PRO B 27 -9.706 -4.305 7.500 1.00 0.00 C ATOM 909 O PRO B 27 -9.595 -5.382 8.084 1.00 0.00 O ATOM 910 CB PRO B 27 -12.107 -3.913 6.758 1.00 0.00 C ATOM 911 CG PRO B 27 -12.825 -5.242 6.590 1.00 0.00 C ATOM 912 CD PRO B 27 -11.940 -6.146 5.747 1.00 0.00 C ATOM 0 HA PRO B 27 -10.289 -3.304 5.761 1.00 0.00 H new ATOM 0 HB2 PRO B 27 -12.149 -3.575 7.793 1.00 0.00 H new ATOM 0 HB3 PRO B 27 -12.573 -3.138 6.150 1.00 0.00 H new ATOM 0 HG2 PRO B 27 -13.020 -5.696 7.561 1.00 0.00 H new ATOM 0 HG3 PRO B 27 -13.791 -5.096 6.107 1.00 0.00 H new ATOM 0 HD2 PRO B 27 -11.730 -7.084 6.260 1.00 0.00 H new ATOM 0 HD3 PRO B 27 -12.420 -6.400 4.802 1.00 0.00 H new ATOM 920 N VAL B 28 -9.033 -3.208 7.815 1.00 0.00 N ATOM 921 CA VAL B 28 -8.081 -3.203 8.912 1.00 0.00 C ATOM 922 C VAL B 28 -8.290 -1.945 9.758 1.00 0.00 C ATOM 923 O VAL B 28 -9.112 -1.095 9.419 1.00 0.00 O ATOM 924 CB VAL B 28 -6.656 -3.328 8.370 1.00 0.00 C ATOM 925 CG1 VAL B 28 -6.541 -4.503 7.396 1.00 0.00 C ATOM 926 CG2 VAL B 28 -6.203 -2.023 7.711 1.00 0.00 C ATOM 0 H VAL B 28 -9.128 -2.316 7.329 1.00 0.00 H new ATOM 0 HA VAL B 28 -8.244 -4.063 9.562 1.00 0.00 H new ATOM 0 HB VAL B 28 -5.993 -3.525 9.213 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -5.518 -4.570 7.025 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -6.802 -5.428 7.910 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -7.221 -4.349 6.558 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -5.187 -2.139 7.334 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -6.871 -1.782 6.884 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -6.228 -1.217 8.445 1.00 0.00 H new ATOM 936 N ASP B 29 -7.533 -1.867 10.842 1.00 0.00 N ATOM 937 CA ASP B 29 -7.625 -0.727 11.739 1.00 0.00 C ATOM 938 C ASP B 29 -6.311 0.056 11.698 1.00 0.00 C ATOM 939 O ASP B 29 -6.308 1.256 11.428 1.00 0.00 O ATOM 940 CB ASP B 29 -7.862 -1.178 13.181 1.00 0.00 C ATOM 941 CG ASP B 29 -8.867 -0.334 13.966 1.00 0.00 C ATOM 942 OD1 ASP B 29 -9.130 0.802 13.514 1.00 0.00 O ATOM 943 OD2 ASP B 29 -9.350 -0.842 15.001 1.00 0.00 O ATOM 0 H ASP B 29 -6.853 -2.575 11.120 1.00 0.00 H new ATOM 0 HA ASP B 29 -8.461 -0.108 11.413 1.00 0.00 H new ATOM 0 HB2 ASP B 29 -8.209 -2.211 13.170 1.00 0.00 H new ATOM 0 HB3 ASP B 29 -6.909 -1.167 13.710 1.00 0.00 H new ATOM 948 N ARG B 30 -5.227 -0.655 11.970 1.00 0.00 N ATOM 949 CA ARG B 30 -3.910 -0.042 11.968 1.00 0.00 C ATOM 950 C ARG B 30 -3.287 -0.127 10.573 1.00 0.00 C ATOM 951 O ARG B 30 -3.553 -1.068 9.827 1.00 0.00 O ATOM 952 CB ARG B 30 -2.983 -0.725 12.976 1.00 0.00 C ATOM 953 CG ARG B 30 -3.352 -0.339 14.410 1.00 0.00 C ATOM 954 CD ARG B 30 -2.919 1.095 14.721 1.00 0.00 C ATOM 955 NE ARG B 30 -3.482 1.524 16.020 1.00 0.00 N ATOM 956 CZ ARG B 30 -3.080 2.611 16.692 1.00 0.00 C ATOM 957 NH1 ARG B 30 -2.108 3.386 16.191 1.00 0.00 N ATOM 958 NH2 ARG B 30 -3.648 2.923 17.864 1.00 0.00 N ATOM 0 H ARG B 30 -5.234 -1.650 12.193 1.00 0.00 H new ATOM 0 HA ARG B 30 -4.030 1.003 12.253 1.00 0.00 H new ATOM 0 HB2 ARG B 30 -3.047 -1.807 12.859 1.00 0.00 H new ATOM 0 HB3 ARG B 30 -1.950 -0.443 12.774 1.00 0.00 H new ATOM 0 HG2 ARG B 30 -4.428 -0.436 14.551 1.00 0.00 H new ATOM 0 HG3 ARG B 30 -2.876 -1.026 15.109 1.00 0.00 H new ATOM 0 HD2 ARG B 30 -1.831 1.157 14.749 1.00 0.00 H new ATOM 0 HD3 ARG B 30 -3.256 1.765 13.930 1.00 0.00 H new ATOM 0 HE ARG B 30 -4.223 0.956 16.430 1.00 0.00 H new ATOM 0 HH11 ARG B 30 -1.675 3.148 15.299 1.00 0.00 H new ATOM 0 HH12 ARG B 30 -1.801 4.214 16.702 1.00 0.00 H new ATOM 0 HH21 ARG B 30 -4.387 2.333 18.246 1.00 0.00 H new ATOM 0 HH22 ARG B 30 -3.341 3.751 18.375 1.00 0.00 H new ATOM 972 N PRO B 31 -2.447 0.895 10.256 1.00 0.00 N ATOM 973 CA PRO B 31 -1.784 0.945 8.964 1.00 0.00 C ATOM 974 C PRO B 31 -0.636 -0.065 8.897 1.00 0.00 C ATOM 975 O PRO B 31 -0.315 -0.576 7.825 1.00 0.00 O ATOM 976 CB PRO B 31 -1.319 2.384 8.815 1.00 0.00 C ATOM 977 CG PRO B 31 -1.326 2.971 10.218 1.00 0.00 C ATOM 978 CD PRO B 31 -2.109 2.026 11.115 1.00 0.00 C ATOM 0 HA PRO B 31 -2.444 0.667 8.142 1.00 0.00 H new ATOM 0 HB2 PRO B 31 -0.322 2.429 8.378 1.00 0.00 H new ATOM 0 HB3 PRO B 31 -1.982 2.943 8.154 1.00 0.00 H new ATOM 0 HG2 PRO B 31 -0.307 3.091 10.587 1.00 0.00 H new ATOM 0 HG3 PRO B 31 -1.783 3.961 10.215 1.00 0.00 H new ATOM 0 HD2 PRO B 31 -1.514 1.709 11.971 1.00 0.00 H new ATOM 0 HD3 PRO B 31 -3.005 2.506 11.509 1.00 0.00 H new ATOM 986 N VAL B 32 -0.050 -0.322 10.057 1.00 0.00 N ATOM 987 CA VAL B 32 1.056 -1.262 10.144 1.00 0.00 C ATOM 988 C VAL B 32 0.776 -2.270 11.261 1.00 0.00 C ATOM 989 O VAL B 32 0.453 -1.884 12.383 1.00 0.00 O ATOM 990 CB VAL B 32 2.371 -0.505 10.338 1.00 0.00 C ATOM 991 CG1 VAL B 32 2.462 0.690 9.387 1.00 0.00 C ATOM 992 CG2 VAL B 32 2.540 -0.062 11.792 1.00 0.00 C ATOM 0 H VAL B 32 -0.319 0.104 10.944 1.00 0.00 H new ATOM 0 HA VAL B 32 1.154 -1.824 9.215 1.00 0.00 H new ATOM 0 HB VAL B 32 3.187 -1.187 10.099 1.00 0.00 H new ATOM 0 HG11 VAL B 32 3.406 1.210 9.546 1.00 0.00 H new ATOM 0 HG12 VAL B 32 2.410 0.339 8.356 1.00 0.00 H new ATOM 0 HG13 VAL B 32 1.635 1.373 9.580 1.00 0.00 H new ATOM 0 HG21 VAL B 32 3.483 0.474 11.902 1.00 0.00 H new ATOM 0 HG22 VAL B 32 1.715 0.594 12.071 1.00 0.00 H new ATOM 0 HG23 VAL B 32 2.542 -0.938 12.441 1.00 0.00 H new ATOM 1002 N GLY B 33 0.910 -3.541 10.913 1.00 0.00 N ATOM 1003 CA GLY B 33 0.676 -4.607 11.872 1.00 0.00 C ATOM 1004 C GLY B 33 0.761 -5.979 11.199 1.00 0.00 C ATOM 1005 O GLY B 33 0.202 -6.181 10.123 1.00 0.00 O ATOM 0 H GLY B 33 1.178 -3.857 9.981 1.00 0.00 H new ATOM 0 HA2 GLY B 33 1.410 -4.546 12.675 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -0.306 -4.482 12.328 1.00 0.00 H new ATOM 1009 N MET B 34 1.465 -6.885 11.862 1.00 0.00 N ATOM 1010 CA MET B 34 1.631 -8.231 11.341 1.00 0.00 C ATOM 1011 C MET B 34 0.359 -9.057 11.543 1.00 0.00 C ATOM 1012 O MET B 34 -0.035 -9.822 10.663 1.00 0.00 O ATOM 1013 CB MET B 34 2.802 -8.913 12.052 1.00 0.00 C ATOM 1014 CG MET B 34 3.698 -9.646 11.052 1.00 0.00 C ATOM 1015 SD MET B 34 2.883 -11.123 10.470 1.00 0.00 S ATOM 1016 CE MET B 34 3.058 -10.900 8.707 1.00 0.00 C ATOM 0 H MET B 34 1.927 -6.713 12.755 1.00 0.00 H new ATOM 0 HA MET B 34 1.833 -8.165 10.272 1.00 0.00 H new ATOM 0 HB2 MET B 34 3.387 -8.169 12.593 1.00 0.00 H new ATOM 0 HB3 MET B 34 2.422 -9.619 12.791 1.00 0.00 H new ATOM 0 HG2 MET B 34 3.928 -8.992 10.211 1.00 0.00 H new ATOM 0 HG3 MET B 34 4.646 -9.906 11.523 1.00 0.00 H new ATOM 0 HE1 MET B 34 2.084 -11.003 8.229 1.00 0.00 H new ATOM 0 HE2 MET B 34 3.459 -9.907 8.504 1.00 0.00 H new ATOM 0 HE3 MET B 34 3.738 -11.654 8.311 1.00 0.00 H new ATOM 1026 N ASP B 35 -0.248 -8.876 12.706 1.00 0.00 N ATOM 1027 CA ASP B 35 -1.467 -9.595 13.035 1.00 0.00 C ATOM 1028 C ASP B 35 -2.618 -9.054 12.185 1.00 0.00 C ATOM 1029 O ASP B 35 -3.505 -9.806 11.785 1.00 0.00 O ATOM 1030 CB ASP B 35 -1.837 -9.407 14.507 1.00 0.00 C ATOM 1031 CG ASP B 35 -2.127 -10.700 15.271 1.00 0.00 C ATOM 1032 OD1 ASP B 35 -3.238 -11.238 15.076 1.00 0.00 O ATOM 1033 OD2 ASP B 35 -1.231 -11.122 16.034 1.00 0.00 O ATOM 0 H ASP B 35 0.082 -8.241 13.433 1.00 0.00 H new ATOM 0 HA ASP B 35 -1.298 -10.654 12.838 1.00 0.00 H new ATOM 0 HB2 ASP B 35 -1.023 -8.882 15.007 1.00 0.00 H new ATOM 0 HB3 ASP B 35 -2.715 -8.763 14.566 1.00 0.00 H new ATOM 1038 N THR B 36 -2.565 -7.754 11.934 1.00 0.00 N ATOM 1039 CA THR B 36 -3.593 -7.104 11.138 1.00 0.00 C ATOM 1040 C THR B 36 -3.512 -7.566 9.682 1.00 0.00 C ATOM 1041 O THR B 36 -4.508 -7.534 8.961 1.00 0.00 O ATOM 1042 CB THR B 36 -3.433 -5.591 11.306 1.00 0.00 C ATOM 1043 OG1 THR B 36 -4.317 -5.265 12.375 1.00 0.00 O ATOM 1044 CG2 THR B 36 -3.987 -4.808 10.113 1.00 0.00 C ATOM 0 H THR B 36 -1.827 -7.134 12.267 1.00 0.00 H new ATOM 0 HA THR B 36 -4.591 -7.380 11.478 1.00 0.00 H new ATOM 0 HB THR B 36 -2.379 -5.350 11.441 1.00 0.00 H new ATOM 0 HG1 THR B 36 -4.275 -4.302 12.552 1.00 0.00 H new ATOM 0 HG21 THR B 36 -3.849 -3.740 10.283 1.00 0.00 H new ATOM 0 HG22 THR B 36 -3.458 -5.103 9.207 1.00 0.00 H new ATOM 0 HG23 THR B 36 -5.050 -5.023 9.999 1.00 0.00 H new ATOM 1052 N LEU B 37 -2.317 -7.984 9.293 1.00 0.00 N ATOM 1053 CA LEU B 37 -2.093 -8.452 7.936 1.00 0.00 C ATOM 1054 C LEU B 37 -2.605 -9.888 7.805 1.00 0.00 C ATOM 1055 O LEU B 37 -3.468 -10.170 6.975 1.00 0.00 O ATOM 1056 CB LEU B 37 -0.623 -8.286 7.547 1.00 0.00 C ATOM 1057 CG LEU B 37 -0.333 -8.179 6.048 1.00 0.00 C ATOM 1058 CD1 LEU B 37 -0.846 -6.852 5.484 1.00 0.00 C ATOM 1059 CD2 LEU B 37 1.156 -8.387 5.762 1.00 0.00 C ATOM 0 H LEU B 37 -1.493 -8.008 9.894 1.00 0.00 H new ATOM 0 HA LEU B 37 -2.657 -7.846 7.227 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -0.237 -7.392 8.036 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -0.065 -9.133 7.945 1.00 0.00 H new ATOM 0 HG LEU B 37 -0.873 -8.976 5.537 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -0.627 -6.801 4.417 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -1.923 -6.784 5.637 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -0.353 -6.025 5.995 1.00 0.00 H new ATOM 0 HD21 LEU B 37 1.335 -8.306 4.690 1.00 0.00 H new ATOM 0 HD22 LEU B 37 1.737 -7.627 6.285 1.00 0.00 H new ATOM 0 HD23 LEU B 37 1.458 -9.376 6.107 1.00 0.00 H new ATOM 1071 N ASN B 38 -2.051 -10.758 8.637 1.00 0.00 N ATOM 1072 CA ASN B 38 -2.440 -12.158 8.625 1.00 0.00 C ATOM 1073 C ASN B 38 -3.958 -12.262 8.792 1.00 0.00 C ATOM 1074 O ASN B 38 -4.612 -13.028 8.087 1.00 0.00 O ATOM 1075 CB ASN B 38 -1.784 -12.922 9.776 1.00 0.00 C ATOM 1076 CG ASN B 38 -0.696 -13.864 9.259 1.00 0.00 C ATOM 1077 OD1 ASN B 38 -0.955 -14.972 8.818 1.00 0.00 O ATOM 1078 ND2 ASN B 38 0.534 -13.365 9.339 1.00 0.00 N ATOM 0 H ASN B 38 -1.336 -10.520 9.324 1.00 0.00 H new ATOM 0 HA ASN B 38 -2.119 -12.589 7.677 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -1.352 -12.217 10.486 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -2.539 -13.494 10.315 1.00 0.00 H new ATOM 0 HD21 ASN B 38 1.330 -13.917 9.021 1.00 0.00 H new ATOM 0 HD22 ASN B 38 0.681 -12.430 9.719 1.00 0.00 H new ATOM 1085 N SER B 39 -4.473 -11.480 9.730 1.00 0.00 N ATOM 1086 CA SER B 39 -5.900 -11.475 9.999 1.00 0.00 C ATOM 1087 C SER B 39 -6.681 -11.455 8.682 1.00 0.00 C ATOM 1088 O SER B 39 -7.631 -12.217 8.509 1.00 0.00 O ATOM 1089 CB SER B 39 -6.293 -10.277 10.866 1.00 0.00 C ATOM 1090 OG SER B 39 -7.690 -10.258 11.148 1.00 0.00 O ATOM 0 H SER B 39 -3.927 -10.846 10.313 1.00 0.00 H new ATOM 0 HA SER B 39 -6.147 -12.384 10.548 1.00 0.00 H new ATOM 0 HB2 SER B 39 -5.735 -10.308 11.802 1.00 0.00 H new ATOM 0 HB3 SER B 39 -6.013 -9.354 10.358 1.00 0.00 H new ATOM 0 HG SER B 39 -7.901 -9.480 11.705 1.00 0.00 H new ATOM 1096 N ALA B 40 -6.250 -10.576 7.789 1.00 0.00 N ATOM 1097 CA ALA B 40 -6.897 -10.448 6.494 1.00 0.00 C ATOM 1098 C ALA B 40 -6.722 -11.750 5.711 1.00 0.00 C ATOM 1099 O ALA B 40 -7.699 -12.437 5.417 1.00 0.00 O ATOM 1100 CB ALA B 40 -6.320 -9.240 5.753 1.00 0.00 C ATOM 0 H ALA B 40 -5.461 -9.946 7.936 1.00 0.00 H new ATOM 0 HA ALA B 40 -7.967 -10.277 6.614 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -6.805 -9.143 4.782 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -6.495 -8.337 6.337 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -5.248 -9.378 5.611 1.00 0.00 H new ATOM 1106 N ILE B 41 -5.471 -12.050 5.394 1.00 0.00 N ATOM 1107 CA ILE B 41 -5.157 -13.258 4.651 1.00 0.00 C ATOM 1108 C ILE B 41 -6.008 -14.414 5.180 1.00 0.00 C ATOM 1109 O ILE B 41 -6.659 -15.115 4.406 1.00 0.00 O ATOM 1110 CB ILE B 41 -3.652 -13.535 4.689 1.00 0.00 C ATOM 1111 CG1 ILE B 41 -2.868 -12.389 4.045 1.00 0.00 C ATOM 1112 CG2 ILE B 41 -3.326 -14.885 4.047 1.00 0.00 C ATOM 1113 CD1 ILE B 41 -1.471 -12.269 4.658 1.00 0.00 C ATOM 0 H ILE B 41 -4.663 -11.477 5.638 1.00 0.00 H new ATOM 0 HA ILE B 41 -5.409 -13.133 3.598 1.00 0.00 H new ATOM 0 HB ILE B 41 -3.341 -13.592 5.732 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -2.785 -12.559 2.971 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -3.410 -11.453 4.179 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -2.250 -15.057 4.087 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -3.841 -15.679 4.588 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -3.654 -14.882 3.008 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -0.935 -11.448 4.183 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -1.558 -12.075 5.727 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -0.924 -13.198 4.501 1.00 0.00 H new ATOM 1125 N GLU B 42 -5.975 -14.578 6.494 1.00 0.00 N ATOM 1126 CA GLU B 42 -6.735 -15.637 7.135 1.00 0.00 C ATOM 1127 C GLU B 42 -8.232 -15.444 6.882 1.00 0.00 C ATOM 1128 O GLU B 42 -8.953 -16.410 6.636 1.00 0.00 O ATOM 1129 CB GLU B 42 -6.436 -15.696 8.635 1.00 0.00 C ATOM 1130 CG GLU B 42 -5.017 -16.206 8.891 1.00 0.00 C ATOM 1131 CD GLU B 42 -4.879 -16.754 10.313 1.00 0.00 C ATOM 1132 OE1 GLU B 42 -5.260 -17.929 10.508 1.00 0.00 O ATOM 1133 OE2 GLU B 42 -4.397 -15.986 11.173 1.00 0.00 O ATOM 0 H GLU B 42 -5.434 -13.995 7.132 1.00 0.00 H new ATOM 0 HA GLU B 42 -6.432 -16.589 6.700 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -6.554 -14.705 9.072 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -7.156 -16.350 9.128 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -4.772 -16.987 8.171 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -4.303 -15.397 8.738 1.00 0.00 H new ATOM 1140 N ASN B 43 -8.655 -14.190 6.952 1.00 0.00 N ATOM 1141 CA ASN B 43 -10.052 -13.859 6.733 1.00 0.00 C ATOM 1142 C ASN B 43 -10.446 -14.242 5.305 1.00 0.00 C ATOM 1143 O ASN B 43 -11.303 -15.101 5.103 1.00 0.00 O ATOM 1144 CB ASN B 43 -10.295 -12.358 6.903 1.00 0.00 C ATOM 1145 CG ASN B 43 -11.397 -12.093 7.931 1.00 0.00 C ATOM 1146 OD1 ASN B 43 -11.146 -11.774 9.081 1.00 0.00 O ATOM 1147 ND2 ASN B 43 -12.630 -12.244 7.453 1.00 0.00 N ATOM 0 H ASN B 43 -8.054 -13.392 7.157 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.646 -14.407 7.464 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -9.373 -11.870 7.219 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -10.574 -11.920 5.945 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -13.435 -12.091 8.061 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -12.770 -12.513 6.479 1.00 0.00 H new ATOM 1154 N LEU B 44 -9.800 -13.587 4.351 1.00 0.00 N ATOM 1155 CA LEU B 44 -10.072 -13.849 2.948 1.00 0.00 C ATOM 1156 C LEU B 44 -9.951 -15.351 2.681 1.00 0.00 C ATOM 1157 O LEU B 44 -10.807 -15.939 2.022 1.00 0.00 O ATOM 1158 CB LEU B 44 -9.170 -12.992 2.058 1.00 0.00 C ATOM 1159 CG LEU B 44 -9.478 -11.493 2.037 1.00 0.00 C ATOM 1160 CD1 LEU B 44 -8.297 -10.699 1.477 1.00 0.00 C ATOM 1161 CD2 LEU B 44 -10.773 -11.210 1.274 1.00 0.00 C ATOM 0 H LEU B 44 -9.089 -12.876 4.522 1.00 0.00 H new ATOM 0 HA LEU B 44 -11.093 -13.562 2.698 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -8.138 -13.126 2.383 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -9.234 -13.370 1.038 1.00 0.00 H new ATOM 0 HG LEU B 44 -9.631 -11.161 3.064 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.542 -9.637 1.473 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.418 -10.866 2.100 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -8.088 -11.027 0.459 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -10.969 -10.138 1.274 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -10.674 -11.561 0.247 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -11.601 -11.730 1.757 1.00 0.00 H new ATOM 1173 N MET B 45 -8.881 -15.928 3.207 1.00 0.00 N ATOM 1174 CA MET B 45 -8.636 -17.350 3.034 1.00 0.00 C ATOM 1175 C MET B 45 -9.934 -18.149 3.163 1.00 0.00 C ATOM 1176 O MET B 45 -10.233 -18.996 2.322 1.00 0.00 O ATOM 1177 CB MET B 45 -7.635 -17.828 4.087 1.00 0.00 C ATOM 1178 CG MET B 45 -6.197 -17.678 3.585 1.00 0.00 C ATOM 1179 SD MET B 45 -5.622 -19.227 2.909 1.00 0.00 S ATOM 1180 CE MET B 45 -4.820 -18.639 1.426 1.00 0.00 C ATOM 0 H MET B 45 -8.174 -15.437 3.753 1.00 0.00 H new ATOM 0 HA MET B 45 -8.230 -17.511 2.035 1.00 0.00 H new ATOM 0 HB2 MET B 45 -7.765 -17.254 5.005 1.00 0.00 H new ATOM 0 HB3 MET B 45 -7.831 -18.872 4.333 1.00 0.00 H new ATOM 0 HG2 MET B 45 -6.148 -16.899 2.824 1.00 0.00 H new ATOM 0 HG3 MET B 45 -5.548 -17.366 4.403 1.00 0.00 H new ATOM 0 HE1 MET B 45 -5.072 -19.294 0.592 1.00 0.00 H new ATOM 0 HE2 MET B 45 -5.158 -17.626 1.207 1.00 0.00 H new ATOM 0 HE3 MET B 45 -3.740 -18.637 1.573 1.00 0.00 H new ATOM 1190 N THR B 46 -10.672 -17.852 4.223 1.00 0.00 N ATOM 1191 CA THR B 46 -11.931 -18.532 4.474 1.00 0.00 C ATOM 1192 C THR B 46 -13.084 -17.782 3.805 1.00 0.00 C ATOM 1193 O THR B 46 -14.007 -18.399 3.275 1.00 0.00 O ATOM 1194 CB THR B 46 -12.097 -18.678 5.988 1.00 0.00 C ATOM 1195 OG1 THR B 46 -13.438 -19.130 6.148 1.00 0.00 O ATOM 1196 CG2 THR B 46 -12.068 -17.331 6.712 1.00 0.00 C ATOM 0 H THR B 46 -10.421 -17.149 4.918 1.00 0.00 H new ATOM 0 HA THR B 46 -11.936 -19.530 4.035 1.00 0.00 H new ATOM 0 HB THR B 46 -11.306 -19.318 6.380 1.00 0.00 H new ATOM 0 HG1 THR B 46 -13.630 -19.253 7.101 1.00 0.00 H new ATOM 0 HG21 THR B 46 -12.190 -17.491 7.783 1.00 0.00 H new ATOM 0 HG22 THR B 46 -11.114 -16.838 6.525 1.00 0.00 H new ATOM 0 HG23 THR B 46 -12.879 -16.703 6.344 1.00 0.00 H new ATOM 1204 N SER B 47 -12.995 -16.461 3.853 1.00 0.00 N ATOM 1205 CA SER B 47 -14.020 -15.619 3.259 1.00 0.00 C ATOM 1206 C SER B 47 -14.488 -16.222 1.933 1.00 0.00 C ATOM 1207 O SER B 47 -15.635 -16.651 1.813 1.00 0.00 O ATOM 1208 CB SER B 47 -13.506 -14.195 3.042 1.00 0.00 C ATOM 1209 OG SER B 47 -14.570 -13.253 2.939 1.00 0.00 O ATOM 0 H SER B 47 -12.229 -15.953 4.294 1.00 0.00 H new ATOM 0 HA SER B 47 -14.864 -15.570 3.947 1.00 0.00 H new ATOM 0 HB2 SER B 47 -12.853 -13.915 3.869 1.00 0.00 H new ATOM 0 HB3 SER B 47 -12.903 -14.162 2.134 1.00 0.00 H new ATOM 0 HG SER B 47 -14.200 -12.356 2.803 1.00 0.00 H new ATOM 1215 N SER B 48 -13.577 -16.235 0.972 1.00 0.00 N ATOM 1216 CA SER B 48 -13.883 -16.778 -0.341 1.00 0.00 C ATOM 1217 C SER B 48 -13.155 -18.110 -0.538 1.00 0.00 C ATOM 1218 O SER B 48 -12.505 -18.608 0.379 1.00 0.00 O ATOM 1219 CB SER B 48 -13.498 -15.795 -1.448 1.00 0.00 C ATOM 1220 OG SER B 48 -14.424 -14.716 -1.549 1.00 0.00 O ATOM 0 H SER B 48 -12.627 -15.879 1.076 1.00 0.00 H new ATOM 0 HA SER B 48 -14.958 -16.945 -0.399 1.00 0.00 H new ATOM 0 HB2 SER B 48 -12.501 -15.400 -1.252 1.00 0.00 H new ATOM 0 HB3 SER B 48 -13.450 -16.322 -2.401 1.00 0.00 H new ATOM 0 HG SER B 48 -14.143 -14.109 -2.266 1.00 0.00 H new ATOM 1226 N SER B 49 -13.290 -18.649 -1.741 1.00 0.00 N ATOM 1227 CA SER B 49 -12.654 -19.913 -2.071 1.00 0.00 C ATOM 1228 C SER B 49 -11.364 -19.661 -2.854 1.00 0.00 C ATOM 1229 O SER B 49 -11.085 -18.531 -3.250 1.00 0.00 O ATOM 1230 CB SER B 49 -13.597 -20.811 -2.875 1.00 0.00 C ATOM 1231 OG SER B 49 -14.637 -21.353 -2.066 1.00 0.00 O ATOM 0 H SER B 49 -13.831 -18.233 -2.499 1.00 0.00 H new ATOM 0 HA SER B 49 -12.412 -20.427 -1.141 1.00 0.00 H new ATOM 0 HB2 SER B 49 -14.035 -20.238 -3.692 1.00 0.00 H new ATOM 0 HB3 SER B 49 -13.027 -21.624 -3.326 1.00 0.00 H new ATOM 0 HG SER B 49 -15.218 -21.919 -2.616 1.00 0.00 H new ATOM 1237 N LYS B 50 -10.612 -20.734 -3.055 1.00 0.00 N ATOM 1238 CA LYS B 50 -9.359 -20.643 -3.784 1.00 0.00 C ATOM 1239 C LYS B 50 -9.653 -20.437 -5.271 1.00 0.00 C ATOM 1240 O LYS B 50 -8.882 -19.786 -5.975 1.00 0.00 O ATOM 1241 CB LYS B 50 -8.481 -21.862 -3.493 1.00 0.00 C ATOM 1242 CG LYS B 50 -7.558 -22.167 -4.675 1.00 0.00 C ATOM 1243 CD LYS B 50 -6.204 -22.692 -4.192 1.00 0.00 C ATOM 1244 CE LYS B 50 -5.105 -21.649 -4.401 1.00 0.00 C ATOM 1245 NZ LYS B 50 -4.065 -22.168 -5.316 1.00 0.00 N ATOM 0 H LYS B 50 -10.847 -21.670 -2.726 1.00 0.00 H new ATOM 0 HA LYS B 50 -8.785 -19.779 -3.450 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -7.885 -21.680 -2.599 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -9.111 -22.727 -3.286 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -8.027 -22.905 -5.326 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -7.411 -21.265 -5.269 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -6.267 -22.952 -3.135 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -5.951 -23.605 -4.731 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -5.536 -20.736 -4.811 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -4.657 -21.387 -3.442 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -3.147 -21.743 -5.075 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -4.003 -23.202 -5.221 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -4.313 -21.925 -6.296 1.00 0.00 H new ATOM 1259 N GLU B 51 -10.769 -21.004 -5.705 1.00 0.00 N ATOM 1260 CA GLU B 51 -11.174 -20.891 -7.096 1.00 0.00 C ATOM 1261 C GLU B 51 -11.873 -19.551 -7.338 1.00 0.00 C ATOM 1262 O GLU B 51 -11.810 -19.004 -8.437 1.00 0.00 O ATOM 1263 CB GLU B 51 -12.073 -22.060 -7.502 1.00 0.00 C ATOM 1264 CG GLU B 51 -11.274 -23.362 -7.585 1.00 0.00 C ATOM 1265 CD GLU B 51 -12.174 -24.533 -7.985 1.00 0.00 C ATOM 1266 OE1 GLU B 51 -13.200 -24.721 -7.296 1.00 0.00 O ATOM 1267 OE2 GLU B 51 -11.817 -25.213 -8.971 1.00 0.00 O ATOM 0 H GLU B 51 -11.405 -21.543 -5.118 1.00 0.00 H new ATOM 0 HA GLU B 51 -10.280 -20.930 -7.719 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -12.881 -22.170 -6.779 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -12.535 -21.850 -8.467 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -10.469 -23.253 -8.311 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -10.808 -23.569 -6.622 1.00 0.00 H new ATOM 1274 N ASP B 52 -12.524 -19.063 -6.292 1.00 0.00 N ATOM 1275 CA ASP B 52 -13.235 -17.798 -6.377 1.00 0.00 C ATOM 1276 C ASP B 52 -12.244 -16.684 -6.719 1.00 0.00 C ATOM 1277 O ASP B 52 -12.544 -15.809 -7.529 1.00 0.00 O ATOM 1278 CB ASP B 52 -13.898 -17.449 -5.043 1.00 0.00 C ATOM 1279 CG ASP B 52 -15.175 -18.232 -4.732 1.00 0.00 C ATOM 1280 OD1 ASP B 52 -15.404 -19.245 -5.428 1.00 0.00 O ATOM 1281 OD2 ASP B 52 -15.893 -17.801 -3.804 1.00 0.00 O ATOM 0 H ASP B 52 -12.574 -19.520 -5.382 1.00 0.00 H new ATOM 0 HA ASP B 52 -14.001 -17.892 -7.147 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -13.180 -17.621 -4.241 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -14.132 -16.384 -5.038 1.00 0.00 H new ATOM 1286 N TRP B 53 -11.084 -16.751 -6.083 1.00 0.00 N ATOM 1287 CA TRP B 53 -10.047 -15.759 -6.309 1.00 0.00 C ATOM 1288 C TRP B 53 -9.852 -15.615 -7.820 1.00 0.00 C ATOM 1289 O TRP B 53 -9.352 -16.529 -8.474 1.00 0.00 O ATOM 1290 CB TRP B 53 -8.759 -16.133 -5.573 1.00 0.00 C ATOM 1291 CG TRP B 53 -8.968 -16.500 -4.102 1.00 0.00 C ATOM 1292 CD1 TRP B 53 -9.897 -16.032 -3.259 1.00 0.00 C ATOM 1293 CD2 TRP B 53 -8.187 -17.438 -3.332 1.00 0.00 C ATOM 1294 NE1 TRP B 53 -9.774 -16.597 -2.006 1.00 0.00 N ATOM 1295 CE2 TRP B 53 -8.701 -17.480 -2.052 1.00 0.00 C ATOM 1296 CE3 TRP B 53 -7.084 -18.226 -3.704 1.00 0.00 C ATOM 1297 CZ2 TRP B 53 -8.176 -18.293 -1.040 1.00 0.00 C ATOM 1298 CZ3 TRP B 53 -6.570 -19.034 -2.682 1.00 0.00 C ATOM 1299 CH2 TRP B 53 -7.076 -19.086 -1.388 1.00 0.00 C ATOM 0 H TRP B 53 -10.839 -17.478 -5.410 1.00 0.00 H new ATOM 0 HA TRP B 53 -10.343 -14.792 -5.902 1.00 0.00 H new ATOM 0 HB2 TRP B 53 -8.292 -16.975 -6.084 1.00 0.00 H new ATOM 0 HB3 TRP B 53 -8.062 -15.297 -5.633 1.00 0.00 H new ATOM 0 HD1 TRP B 53 -10.648 -15.304 -3.526 1.00 0.00 H new ATOM 0 HE1 TRP B 53 -10.362 -16.403 -1.195 1.00 0.00 H new ATOM 0 HE3 TRP B 53 -6.666 -18.210 -4.700 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 -8.597 -18.308 -0.045 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 -5.722 -19.660 -2.915 1.00 0.00 H new ATOM 0 HH2 TRP B 53 -6.622 -19.736 -0.654 1.00 0.00 H new ATOM 1310 N PRO B 54 -10.266 -14.430 -8.343 1.00 0.00 N ATOM 1311 CA PRO B 54 -10.142 -14.156 -9.765 1.00 0.00 C ATOM 1312 C PRO B 54 -8.690 -13.853 -10.139 1.00 0.00 C ATOM 1313 O PRO B 54 -7.892 -13.468 -9.286 1.00 0.00 O ATOM 1314 CB PRO B 54 -11.078 -12.986 -10.023 1.00 0.00 C ATOM 1315 CG PRO B 54 -11.338 -12.353 -8.665 1.00 0.00 C ATOM 1316 CD PRO B 54 -10.862 -13.325 -7.598 1.00 0.00 C ATOM 0 HA PRO B 54 -10.414 -15.011 -10.384 1.00 0.00 H new ATOM 0 HB2 PRO B 54 -10.627 -12.269 -10.708 1.00 0.00 H new ATOM 0 HB3 PRO B 54 -12.008 -13.323 -10.481 1.00 0.00 H new ATOM 0 HG2 PRO B 54 -10.810 -11.403 -8.579 1.00 0.00 H new ATOM 0 HG3 PRO B 54 -12.400 -12.140 -8.540 1.00 0.00 H new ATOM 0 HD2 PRO B 54 -10.135 -12.858 -6.933 1.00 0.00 H new ATOM 0 HD3 PRO B 54 -11.689 -13.667 -6.976 1.00 0.00 H new ATOM 1324 N SER B 55 -8.391 -14.038 -11.417 1.00 0.00 N ATOM 1325 CA SER B 55 -7.049 -13.789 -11.915 1.00 0.00 C ATOM 1326 C SER B 55 -6.877 -12.303 -12.237 1.00 0.00 C ATOM 1327 O SER B 55 -7.742 -11.698 -12.870 1.00 0.00 O ATOM 1328 CB SER B 55 -6.755 -14.638 -13.153 1.00 0.00 C ATOM 1329 OG SER B 55 -7.909 -14.805 -13.973 1.00 0.00 O ATOM 0 H SER B 55 -9.055 -14.357 -12.122 1.00 0.00 H new ATOM 0 HA SER B 55 -6.338 -14.070 -11.138 1.00 0.00 H new ATOM 0 HB2 SER B 55 -5.962 -14.168 -13.735 1.00 0.00 H new ATOM 0 HB3 SER B 55 -6.386 -15.616 -12.843 1.00 0.00 H new ATOM 0 HG SER B 55 -7.676 -14.622 -14.907 1.00 0.00 H new ATOM 1335 N VAL B 56 -5.756 -11.759 -11.788 1.00 0.00 N ATOM 1336 CA VAL B 56 -5.460 -10.355 -12.021 1.00 0.00 C ATOM 1337 C VAL B 56 -4.003 -10.212 -12.465 1.00 0.00 C ATOM 1338 O VAL B 56 -3.295 -11.207 -12.611 1.00 0.00 O ATOM 1339 CB VAL B 56 -5.787 -9.537 -10.770 1.00 0.00 C ATOM 1340 CG1 VAL B 56 -7.261 -9.684 -10.388 1.00 0.00 C ATOM 1341 CG2 VAL B 56 -4.877 -9.930 -9.604 1.00 0.00 C ATOM 0 H VAL B 56 -5.042 -12.264 -11.264 1.00 0.00 H new ATOM 0 HA VAL B 56 -6.084 -9.961 -12.823 1.00 0.00 H new ATOM 0 HB VAL B 56 -5.603 -8.487 -10.999 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -7.466 -9.093 -9.496 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -7.886 -9.332 -11.208 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -7.482 -10.732 -10.187 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -5.131 -9.334 -8.728 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -5.014 -10.987 -9.376 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -3.837 -9.750 -9.877 1.00 0.00 H new ATOM 1351 N ASN B 57 -3.599 -8.967 -12.667 1.00 0.00 N ATOM 1352 CA ASN B 57 -2.239 -8.681 -13.091 1.00 0.00 C ATOM 1353 C ASN B 57 -1.645 -7.598 -12.189 1.00 0.00 C ATOM 1354 O ASN B 57 -2.042 -6.436 -12.264 1.00 0.00 O ATOM 1355 CB ASN B 57 -2.208 -8.166 -14.532 1.00 0.00 C ATOM 1356 CG ASN B 57 -2.765 -9.212 -15.500 1.00 0.00 C ATOM 1357 OD1 ASN B 57 -2.804 -10.398 -15.218 1.00 0.00 O ATOM 1358 ND2 ASN B 57 -3.191 -8.707 -16.655 1.00 0.00 N ATOM 0 H ASN B 57 -4.190 -8.144 -12.545 1.00 0.00 H new ATOM 0 HA ASN B 57 -1.664 -9.605 -13.026 1.00 0.00 H new ATOM 0 HB2 ASN B 57 -2.792 -7.249 -14.607 1.00 0.00 H new ATOM 0 HB3 ASN B 57 -1.184 -7.916 -14.811 1.00 0.00 H new ATOM 0 HD21 ASN B 57 -3.579 -9.323 -17.369 1.00 0.00 H new ATOM 0 HD22 ASN B 57 -3.129 -7.703 -16.826 1.00 0.00 H new ATOM 1365 N MET B 58 -0.703 -8.017 -11.357 1.00 0.00 N ATOM 1366 CA MET B 58 -0.050 -7.097 -10.441 1.00 0.00 C ATOM 1367 C MET B 58 1.109 -6.371 -11.127 1.00 0.00 C ATOM 1368 O MET B 58 2.185 -6.940 -11.304 1.00 0.00 O ATOM 1369 CB MET B 58 0.477 -7.870 -9.230 1.00 0.00 C ATOM 1370 CG MET B 58 1.453 -7.017 -8.417 1.00 0.00 C ATOM 1371 SD MET B 58 1.765 -7.785 -6.837 1.00 0.00 S ATOM 1372 CE MET B 58 0.089 -8.007 -6.263 1.00 0.00 C ATOM 0 H MET B 58 -0.376 -8.981 -11.298 1.00 0.00 H new ATOM 0 HA MET B 58 -0.780 -6.354 -10.119 1.00 0.00 H new ATOM 0 HB2 MET B 58 -0.357 -8.176 -8.599 1.00 0.00 H new ATOM 0 HB3 MET B 58 0.975 -8.780 -9.564 1.00 0.00 H new ATOM 0 HG2 MET B 58 2.388 -6.899 -8.964 1.00 0.00 H new ATOM 0 HG3 MET B 58 1.041 -6.019 -8.270 1.00 0.00 H new ATOM 0 HE1 MET B 58 0.068 -7.959 -5.174 1.00 0.00 H new ATOM 0 HE2 MET B 58 -0.543 -7.220 -6.674 1.00 0.00 H new ATOM 0 HE3 MET B 58 -0.282 -8.978 -6.590 1.00 0.00 H new ATOM 1382 N ASN B 59 0.849 -5.125 -11.495 1.00 0.00 N ATOM 1383 CA ASN B 59 1.857 -4.315 -12.157 1.00 0.00 C ATOM 1384 C ASN B 59 2.833 -3.768 -11.113 1.00 0.00 C ATOM 1385 O ASN B 59 2.416 -3.192 -10.110 1.00 0.00 O ATOM 1386 CB ASN B 59 1.221 -3.125 -12.878 1.00 0.00 C ATOM 1387 CG ASN B 59 0.565 -3.565 -14.189 1.00 0.00 C ATOM 1388 OD1 ASN B 59 -0.551 -4.270 -14.025 1.00 0.00 O flip ATOM 1389 ND2 ASN B 59 1.040 -3.283 -15.276 1.00 0.00 N flip ATOM 0 H ASN B 59 -0.045 -4.657 -11.347 1.00 0.00 H new ATOM 0 HA ASN B 59 2.371 -4.944 -12.883 1.00 0.00 H new ATOM 0 HB2 ASN B 59 0.476 -2.660 -12.232 1.00 0.00 H new ATOM 0 HB3 ASN B 59 1.981 -2.371 -13.083 1.00 0.00 H new ATOM 0 HD21 ASN B 59 1.901 -2.738 -15.331 1.00 0.00 H new ATOM 0 HD22 ASN B 59 0.577 -3.592 -16.131 1.00 0.00 H new ATOM 1396 N VAL B 60 4.114 -3.968 -11.386 1.00 0.00 N ATOM 1397 CA VAL B 60 5.153 -3.502 -10.483 1.00 0.00 C ATOM 1398 C VAL B 60 6.236 -2.781 -11.287 1.00 0.00 C ATOM 1399 O VAL B 60 7.048 -3.419 -11.954 1.00 0.00 O ATOM 1400 CB VAL B 60 5.698 -4.674 -9.663 1.00 0.00 C ATOM 1401 CG1 VAL B 60 6.690 -4.188 -8.604 1.00 0.00 C ATOM 1402 CG2 VAL B 60 4.560 -5.471 -9.023 1.00 0.00 C ATOM 0 H VAL B 60 4.456 -4.446 -12.219 1.00 0.00 H new ATOM 0 HA VAL B 60 4.746 -2.785 -9.770 1.00 0.00 H new ATOM 0 HB VAL B 60 6.232 -5.339 -10.342 1.00 0.00 H new ATOM 0 HG11 VAL B 60 7.062 -5.040 -8.036 1.00 0.00 H new ATOM 0 HG12 VAL B 60 7.525 -3.685 -9.091 1.00 0.00 H new ATOM 0 HG13 VAL B 60 6.191 -3.492 -7.930 1.00 0.00 H new ATOM 0 HG21 VAL B 60 4.974 -6.298 -8.446 1.00 0.00 H new ATOM 0 HG22 VAL B 60 3.986 -4.820 -8.363 1.00 0.00 H new ATOM 0 HG23 VAL B 60 3.907 -5.864 -9.803 1.00 0.00 H new ATOM 1412 N ALA B 61 6.214 -1.459 -11.196 1.00 0.00 N ATOM 1413 CA ALA B 61 7.184 -0.643 -11.907 1.00 0.00 C ATOM 1414 C ALA B 61 8.213 -0.102 -10.914 1.00 0.00 C ATOM 1415 O ALA B 61 8.448 -0.704 -9.867 1.00 0.00 O ATOM 1416 CB ALA B 61 6.458 0.472 -12.661 1.00 0.00 C ATOM 0 H ALA B 61 5.540 -0.933 -10.641 1.00 0.00 H new ATOM 0 HA ALA B 61 7.720 -1.239 -12.645 1.00 0.00 H new ATOM 0 HB1 ALA B 61 7.185 1.084 -13.194 1.00 0.00 H new ATOM 0 HB2 ALA B 61 5.760 0.034 -13.374 1.00 0.00 H new ATOM 0 HB3 ALA B 61 5.911 1.094 -11.953 1.00 0.00 H new ATOM 1422 N ASP B 62 8.801 1.029 -11.277 1.00 0.00 N ATOM 1423 CA ASP B 62 9.800 1.659 -10.431 1.00 0.00 C ATOM 1424 C ASP B 62 9.366 1.549 -8.968 1.00 0.00 C ATOM 1425 O ASP B 62 9.993 0.840 -8.182 1.00 0.00 O ATOM 1426 CB ASP B 62 9.952 3.143 -10.769 1.00 0.00 C ATOM 1427 CG ASP B 62 11.046 3.875 -9.989 1.00 0.00 C ATOM 1428 OD1 ASP B 62 10.804 4.151 -8.795 1.00 0.00 O ATOM 1429 OD2 ASP B 62 12.100 4.142 -10.606 1.00 0.00 O ATOM 0 H ASP B 62 8.604 1.525 -12.146 1.00 0.00 H new ATOM 0 HA ASP B 62 10.751 1.152 -10.598 1.00 0.00 H new ATOM 0 HB2 ASP B 62 10.161 3.238 -11.835 1.00 0.00 H new ATOM 0 HB3 ASP B 62 9.000 3.641 -10.585 1.00 0.00 H new ATOM 1434 N ALA B 63 8.296 2.261 -8.646 1.00 0.00 N ATOM 1435 CA ALA B 63 7.771 2.253 -7.292 1.00 0.00 C ATOM 1436 C ALA B 63 6.250 2.414 -7.338 1.00 0.00 C ATOM 1437 O ALA B 63 5.716 3.433 -6.902 1.00 0.00 O ATOM 1438 CB ALA B 63 8.449 3.354 -6.474 1.00 0.00 C ATOM 0 H ALA B 63 7.778 2.848 -9.300 1.00 0.00 H new ATOM 0 HA ALA B 63 7.988 1.303 -6.803 1.00 0.00 H new ATOM 0 HB1 ALA B 63 8.055 3.348 -5.458 1.00 0.00 H new ATOM 0 HB2 ALA B 63 9.524 3.177 -6.447 1.00 0.00 H new ATOM 0 HB3 ALA B 63 8.252 4.323 -6.934 1.00 0.00 H new ATOM 1444 N THR B 64 5.595 1.392 -7.870 1.00 0.00 N ATOM 1445 CA THR B 64 4.146 1.407 -7.979 1.00 0.00 C ATOM 1446 C THR B 64 3.607 -0.018 -8.118 1.00 0.00 C ATOM 1447 O THR B 64 4.132 -0.811 -8.898 1.00 0.00 O ATOM 1448 CB THR B 64 3.769 2.317 -9.150 1.00 0.00 C ATOM 1449 OG1 THR B 64 4.224 3.606 -8.749 1.00 0.00 O ATOM 1450 CG2 THR B 64 2.256 2.485 -9.298 1.00 0.00 C ATOM 0 H THR B 64 6.041 0.548 -8.230 1.00 0.00 H new ATOM 0 HA THR B 64 3.685 1.808 -7.076 1.00 0.00 H new ATOM 0 HB THR B 64 4.180 1.909 -10.073 1.00 0.00 H new ATOM 0 HG1 THR B 64 4.273 3.646 -7.771 1.00 0.00 H new ATOM 0 HG21 THR B 64 2.044 3.140 -10.143 1.00 0.00 H new ATOM 0 HG22 THR B 64 1.797 1.511 -9.469 1.00 0.00 H new ATOM 0 HG23 THR B 64 1.848 2.924 -8.388 1.00 0.00 H new ATOM 1458 N VAL B 65 2.565 -0.299 -7.350 1.00 0.00 N ATOM 1459 CA VAL B 65 1.949 -1.615 -7.377 1.00 0.00 C ATOM 1460 C VAL B 65 0.472 -1.474 -7.751 1.00 0.00 C ATOM 1461 O VAL B 65 -0.366 -1.197 -6.893 1.00 0.00 O ATOM 1462 CB VAL B 65 2.161 -2.321 -6.037 1.00 0.00 C ATOM 1463 CG1 VAL B 65 1.293 -3.576 -5.934 1.00 0.00 C ATOM 1464 CG2 VAL B 65 3.638 -2.657 -5.822 1.00 0.00 C ATOM 0 H VAL B 65 2.132 0.362 -6.705 1.00 0.00 H new ATOM 0 HA VAL B 65 2.419 -2.241 -8.136 1.00 0.00 H new ATOM 0 HB VAL B 65 1.854 -1.636 -5.246 1.00 0.00 H new ATOM 0 HG11 VAL B 65 1.464 -4.058 -4.972 1.00 0.00 H new ATOM 0 HG12 VAL B 65 0.242 -3.300 -6.020 1.00 0.00 H new ATOM 0 HG13 VAL B 65 1.554 -4.266 -6.737 1.00 0.00 H new ATOM 0 HG21 VAL B 65 3.761 -3.158 -4.862 1.00 0.00 H new ATOM 0 HG22 VAL B 65 3.982 -3.314 -6.621 1.00 0.00 H new ATOM 0 HG23 VAL B 65 4.225 -1.739 -5.830 1.00 0.00 H new ATOM 1474 N THR B 66 0.197 -1.671 -9.032 1.00 0.00 N ATOM 1475 CA THR B 66 -1.165 -1.569 -9.529 1.00 0.00 C ATOM 1476 C THR B 66 -1.691 -2.949 -9.929 1.00 0.00 C ATOM 1477 O THR B 66 -0.924 -3.809 -10.360 1.00 0.00 O ATOM 1478 CB THR B 66 -1.174 -0.559 -10.678 1.00 0.00 C ATOM 1479 OG1 THR B 66 -0.520 0.587 -10.139 1.00 0.00 O ATOM 1480 CG2 THR B 66 -2.582 -0.062 -11.010 1.00 0.00 C ATOM 0 H THR B 66 0.894 -1.901 -9.741 1.00 0.00 H new ATOM 0 HA THR B 66 -1.843 -1.209 -8.755 1.00 0.00 H new ATOM 0 HB THR B 66 -0.731 -1.014 -11.564 1.00 0.00 H new ATOM 0 HG1 THR B 66 -0.481 1.291 -10.819 1.00 0.00 H new ATOM 0 HG21 THR B 66 -2.531 0.652 -11.832 1.00 0.00 H new ATOM 0 HG22 THR B 66 -3.207 -0.906 -11.301 1.00 0.00 H new ATOM 0 HG23 THR B 66 -3.013 0.423 -10.134 1.00 0.00 H new ATOM 1488 N VAL B 67 -2.996 -3.117 -9.773 1.00 0.00 N ATOM 1489 CA VAL B 67 -3.634 -4.378 -10.112 1.00 0.00 C ATOM 1490 C VAL B 67 -4.607 -4.156 -11.272 1.00 0.00 C ATOM 1491 O VAL B 67 -5.716 -3.664 -11.071 1.00 0.00 O ATOM 1492 CB VAL B 67 -4.305 -4.975 -8.874 1.00 0.00 C ATOM 1493 CG1 VAL B 67 -4.955 -6.321 -9.198 1.00 0.00 C ATOM 1494 CG2 VAL B 67 -3.308 -5.109 -7.721 1.00 0.00 C ATOM 0 H VAL B 67 -3.629 -2.401 -9.416 1.00 0.00 H new ATOM 0 HA VAL B 67 -2.892 -5.104 -10.444 1.00 0.00 H new ATOM 0 HB VAL B 67 -5.093 -4.291 -8.557 1.00 0.00 H new ATOM 0 HG11 VAL B 67 -5.425 -6.724 -8.301 1.00 0.00 H new ATOM 0 HG12 VAL B 67 -5.710 -6.184 -9.972 1.00 0.00 H new ATOM 0 HG13 VAL B 67 -4.194 -7.017 -9.552 1.00 0.00 H new ATOM 0 HG21 VAL B 67 -3.811 -5.536 -6.853 1.00 0.00 H new ATOM 0 HG22 VAL B 67 -2.488 -5.761 -8.023 1.00 0.00 H new ATOM 0 HG23 VAL B 67 -2.914 -4.126 -7.465 1.00 0.00 H new ATOM 1504 N ILE B 68 -4.156 -4.530 -12.461 1.00 0.00 N ATOM 1505 CA ILE B 68 -4.974 -4.378 -13.652 1.00 0.00 C ATOM 1506 C ILE B 68 -5.594 -5.729 -14.016 1.00 0.00 C ATOM 1507 O ILE B 68 -4.922 -6.758 -13.965 1.00 0.00 O ATOM 1508 CB ILE B 68 -4.158 -3.751 -14.785 1.00 0.00 C ATOM 1509 CG1 ILE B 68 -3.325 -2.574 -14.274 1.00 0.00 C ATOM 1510 CG2 ILE B 68 -5.060 -3.351 -15.954 1.00 0.00 C ATOM 1511 CD1 ILE B 68 -2.284 -2.147 -15.311 1.00 0.00 C ATOM 0 H ILE B 68 -3.235 -4.938 -12.625 1.00 0.00 H new ATOM 0 HA ILE B 68 -5.798 -3.689 -13.463 1.00 0.00 H new ATOM 0 HB ILE B 68 -3.460 -4.500 -15.159 1.00 0.00 H new ATOM 0 HG12 ILE B 68 -3.980 -1.734 -14.044 1.00 0.00 H new ATOM 0 HG13 ILE B 68 -2.826 -2.853 -13.346 1.00 0.00 H new ATOM 0 HG21 ILE B 68 -4.455 -2.908 -16.745 1.00 0.00 H new ATOM 0 HG22 ILE B 68 -5.570 -4.234 -16.338 1.00 0.00 H new ATOM 0 HG23 ILE B 68 -5.798 -2.625 -15.612 1.00 0.00 H new ATOM 0 HD11 ILE B 68 -1.706 -1.309 -14.922 1.00 0.00 H new ATOM 0 HD12 ILE B 68 -1.616 -2.982 -15.521 1.00 0.00 H new ATOM 0 HD13 ILE B 68 -2.788 -1.845 -16.229 1.00 0.00 H new ATOM 1523 N SER B 69 -6.868 -5.681 -14.375 1.00 0.00 N ATOM 1524 CA SER B 69 -7.586 -6.888 -14.746 1.00 0.00 C ATOM 1525 C SER B 69 -6.698 -7.778 -15.619 1.00 0.00 C ATOM 1526 O SER B 69 -5.821 -7.283 -16.324 1.00 0.00 O ATOM 1527 CB SER B 69 -8.886 -6.552 -15.481 1.00 0.00 C ATOM 1528 OG SER B 69 -9.812 -7.635 -15.451 1.00 0.00 O ATOM 0 H SER B 69 -7.422 -4.825 -14.417 1.00 0.00 H new ATOM 0 HA SER B 69 -7.844 -7.426 -13.834 1.00 0.00 H new ATOM 0 HB2 SER B 69 -9.342 -5.672 -15.027 1.00 0.00 H new ATOM 0 HB3 SER B 69 -8.661 -6.296 -16.516 1.00 0.00 H new ATOM 0 HG SER B 69 -10.629 -7.380 -15.929 1.00 0.00 H new ATOM 1534 N GLU B 70 -6.958 -9.075 -15.542 1.00 0.00 N ATOM 1535 CA GLU B 70 -6.193 -10.038 -16.316 1.00 0.00 C ATOM 1536 C GLU B 70 -6.480 -9.867 -17.809 1.00 0.00 C ATOM 1537 O GLU B 70 -5.564 -9.640 -18.599 1.00 0.00 O ATOM 1538 CB GLU B 70 -6.491 -11.468 -15.860 1.00 0.00 C ATOM 1539 CG GLU B 70 -5.197 -12.240 -15.596 1.00 0.00 C ATOM 1540 CD GLU B 70 -5.338 -13.706 -16.013 1.00 0.00 C ATOM 1541 OE1 GLU B 70 -6.478 -14.093 -16.349 1.00 0.00 O ATOM 1542 OE2 GLU B 70 -4.303 -14.406 -15.986 1.00 0.00 O ATOM 0 H GLU B 70 -7.687 -9.481 -14.956 1.00 0.00 H new ATOM 0 HA GLU B 70 -5.133 -9.851 -16.147 1.00 0.00 H new ATOM 0 HB2 GLU B 70 -7.097 -11.446 -14.954 1.00 0.00 H new ATOM 0 HB3 GLU B 70 -7.076 -11.982 -16.622 1.00 0.00 H new ATOM 0 HG2 GLU B 70 -4.376 -11.779 -16.145 1.00 0.00 H new ATOM 0 HG3 GLU B 70 -4.944 -12.182 -14.537 1.00 0.00 H new ATOM 1549 N LYS B 71 -7.755 -9.982 -18.151 1.00 0.00 N ATOM 1550 CA LYS B 71 -8.174 -9.843 -19.535 1.00 0.00 C ATOM 1551 C LYS B 71 -7.762 -8.463 -20.052 1.00 0.00 C ATOM 1552 O LYS B 71 -6.858 -8.350 -20.878 1.00 0.00 O ATOM 1553 CB LYS B 71 -9.670 -10.130 -19.674 1.00 0.00 C ATOM 1554 CG LYS B 71 -9.920 -11.283 -20.649 1.00 0.00 C ATOM 1555 CD LYS B 71 -10.140 -10.761 -22.070 1.00 0.00 C ATOM 1556 CE LYS B 71 -11.338 -11.448 -22.727 1.00 0.00 C ATOM 1557 NZ LYS B 71 -12.604 -10.962 -22.132 1.00 0.00 N ATOM 0 H LYS B 71 -8.512 -10.170 -17.493 1.00 0.00 H new ATOM 0 HA LYS B 71 -7.672 -10.581 -20.160 1.00 0.00 H new ATOM 0 HB2 LYS B 71 -10.089 -10.377 -18.698 1.00 0.00 H new ATOM 0 HB3 LYS B 71 -10.184 -9.235 -20.024 1.00 0.00 H new ATOM 0 HG2 LYS B 71 -9.070 -11.966 -20.636 1.00 0.00 H new ATOM 0 HG3 LYS B 71 -10.792 -11.853 -20.328 1.00 0.00 H new ATOM 0 HD2 LYS B 71 -10.303 -9.684 -22.044 1.00 0.00 H new ATOM 0 HD3 LYS B 71 -9.245 -10.934 -22.667 1.00 0.00 H new ATOM 0 HE2 LYS B 71 -11.334 -11.252 -23.799 1.00 0.00 H new ATOM 0 HE3 LYS B 71 -11.260 -12.528 -22.600 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 -13.404 -11.263 -22.725 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 -12.713 -11.358 -21.177 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 -12.585 -9.924 -22.076 1.00 0.00 H new ATOM 1571 N ASN B 72 -8.445 -7.448 -19.544 1.00 0.00 N ATOM 1572 CA ASN B 72 -8.162 -6.080 -19.944 1.00 0.00 C ATOM 1573 C ASN B 72 -6.838 -5.635 -19.321 1.00 0.00 C ATOM 1574 O ASN B 72 -6.549 -5.961 -18.170 1.00 0.00 O ATOM 1575 CB ASN B 72 -9.257 -5.127 -19.460 1.00 0.00 C ATOM 1576 CG ASN B 72 -10.526 -5.278 -20.301 1.00 0.00 C ATOM 1577 OD1 ASN B 72 -10.603 -6.079 -21.218 1.00 0.00 O ATOM 1578 ND2 ASN B 72 -11.515 -4.466 -19.938 1.00 0.00 N ATOM 0 H ASN B 72 -9.194 -7.545 -18.859 1.00 0.00 H new ATOM 0 HA ASN B 72 -8.113 -6.050 -21.032 1.00 0.00 H new ATOM 0 HB2 ASN B 72 -9.484 -5.330 -18.413 1.00 0.00 H new ATOM 0 HB3 ASN B 72 -8.900 -4.099 -19.516 1.00 0.00 H new ATOM 0 HD21 ASN B 72 -12.404 -4.491 -20.437 1.00 0.00 H new ATOM 0 HD22 ASN B 72 -11.384 -3.819 -19.161 1.00 0.00 H new ATOM 1585 N GLU B 73 -6.068 -4.897 -20.108 1.00 0.00 N ATOM 1586 CA GLU B 73 -4.782 -4.404 -19.647 1.00 0.00 C ATOM 1587 C GLU B 73 -4.857 -2.901 -19.372 1.00 0.00 C ATOM 1588 O GLU B 73 -3.872 -2.293 -18.956 1.00 0.00 O ATOM 1589 CB GLU B 73 -3.679 -4.722 -20.659 1.00 0.00 C ATOM 1590 CG GLU B 73 -2.295 -4.453 -20.064 1.00 0.00 C ATOM 1591 CD GLU B 73 -1.550 -3.387 -20.870 1.00 0.00 C ATOM 1592 OE1 GLU B 73 -2.173 -2.336 -21.134 1.00 0.00 O ATOM 1593 OE2 GLU B 73 -0.373 -3.647 -21.203 1.00 0.00 O ATOM 0 H GLU B 73 -6.311 -4.629 -21.062 1.00 0.00 H new ATOM 0 HA GLU B 73 -4.533 -4.912 -18.715 1.00 0.00 H new ATOM 0 HB2 GLU B 73 -3.751 -5.766 -20.965 1.00 0.00 H new ATOM 0 HB3 GLU B 73 -3.817 -4.117 -21.555 1.00 0.00 H new ATOM 0 HG2 GLU B 73 -2.397 -4.126 -19.029 1.00 0.00 H new ATOM 0 HG3 GLU B 73 -1.715 -5.376 -20.051 1.00 0.00 H new ATOM 1600 N GLU B 74 -6.034 -2.345 -19.617 1.00 0.00 N ATOM 1601 CA GLU B 74 -6.251 -0.925 -19.401 1.00 0.00 C ATOM 1602 C GLU B 74 -7.281 -0.707 -18.292 1.00 0.00 C ATOM 1603 O GLU B 74 -7.635 0.429 -17.982 1.00 0.00 O ATOM 1604 CB GLU B 74 -6.684 -0.233 -20.695 1.00 0.00 C ATOM 1605 CG GLU B 74 -7.914 -0.917 -21.297 1.00 0.00 C ATOM 1606 CD GLU B 74 -9.047 0.088 -21.515 1.00 0.00 C ATOM 1607 OE1 GLU B 74 -9.210 0.960 -20.635 1.00 0.00 O ATOM 1608 OE2 GLU B 74 -9.726 -0.039 -22.557 1.00 0.00 O ATOM 0 H GLU B 74 -6.848 -2.853 -19.963 1.00 0.00 H new ATOM 0 HA GLU B 74 -5.308 -0.478 -19.086 1.00 0.00 H new ATOM 0 HB2 GLU B 74 -6.908 0.815 -20.494 1.00 0.00 H new ATOM 0 HB3 GLU B 74 -5.865 -0.252 -21.414 1.00 0.00 H new ATOM 0 HG2 GLU B 74 -7.648 -1.382 -22.246 1.00 0.00 H new ATOM 0 HG3 GLU B 74 -8.252 -1.714 -20.635 1.00 0.00 H new ATOM 1615 N GLU B 75 -7.734 -1.815 -17.723 1.00 0.00 N ATOM 1616 CA GLU B 75 -8.717 -1.760 -16.655 1.00 0.00 C ATOM 1617 C GLU B 75 -8.041 -1.977 -15.299 1.00 0.00 C ATOM 1618 O GLU B 75 -7.767 -3.112 -14.913 1.00 0.00 O ATOM 1619 CB GLU B 75 -9.831 -2.784 -16.881 1.00 0.00 C ATOM 1620 CG GLU B 75 -11.087 -2.412 -16.090 1.00 0.00 C ATOM 1621 CD GLU B 75 -12.307 -3.179 -16.604 1.00 0.00 C ATOM 1622 OE1 GLU B 75 -12.702 -2.908 -17.758 1.00 0.00 O ATOM 1623 OE2 GLU B 75 -12.816 -4.019 -15.831 1.00 0.00 O ATOM 0 H GLU B 75 -7.438 -2.756 -17.982 1.00 0.00 H new ATOM 0 HA GLU B 75 -9.172 -0.770 -16.658 1.00 0.00 H new ATOM 0 HB2 GLU B 75 -10.069 -2.839 -17.943 1.00 0.00 H new ATOM 0 HB3 GLU B 75 -9.487 -3.773 -16.580 1.00 0.00 H new ATOM 0 HG2 GLU B 75 -10.934 -2.632 -15.033 1.00 0.00 H new ATOM 0 HG3 GLU B 75 -11.267 -1.340 -16.170 1.00 0.00 H new ATOM 1630 N VAL B 76 -7.790 -0.871 -14.615 1.00 0.00 N ATOM 1631 CA VAL B 76 -7.151 -0.925 -13.311 1.00 0.00 C ATOM 1632 C VAL B 76 -8.116 -1.550 -12.301 1.00 0.00 C ATOM 1633 O VAL B 76 -9.318 -1.627 -12.551 1.00 0.00 O ATOM 1634 CB VAL B 76 -6.677 0.470 -12.901 1.00 0.00 C ATOM 1635 CG1 VAL B 76 -7.808 1.493 -13.032 1.00 0.00 C ATOM 1636 CG2 VAL B 76 -6.107 0.461 -11.482 1.00 0.00 C ATOM 0 H VAL B 76 -8.018 0.069 -14.939 1.00 0.00 H new ATOM 0 HA VAL B 76 -6.263 -1.557 -13.347 1.00 0.00 H new ATOM 0 HB VAL B 76 -5.877 0.765 -13.580 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -7.445 2.477 -12.734 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -8.148 1.529 -14.067 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -8.638 1.202 -12.388 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -5.777 1.465 -11.216 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -6.877 0.134 -10.783 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -5.260 -0.223 -11.435 1.00 0.00 H new ATOM 1646 N LEU B 77 -7.553 -1.980 -11.181 1.00 0.00 N ATOM 1647 CA LEU B 77 -8.349 -2.595 -10.132 1.00 0.00 C ATOM 1648 C LEU B 77 -7.937 -2.012 -8.778 1.00 0.00 C ATOM 1649 O LEU B 77 -8.789 -1.616 -7.984 1.00 0.00 O ATOM 1650 CB LEU B 77 -8.243 -4.119 -10.204 1.00 0.00 C ATOM 1651 CG LEU B 77 -8.317 -4.732 -11.604 1.00 0.00 C ATOM 1652 CD1 LEU B 77 -8.165 -6.253 -11.546 1.00 0.00 C ATOM 1653 CD2 LEU B 77 -9.603 -4.312 -12.318 1.00 0.00 C ATOM 0 H LEU B 77 -6.556 -1.915 -10.977 1.00 0.00 H new ATOM 0 HA LEU B 77 -9.406 -2.366 -10.270 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -7.300 -4.420 -9.747 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -9.042 -4.548 -9.599 1.00 0.00 H new ATOM 0 HG LEU B 77 -7.482 -4.347 -12.190 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -8.221 -6.663 -12.554 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -7.201 -6.506 -11.105 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -8.964 -6.676 -10.937 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -9.631 -4.761 -13.311 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -10.465 -4.649 -11.743 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -9.630 -3.226 -12.410 1.00 0.00 H new ATOM 1665 N VAL B 78 -6.631 -1.979 -8.557 1.00 0.00 N ATOM 1666 CA VAL B 78 -6.096 -1.452 -7.313 1.00 0.00 C ATOM 1667 C VAL B 78 -4.754 -0.772 -7.588 1.00 0.00 C ATOM 1668 O VAL B 78 -3.969 -1.248 -8.407 1.00 0.00 O ATOM 1669 CB VAL B 78 -5.999 -2.568 -6.271 1.00 0.00 C ATOM 1670 CG1 VAL B 78 -4.800 -2.352 -5.346 1.00 0.00 C ATOM 1671 CG2 VAL B 78 -7.297 -2.682 -5.468 1.00 0.00 C ATOM 0 H VAL B 78 -5.928 -2.309 -9.218 1.00 0.00 H new ATOM 0 HA VAL B 78 -6.764 -0.697 -6.899 1.00 0.00 H new ATOM 0 HB VAL B 78 -5.848 -3.509 -6.801 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -4.754 -3.159 -4.615 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -3.883 -2.344 -5.935 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -4.907 -1.399 -4.828 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -7.202 -3.482 -4.734 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -7.491 -1.740 -4.955 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -8.124 -2.905 -6.143 1.00 0.00 H new ATOM 1681 N GLU B 79 -4.530 0.330 -6.887 1.00 0.00 N ATOM 1682 CA GLU B 79 -3.296 1.080 -7.045 1.00 0.00 C ATOM 1683 C GLU B 79 -2.597 1.243 -5.694 1.00 0.00 C ATOM 1684 O GLU B 79 -2.907 2.162 -4.937 1.00 0.00 O ATOM 1685 CB GLU B 79 -3.560 2.441 -7.693 1.00 0.00 C ATOM 1686 CG GLU B 79 -2.529 2.738 -8.784 1.00 0.00 C ATOM 1687 CD GLU B 79 -2.987 3.899 -9.669 1.00 0.00 C ATOM 1688 OE1 GLU B 79 -4.107 3.792 -10.212 1.00 0.00 O ATOM 1689 OE2 GLU B 79 -2.206 4.868 -9.782 1.00 0.00 O ATOM 0 H GLU B 79 -5.183 0.721 -6.208 1.00 0.00 H new ATOM 0 HA GLU B 79 -2.637 0.520 -7.708 1.00 0.00 H new ATOM 0 HB2 GLU B 79 -4.562 2.456 -8.121 1.00 0.00 H new ATOM 0 HB3 GLU B 79 -3.526 3.222 -6.933 1.00 0.00 H new ATOM 0 HG2 GLU B 79 -1.570 2.981 -8.327 1.00 0.00 H new ATOM 0 HG3 GLU B 79 -2.375 1.849 -9.395 1.00 0.00 H new ATOM 1696 N CYS B 80 -1.667 0.337 -5.431 1.00 0.00 N ATOM 1697 CA CYS B 80 -0.922 0.369 -4.185 1.00 0.00 C ATOM 1698 C CYS B 80 0.401 1.097 -4.434 1.00 0.00 C ATOM 1699 O CYS B 80 1.389 0.479 -4.826 1.00 0.00 O ATOM 1700 CB CYS B 80 -0.702 -1.037 -3.621 1.00 0.00 C ATOM 1701 SG CYS B 80 -0.137 -0.933 -1.883 1.00 0.00 S ATOM 0 H CYS B 80 -1.413 -0.424 -6.060 1.00 0.00 H new ATOM 0 HA CYS B 80 -1.495 0.907 -3.430 1.00 0.00 H new ATOM 0 HB2 CYS B 80 -1.628 -1.609 -3.677 1.00 0.00 H new ATOM 0 HB3 CYS B 80 0.037 -1.567 -4.221 1.00 0.00 H new ATOM 0 HG CYS B 80 -0.863 -1.718 -1.143 1.00 0.00 H new ATOM 1707 N ARG B 81 0.376 2.400 -4.196 1.00 0.00 N ATOM 1708 CA ARG B 81 1.560 3.219 -4.390 1.00 0.00 C ATOM 1709 C ARG B 81 2.521 3.049 -3.211 1.00 0.00 C ATOM 1710 O ARG B 81 2.189 3.400 -2.080 1.00 0.00 O ATOM 1711 CB ARG B 81 1.191 4.697 -4.530 1.00 0.00 C ATOM 1712 CG ARG B 81 0.339 4.933 -5.779 1.00 0.00 C ATOM 1713 CD ARG B 81 1.210 5.346 -6.967 1.00 0.00 C ATOM 1714 NE ARG B 81 0.358 5.647 -8.139 1.00 0.00 N ATOM 1715 CZ ARG B 81 0.799 6.244 -9.254 1.00 0.00 C ATOM 1716 NH1 ARG B 81 2.085 6.608 -9.357 1.00 0.00 N ATOM 1717 NH2 ARG B 81 -0.046 6.478 -10.268 1.00 0.00 N ATOM 0 H ARG B 81 -0.446 2.909 -3.870 1.00 0.00 H new ATOM 0 HA ARG B 81 2.045 2.889 -5.309 1.00 0.00 H new ATOM 0 HB2 ARG B 81 0.645 5.025 -3.645 1.00 0.00 H new ATOM 0 HB3 ARG B 81 2.098 5.298 -4.585 1.00 0.00 H new ATOM 0 HG2 ARG B 81 -0.211 4.025 -6.025 1.00 0.00 H new ATOM 0 HG3 ARG B 81 -0.400 5.709 -5.578 1.00 0.00 H new ATOM 0 HD2 ARG B 81 1.805 6.221 -6.705 1.00 0.00 H new ATOM 0 HD3 ARG B 81 1.909 4.546 -7.211 1.00 0.00 H new ATOM 0 HE ARG B 81 -0.626 5.383 -8.095 1.00 0.00 H new ATOM 0 HH11 ARG B 81 2.729 6.430 -8.586 1.00 0.00 H new ATOM 0 HH12 ARG B 81 2.420 7.063 -10.206 1.00 0.00 H new ATOM 0 HH21 ARG B 81 -1.025 6.201 -10.190 1.00 0.00 H new ATOM 0 HH22 ARG B 81 0.290 6.933 -11.117 1.00 0.00 H new ATOM 1731 N VAL B 82 3.693 2.512 -3.517 1.00 0.00 N ATOM 1732 CA VAL B 82 4.704 2.292 -2.497 1.00 0.00 C ATOM 1733 C VAL B 82 4.699 3.468 -1.517 1.00 0.00 C ATOM 1734 O VAL B 82 4.737 3.269 -0.304 1.00 0.00 O ATOM 1735 CB VAL B 82 6.068 2.067 -3.152 1.00 0.00 C ATOM 1736 CG1 VAL B 82 6.023 0.881 -4.118 1.00 0.00 C ATOM 1737 CG2 VAL B 82 6.552 3.333 -3.861 1.00 0.00 C ATOM 0 H VAL B 82 3.965 2.223 -4.457 1.00 0.00 H new ATOM 0 HA VAL B 82 4.480 1.391 -1.926 1.00 0.00 H new ATOM 0 HB VAL B 82 6.783 1.831 -2.364 1.00 0.00 H new ATOM 0 HG11 VAL B 82 7.005 0.743 -4.570 1.00 0.00 H new ATOM 0 HG12 VAL B 82 5.744 -0.021 -3.574 1.00 0.00 H new ATOM 0 HG13 VAL B 82 5.288 1.076 -4.899 1.00 0.00 H new ATOM 0 HG21 VAL B 82 7.524 3.145 -4.318 1.00 0.00 H new ATOM 0 HG22 VAL B 82 5.836 3.614 -4.633 1.00 0.00 H new ATOM 0 HG23 VAL B 82 6.642 4.143 -3.138 1.00 0.00 H new ATOM 1747 N ARG B 83 4.650 4.666 -2.081 1.00 0.00 N ATOM 1748 CA ARG B 83 4.639 5.873 -1.272 1.00 0.00 C ATOM 1749 C ARG B 83 3.524 5.802 -0.227 1.00 0.00 C ATOM 1750 O ARG B 83 3.764 6.028 0.958 1.00 0.00 O ATOM 1751 CB ARG B 83 4.435 7.116 -2.141 1.00 0.00 C ATOM 1752 CG ARG B 83 5.746 7.886 -2.312 1.00 0.00 C ATOM 1753 CD ARG B 83 5.914 8.369 -3.754 1.00 0.00 C ATOM 1754 NE ARG B 83 6.272 9.806 -3.768 1.00 0.00 N ATOM 1755 CZ ARG B 83 6.204 10.586 -4.855 1.00 0.00 C ATOM 1756 NH1 ARG B 83 5.792 10.074 -6.023 1.00 0.00 N ATOM 1757 NH2 ARG B 83 6.548 11.878 -4.775 1.00 0.00 N ATOM 0 H ARG B 83 4.617 4.827 -3.088 1.00 0.00 H new ATOM 0 HA ARG B 83 5.605 5.946 -0.773 1.00 0.00 H new ATOM 0 HB2 ARG B 83 4.051 6.822 -3.118 1.00 0.00 H new ATOM 0 HB3 ARG B 83 3.685 7.763 -1.686 1.00 0.00 H new ATOM 0 HG2 ARG B 83 5.761 8.740 -1.635 1.00 0.00 H new ATOM 0 HG3 ARG B 83 6.586 7.247 -2.039 1.00 0.00 H new ATOM 0 HD2 ARG B 83 6.689 7.788 -4.253 1.00 0.00 H new ATOM 0 HD3 ARG B 83 4.990 8.211 -4.309 1.00 0.00 H new ATOM 0 HE ARG B 83 6.590 10.228 -2.896 1.00 0.00 H new ATOM 0 HH11 ARG B 83 5.530 9.090 -6.084 1.00 0.00 H new ATOM 0 HH12 ARG B 83 5.740 10.668 -6.850 1.00 0.00 H new ATOM 0 HH21 ARG B 83 6.862 12.268 -3.886 1.00 0.00 H new ATOM 0 HH22 ARG B 83 6.496 12.472 -5.603 1.00 0.00 H new ATOM 1771 N PHE B 84 2.329 5.487 -0.704 1.00 0.00 N ATOM 1772 CA PHE B 84 1.176 5.383 0.174 1.00 0.00 C ATOM 1773 C PHE B 84 1.256 4.122 1.038 1.00 0.00 C ATOM 1774 O PHE B 84 0.870 4.139 2.205 1.00 0.00 O ATOM 1775 CB PHE B 84 -0.062 5.295 -0.721 1.00 0.00 C ATOM 1776 CG PHE B 84 -0.467 6.628 -1.354 1.00 0.00 C ATOM 1777 CD1 PHE B 84 0.299 7.174 -2.336 1.00 0.00 C ATOM 1778 CD2 PHE B 84 -1.593 7.265 -0.936 1.00 0.00 C ATOM 1779 CE1 PHE B 84 -0.077 8.411 -2.924 1.00 0.00 C ATOM 1780 CE2 PHE B 84 -1.969 8.502 -1.524 1.00 0.00 C ATOM 1781 CZ PHE B 84 -1.203 9.049 -2.506 1.00 0.00 C ATOM 0 H PHE B 84 2.134 5.300 -1.688 1.00 0.00 H new ATOM 0 HA PHE B 84 1.137 6.245 0.839 1.00 0.00 H new ATOM 0 HB2 PHE B 84 0.126 4.570 -1.513 1.00 0.00 H new ATOM 0 HB3 PHE B 84 -0.897 4.915 -0.133 1.00 0.00 H new ATOM 0 HD1 PHE B 84 1.193 6.667 -2.669 1.00 0.00 H new ATOM 0 HD2 PHE B 84 -2.202 6.830 -0.157 1.00 0.00 H new ATOM 0 HE1 PHE B 84 0.532 8.845 -3.703 1.00 0.00 H new ATOM 0 HE2 PHE B 84 -2.863 9.008 -1.191 1.00 0.00 H new ATOM 0 HZ PHE B 84 -1.489 9.989 -2.954 1.00 0.00 H new ATOM 1791 N LEU B 85 1.761 3.058 0.430 1.00 0.00 N ATOM 1792 CA LEU B 85 1.897 1.791 1.128 1.00 0.00 C ATOM 1793 C LEU B 85 2.442 2.046 2.535 1.00 0.00 C ATOM 1794 O LEU B 85 3.257 2.944 2.736 1.00 0.00 O ATOM 1795 CB LEU B 85 2.744 0.816 0.308 1.00 0.00 C ATOM 1796 CG LEU B 85 2.300 -0.648 0.340 1.00 0.00 C ATOM 1797 CD1 LEU B 85 2.676 -1.363 -0.959 1.00 0.00 C ATOM 1798 CD2 LEU B 85 2.859 -1.364 1.571 1.00 0.00 C ATOM 0 H LEU B 85 2.081 3.048 -0.538 1.00 0.00 H new ATOM 0 HA LEU B 85 0.924 1.313 1.244 1.00 0.00 H new ATOM 0 HB2 LEU B 85 2.747 1.152 -0.729 1.00 0.00 H new ATOM 0 HB3 LEU B 85 3.773 0.871 0.664 1.00 0.00 H new ATOM 0 HG LEU B 85 1.213 -0.674 0.419 1.00 0.00 H new ATOM 0 HD11 LEU B 85 2.349 -2.402 -0.910 1.00 0.00 H new ATOM 0 HD12 LEU B 85 2.190 -0.869 -1.800 1.00 0.00 H new ATOM 0 HD13 LEU B 85 3.757 -1.329 -1.093 1.00 0.00 H new ATOM 0 HD21 LEU B 85 2.528 -2.403 1.569 1.00 0.00 H new ATOM 0 HD22 LEU B 85 3.948 -1.330 1.548 1.00 0.00 H new ATOM 0 HD23 LEU B 85 2.499 -0.870 2.474 1.00 0.00 H new ATOM 1810 N SER B 86 1.968 1.239 3.473 1.00 0.00 N ATOM 1811 CA SER B 86 2.397 1.365 4.856 1.00 0.00 C ATOM 1812 C SER B 86 3.099 0.082 5.305 1.00 0.00 C ATOM 1813 O SER B 86 4.211 0.129 5.828 1.00 0.00 O ATOM 1814 CB SER B 86 1.212 1.672 5.774 1.00 0.00 C ATOM 1815 OG SER B 86 0.238 0.632 5.754 1.00 0.00 O ATOM 0 H SER B 86 1.291 0.495 3.303 1.00 0.00 H new ATOM 0 HA SER B 86 3.098 2.197 4.923 1.00 0.00 H new ATOM 0 HB2 SER B 86 1.570 1.814 6.794 1.00 0.00 H new ATOM 0 HB3 SER B 86 0.748 2.609 5.466 1.00 0.00 H new ATOM 0 HG SER B 86 0.379 0.037 6.519 1.00 0.00 H new ATOM 1821 N PHE B 87 2.420 -1.034 5.085 1.00 0.00 N ATOM 1822 CA PHE B 87 2.964 -2.328 5.461 1.00 0.00 C ATOM 1823 C PHE B 87 2.648 -3.385 4.401 1.00 0.00 C ATOM 1824 O PHE B 87 1.655 -3.272 3.684 1.00 0.00 O ATOM 1825 CB PHE B 87 2.297 -2.729 6.778 1.00 0.00 C ATOM 1826 CG PHE B 87 3.011 -3.861 7.518 1.00 0.00 C ATOM 1827 CD1 PHE B 87 2.809 -5.153 7.142 1.00 0.00 C ATOM 1828 CD2 PHE B 87 3.846 -3.577 8.553 1.00 0.00 C ATOM 1829 CE1 PHE B 87 3.472 -6.204 7.829 1.00 0.00 C ATOM 1830 CE2 PHE B 87 4.509 -4.629 9.240 1.00 0.00 C ATOM 1831 CZ PHE B 87 4.308 -5.920 8.863 1.00 0.00 C ATOM 0 H PHE B 87 1.498 -1.069 4.651 1.00 0.00 H new ATOM 0 HA PHE B 87 4.048 -2.261 5.558 1.00 0.00 H new ATOM 0 HB2 PHE B 87 2.249 -1.856 7.429 1.00 0.00 H new ATOM 0 HB3 PHE B 87 1.270 -3.032 6.575 1.00 0.00 H new ATOM 0 HD1 PHE B 87 2.145 -5.379 6.321 1.00 0.00 H new ATOM 0 HD2 PHE B 87 4.005 -2.552 8.853 1.00 0.00 H new ATOM 0 HE1 PHE B 87 3.312 -7.229 7.530 1.00 0.00 H new ATOM 0 HE2 PHE B 87 5.173 -4.403 10.062 1.00 0.00 H new ATOM 0 HZ PHE B 87 4.812 -6.720 9.385 1.00 0.00 H new ATOM 1841 N MET B 88 3.512 -4.387 4.335 1.00 0.00 N ATOM 1842 CA MET B 88 3.338 -5.463 3.375 1.00 0.00 C ATOM 1843 C MET B 88 4.136 -6.702 3.787 1.00 0.00 C ATOM 1844 O MET B 88 5.322 -6.604 4.100 1.00 0.00 O ATOM 1845 CB MET B 88 3.800 -4.995 1.993 1.00 0.00 C ATOM 1846 CG MET B 88 5.227 -4.446 2.049 1.00 0.00 C ATOM 1847 SD MET B 88 6.164 -5.038 0.650 1.00 0.00 S ATOM 1848 CE MET B 88 6.746 -3.485 -0.012 1.00 0.00 C ATOM 0 H MET B 88 4.335 -4.476 4.931 1.00 0.00 H new ATOM 0 HA MET B 88 2.281 -5.728 3.345 1.00 0.00 H new ATOM 0 HB2 MET B 88 3.754 -5.826 1.289 1.00 0.00 H new ATOM 0 HB3 MET B 88 3.124 -4.225 1.621 1.00 0.00 H new ATOM 0 HG2 MET B 88 5.206 -3.356 2.049 1.00 0.00 H new ATOM 0 HG3 MET B 88 5.708 -4.755 2.977 1.00 0.00 H new ATOM 0 HE1 MET B 88 7.397 -3.674 -0.866 1.00 0.00 H new ATOM 0 HE2 MET B 88 5.895 -2.884 -0.331 1.00 0.00 H new ATOM 0 HE3 MET B 88 7.302 -2.948 0.756 1.00 0.00 H new ATOM 1858 N GLY B 89 3.455 -7.838 3.774 1.00 0.00 N ATOM 1859 CA GLY B 89 4.086 -9.093 4.143 1.00 0.00 C ATOM 1860 C GLY B 89 3.233 -10.285 3.703 1.00 0.00 C ATOM 1861 O GLY B 89 2.427 -10.170 2.781 1.00 0.00 O ATOM 0 H GLY B 89 2.472 -7.915 3.514 1.00 0.00 H new ATOM 0 HA2 GLY B 89 5.072 -9.157 3.683 1.00 0.00 H new ATOM 0 HA3 GLY B 89 4.235 -9.126 5.222 1.00 0.00 H new ATOM 1865 N VAL B 90 3.442 -11.404 4.382 1.00 0.00 N ATOM 1866 CA VAL B 90 2.703 -12.616 4.072 1.00 0.00 C ATOM 1867 C VAL B 90 2.065 -13.160 5.352 1.00 0.00 C ATOM 1868 O VAL B 90 2.409 -12.731 6.452 1.00 0.00 O ATOM 1869 CB VAL B 90 3.622 -13.628 3.385 1.00 0.00 C ATOM 1870 CG1 VAL B 90 4.996 -13.017 3.102 1.00 0.00 C ATOM 1871 CG2 VAL B 90 3.751 -14.905 4.218 1.00 0.00 C ATOM 0 H VAL B 90 4.112 -11.496 5.145 1.00 0.00 H new ATOM 0 HA VAL B 90 1.896 -12.403 3.371 1.00 0.00 H new ATOM 0 HB VAL B 90 3.171 -13.895 2.429 1.00 0.00 H new ATOM 0 HG11 VAL B 90 5.630 -13.757 2.613 1.00 0.00 H new ATOM 0 HG12 VAL B 90 4.882 -12.151 2.451 1.00 0.00 H new ATOM 0 HG13 VAL B 90 5.457 -12.707 4.040 1.00 0.00 H new ATOM 0 HG21 VAL B 90 4.409 -15.608 3.707 1.00 0.00 H new ATOM 0 HG22 VAL B 90 4.168 -14.661 5.195 1.00 0.00 H new ATOM 0 HG23 VAL B 90 2.767 -15.357 4.346 1.00 0.00 H new ATOM 1881 N GLY B 91 1.146 -14.097 5.165 1.00 0.00 N ATOM 1882 CA GLY B 91 0.457 -14.704 6.291 1.00 0.00 C ATOM 1883 C GLY B 91 1.224 -15.921 6.811 1.00 0.00 C ATOM 1884 O GLY B 91 2.357 -15.794 7.273 1.00 0.00 O ATOM 0 H GLY B 91 0.863 -14.450 4.251 1.00 0.00 H new ATOM 0 HA2 GLY B 91 0.344 -13.972 7.091 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -0.547 -15.004 5.989 1.00 0.00 H new ATOM 1888 N LYS B 92 0.576 -17.073 6.720 1.00 0.00 N ATOM 1889 CA LYS B 92 1.183 -18.312 7.176 1.00 0.00 C ATOM 1890 C LYS B 92 1.912 -18.978 6.008 1.00 0.00 C ATOM 1891 O LYS B 92 2.903 -19.679 6.208 1.00 0.00 O ATOM 1892 CB LYS B 92 0.136 -19.209 7.839 1.00 0.00 C ATOM 1893 CG LYS B 92 -0.697 -18.423 8.853 1.00 0.00 C ATOM 1894 CD LYS B 92 -1.900 -19.241 9.327 1.00 0.00 C ATOM 1895 CE LYS B 92 -2.286 -18.869 10.760 1.00 0.00 C ATOM 1896 NZ LYS B 92 -3.213 -19.874 11.325 1.00 0.00 N ATOM 0 H LYS B 92 -0.364 -17.175 6.337 1.00 0.00 H new ATOM 0 HA LYS B 92 1.929 -18.110 7.944 1.00 0.00 H new ATOM 0 HB2 LYS B 92 -0.518 -19.634 7.078 1.00 0.00 H new ATOM 0 HB3 LYS B 92 0.630 -20.043 8.337 1.00 0.00 H new ATOM 0 HG2 LYS B 92 -0.077 -18.154 9.708 1.00 0.00 H new ATOM 0 HG3 LYS B 92 -1.041 -17.492 8.403 1.00 0.00 H new ATOM 0 HD2 LYS B 92 -2.746 -19.068 8.662 1.00 0.00 H new ATOM 0 HD3 LYS B 92 -1.665 -20.304 9.274 1.00 0.00 H new ATOM 0 HE2 LYS B 92 -1.391 -18.803 11.378 1.00 0.00 H new ATOM 0 HE3 LYS B 92 -2.755 -17.885 10.773 1.00 0.00 H new ATOM 0 HZ1 LYS B 92 -2.998 -20.016 12.333 1.00 0.00 H new ATOM 0 HZ2 LYS B 92 -4.192 -19.539 11.224 1.00 0.00 H new ATOM 0 HZ3 LYS B 92 -3.101 -20.774 10.817 1.00 0.00 H new ATOM 1910 N ASP B 93 1.394 -18.736 4.813 1.00 0.00 N ATOM 1911 CA ASP B 93 1.984 -19.303 3.612 1.00 0.00 C ATOM 1912 C ASP B 93 2.657 -18.191 2.805 1.00 0.00 C ATOM 1913 O ASP B 93 2.099 -17.106 2.651 1.00 0.00 O ATOM 1914 CB ASP B 93 0.916 -19.950 2.727 1.00 0.00 C ATOM 1915 CG ASP B 93 1.230 -21.376 2.273 1.00 0.00 C ATOM 1916 OD1 ASP B 93 2.009 -22.042 2.989 1.00 0.00 O ATOM 1917 OD2 ASP B 93 0.684 -21.770 1.219 1.00 0.00 O ATOM 0 H ASP B 93 0.572 -18.155 4.650 1.00 0.00 H new ATOM 0 HA ASP B 93 2.707 -20.059 3.916 1.00 0.00 H new ATOM 0 HB2 ASP B 93 -0.029 -19.958 3.270 1.00 0.00 H new ATOM 0 HB3 ASP B 93 0.771 -19.327 1.844 1.00 0.00 H new ATOM 1922 N VAL B 94 3.847 -18.500 2.312 1.00 0.00 N ATOM 1923 CA VAL B 94 4.603 -17.540 1.524 1.00 0.00 C ATOM 1924 C VAL B 94 3.983 -17.430 0.130 1.00 0.00 C ATOM 1925 O VAL B 94 4.425 -16.625 -0.688 1.00 0.00 O ATOM 1926 CB VAL B 94 6.080 -17.937 1.492 1.00 0.00 C ATOM 1927 CG1 VAL B 94 6.602 -18.224 2.902 1.00 0.00 C ATOM 1928 CG2 VAL B 94 6.305 -19.137 0.570 1.00 0.00 C ATOM 0 H VAL B 94 4.307 -19.401 2.443 1.00 0.00 H new ATOM 0 HA VAL B 94 4.556 -16.551 1.979 1.00 0.00 H new ATOM 0 HB VAL B 94 6.644 -17.095 1.091 1.00 0.00 H new ATOM 0 HG11 VAL B 94 7.654 -18.504 2.850 1.00 0.00 H new ATOM 0 HG12 VAL B 94 6.494 -17.332 3.519 1.00 0.00 H new ATOM 0 HG13 VAL B 94 6.030 -19.041 3.342 1.00 0.00 H new ATOM 0 HG21 VAL B 94 7.363 -19.399 0.565 1.00 0.00 H new ATOM 0 HG22 VAL B 94 5.723 -19.986 0.929 1.00 0.00 H new ATOM 0 HG23 VAL B 94 5.990 -18.883 -0.442 1.00 0.00 H new ATOM 1938 N HIS B 95 2.968 -18.251 -0.098 1.00 0.00 N ATOM 1939 CA HIS B 95 2.283 -18.256 -1.379 1.00 0.00 C ATOM 1940 C HIS B 95 1.347 -17.049 -1.466 1.00 0.00 C ATOM 1941 O HIS B 95 0.946 -16.647 -2.557 1.00 0.00 O ATOM 1942 CB HIS B 95 1.558 -19.585 -1.603 1.00 0.00 C ATOM 1943 CG HIS B 95 2.468 -20.791 -1.588 1.00 0.00 C ATOM 1944 ND1 HIS B 95 2.695 -21.747 -2.534 1.00 0.00 N flip ATOM 1945 CD2 HIS B 95 3.268 -21.114 -0.506 1.00 0.00 C flip ATOM 1946 CE1 HIS B 95 3.586 -22.607 -2.056 1.00 0.00 C flip ATOM 1947 NE2 HIS B 95 3.942 -22.216 -0.799 1.00 0.00 N flip ATOM 0 H HIS B 95 2.604 -18.917 0.583 1.00 0.00 H new ATOM 0 HA HIS B 95 3.012 -18.166 -2.184 1.00 0.00 H new ATOM 0 HB2 HIS B 95 0.797 -19.707 -0.832 1.00 0.00 H new ATOM 0 HB3 HIS B 95 1.038 -19.547 -2.560 1.00 0.00 H new ATOM 0 HD1 HIS B 95 2.255 -21.793 -3.453 1.00 0.00 H new ATOM 0 HD2 HIS B 95 3.332 -20.562 0.420 1.00 0.00 H new ATOM 0 HE1 HIS B 95 3.966 -23.473 -2.577 1.00 0.00 H new ATOM 1955 N THR B 96 1.027 -16.505 -0.301 1.00 0.00 N ATOM 1956 CA THR B 96 0.146 -15.351 -0.231 1.00 0.00 C ATOM 1957 C THR B 96 0.956 -14.075 0.007 1.00 0.00 C ATOM 1958 O THR B 96 2.101 -14.136 0.453 1.00 0.00 O ATOM 1959 CB THR B 96 -0.899 -15.619 0.854 1.00 0.00 C ATOM 1960 OG1 THR B 96 -0.136 -15.716 2.054 1.00 0.00 O ATOM 1961 CG2 THR B 96 -1.549 -16.997 0.713 1.00 0.00 C ATOM 0 H THR B 96 1.362 -16.842 0.602 1.00 0.00 H new ATOM 0 HA THR B 96 -0.377 -15.195 -1.175 1.00 0.00 H new ATOM 0 HB THR B 96 -1.669 -14.849 0.815 1.00 0.00 H new ATOM 0 HG1 THR B 96 0.361 -16.561 2.058 1.00 0.00 H new ATOM 0 HG21 THR B 96 -2.282 -17.136 1.507 1.00 0.00 H new ATOM 0 HG22 THR B 96 -2.045 -17.068 -0.255 1.00 0.00 H new ATOM 0 HG23 THR B 96 -0.784 -17.770 0.786 1.00 0.00 H new ATOM 1969 N PHE B 97 0.330 -12.949 -0.301 1.00 0.00 N ATOM 1970 CA PHE B 97 0.978 -11.660 -0.126 1.00 0.00 C ATOM 1971 C PHE B 97 -0.056 -10.538 -0.009 1.00 0.00 C ATOM 1972 O PHE B 97 -0.769 -10.244 -0.967 1.00 0.00 O ATOM 1973 CB PHE B 97 1.836 -11.419 -1.370 1.00 0.00 C ATOM 1974 CG PHE B 97 2.492 -10.038 -1.414 1.00 0.00 C ATOM 1975 CD1 PHE B 97 3.410 -9.690 -0.473 1.00 0.00 C ATOM 1976 CD2 PHE B 97 2.158 -9.157 -2.396 1.00 0.00 C ATOM 1977 CE1 PHE B 97 4.018 -8.408 -0.514 1.00 0.00 C ATOM 1978 CE2 PHE B 97 2.766 -7.875 -2.437 1.00 0.00 C ATOM 1979 CZ PHE B 97 3.684 -7.527 -1.495 1.00 0.00 C ATOM 0 H PHE B 97 -0.619 -12.902 -0.671 1.00 0.00 H new ATOM 0 HA PHE B 97 1.575 -11.664 0.786 1.00 0.00 H new ATOM 0 HB2 PHE B 97 2.614 -12.181 -1.416 1.00 0.00 H new ATOM 0 HB3 PHE B 97 1.215 -11.544 -2.257 1.00 0.00 H new ATOM 0 HD1 PHE B 97 3.677 -10.389 0.306 1.00 0.00 H new ATOM 0 HD2 PHE B 97 1.430 -9.433 -3.144 1.00 0.00 H new ATOM 0 HE1 PHE B 97 4.746 -8.132 0.234 1.00 0.00 H new ATOM 0 HE2 PHE B 97 2.500 -7.176 -3.216 1.00 0.00 H new ATOM 0 HZ PHE B 97 4.147 -6.552 -1.526 1.00 0.00 H new ATOM 1989 N ALA B 98 -0.103 -9.942 1.173 1.00 0.00 N ATOM 1990 CA ALA B 98 -1.037 -8.859 1.428 1.00 0.00 C ATOM 1991 C ALA B 98 -0.257 -7.579 1.735 1.00 0.00 C ATOM 1992 O ALA B 98 0.896 -7.639 2.160 1.00 0.00 O ATOM 1993 CB ALA B 98 -1.980 -9.254 2.566 1.00 0.00 C ATOM 0 H ALA B 98 0.491 -10.189 1.965 1.00 0.00 H new ATOM 0 HA ALA B 98 -1.651 -8.668 0.548 1.00 0.00 H new ATOM 0 HB1 ALA B 98 -2.680 -8.441 2.757 1.00 0.00 H new ATOM 0 HB2 ALA B 98 -2.533 -10.151 2.286 1.00 0.00 H new ATOM 0 HB3 ALA B 98 -1.400 -9.452 3.467 1.00 0.00 H new ATOM 1999 N PHE B 99 -0.916 -6.453 1.509 1.00 0.00 N ATOM 2000 CA PHE B 99 -0.298 -5.161 1.756 1.00 0.00 C ATOM 2001 C PHE B 99 -1.347 -4.117 2.144 1.00 0.00 C ATOM 2002 O PHE B 99 -2.451 -4.109 1.601 1.00 0.00 O ATOM 2003 CB PHE B 99 0.375 -4.730 0.452 1.00 0.00 C ATOM 2004 CG PHE B 99 -0.605 -4.397 -0.674 1.00 0.00 C ATOM 2005 CD1 PHE B 99 -1.369 -3.274 -0.601 1.00 0.00 C ATOM 2006 CD2 PHE B 99 -0.713 -5.224 -1.749 1.00 0.00 C ATOM 2007 CE1 PHE B 99 -2.279 -2.965 -1.646 1.00 0.00 C ATOM 2008 CE2 PHE B 99 -1.623 -4.915 -2.794 1.00 0.00 C ATOM 2009 CZ PHE B 99 -2.387 -3.792 -2.721 1.00 0.00 C ATOM 0 H PHE B 99 -1.872 -6.408 1.157 1.00 0.00 H new ATOM 0 HA PHE B 99 0.417 -5.241 2.575 1.00 0.00 H new ATOM 0 HB2 PHE B 99 0.998 -3.857 0.648 1.00 0.00 H new ATOM 0 HB3 PHE B 99 1.039 -5.527 0.118 1.00 0.00 H new ATOM 0 HD1 PHE B 99 -1.283 -2.617 0.252 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -0.106 -6.116 -1.807 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -2.886 -2.073 -1.588 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -1.709 -5.572 -3.647 1.00 0.00 H new ATOM 0 HZ PHE B 99 -3.079 -3.557 -3.516 1.00 0.00 H new ATOM 2019 N ILE B 100 -0.965 -3.261 3.080 1.00 0.00 N ATOM 2020 CA ILE B 100 -1.859 -2.215 3.547 1.00 0.00 C ATOM 2021 C ILE B 100 -1.578 -0.926 2.771 1.00 0.00 C ATOM 2022 O ILE B 100 -0.446 -0.446 2.748 1.00 0.00 O ATOM 2023 CB ILE B 100 -1.750 -2.054 5.065 1.00 0.00 C ATOM 2024 CG1 ILE B 100 -2.313 -3.280 5.787 1.00 0.00 C ATOM 2025 CG2 ILE B 100 -2.418 -0.758 5.529 1.00 0.00 C ATOM 2026 CD1 ILE B 100 -1.355 -3.761 6.879 1.00 0.00 C ATOM 0 H ILE B 100 -0.049 -3.270 3.528 1.00 0.00 H new ATOM 0 HA ILE B 100 -2.897 -2.486 3.352 1.00 0.00 H new ATOM 0 HB ILE B 100 -0.694 -1.982 5.326 1.00 0.00 H new ATOM 0 HG12 ILE B 100 -3.279 -3.035 6.228 1.00 0.00 H new ATOM 0 HG13 ILE B 100 -2.484 -4.082 5.069 1.00 0.00 H new ATOM 0 HG21 ILE B 100 -2.326 -0.669 6.611 1.00 0.00 H new ATOM 0 HG22 ILE B 100 -1.932 0.093 5.052 1.00 0.00 H new ATOM 0 HG23 ILE B 100 -3.473 -0.774 5.255 1.00 0.00 H new ATOM 0 HD11 ILE B 100 -1.779 -4.633 7.377 1.00 0.00 H new ATOM 0 HD12 ILE B 100 -0.398 -4.028 6.431 1.00 0.00 H new ATOM 0 HD13 ILE B 100 -1.205 -2.965 7.608 1.00 0.00 H new ATOM 2038 N MET B 101 -2.628 -0.404 2.154 1.00 0.00 N ATOM 2039 CA MET B 101 -2.509 0.819 1.379 1.00 0.00 C ATOM 2040 C MET B 101 -3.449 1.902 1.915 1.00 0.00 C ATOM 2041 O MET B 101 -4.527 1.597 2.423 1.00 0.00 O ATOM 2042 CB MET B 101 -2.844 0.531 -0.085 1.00 0.00 C ATOM 2043 CG MET B 101 -4.312 0.130 -0.243 1.00 0.00 C ATOM 2044 SD MET B 101 -4.723 -0.016 -1.974 1.00 0.00 S ATOM 2045 CE MET B 101 -4.340 1.639 -2.523 1.00 0.00 C ATOM 0 H MET B 101 -3.565 -0.806 2.175 1.00 0.00 H new ATOM 0 HA MET B 101 -1.484 1.181 1.462 1.00 0.00 H new ATOM 0 HB2 MET B 101 -2.637 1.414 -0.690 1.00 0.00 H new ATOM 0 HB3 MET B 101 -2.203 -0.268 -0.458 1.00 0.00 H new ATOM 0 HG2 MET B 101 -4.495 -0.818 0.264 1.00 0.00 H new ATOM 0 HG3 MET B 101 -4.953 0.874 0.230 1.00 0.00 H new ATOM 0 HE1 MET B 101 -4.811 1.820 -3.489 1.00 0.00 H new ATOM 0 HE2 MET B 101 -4.715 2.359 -1.796 1.00 0.00 H new ATOM 0 HE3 MET B 101 -3.260 1.750 -2.619 1.00 0.00 H new ATOM 2055 N ASP B 102 -3.006 3.143 1.783 1.00 0.00 N ATOM 2056 CA ASP B 102 -3.793 4.272 2.247 1.00 0.00 C ATOM 2057 C ASP B 102 -4.671 4.781 1.102 1.00 0.00 C ATOM 2058 O ASP B 102 -4.189 5.473 0.206 1.00 0.00 O ATOM 2059 CB ASP B 102 -2.893 5.423 2.700 1.00 0.00 C ATOM 2060 CG ASP B 102 -3.611 6.553 3.441 1.00 0.00 C ATOM 2061 OD1 ASP B 102 -4.463 7.202 2.797 1.00 0.00 O ATOM 2062 OD2 ASP B 102 -3.292 6.742 4.635 1.00 0.00 O ATOM 0 H ASP B 102 -2.111 3.392 1.361 1.00 0.00 H new ATOM 0 HA ASP B 102 -4.400 3.937 3.088 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -2.114 5.022 3.348 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -2.396 5.841 1.825 1.00 0.00 H new ATOM 2143 N PHE B 108 -7.387 2.226 5.351 1.00 0.00 N ATOM 2144 CA PHE B 108 -6.419 1.153 5.201 1.00 0.00 C ATOM 2145 C PHE B 108 -7.078 -0.104 4.628 1.00 0.00 C ATOM 2146 O PHE B 108 -7.936 -0.707 5.271 1.00 0.00 O ATOM 2147 CB PHE B 108 -5.878 0.839 6.597 1.00 0.00 C ATOM 2148 CG PHE B 108 -5.318 2.057 7.335 1.00 0.00 C ATOM 2149 CD1 PHE B 108 -4.550 2.962 6.671 1.00 0.00 C ATOM 2150 CD2 PHE B 108 -5.589 2.235 8.656 1.00 0.00 C ATOM 2151 CE1 PHE B 108 -4.031 4.092 7.356 1.00 0.00 C ATOM 2152 CE2 PHE B 108 -5.069 3.365 9.341 1.00 0.00 C ATOM 2153 CZ PHE B 108 -4.301 4.270 8.677 1.00 0.00 C ATOM 0 HA PHE B 108 -5.627 1.460 4.518 1.00 0.00 H new ATOM 0 HB2 PHE B 108 -6.677 0.400 7.195 1.00 0.00 H new ATOM 0 HB3 PHE B 108 -5.094 0.087 6.511 1.00 0.00 H new ATOM 0 HD1 PHE B 108 -4.335 2.821 5.622 1.00 0.00 H new ATOM 0 HD2 PHE B 108 -6.199 1.517 9.184 1.00 0.00 H new ATOM 0 HE1 PHE B 108 -3.422 4.810 6.828 1.00 0.00 H new ATOM 0 HE2 PHE B 108 -5.284 3.506 10.390 1.00 0.00 H new ATOM 0 HZ PHE B 108 -3.906 5.129 9.198 1.00 0.00 H new ATOM 2163 N GLU B 109 -6.651 -0.461 3.426 1.00 0.00 N ATOM 2164 CA GLU B 109 -7.189 -1.635 2.759 1.00 0.00 C ATOM 2165 C GLU B 109 -6.087 -2.674 2.543 1.00 0.00 C ATOM 2166 O GLU B 109 -5.028 -2.358 2.003 1.00 0.00 O ATOM 2167 CB GLU B 109 -7.854 -1.257 1.434 1.00 0.00 C ATOM 2168 CG GLU B 109 -9.260 -0.701 1.665 1.00 0.00 C ATOM 2169 CD GLU B 109 -9.954 -0.394 0.336 1.00 0.00 C ATOM 2170 OE1 GLU B 109 -9.271 -0.521 -0.703 1.00 0.00 O ATOM 2171 OE2 GLU B 109 -11.151 -0.039 0.390 1.00 0.00 O ATOM 0 H GLU B 109 -5.939 0.042 2.896 1.00 0.00 H new ATOM 0 HA GLU B 109 -7.955 -2.074 3.399 1.00 0.00 H new ATOM 0 HB2 GLU B 109 -7.246 -0.515 0.917 1.00 0.00 H new ATOM 0 HB3 GLU B 109 -7.907 -2.133 0.787 1.00 0.00 H new ATOM 0 HG2 GLU B 109 -9.851 -1.421 2.230 1.00 0.00 H new ATOM 0 HG3 GLU B 109 -9.202 0.206 2.267 1.00 0.00 H new ATOM 2178 N CYS B 110 -6.374 -3.893 2.977 1.00 0.00 N ATOM 2179 CA CYS B 110 -5.420 -4.981 2.837 1.00 0.00 C ATOM 2180 C CYS B 110 -5.814 -5.811 1.614 1.00 0.00 C ATOM 2181 O CYS B 110 -6.887 -6.413 1.588 1.00 0.00 O ATOM 2182 CB CYS B 110 -5.344 -5.833 4.106 1.00 0.00 C ATOM 2183 SG CYS B 110 -3.936 -6.996 3.995 1.00 0.00 S ATOM 0 H CYS B 110 -7.253 -4.151 3.425 1.00 0.00 H new ATOM 0 HA CYS B 110 -4.419 -4.575 2.691 1.00 0.00 H new ATOM 0 HB2 CYS B 110 -5.228 -5.191 4.979 1.00 0.00 H new ATOM 0 HB3 CYS B 110 -6.274 -6.386 4.239 1.00 0.00 H new ATOM 0 HG CYS B 110 -3.879 -7.713 5.078 1.00 0.00 H new ATOM 2189 N HIS B 111 -4.925 -5.818 0.632 1.00 0.00 N ATOM 2190 CA HIS B 111 -5.167 -6.565 -0.591 1.00 0.00 C ATOM 2191 C HIS B 111 -4.265 -7.800 -0.624 1.00 0.00 C ATOM 2192 O HIS B 111 -3.052 -7.684 -0.796 1.00 0.00 O ATOM 2193 CB HIS B 111 -4.991 -5.669 -1.819 1.00 0.00 C ATOM 2194 CG HIS B 111 -5.921 -4.480 -1.850 1.00 0.00 C ATOM 2195 ND1 HIS B 111 -7.239 -4.570 -2.263 1.00 0.00 N ATOM 2196 CD2 HIS B 111 -5.711 -3.175 -1.515 1.00 0.00 C ATOM 2197 CE1 HIS B 111 -7.788 -3.367 -2.177 1.00 0.00 C ATOM 2198 NE2 HIS B 111 -6.839 -2.504 -1.713 1.00 0.00 N ATOM 0 H HIS B 111 -4.036 -5.318 0.658 1.00 0.00 H new ATOM 0 HA HIS B 111 -6.200 -6.911 -0.612 1.00 0.00 H new ATOM 0 HB2 HIS B 111 -3.961 -5.313 -1.852 1.00 0.00 H new ATOM 0 HB3 HIS B 111 -5.151 -6.266 -2.717 1.00 0.00 H new ATOM 0 HD2 HIS B 111 -4.784 -2.758 -1.150 1.00 0.00 H new ATOM 0 HE1 HIS B 111 -8.807 -3.114 -2.430 1.00 0.00 H new ATOM 0 HE2 HIS B 111 -6.974 -1.507 -1.546 1.00 0.00 H new ATOM 2206 N VAL B 112 -4.892 -8.956 -0.457 1.00 0.00 N ATOM 2207 CA VAL B 112 -4.161 -10.211 -0.466 1.00 0.00 C ATOM 2208 C VAL B 112 -4.105 -10.754 -1.895 1.00 0.00 C ATOM 2209 O VAL B 112 -4.928 -10.389 -2.734 1.00 0.00 O ATOM 2210 CB VAL B 112 -4.795 -11.193 0.522 1.00 0.00 C ATOM 2211 CG1 VAL B 112 -3.979 -12.484 0.612 1.00 0.00 C ATOM 2212 CG2 VAL B 112 -4.962 -10.552 1.901 1.00 0.00 C ATOM 0 H VAL B 112 -5.898 -9.049 -0.315 1.00 0.00 H new ATOM 0 HA VAL B 112 -3.134 -10.056 -0.137 1.00 0.00 H new ATOM 0 HB VAL B 112 -5.787 -11.449 0.150 1.00 0.00 H new ATOM 0 HG11 VAL B 112 -4.451 -13.164 1.321 1.00 0.00 H new ATOM 0 HG12 VAL B 112 -3.935 -12.956 -0.370 1.00 0.00 H new ATOM 0 HG13 VAL B 112 -2.969 -12.253 0.949 1.00 0.00 H new ATOM 0 HG21 VAL B 112 -5.415 -11.271 2.584 1.00 0.00 H new ATOM 0 HG22 VAL B 112 -3.986 -10.253 2.284 1.00 0.00 H new ATOM 0 HG23 VAL B 112 -5.604 -9.675 1.819 1.00 0.00 H new ATOM 2222 N PHE B 113 -3.127 -11.617 -2.129 1.00 0.00 N ATOM 2223 CA PHE B 113 -2.954 -12.214 -3.443 1.00 0.00 C ATOM 2224 C PHE B 113 -2.308 -13.597 -3.336 1.00 0.00 C ATOM 2225 O PHE B 113 -1.511 -13.845 -2.433 1.00 0.00 O ATOM 2226 CB PHE B 113 -2.025 -11.291 -4.234 1.00 0.00 C ATOM 2227 CG PHE B 113 -2.593 -9.889 -4.468 1.00 0.00 C ATOM 2228 CD1 PHE B 113 -2.553 -8.964 -3.472 1.00 0.00 C ATOM 2229 CD2 PHE B 113 -3.137 -9.568 -5.673 1.00 0.00 C ATOM 2230 CE1 PHE B 113 -3.079 -7.663 -3.689 1.00 0.00 C ATOM 2231 CE2 PHE B 113 -3.663 -8.267 -5.890 1.00 0.00 C ATOM 2232 CZ PHE B 113 -3.623 -7.343 -4.894 1.00 0.00 C ATOM 0 H PHE B 113 -2.446 -11.917 -1.431 1.00 0.00 H new ATOM 0 HA PHE B 113 -3.923 -12.331 -3.929 1.00 0.00 H new ATOM 0 HB2 PHE B 113 -1.077 -11.204 -3.703 1.00 0.00 H new ATOM 0 HB3 PHE B 113 -1.809 -11.750 -5.199 1.00 0.00 H new ATOM 0 HD1 PHE B 113 -2.121 -9.219 -2.516 1.00 0.00 H new ATOM 0 HD2 PHE B 113 -3.169 -10.302 -6.464 1.00 0.00 H new ATOM 0 HE1 PHE B 113 -3.047 -6.928 -2.898 1.00 0.00 H new ATOM 0 HE2 PHE B 113 -4.095 -8.012 -6.846 1.00 0.00 H new ATOM 0 HZ PHE B 113 -4.024 -6.354 -5.059 1.00 0.00 H new ATOM 2242 N TRP B 114 -2.678 -14.461 -4.270 1.00 0.00 N ATOM 2243 CA TRP B 114 -2.145 -15.812 -4.292 1.00 0.00 C ATOM 2244 C TRP B 114 -1.087 -15.886 -5.395 1.00 0.00 C ATOM 2245 O TRP B 114 -1.389 -15.661 -6.566 1.00 0.00 O ATOM 2246 CB TRP B 114 -3.264 -16.840 -4.468 1.00 0.00 C ATOM 2247 CG TRP B 114 -2.792 -18.294 -4.391 1.00 0.00 C ATOM 2248 CD1 TRP B 114 -2.395 -19.086 -5.396 1.00 0.00 C ATOM 2249 CD2 TRP B 114 -2.683 -19.101 -3.200 1.00 0.00 C ATOM 2250 NE1 TRP B 114 -2.040 -20.340 -4.942 1.00 0.00 N ATOM 2251 CE2 TRP B 114 -2.221 -20.349 -3.564 1.00 0.00 C ATOM 2252 CE3 TRP B 114 -2.967 -18.786 -1.859 1.00 0.00 C ATOM 2253 CZ2 TRP B 114 -2.000 -21.382 -2.645 1.00 0.00 C ATOM 2254 CZ3 TRP B 114 -2.741 -19.830 -0.954 1.00 0.00 C ATOM 2255 CH2 TRP B 114 -2.276 -21.092 -1.304 1.00 0.00 C ATOM 0 H TRP B 114 -3.340 -14.251 -5.017 1.00 0.00 H new ATOM 0 HA TRP B 114 -1.673 -16.055 -3.340 1.00 0.00 H new ATOM 0 HB2 TRP B 114 -4.020 -16.673 -3.701 1.00 0.00 H new ATOM 0 HB3 TRP B 114 -3.746 -16.676 -5.432 1.00 0.00 H new ATOM 0 HD1 TRP B 114 -2.357 -18.781 -6.431 1.00 0.00 H new ATOM 0 HE1 TRP B 114 -1.706 -21.117 -5.513 1.00 0.00 H new ATOM 0 HE3 TRP B 114 -3.330 -17.816 -1.552 1.00 0.00 H new ATOM 0 HZ2 TRP B 114 -1.636 -22.351 -2.954 1.00 0.00 H new ATOM 0 HZ3 TRP B 114 -2.942 -19.641 0.090 1.00 0.00 H new ATOM 0 HH2 TRP B 114 -2.128 -21.846 -0.545 1.00 0.00 H new ATOM 2266 N CYS B 115 0.132 -16.200 -4.981 1.00 0.00 N ATOM 2267 CA CYS B 115 1.236 -16.306 -5.920 1.00 0.00 C ATOM 2268 C CYS B 115 1.647 -17.777 -6.015 1.00 0.00 C ATOM 2269 O CYS B 115 1.445 -18.543 -5.075 1.00 0.00 O ATOM 2270 CB CYS B 115 2.410 -15.411 -5.516 1.00 0.00 C ATOM 2271 SG CYS B 115 1.786 -13.834 -4.827 1.00 0.00 S ATOM 0 H CYS B 115 0.379 -16.384 -4.009 1.00 0.00 H new ATOM 0 HA CYS B 115 0.917 -15.955 -6.901 1.00 0.00 H new ATOM 0 HB2 CYS B 115 3.029 -15.920 -4.778 1.00 0.00 H new ATOM 0 HB3 CYS B 115 3.043 -15.214 -6.381 1.00 0.00 H new ATOM 0 HG CYS B 115 1.407 -14.018 -3.597 1.00 0.00 H new ATOM 2277 N GLU B 116 2.216 -18.126 -7.160 1.00 0.00 N ATOM 2278 CA GLU B 116 2.656 -19.491 -7.390 1.00 0.00 C ATOM 2279 C GLU B 116 4.046 -19.499 -8.030 1.00 0.00 C ATOM 2280 O GLU B 116 4.287 -18.795 -9.010 1.00 0.00 O ATOM 2281 CB GLU B 116 1.650 -20.253 -8.255 1.00 0.00 C ATOM 2282 CG GLU B 116 0.322 -20.436 -7.518 1.00 0.00 C ATOM 2283 CD GLU B 116 -0.495 -21.573 -8.134 1.00 0.00 C ATOM 2284 OE1 GLU B 116 -1.048 -21.345 -9.232 1.00 0.00 O ATOM 2285 OE2 GLU B 116 -0.549 -22.645 -7.493 1.00 0.00 O ATOM 0 H GLU B 116 2.382 -17.487 -7.938 1.00 0.00 H new ATOM 0 HA GLU B 116 2.717 -20.000 -6.428 1.00 0.00 H new ATOM 0 HB2 GLU B 116 1.482 -19.712 -9.186 1.00 0.00 H new ATOM 0 HB3 GLU B 116 2.059 -21.227 -8.522 1.00 0.00 H new ATOM 0 HG2 GLU B 116 0.512 -20.649 -6.466 1.00 0.00 H new ATOM 0 HG3 GLU B 116 -0.251 -19.509 -7.557 1.00 0.00 H new ATOM 2292 N PRO B 117 4.948 -20.326 -7.436 1.00 0.00 N ATOM 2293 CA PRO B 117 4.581 -21.126 -6.279 1.00 0.00 C ATOM 2294 C PRO B 117 4.491 -20.261 -5.020 1.00 0.00 C ATOM 2295 O PRO B 117 3.443 -20.198 -4.380 1.00 0.00 O ATOM 2296 CB PRO B 117 5.653 -22.199 -6.187 1.00 0.00 C ATOM 2297 CG PRO B 117 6.827 -21.687 -7.006 1.00 0.00 C ATOM 2298 CD PRO B 117 6.335 -20.519 -7.846 1.00 0.00 C ATOM 0 HA PRO B 117 3.593 -21.576 -6.375 1.00 0.00 H new ATOM 0 HB2 PRO B 117 5.945 -22.371 -5.151 1.00 0.00 H new ATOM 0 HB3 PRO B 117 5.289 -23.149 -6.578 1.00 0.00 H new ATOM 0 HG2 PRO B 117 7.640 -21.371 -6.352 1.00 0.00 H new ATOM 0 HG3 PRO B 117 7.221 -22.478 -7.645 1.00 0.00 H new ATOM 0 HD2 PRO B 117 6.930 -19.623 -7.666 1.00 0.00 H new ATOM 0 HD3 PRO B 117 6.406 -20.740 -8.911 1.00 0.00 H new ATOM 2306 N ASN B 118 5.604 -19.616 -4.704 1.00 0.00 N ATOM 2307 CA ASN B 118 5.664 -18.757 -3.533 1.00 0.00 C ATOM 2308 C ASN B 118 5.580 -17.295 -3.973 1.00 0.00 C ATOM 2309 O ASN B 118 5.714 -16.991 -5.158 1.00 0.00 O ATOM 2310 CB ASN B 118 6.980 -18.949 -2.777 1.00 0.00 C ATOM 2311 CG ASN B 118 8.176 -18.864 -3.727 1.00 0.00 C ATOM 2312 OD1 ASN B 118 8.047 -18.569 -4.904 1.00 0.00 O ATOM 2313 ND2 ASN B 118 9.344 -19.137 -3.153 1.00 0.00 N ATOM 0 H ASN B 118 6.471 -19.671 -5.238 1.00 0.00 H new ATOM 0 HA ASN B 118 4.831 -19.018 -2.880 1.00 0.00 H new ATOM 0 HB2 ASN B 118 7.072 -18.188 -2.002 1.00 0.00 H new ATOM 0 HB3 ASN B 118 6.978 -19.917 -2.276 1.00 0.00 H new ATOM 0 HD21 ASN B 118 10.202 -19.106 -3.703 1.00 0.00 H new ATOM 0 HD22 ASN B 118 9.382 -19.377 -2.162 1.00 0.00 H new ATOM 2320 N ALA B 119 5.358 -16.428 -2.996 1.00 0.00 N ATOM 2321 CA ALA B 119 5.255 -15.004 -3.268 1.00 0.00 C ATOM 2322 C ALA B 119 6.591 -14.330 -2.951 1.00 0.00 C ATOM 2323 O ALA B 119 6.635 -13.349 -2.209 1.00 0.00 O ATOM 2324 CB ALA B 119 4.097 -14.413 -2.461 1.00 0.00 C ATOM 0 H ALA B 119 5.247 -16.684 -2.015 1.00 0.00 H new ATOM 0 HA ALA B 119 5.041 -14.829 -4.322 1.00 0.00 H new ATOM 0 HB1 ALA B 119 4.019 -13.345 -2.665 1.00 0.00 H new ATOM 0 HB2 ALA B 119 3.167 -14.905 -2.745 1.00 0.00 H new ATOM 0 HB3 ALA B 119 4.279 -14.567 -1.397 1.00 0.00 H new ATOM 2330 N ALA B 120 7.648 -14.882 -3.528 1.00 0.00 N ATOM 2331 CA ALA B 120 8.982 -14.347 -3.315 1.00 0.00 C ATOM 2332 C ALA B 120 9.235 -13.211 -4.309 1.00 0.00 C ATOM 2333 O ALA B 120 9.642 -12.118 -3.917 1.00 0.00 O ATOM 2334 CB ALA B 120 10.010 -15.472 -3.443 1.00 0.00 C ATOM 0 H ALA B 120 7.608 -15.695 -4.143 1.00 0.00 H new ATOM 0 HA ALA B 120 9.074 -13.934 -2.310 1.00 0.00 H new ATOM 0 HB1 ALA B 120 11.011 -15.070 -3.283 1.00 0.00 H new ATOM 0 HB2 ALA B 120 9.804 -16.240 -2.697 1.00 0.00 H new ATOM 0 HB3 ALA B 120 9.949 -15.909 -4.440 1.00 0.00 H new ATOM 2340 N ASN B 121 8.983 -13.508 -5.575 1.00 0.00 N ATOM 2341 CA ASN B 121 9.178 -12.526 -6.628 1.00 0.00 C ATOM 2342 C ASN B 121 8.209 -11.361 -6.418 1.00 0.00 C ATOM 2343 O ASN B 121 8.579 -10.201 -6.594 1.00 0.00 O ATOM 2344 CB ASN B 121 8.900 -13.131 -8.005 1.00 0.00 C ATOM 2345 CG ASN B 121 10.123 -13.886 -8.530 1.00 0.00 C ATOM 2346 OD1 ASN B 121 10.320 -15.060 -8.266 1.00 0.00 O ATOM 2347 ND2 ASN B 121 10.931 -13.147 -9.285 1.00 0.00 N ATOM 0 H ASN B 121 8.645 -14.415 -5.896 1.00 0.00 H new ATOM 0 HA ASN B 121 10.213 -12.188 -6.586 1.00 0.00 H new ATOM 0 HB2 ASN B 121 8.049 -13.809 -7.943 1.00 0.00 H new ATOM 0 HB3 ASN B 121 8.628 -12.341 -8.705 1.00 0.00 H new ATOM 0 HD21 ASN B 121 11.775 -13.558 -9.682 1.00 0.00 H new ATOM 0 HD22 ASN B 121 10.706 -12.169 -9.467 1.00 0.00 H new ATOM 2354 N VAL B 122 6.986 -11.710 -6.046 1.00 0.00 N ATOM 2355 CA VAL B 122 5.960 -10.708 -5.811 1.00 0.00 C ATOM 2356 C VAL B 122 6.410 -9.779 -4.681 1.00 0.00 C ATOM 2357 O VAL B 122 6.672 -8.600 -4.910 1.00 0.00 O ATOM 2358 CB VAL B 122 4.619 -11.388 -5.528 1.00 0.00 C ATOM 2359 CG1 VAL B 122 3.720 -10.493 -4.673 1.00 0.00 C ATOM 2360 CG2 VAL B 122 3.920 -11.785 -6.829 1.00 0.00 C ATOM 0 H VAL B 122 6.682 -12.673 -5.902 1.00 0.00 H new ATOM 0 HA VAL B 122 5.816 -10.093 -6.699 1.00 0.00 H new ATOM 0 HB VAL B 122 4.818 -12.299 -4.964 1.00 0.00 H new ATOM 0 HG11 VAL B 122 2.773 -11.000 -4.487 1.00 0.00 H new ATOM 0 HG12 VAL B 122 4.213 -10.283 -3.723 1.00 0.00 H new ATOM 0 HG13 VAL B 122 3.533 -9.557 -5.199 1.00 0.00 H new ATOM 0 HG21 VAL B 122 2.969 -12.266 -6.599 1.00 0.00 H new ATOM 0 HG22 VAL B 122 3.740 -10.895 -7.431 1.00 0.00 H new ATOM 0 HG23 VAL B 122 4.552 -12.477 -7.385 1.00 0.00 H new ATOM 2370 N SER B 123 6.486 -10.347 -3.487 1.00 0.00 N ATOM 2371 CA SER B 123 6.900 -9.585 -2.321 1.00 0.00 C ATOM 2372 C SER B 123 8.235 -8.890 -2.597 1.00 0.00 C ATOM 2373 O SER B 123 8.489 -7.801 -2.084 1.00 0.00 O ATOM 2374 CB SER B 123 7.013 -10.483 -1.087 1.00 0.00 C ATOM 2375 OG SER B 123 5.754 -10.674 -0.449 1.00 0.00 O ATOM 0 H SER B 123 6.268 -11.326 -3.301 1.00 0.00 H new ATOM 0 HA SER B 123 6.140 -8.830 -2.118 1.00 0.00 H new ATOM 0 HB2 SER B 123 7.422 -11.450 -1.379 1.00 0.00 H new ATOM 0 HB3 SER B 123 7.714 -10.041 -0.380 1.00 0.00 H new ATOM 0 HG SER B 123 5.085 -10.090 -0.864 1.00 0.00 H new ATOM 2381 N GLU B 124 9.052 -9.548 -3.405 1.00 0.00 N ATOM 2382 CA GLU B 124 10.354 -9.007 -3.755 1.00 0.00 C ATOM 2383 C GLU B 124 10.196 -7.799 -4.680 1.00 0.00 C ATOM 2384 O GLU B 124 10.723 -6.724 -4.397 1.00 0.00 O ATOM 2385 CB GLU B 124 11.238 -10.078 -4.399 1.00 0.00 C ATOM 2386 CG GLU B 124 12.474 -9.452 -5.048 1.00 0.00 C ATOM 2387 CD GLU B 124 13.299 -8.675 -4.020 1.00 0.00 C ATOM 2388 OE1 GLU B 124 14.176 -9.313 -3.398 1.00 0.00 O ATOM 2389 OE2 GLU B 124 13.034 -7.462 -3.879 1.00 0.00 O ATOM 0 H GLU B 124 8.838 -10.451 -3.828 1.00 0.00 H new ATOM 0 HA GLU B 124 10.846 -8.678 -2.840 1.00 0.00 H new ATOM 0 HB2 GLU B 124 11.546 -10.802 -3.645 1.00 0.00 H new ATOM 0 HB3 GLU B 124 10.666 -10.624 -5.149 1.00 0.00 H new ATOM 0 HG2 GLU B 124 13.088 -10.233 -5.497 1.00 0.00 H new ATOM 0 HG3 GLU B 124 12.168 -8.784 -5.853 1.00 0.00 H new ATOM 2396 N ALA B 125 9.468 -8.015 -5.766 1.00 0.00 N ATOM 2397 CA ALA B 125 9.234 -6.957 -6.733 1.00 0.00 C ATOM 2398 C ALA B 125 8.594 -5.759 -6.028 1.00 0.00 C ATOM 2399 O ALA B 125 8.631 -4.641 -6.539 1.00 0.00 O ATOM 2400 CB ALA B 125 8.368 -7.492 -7.875 1.00 0.00 C ATOM 0 H ALA B 125 9.032 -8.908 -5.997 1.00 0.00 H new ATOM 0 HA ALA B 125 10.175 -6.619 -7.167 1.00 0.00 H new ATOM 0 HB1 ALA B 125 8.192 -6.698 -8.601 1.00 0.00 H new ATOM 0 HB2 ALA B 125 8.880 -8.322 -8.362 1.00 0.00 H new ATOM 0 HB3 ALA B 125 7.414 -7.838 -7.477 1.00 0.00 H new ATOM 2406 N VAL B 126 8.023 -6.034 -4.864 1.00 0.00 N ATOM 2407 CA VAL B 126 7.376 -4.993 -4.084 1.00 0.00 C ATOM 2408 C VAL B 126 8.375 -4.423 -3.075 1.00 0.00 C ATOM 2409 O VAL B 126 8.589 -3.213 -3.024 1.00 0.00 O ATOM 2410 CB VAL B 126 6.110 -5.544 -3.425 1.00 0.00 C ATOM 2411 CG1 VAL B 126 5.273 -4.416 -2.817 1.00 0.00 C ATOM 2412 CG2 VAL B 126 5.286 -6.363 -4.420 1.00 0.00 C ATOM 0 H VAL B 126 7.995 -6.962 -4.443 1.00 0.00 H new ATOM 0 HA VAL B 126 7.061 -4.173 -4.729 1.00 0.00 H new ATOM 0 HB VAL B 126 6.415 -6.208 -2.616 1.00 0.00 H new ATOM 0 HG11 VAL B 126 4.379 -4.835 -2.355 1.00 0.00 H new ATOM 0 HG12 VAL B 126 5.860 -3.893 -2.062 1.00 0.00 H new ATOM 0 HG13 VAL B 126 4.983 -3.716 -3.600 1.00 0.00 H new ATOM 0 HG21 VAL B 126 4.392 -6.743 -3.926 1.00 0.00 H new ATOM 0 HG22 VAL B 126 4.996 -5.731 -5.259 1.00 0.00 H new ATOM 0 HG23 VAL B 126 5.882 -7.199 -4.785 1.00 0.00 H new ATOM 2422 N GLN B 127 8.961 -5.322 -2.298 1.00 0.00 N ATOM 2423 CA GLN B 127 9.933 -4.924 -1.293 1.00 0.00 C ATOM 2424 C GLN B 127 11.021 -4.052 -1.924 1.00 0.00 C ATOM 2425 O GLN B 127 11.666 -3.263 -1.235 1.00 0.00 O ATOM 2426 CB GLN B 127 10.541 -6.146 -0.603 1.00 0.00 C ATOM 2427 CG GLN B 127 11.161 -5.764 0.742 1.00 0.00 C ATOM 2428 CD GLN B 127 12.164 -6.823 1.204 1.00 0.00 C ATOM 2429 OE1 GLN B 127 12.742 -7.554 0.416 1.00 0.00 O ATOM 2430 NE2 GLN B 127 12.338 -6.865 2.522 1.00 0.00 N ATOM 0 H GLN B 127 8.782 -6.325 -2.344 1.00 0.00 H new ATOM 0 HA GLN B 127 9.420 -4.337 -0.531 1.00 0.00 H new ATOM 0 HB2 GLN B 127 9.771 -6.903 -0.451 1.00 0.00 H new ATOM 0 HB3 GLN B 127 11.302 -6.590 -1.245 1.00 0.00 H new ATOM 0 HG2 GLN B 127 11.660 -4.799 0.655 1.00 0.00 H new ATOM 0 HG3 GLN B 127 10.376 -5.651 1.489 1.00 0.00 H new ATOM 0 HE21 GLN B 127 11.822 -6.224 3.125 1.00 0.00 H new ATOM 0 HE22 GLN B 127 12.987 -7.538 2.930 1.00 0.00 H new ATOM 2439 N ALA B 128 11.192 -4.224 -3.227 1.00 0.00 N ATOM 2440 CA ALA B 128 12.191 -3.463 -3.957 1.00 0.00 C ATOM 2441 C ALA B 128 11.573 -2.148 -4.437 1.00 0.00 C ATOM 2442 O ALA B 128 12.263 -1.134 -4.537 1.00 0.00 O ATOM 2443 CB ALA B 128 12.732 -4.308 -5.112 1.00 0.00 C ATOM 0 H ALA B 128 10.655 -4.879 -3.795 1.00 0.00 H new ATOM 0 HA ALA B 128 13.033 -3.216 -3.311 1.00 0.00 H new ATOM 0 HB1 ALA B 128 13.482 -3.737 -5.660 1.00 0.00 H new ATOM 0 HB2 ALA B 128 13.185 -5.217 -4.717 1.00 0.00 H new ATOM 0 HB3 ALA B 128 11.915 -4.572 -5.783 1.00 0.00 H new ATOM 2449 N ALA B 129 10.280 -2.207 -4.720 1.00 0.00 N ATOM 2450 CA ALA B 129 9.562 -1.033 -5.187 1.00 0.00 C ATOM 2451 C ALA B 129 9.601 0.047 -4.103 1.00 0.00 C ATOM 2452 O ALA B 129 9.717 1.233 -4.408 1.00 0.00 O ATOM 2453 CB ALA B 129 8.134 -1.426 -5.568 1.00 0.00 C ATOM 0 H ALA B 129 9.711 -3.049 -4.635 1.00 0.00 H new ATOM 0 HA ALA B 129 10.035 -0.622 -6.079 1.00 0.00 H new ATOM 0 HB1 ALA B 129 7.595 -0.545 -5.918 1.00 0.00 H new ATOM 0 HB2 ALA B 129 8.162 -2.174 -6.361 1.00 0.00 H new ATOM 0 HB3 ALA B 129 7.626 -1.839 -4.697 1.00 0.00 H new ATOM 2459 N CYS B 130 9.502 -0.402 -2.861 1.00 0.00 N ATOM 2460 CA CYS B 130 9.524 0.511 -1.731 1.00 0.00 C ATOM 2461 C CYS B 130 10.979 0.892 -1.449 1.00 0.00 C ATOM 2462 O CYS B 130 11.288 2.064 -1.242 1.00 0.00 O ATOM 2463 CB CYS B 130 8.845 -0.095 -0.501 1.00 0.00 C ATOM 2464 SG CYS B 130 7.054 -0.304 -0.814 1.00 0.00 S ATOM 0 H CYS B 130 9.406 -1.386 -2.612 1.00 0.00 H new ATOM 0 HA CYS B 130 8.955 1.408 -1.974 1.00 0.00 H new ATOM 0 HB2 CYS B 130 9.296 -1.059 -0.264 1.00 0.00 H new ATOM 0 HB3 CYS B 130 8.999 0.550 0.364 1.00 0.00 H new ATOM 0 HG CYS B 130 6.453 -0.619 0.295 1.00 0.00 H new