USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 915 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 88 MET CE :methyl -118:sc= -5.36! (180deg=-8.61!) USER MOD Set 1.2: B 130 CYS SG : rot -163:sc= -3.9! USER MOD Set 2.1: B 22 TYR OH : rot 26:sc= 0.325 USER MOD Set 2.2: B 111 HIS : no HD1:sc= -3.95! C(o=-3.6!,f=-4.2!) USER MOD Set 3.1: A 16 GLN : amide:sc= -7.53! C(o=-7.5!,f=-7.8!) USER MOD Set 3.2: A 17 ASN : amide:sc= 0.0802 X(o=-7.5,f=-7.8) USER MOD Set 4.1: A 14 MET CE :methyl 140:sc= -0.507 (180deg=-1.72) USER MOD Set 4.2: B 127 GLN : amide:sc= -0.183 K(o=-0.69,f=-3.7!) 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 15 GLN : amide:sc= -3.66! C(o=-3.7!,f=-3.8!) USER MOD Single : A 19 TYR OH : rot 30:sc= 0 USER MOD Single : B 16 GLN : amide:sc= -0.517 X(o=-0.52,f=-0.13) USER MOD Single : B 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 21 GLN : amide:sc= -2.04 K(o=-2,f=-0.32) USER MOD Single : B 25 MET CE :methyl 161:sc= -0.343 (180deg=-0.882) USER MOD Single : B 34 MET CE :methyl 166:sc= -5.04! (180deg=-5.61!) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0 USER MOD Single : B 38 ASN : amide:sc= -3.05 K(o=-3,f=-8.5!) USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 43 ASN : amide:sc= -1.53! C(o=-1.5!,f=-1.4!) USER MOD Single : B 45 MET CE :methyl -124:sc= -3.98! (180deg=-8.83!) USER MOD Single : B 46 THR OG1 : rot -6:sc= 0.681 USER MOD Single : B 47 SER OG : rot 50:sc= 1.13 USER MOD Single : B 48 SER OG : rot 61:sc= 1.25 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 50 LYS NZ :NH3+ -160:sc= 0.848 (180deg=0.144) USER MOD Single : B 55 SER OG : rot 180:sc= 0.0709 USER MOD Single : B 57 ASN : amide:sc= -0.461 K(o=-0.46,f=-2.6!) USER MOD Single : B 58 MET CE :methyl -146:sc= -0.509 (180deg=-2.3!) USER MOD Single : B 59 ASN : amide:sc= -3.6 K(o=-3.6,f=-4.7!) USER MOD Single : B 64 THR OG1 : rot -23:sc= -0.434 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 ASN : amide:sc= -2.33! C(o=-2.3!,f=-4.8!) USER MOD Single : B 80 CYS SG : rot 141:sc= -9.62! USER MOD Single : B 86 SER OG : rot 107:sc= 0.147 USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 95 HIS : no HD1:sc= -4.52! C(o=-4.5!,f=-4.6!) USER MOD Single : B 96 THR OG1 : rot 24:sc= 0.49 USER MOD Single : B 101 MET CE :methyl -165:sc= -2.18 (180deg=-3.59!) USER MOD Single : B 110 CYS SG : rot 150:sc= -3.26! USER MOD Single : B 115 CYS SG : rot 180:sc=-0.00371 USER MOD Single : B 118 ASN : amide:sc= 0.32 K(o=0.32,f=-4.8!) USER MOD Single : B 121 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 123 SER OG : rot -94:sc= 0.963 USER MOD ----------------------------------------------------------------- ATOM 148 N LEU A 11 11.430 -14.532 2.326 1.00 0.00 N ATOM 149 CA LEU A 11 10.016 -14.537 2.663 1.00 0.00 C ATOM 150 C LEU A 11 9.858 -14.448 4.182 1.00 0.00 C ATOM 151 O LEU A 11 9.034 -13.682 4.680 1.00 0.00 O ATOM 152 CB LEU A 11 9.322 -15.752 2.043 1.00 0.00 C ATOM 153 CG LEU A 11 9.479 -15.913 0.529 1.00 0.00 C ATOM 154 CD1 LEU A 11 9.124 -17.335 0.090 1.00 0.00 C ATOM 155 CD2 LEU A 11 8.661 -14.860 -0.221 1.00 0.00 C ATOM 0 HA LEU A 11 9.520 -13.664 2.239 1.00 0.00 H new ATOM 0 HB2 LEU A 11 9.706 -16.651 2.526 1.00 0.00 H new ATOM 0 HB3 LEU A 11 8.258 -15.695 2.274 1.00 0.00 H new ATOM 0 HG LEU A 11 10.526 -15.749 0.274 1.00 0.00 H new ATOM 0 HD11 LEU A 11 9.244 -17.423 -0.990 1.00 0.00 H new ATOM 0 HD12 LEU A 11 9.785 -18.045 0.587 1.00 0.00 H new ATOM 0 HD13 LEU A 11 8.090 -17.551 0.359 1.00 0.00 H new ATOM 0 HD21 LEU A 11 8.790 -14.996 -1.295 1.00 0.00 H new ATOM 0 HD22 LEU A 11 7.607 -14.968 0.035 1.00 0.00 H new ATOM 0 HD23 LEU A 11 9.003 -13.864 0.062 1.00 0.00 H new ATOM 167 N SER A 12 10.660 -15.242 4.876 1.00 0.00 N ATOM 168 CA SER A 12 10.619 -15.262 6.329 1.00 0.00 C ATOM 169 C SER A 12 10.591 -13.831 6.871 1.00 0.00 C ATOM 170 O SER A 12 9.696 -13.471 7.634 1.00 0.00 O ATOM 171 CB SER A 12 11.816 -16.024 6.903 1.00 0.00 C ATOM 172 OG SER A 12 11.636 -17.435 6.826 1.00 0.00 O ATOM 0 H SER A 12 11.342 -15.876 4.460 1.00 0.00 H new ATOM 0 HA SER A 12 9.711 -15.779 6.639 1.00 0.00 H new ATOM 0 HB2 SER A 12 12.719 -15.743 6.360 1.00 0.00 H new ATOM 0 HB3 SER A 12 11.966 -15.734 7.943 1.00 0.00 H new ATOM 0 HG SER A 12 12.421 -17.886 7.200 1.00 0.00 H new ATOM 178 N LYS A 13 11.582 -13.055 6.456 1.00 0.00 N ATOM 179 CA LYS A 13 11.681 -11.672 6.891 1.00 0.00 C ATOM 180 C LYS A 13 10.290 -11.036 6.876 1.00 0.00 C ATOM 181 O LYS A 13 9.932 -10.298 7.793 1.00 0.00 O ATOM 182 CB LYS A 13 12.711 -10.919 6.047 1.00 0.00 C ATOM 183 CG LYS A 13 13.106 -9.599 6.714 1.00 0.00 C ATOM 184 CD LYS A 13 13.017 -8.436 5.723 1.00 0.00 C ATOM 185 CE LYS A 13 11.839 -7.519 6.058 1.00 0.00 C ATOM 186 NZ LYS A 13 12.154 -6.682 7.237 1.00 0.00 N ATOM 0 H LYS A 13 12.323 -13.358 5.824 1.00 0.00 H new ATOM 0 HA LYS A 13 12.044 -11.620 7.918 1.00 0.00 H new ATOM 0 HB2 LYS A 13 13.596 -11.540 5.908 1.00 0.00 H new ATOM 0 HB3 LYS A 13 12.301 -10.722 5.057 1.00 0.00 H new ATOM 0 HG2 LYS A 13 12.452 -9.407 7.565 1.00 0.00 H new ATOM 0 HG3 LYS A 13 14.122 -9.673 7.103 1.00 0.00 H new ATOM 0 HD2 LYS A 13 13.945 -7.864 5.744 1.00 0.00 H new ATOM 0 HD3 LYS A 13 12.904 -8.824 4.711 1.00 0.00 H new ATOM 0 HE2 LYS A 13 11.611 -6.883 5.203 1.00 0.00 H new ATOM 0 HE3 LYS A 13 10.950 -8.117 6.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 11.344 -6.065 7.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 12.349 -7.294 8.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 12.990 -6.098 7.034 1.00 0.00 H new ATOM 200 N MET A 14 9.544 -11.345 5.826 1.00 0.00 N ATOM 201 CA MET A 14 8.200 -10.813 5.680 1.00 0.00 C ATOM 202 C MET A 14 7.196 -11.627 6.498 1.00 0.00 C ATOM 203 O MET A 14 6.345 -11.063 7.185 1.00 0.00 O ATOM 204 CB MET A 14 7.797 -10.840 4.205 1.00 0.00 C ATOM 205 CG MET A 14 8.587 -9.803 3.402 1.00 0.00 C ATOM 206 SD MET A 14 7.566 -9.132 2.101 1.00 0.00 S ATOM 207 CE MET A 14 8.384 -7.567 1.842 1.00 0.00 C ATOM 0 H MET A 14 9.845 -11.957 5.068 1.00 0.00 H new ATOM 0 HA MET A 14 8.194 -9.787 6.049 1.00 0.00 H new ATOM 0 HB2 MET A 14 7.973 -11.834 3.794 1.00 0.00 H new ATOM 0 HB3 MET A 14 6.729 -10.641 4.112 1.00 0.00 H new ATOM 0 HG2 MET A 14 8.925 -9.002 4.060 1.00 0.00 H new ATOM 0 HG3 MET A 14 9.478 -10.263 2.975 1.00 0.00 H new ATOM 0 HE1 MET A 14 8.422 -7.349 0.775 1.00 0.00 H new ATOM 0 HE2 MET A 14 7.832 -6.779 2.354 1.00 0.00 H new ATOM 0 HE3 MET A 14 9.398 -7.616 2.239 1.00 0.00 H new ATOM 217 N GLN A 15 7.327 -12.942 6.398 1.00 0.00 N ATOM 218 CA GLN A 15 6.442 -13.840 7.120 1.00 0.00 C ATOM 219 C GLN A 15 6.176 -13.304 8.529 1.00 0.00 C ATOM 220 O GLN A 15 5.024 -13.150 8.931 1.00 0.00 O ATOM 221 CB GLN A 15 7.020 -15.256 7.172 1.00 0.00 C ATOM 222 CG GLN A 15 7.003 -15.905 5.787 1.00 0.00 C ATOM 223 CD GLN A 15 6.450 -17.330 5.856 1.00 0.00 C ATOM 224 OE1 GLN A 15 7.177 -18.309 5.807 1.00 0.00 O ATOM 225 NE2 GLN A 15 5.126 -17.392 5.972 1.00 0.00 N ATOM 0 H GLN A 15 8.033 -13.407 5.827 1.00 0.00 H new ATOM 0 HA GLN A 15 5.493 -13.890 6.586 1.00 0.00 H new ATOM 0 HB2 GLN A 15 8.042 -15.222 7.549 1.00 0.00 H new ATOM 0 HB3 GLN A 15 6.443 -15.863 7.869 1.00 0.00 H new ATOM 0 HG2 GLN A 15 6.394 -15.307 5.109 1.00 0.00 H new ATOM 0 HG3 GLN A 15 8.013 -15.922 5.377 1.00 0.00 H new ATOM 0 HE21 GLN A 15 4.576 -16.533 6.007 1.00 0.00 H new ATOM 0 HE22 GLN A 15 4.661 -18.298 6.026 1.00 0.00 H new ATOM 234 N GLN A 16 7.262 -13.035 9.239 1.00 0.00 N ATOM 235 CA GLN A 16 7.161 -12.520 10.594 1.00 0.00 C ATOM 236 C GLN A 16 7.651 -11.072 10.650 1.00 0.00 C ATOM 237 O GLN A 16 8.331 -10.608 9.736 1.00 0.00 O ATOM 238 CB GLN A 16 7.939 -13.400 11.575 1.00 0.00 C ATOM 239 CG GLN A 16 9.357 -13.667 11.065 1.00 0.00 C ATOM 240 CD GLN A 16 10.136 -12.360 10.903 1.00 0.00 C ATOM 241 OE1 GLN A 16 10.488 -11.694 11.862 1.00 0.00 O ATOM 242 NE2 GLN A 16 10.385 -12.032 9.638 1.00 0.00 N ATOM 0 H GLN A 16 8.216 -13.164 8.901 1.00 0.00 H new ATOM 0 HA GLN A 16 6.113 -12.540 10.891 1.00 0.00 H new ATOM 0 HB2 GLN A 16 7.985 -12.913 12.549 1.00 0.00 H new ATOM 0 HB3 GLN A 16 7.415 -14.345 11.716 1.00 0.00 H new ATOM 0 HG2 GLN A 16 9.880 -14.323 11.761 1.00 0.00 H new ATOM 0 HG3 GLN A 16 9.311 -14.188 10.109 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.061 -12.635 8.882 1.00 0.00 H new ATOM 0 HE22 GLN A 16 10.900 -11.178 9.424 1.00 0.00 H new ATOM 251 N ASN A 17 7.285 -10.398 11.730 1.00 0.00 N ATOM 252 CA ASN A 17 7.679 -9.012 11.917 1.00 0.00 C ATOM 253 C ASN A 17 6.931 -8.134 10.911 1.00 0.00 C ATOM 254 O ASN A 17 6.160 -7.258 11.300 1.00 0.00 O ATOM 255 CB ASN A 17 9.179 -8.829 11.679 1.00 0.00 C ATOM 256 CG ASN A 17 9.891 -8.409 12.967 1.00 0.00 C ATOM 257 OD1 ASN A 17 9.437 -7.553 13.707 1.00 0.00 O ATOM 258 ND2 ASN A 17 11.029 -9.059 13.193 1.00 0.00 N ATOM 0 H ASN A 17 6.720 -10.786 12.485 1.00 0.00 H new ATOM 0 HA ASN A 17 7.439 -8.728 12.942 1.00 0.00 H new ATOM 0 HB2 ASN A 17 9.608 -9.760 11.309 1.00 0.00 H new ATOM 0 HB3 ASN A 17 9.339 -8.075 10.908 1.00 0.00 H new ATOM 0 HD21 ASN A 17 11.578 -8.851 14.027 1.00 0.00 H new ATOM 0 HD22 ASN A 17 11.353 -9.765 12.532 1.00 0.00 H new ATOM 265 N GLY A 18 7.184 -8.400 9.638 1.00 0.00 N ATOM 266 CA GLY A 18 6.544 -7.646 8.574 1.00 0.00 C ATOM 267 C GLY A 18 7.430 -6.486 8.116 1.00 0.00 C ATOM 268 O GLY A 18 8.379 -6.114 8.805 1.00 0.00 O ATOM 0 H GLY A 18 7.824 -9.128 9.319 1.00 0.00 H new ATOM 0 HA2 GLY A 18 6.336 -8.305 7.731 1.00 0.00 H new ATOM 0 HA3 GLY A 18 5.585 -7.261 8.922 1.00 0.00 H new ATOM 272 N TYR A 19 7.088 -5.945 6.955 1.00 0.00 N ATOM 273 CA TYR A 19 7.841 -4.835 6.397 1.00 0.00 C ATOM 274 C TYR A 19 7.068 -3.522 6.540 1.00 0.00 C ATOM 275 O TYR A 19 5.872 -3.467 6.256 1.00 0.00 O ATOM 276 CB TYR A 19 8.016 -5.150 4.910 1.00 0.00 C ATOM 277 CG TYR A 19 8.868 -4.128 4.153 1.00 0.00 C ATOM 278 CD1 TYR A 19 10.244 -4.218 4.187 1.00 0.00 C ATOM 279 CD2 TYR A 19 8.259 -3.117 3.438 1.00 0.00 C ATOM 280 CE1 TYR A 19 11.046 -3.256 3.475 1.00 0.00 C ATOM 281 CE2 TYR A 19 9.060 -2.156 2.726 1.00 0.00 C ATOM 282 CZ TYR A 19 10.414 -2.273 2.779 1.00 0.00 C ATOM 283 OH TYR A 19 11.171 -1.365 2.107 1.00 0.00 O ATOM 0 H TYR A 19 6.300 -6.255 6.386 1.00 0.00 H new ATOM 0 HA TYR A 19 8.793 -4.718 6.915 1.00 0.00 H new ATOM 0 HB2 TYR A 19 8.473 -6.134 4.809 1.00 0.00 H new ATOM 0 HB3 TYR A 19 7.033 -5.205 4.443 1.00 0.00 H new ATOM 0 HD1 TYR A 19 10.720 -5.009 4.747 1.00 0.00 H new ATOM 0 HD2 TYR A 19 7.182 -3.047 3.413 1.00 0.00 H new ATOM 0 HE1 TYR A 19 12.124 -3.314 3.493 1.00 0.00 H new ATOM 0 HE2 TYR A 19 8.596 -1.360 2.162 1.00 0.00 H new ATOM 0 HH TYR A 19 12.010 -1.785 1.823 1.00 0.00 H new ATOM 293 N GLU A 20 7.783 -2.497 6.980 1.00 0.00 N ATOM 294 CA GLU A 20 7.179 -1.188 7.164 1.00 0.00 C ATOM 295 C GLU A 20 7.790 -0.180 6.189 1.00 0.00 C ATOM 296 O GLU A 20 9.009 -0.119 6.037 1.00 0.00 O ATOM 297 CB GLU A 20 7.330 -0.713 8.611 1.00 0.00 C ATOM 298 CG GLU A 20 5.963 -0.511 9.267 1.00 0.00 C ATOM 299 CD GLU A 20 5.936 0.779 10.091 1.00 0.00 C ATOM 300 OE1 GLU A 20 5.645 1.833 9.486 1.00 0.00 O ATOM 301 OE2 GLU A 20 6.207 0.681 11.307 1.00 0.00 O ATOM 0 H GLU A 20 8.774 -2.546 7.214 1.00 0.00 H new ATOM 0 HA GLU A 20 6.113 -1.268 6.952 1.00 0.00 H new ATOM 0 HB2 GLU A 20 7.906 -1.444 9.179 1.00 0.00 H new ATOM 0 HB3 GLU A 20 7.890 0.222 8.634 1.00 0.00 H new ATOM 0 HG2 GLU A 20 5.189 -0.473 8.500 1.00 0.00 H new ATOM 0 HG3 GLU A 20 5.734 -1.362 9.909 1.00 0.00 H new ATOM 691 N VAL B 15 7.456 -2.800 -17.466 1.00 0.00 N ATOM 692 CA VAL B 15 6.959 -3.111 -16.137 1.00 0.00 C ATOM 693 C VAL B 15 7.193 -4.595 -15.844 1.00 0.00 C ATOM 694 O VAL B 15 7.263 -5.409 -16.763 1.00 0.00 O ATOM 695 CB VAL B 15 5.488 -2.704 -16.020 1.00 0.00 C ATOM 696 CG1 VAL B 15 4.850 -3.309 -14.768 1.00 0.00 C ATOM 697 CG2 VAL B 15 5.339 -1.182 -16.030 1.00 0.00 C ATOM 0 HA VAL B 15 7.502 -2.541 -15.383 1.00 0.00 H new ATOM 0 HB VAL B 15 4.961 -3.098 -16.889 1.00 0.00 H new ATOM 0 HG11 VAL B 15 3.805 -3.004 -14.709 1.00 0.00 H new ATOM 0 HG12 VAL B 15 4.909 -4.396 -14.819 1.00 0.00 H new ATOM 0 HG13 VAL B 15 5.381 -2.958 -13.883 1.00 0.00 H new ATOM 0 HG21 VAL B 15 4.285 -0.919 -15.946 1.00 0.00 H new ATOM 0 HG22 VAL B 15 5.887 -0.757 -15.189 1.00 0.00 H new ATOM 0 HG23 VAL B 15 5.739 -0.783 -16.962 1.00 0.00 H new ATOM 707 N GLN B 16 7.308 -4.900 -14.560 1.00 0.00 N ATOM 708 CA GLN B 16 7.533 -6.271 -14.134 1.00 0.00 C ATOM 709 C GLN B 16 6.272 -7.109 -14.355 1.00 0.00 C ATOM 710 O GLN B 16 6.310 -8.124 -15.050 1.00 0.00 O ATOM 711 CB GLN B 16 7.979 -6.325 -12.672 1.00 0.00 C ATOM 712 CG GLN B 16 9.210 -5.447 -12.441 1.00 0.00 C ATOM 713 CD GLN B 16 10.426 -6.296 -12.064 1.00 0.00 C ATOM 714 OE1 GLN B 16 11.515 -6.135 -12.592 1.00 0.00 O ATOM 715 NE2 GLN B 16 10.181 -7.205 -11.125 1.00 0.00 N ATOM 0 H GLN B 16 7.250 -4.221 -13.801 1.00 0.00 H new ATOM 0 HA GLN B 16 8.336 -6.692 -14.739 1.00 0.00 H new ATOM 0 HB2 GLN B 16 7.165 -5.993 -12.027 1.00 0.00 H new ATOM 0 HB3 GLN B 16 8.205 -7.355 -12.395 1.00 0.00 H new ATOM 0 HG2 GLN B 16 9.427 -4.874 -13.343 1.00 0.00 H new ATOM 0 HG3 GLN B 16 9.004 -4.728 -11.648 1.00 0.00 H new ATOM 0 HE21 GLN B 16 9.246 -7.286 -10.725 1.00 0.00 H new ATOM 0 HE22 GLN B 16 10.928 -7.821 -10.804 1.00 0.00 H new ATOM 724 N LYS B 17 5.185 -6.654 -13.750 1.00 0.00 N ATOM 725 CA LYS B 17 3.915 -7.350 -13.872 1.00 0.00 C ATOM 726 C LYS B 17 4.036 -8.739 -13.241 1.00 0.00 C ATOM 727 O LYS B 17 5.114 -9.332 -13.241 1.00 0.00 O ATOM 728 CB LYS B 17 3.455 -7.375 -15.331 1.00 0.00 C ATOM 729 CG LYS B 17 2.525 -6.197 -15.633 1.00 0.00 C ATOM 730 CD LYS B 17 2.412 -5.961 -17.140 1.00 0.00 C ATOM 731 CE LYS B 17 1.424 -4.834 -17.446 1.00 0.00 C ATOM 732 NZ LYS B 17 1.525 -4.426 -18.865 1.00 0.00 N ATOM 0 H LYS B 17 5.157 -5.813 -13.174 1.00 0.00 H new ATOM 0 HA LYS B 17 3.136 -6.818 -13.326 1.00 0.00 H new ATOM 0 HB2 LYS B 17 4.322 -7.337 -15.990 1.00 0.00 H new ATOM 0 HB3 LYS B 17 2.939 -8.313 -15.537 1.00 0.00 H new ATOM 0 HG2 LYS B 17 1.537 -6.393 -15.217 1.00 0.00 H new ATOM 0 HG3 LYS B 17 2.903 -5.297 -15.148 1.00 0.00 H new ATOM 0 HD2 LYS B 17 3.392 -5.711 -17.547 1.00 0.00 H new ATOM 0 HD3 LYS B 17 2.087 -6.878 -17.632 1.00 0.00 H new ATOM 0 HE2 LYS B 17 0.408 -5.164 -17.228 1.00 0.00 H new ATOM 0 HE3 LYS B 17 1.627 -3.979 -16.801 1.00 0.00 H new ATOM 0 HZ1 LYS B 17 0.847 -3.660 -19.055 1.00 0.00 H new ATOM 0 HZ2 LYS B 17 2.490 -4.092 -19.062 1.00 0.00 H new ATOM 0 HZ3 LYS B 17 1.309 -5.239 -19.476 1.00 0.00 H new ATOM 746 N PHE B 18 2.916 -9.217 -12.720 1.00 0.00 N ATOM 747 CA PHE B 18 2.883 -10.525 -12.088 1.00 0.00 C ATOM 748 C PHE B 18 1.463 -11.092 -12.075 1.00 0.00 C ATOM 749 O PHE B 18 0.692 -10.824 -11.155 1.00 0.00 O ATOM 750 CB PHE B 18 3.358 -10.336 -10.646 1.00 0.00 C ATOM 751 CG PHE B 18 4.857 -10.058 -10.515 1.00 0.00 C ATOM 752 CD1 PHE B 18 5.751 -11.073 -10.651 1.00 0.00 C ATOM 753 CD2 PHE B 18 5.294 -8.795 -10.263 1.00 0.00 C ATOM 754 CE1 PHE B 18 7.142 -10.814 -10.529 1.00 0.00 C ATOM 755 CE2 PHE B 18 6.685 -8.536 -10.141 1.00 0.00 C ATOM 756 CZ PHE B 18 7.580 -9.552 -10.277 1.00 0.00 C ATOM 0 H PHE B 18 2.024 -8.722 -12.722 1.00 0.00 H new ATOM 0 HA PHE B 18 3.517 -11.220 -12.638 1.00 0.00 H new ATOM 0 HB2 PHE B 18 2.805 -9.510 -10.198 1.00 0.00 H new ATOM 0 HB3 PHE B 18 3.114 -11.231 -10.074 1.00 0.00 H new ATOM 0 HD1 PHE B 18 5.404 -12.076 -10.852 1.00 0.00 H new ATOM 0 HD2 PHE B 18 4.583 -7.989 -10.156 1.00 0.00 H new ATOM 0 HE1 PHE B 18 7.852 -11.620 -10.637 1.00 0.00 H new ATOM 0 HE2 PHE B 18 7.032 -7.533 -9.940 1.00 0.00 H new ATOM 0 HZ PHE B 18 8.638 -9.356 -10.185 1.00 0.00 H new ATOM 766 N ARG B 19 1.159 -11.866 -13.107 1.00 0.00 N ATOM 767 CA ARG B 19 -0.155 -12.473 -13.226 1.00 0.00 C ATOM 768 C ARG B 19 -0.422 -13.399 -12.037 1.00 0.00 C ATOM 769 O ARG B 19 0.011 -14.551 -12.034 1.00 0.00 O ATOM 770 CB ARG B 19 -0.277 -13.273 -14.524 1.00 0.00 C ATOM 771 CG ARG B 19 -1.744 -13.542 -14.867 1.00 0.00 C ATOM 772 CD ARG B 19 -2.150 -14.961 -14.463 1.00 0.00 C ATOM 773 NE ARG B 19 -2.375 -15.787 -15.670 1.00 0.00 N ATOM 774 CZ ARG B 19 -2.554 -17.115 -15.650 1.00 0.00 C ATOM 775 NH1 ARG B 19 -2.535 -17.775 -14.484 1.00 0.00 N ATOM 776 NH2 ARG B 19 -2.752 -17.782 -16.795 1.00 0.00 N ATOM 0 H ARG B 19 1.801 -12.086 -13.868 1.00 0.00 H new ATOM 0 HA ARG B 19 -0.891 -11.669 -13.238 1.00 0.00 H new ATOM 0 HB2 ARG B 19 0.196 -12.725 -15.339 1.00 0.00 H new ATOM 0 HB3 ARG B 19 0.256 -14.219 -14.424 1.00 0.00 H new ATOM 0 HG2 ARG B 19 -2.379 -12.819 -14.356 1.00 0.00 H new ATOM 0 HG3 ARG B 19 -1.902 -13.405 -15.937 1.00 0.00 H new ATOM 0 HD2 ARG B 19 -1.371 -15.409 -13.846 1.00 0.00 H new ATOM 0 HD3 ARG B 19 -3.057 -14.930 -13.859 1.00 0.00 H new ATOM 0 HE ARG B 19 -2.395 -15.316 -16.574 1.00 0.00 H new ATOM 0 HH11 ARG B 19 -2.384 -17.267 -13.613 1.00 0.00 H new ATOM 0 HH12 ARG B 19 -2.671 -18.786 -14.468 1.00 0.00 H new ATOM 0 HH21 ARG B 19 -2.767 -17.279 -17.682 1.00 0.00 H new ATOM 0 HH22 ARG B 19 -2.888 -18.793 -16.779 1.00 0.00 H new ATOM 790 N VAL B 20 -1.132 -12.861 -11.057 1.00 0.00 N ATOM 791 CA VAL B 20 -1.461 -13.625 -9.865 1.00 0.00 C ATOM 792 C VAL B 20 -2.980 -13.649 -9.683 1.00 0.00 C ATOM 793 O VAL B 20 -3.725 -13.366 -10.619 1.00 0.00 O ATOM 794 CB VAL B 20 -0.722 -13.050 -8.655 1.00 0.00 C ATOM 795 CG1 VAL B 20 0.706 -12.646 -9.025 1.00 0.00 C ATOM 796 CG2 VAL B 20 -1.488 -11.870 -8.055 1.00 0.00 C ATOM 0 H VAL B 20 -1.489 -11.905 -11.063 1.00 0.00 H new ATOM 0 HA VAL B 20 -1.130 -14.658 -9.970 1.00 0.00 H new ATOM 0 HB VAL B 20 -0.663 -13.831 -7.897 1.00 0.00 H new ATOM 0 HG11 VAL B 20 1.209 -12.241 -8.147 1.00 0.00 H new ATOM 0 HG12 VAL B 20 1.250 -13.520 -9.383 1.00 0.00 H new ATOM 0 HG13 VAL B 20 0.678 -11.889 -9.809 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -0.941 -11.480 -7.197 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -1.594 -11.086 -8.805 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -2.476 -12.202 -7.736 1.00 0.00 H new ATOM 806 N GLN B 21 -3.393 -13.988 -8.471 1.00 0.00 N ATOM 807 CA GLN B 21 -4.810 -14.052 -8.154 1.00 0.00 C ATOM 808 C GLN B 21 -5.180 -12.954 -7.155 1.00 0.00 C ATOM 809 O GLN B 21 -4.304 -12.281 -6.614 1.00 0.00 O ATOM 810 CB GLN B 21 -5.189 -15.433 -7.616 1.00 0.00 C ATOM 811 CG GLN B 21 -6.104 -16.171 -8.597 1.00 0.00 C ATOM 812 CD GLN B 21 -6.239 -17.647 -8.216 1.00 0.00 C ATOM 813 OE1 GLN B 21 -6.220 -18.535 -9.052 1.00 0.00 O ATOM 814 NE2 GLN B 21 -6.377 -17.858 -6.910 1.00 0.00 N ATOM 0 H GLN B 21 -2.772 -14.221 -7.697 1.00 0.00 H new ATOM 0 HA GLN B 21 -5.376 -13.888 -9.071 1.00 0.00 H new ATOM 0 HB2 GLN B 21 -4.287 -16.020 -7.442 1.00 0.00 H new ATOM 0 HB3 GLN B 21 -5.691 -15.328 -6.654 1.00 0.00 H new ATOM 0 HG2 GLN B 21 -7.088 -15.702 -8.605 1.00 0.00 H new ATOM 0 HG3 GLN B 21 -5.703 -16.088 -9.607 1.00 0.00 H new ATOM 0 HE21 GLN B 21 -6.385 -17.069 -6.264 1.00 0.00 H new ATOM 0 HE22 GLN B 21 -6.475 -18.809 -6.555 1.00 0.00 H new ATOM 823 N TYR B 22 -6.479 -12.808 -6.940 1.00 0.00 N ATOM 824 CA TYR B 22 -6.976 -11.803 -6.015 1.00 0.00 C ATOM 825 C TYR B 22 -7.861 -12.437 -4.940 1.00 0.00 C ATOM 826 O TYR B 22 -8.942 -12.942 -5.238 1.00 0.00 O ATOM 827 CB TYR B 22 -7.822 -10.842 -6.852 1.00 0.00 C ATOM 828 CG TYR B 22 -8.126 -9.513 -6.156 1.00 0.00 C ATOM 829 CD1 TYR B 22 -7.615 -9.260 -4.900 1.00 0.00 C ATOM 830 CD2 TYR B 22 -8.912 -8.569 -6.785 1.00 0.00 C ATOM 831 CE1 TYR B 22 -7.901 -8.009 -4.245 1.00 0.00 C ATOM 832 CE2 TYR B 22 -9.198 -7.319 -6.130 1.00 0.00 C ATOM 833 CZ TYR B 22 -8.679 -7.101 -4.892 1.00 0.00 C ATOM 834 OH TYR B 22 -8.949 -5.920 -4.274 1.00 0.00 O ATOM 0 H TYR B 22 -7.203 -13.369 -7.390 1.00 0.00 H new ATOM 0 HA TYR B 22 -6.149 -11.303 -5.511 1.00 0.00 H new ATOM 0 HB2 TYR B 22 -7.303 -10.639 -7.789 1.00 0.00 H new ATOM 0 HB3 TYR B 22 -8.763 -11.330 -7.107 1.00 0.00 H new ATOM 0 HD1 TYR B 22 -7.001 -9.999 -4.408 1.00 0.00 H new ATOM 0 HD2 TYR B 22 -9.312 -8.768 -7.768 1.00 0.00 H new ATOM 0 HE1 TYR B 22 -7.506 -7.797 -3.262 1.00 0.00 H new ATOM 0 HE2 TYR B 22 -9.811 -6.571 -6.611 1.00 0.00 H new ATOM 0 HH TYR B 22 -8.233 -5.713 -3.637 1.00 0.00 H new ATOM 844 N LEU B 23 -7.368 -12.390 -3.711 1.00 0.00 N ATOM 845 CA LEU B 23 -8.100 -12.954 -2.589 1.00 0.00 C ATOM 846 C LEU B 23 -9.273 -12.036 -2.238 1.00 0.00 C ATOM 847 O LEU B 23 -10.336 -12.508 -1.838 1.00 0.00 O ATOM 848 CB LEU B 23 -7.158 -13.223 -1.415 1.00 0.00 C ATOM 849 CG LEU B 23 -6.736 -14.680 -1.213 1.00 0.00 C ATOM 850 CD1 LEU B 23 -5.334 -14.928 -1.774 1.00 0.00 C ATOM 851 CD2 LEU B 23 -6.844 -15.083 0.259 1.00 0.00 C ATOM 0 H LEU B 23 -6.471 -11.970 -3.467 1.00 0.00 H new ATOM 0 HA LEU B 23 -8.521 -13.923 -2.858 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -6.260 -12.621 -1.551 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -7.640 -12.875 -0.501 1.00 0.00 H new ATOM 0 HG LEU B 23 -7.423 -15.315 -1.772 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -5.059 -15.971 -1.617 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -5.325 -14.707 -2.841 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -4.619 -14.283 -1.263 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -6.538 -16.123 0.375 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -6.195 -14.445 0.859 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -7.875 -14.969 0.593 1.00 0.00 H new ATOM 863 N GLY B 24 -9.040 -10.743 -2.402 1.00 0.00 N ATOM 864 CA GLY B 24 -10.064 -9.755 -2.107 1.00 0.00 C ATOM 865 C GLY B 24 -9.531 -8.678 -1.160 1.00 0.00 C ATOM 866 O GLY B 24 -8.360 -8.702 -0.784 1.00 0.00 O ATOM 0 H GLY B 24 -8.157 -10.356 -2.735 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -10.406 -9.293 -3.033 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -10.928 -10.245 -1.657 1.00 0.00 H new ATOM 870 N MET B 25 -10.417 -7.760 -0.801 1.00 0.00 N ATOM 871 CA MET B 25 -10.050 -6.677 0.095 1.00 0.00 C ATOM 872 C MET B 25 -10.556 -6.944 1.514 1.00 0.00 C ATOM 873 O MET B 25 -11.741 -7.209 1.714 1.00 0.00 O ATOM 874 CB MET B 25 -10.643 -5.364 -0.420 1.00 0.00 C ATOM 875 CG MET B 25 -10.084 -4.168 0.353 1.00 0.00 C ATOM 876 SD MET B 25 -11.404 -3.044 0.778 1.00 0.00 S ATOM 877 CE MET B 25 -12.306 -4.052 1.943 1.00 0.00 C ATOM 0 H MET B 25 -11.388 -7.744 -1.114 1.00 0.00 H new ATOM 0 HA MET B 25 -8.963 -6.608 0.124 1.00 0.00 H new ATOM 0 HB2 MET B 25 -10.420 -5.252 -1.481 1.00 0.00 H new ATOM 0 HB3 MET B 25 -11.728 -5.389 -0.323 1.00 0.00 H new ATOM 0 HG2 MET B 25 -9.583 -4.512 1.258 1.00 0.00 H new ATOM 0 HG3 MET B 25 -9.336 -3.652 -0.250 1.00 0.00 H new ATOM 0 HE1 MET B 25 -12.948 -3.417 2.554 1.00 0.00 H new ATOM 0 HE2 MET B 25 -12.919 -4.773 1.402 1.00 0.00 H new ATOM 0 HE3 MET B 25 -11.603 -4.582 2.586 1.00 0.00 H new ATOM 887 N LEU B 26 -9.634 -6.864 2.462 1.00 0.00 N ATOM 888 CA LEU B 26 -9.973 -7.094 3.856 1.00 0.00 C ATOM 889 C LEU B 26 -9.744 -5.807 4.651 1.00 0.00 C ATOM 890 O LEU B 26 -8.712 -5.155 4.500 1.00 0.00 O ATOM 891 CB LEU B 26 -9.204 -8.299 4.402 1.00 0.00 C ATOM 892 CG LEU B 26 -10.045 -9.374 5.093 1.00 0.00 C ATOM 893 CD1 LEU B 26 -10.310 -9.008 6.555 1.00 0.00 C ATOM 894 CD2 LEU B 26 -11.341 -9.635 4.324 1.00 0.00 C ATOM 0 H LEU B 26 -8.653 -6.643 2.292 1.00 0.00 H new ATOM 0 HA LEU B 26 -11.029 -7.347 3.955 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -8.663 -8.763 3.578 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -8.458 -7.938 5.110 1.00 0.00 H new ATOM 0 HG LEU B 26 -9.477 -10.304 5.092 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -10.910 -9.789 7.023 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -9.362 -8.913 7.084 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -10.848 -8.061 6.601 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -11.920 -10.403 4.837 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -11.924 -8.716 4.271 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -11.104 -9.972 3.315 1.00 0.00 H new ATOM 906 N PRO B 27 -10.750 -5.471 5.502 1.00 0.00 N ATOM 907 CA PRO B 27 -10.669 -4.273 6.320 1.00 0.00 C ATOM 908 C PRO B 27 -9.701 -4.472 7.489 1.00 0.00 C ATOM 909 O PRO B 27 -9.517 -5.592 7.963 1.00 0.00 O ATOM 910 CB PRO B 27 -12.096 -4.006 6.770 1.00 0.00 C ATOM 911 CG PRO B 27 -12.846 -5.314 6.576 1.00 0.00 C ATOM 912 CD PRO B 27 -11.987 -6.218 5.706 1.00 0.00 C ATOM 0 HA PRO B 27 -10.271 -3.417 5.774 1.00 0.00 H new ATOM 0 HB2 PRO B 27 -12.124 -3.691 7.813 1.00 0.00 H new ATOM 0 HB3 PRO B 27 -12.547 -3.206 6.183 1.00 0.00 H new ATOM 0 HG2 PRO B 27 -13.045 -5.786 7.538 1.00 0.00 H new ATOM 0 HG3 PRO B 27 -13.812 -5.134 6.103 1.00 0.00 H new ATOM 0 HD2 PRO B 27 -11.796 -7.173 6.195 1.00 0.00 H new ATOM 0 HD3 PRO B 27 -12.478 -6.438 4.758 1.00 0.00 H new ATOM 920 N VAL B 28 -9.107 -3.368 7.918 1.00 0.00 N ATOM 921 CA VAL B 28 -8.163 -3.407 9.022 1.00 0.00 C ATOM 922 C VAL B 28 -8.386 -2.190 9.922 1.00 0.00 C ATOM 923 O VAL B 28 -9.314 -1.413 9.702 1.00 0.00 O ATOM 924 CB VAL B 28 -6.734 -3.499 8.484 1.00 0.00 C ATOM 925 CG1 VAL B 28 -6.561 -4.731 7.593 1.00 0.00 C ATOM 926 CG2 VAL B 28 -6.346 -2.222 7.736 1.00 0.00 C ATOM 0 H VAL B 28 -9.261 -2.441 7.521 1.00 0.00 H new ATOM 0 HA VAL B 28 -8.325 -4.296 9.632 1.00 0.00 H new ATOM 0 HB VAL B 28 -6.062 -3.605 9.336 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -5.536 -4.772 7.224 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -6.775 -5.630 8.170 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -7.248 -4.669 6.749 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -5.326 -2.314 7.364 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -7.026 -2.071 6.897 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -6.410 -1.370 8.413 1.00 0.00 H new ATOM 936 N ASP B 29 -7.520 -2.062 10.916 1.00 0.00 N ATOM 937 CA ASP B 29 -7.610 -0.953 11.850 1.00 0.00 C ATOM 938 C ASP B 29 -6.283 -0.191 11.861 1.00 0.00 C ATOM 939 O ASP B 29 -6.264 1.030 11.719 1.00 0.00 O ATOM 940 CB ASP B 29 -7.882 -1.450 13.271 1.00 0.00 C ATOM 941 CG ASP B 29 -9.350 -1.747 13.583 1.00 0.00 C ATOM 942 OD1 ASP B 29 -10.041 -0.800 14.016 1.00 0.00 O ATOM 943 OD2 ASP B 29 -9.748 -2.915 13.381 1.00 0.00 O ATOM 0 H ASP B 29 -6.752 -2.709 11.095 1.00 0.00 H new ATOM 0 HA ASP B 29 -8.429 -0.309 11.530 1.00 0.00 H new ATOM 0 HB2 ASP B 29 -7.300 -2.356 13.440 1.00 0.00 H new ATOM 0 HB3 ASP B 29 -7.520 -0.702 13.977 1.00 0.00 H new ATOM 948 N ARG B 30 -5.207 -0.944 12.031 1.00 0.00 N ATOM 949 CA ARG B 30 -3.879 -0.356 12.062 1.00 0.00 C ATOM 950 C ARG B 30 -3.233 -0.429 10.677 1.00 0.00 C ATOM 951 O ARG B 30 -3.519 -1.341 9.902 1.00 0.00 O ATOM 952 CB ARG B 30 -2.982 -1.072 13.074 1.00 0.00 C ATOM 953 CG ARG B 30 -3.401 -0.740 14.508 1.00 0.00 C ATOM 954 CD ARG B 30 -3.005 0.691 14.878 1.00 0.00 C ATOM 955 NE ARG B 30 -3.435 0.994 16.261 1.00 0.00 N ATOM 956 CZ ARG B 30 -2.761 0.617 17.357 1.00 0.00 C ATOM 957 NH1 ARG B 30 -1.623 -0.078 17.237 1.00 0.00 N ATOM 958 NH2 ARG B 30 -3.227 0.937 18.572 1.00 0.00 N ATOM 0 H ARG B 30 -5.228 -1.957 12.149 1.00 0.00 H new ATOM 0 HA ARG B 30 -3.986 0.686 12.362 1.00 0.00 H new ATOM 0 HB2 ARG B 30 -3.036 -2.149 12.915 1.00 0.00 H new ATOM 0 HB3 ARG B 30 -1.944 -0.778 12.917 1.00 0.00 H new ATOM 0 HG2 ARG B 30 -4.479 -0.861 14.613 1.00 0.00 H new ATOM 0 HG3 ARG B 30 -2.933 -1.441 15.199 1.00 0.00 H new ATOM 0 HD2 ARG B 30 -1.925 0.813 14.789 1.00 0.00 H new ATOM 0 HD3 ARG B 30 -3.463 1.395 14.183 1.00 0.00 H new ATOM 0 HE ARG B 30 -4.298 1.523 16.389 1.00 0.00 H new ATOM 0 HH11 ARG B 30 -1.269 -0.321 16.312 1.00 0.00 H new ATOM 0 HH12 ARG B 30 -1.110 -0.365 18.071 1.00 0.00 H new ATOM 0 HH21 ARG B 30 -4.094 1.467 18.662 1.00 0.00 H new ATOM 0 HH22 ARG B 30 -2.715 0.651 19.406 1.00 0.00 H new ATOM 972 N PRO B 31 -2.351 0.568 10.400 1.00 0.00 N ATOM 973 CA PRO B 31 -1.661 0.625 9.122 1.00 0.00 C ATOM 974 C PRO B 31 -0.550 -0.425 9.052 1.00 0.00 C ATOM 975 O PRO B 31 -0.203 -0.894 7.969 1.00 0.00 O ATOM 976 CB PRO B 31 -1.141 2.049 9.019 1.00 0.00 C ATOM 977 CG PRO B 31 -1.153 2.601 10.435 1.00 0.00 C ATOM 978 CD PRO B 31 -1.987 1.664 11.294 1.00 0.00 C ATOM 0 HA PRO B 31 -2.313 0.392 8.280 1.00 0.00 H new ATOM 0 HB2 PRO B 31 -0.134 2.068 8.601 1.00 0.00 H new ATOM 0 HB3 PRO B 31 -1.771 2.648 8.361 1.00 0.00 H new ATOM 0 HG2 PRO B 31 -0.138 2.674 10.825 1.00 0.00 H new ATOM 0 HG3 PRO B 31 -1.573 3.607 10.449 1.00 0.00 H new ATOM 0 HD2 PRO B 31 -1.420 1.303 12.152 1.00 0.00 H new ATOM 0 HD3 PRO B 31 -2.872 2.167 11.685 1.00 0.00 H new ATOM 986 N VAL B 32 -0.023 -0.762 10.220 1.00 0.00 N ATOM 987 CA VAL B 32 1.042 -1.747 10.304 1.00 0.00 C ATOM 988 C VAL B 32 0.763 -2.693 11.473 1.00 0.00 C ATOM 989 O VAL B 32 0.332 -2.258 12.540 1.00 0.00 O ATOM 990 CB VAL B 32 2.397 -1.045 10.412 1.00 0.00 C ATOM 991 CG1 VAL B 32 2.557 0.011 9.316 1.00 0.00 C ATOM 992 CG2 VAL B 32 2.585 -0.428 11.800 1.00 0.00 C ATOM 0 H VAL B 32 -0.314 -0.371 11.116 1.00 0.00 H new ATOM 0 HA VAL B 32 1.077 -2.351 9.398 1.00 0.00 H new ATOM 0 HB VAL B 32 3.175 -1.795 10.270 1.00 0.00 H new ATOM 0 HG11 VAL B 32 3.529 0.495 9.416 1.00 0.00 H new ATOM 0 HG12 VAL B 32 2.488 -0.466 8.338 1.00 0.00 H new ATOM 0 HG13 VAL B 32 1.769 0.757 9.412 1.00 0.00 H new ATOM 0 HG21 VAL B 32 3.556 0.065 11.851 1.00 0.00 H new ATOM 0 HG22 VAL B 32 1.797 0.303 11.983 1.00 0.00 H new ATOM 0 HG23 VAL B 32 2.536 -1.212 12.556 1.00 0.00 H new ATOM 1002 N GLY B 33 1.022 -3.970 11.233 1.00 0.00 N ATOM 1003 CA GLY B 33 0.805 -4.982 12.253 1.00 0.00 C ATOM 1004 C GLY B 33 0.592 -6.360 11.623 1.00 0.00 C ATOM 1005 O GLY B 33 -0.490 -6.655 11.117 1.00 0.00 O ATOM 0 H GLY B 33 1.380 -4.327 10.347 1.00 0.00 H new ATOM 0 HA2 GLY B 33 1.662 -5.015 12.926 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -0.063 -4.716 12.855 1.00 0.00 H new ATOM 1009 N MET B 34 1.642 -7.167 11.673 1.00 0.00 N ATOM 1010 CA MET B 34 1.583 -8.506 11.113 1.00 0.00 C ATOM 1011 C MET B 34 0.296 -9.220 11.532 1.00 0.00 C ATOM 1012 O MET B 34 -0.262 -10.002 10.764 1.00 0.00 O ATOM 1013 CB MET B 34 2.793 -9.313 11.590 1.00 0.00 C ATOM 1014 CG MET B 34 3.314 -10.228 10.480 1.00 0.00 C ATOM 1015 SD MET B 34 3.927 -9.250 9.119 1.00 0.00 S ATOM 1016 CE MET B 34 3.608 -10.368 7.765 1.00 0.00 C ATOM 0 H MET B 34 2.538 -6.919 12.093 1.00 0.00 H new ATOM 0 HA MET B 34 1.594 -8.425 10.026 1.00 0.00 H new ATOM 0 HB2 MET B 34 3.584 -8.635 11.908 1.00 0.00 H new ATOM 0 HB3 MET B 34 2.517 -9.910 12.459 1.00 0.00 H new ATOM 0 HG2 MET B 34 4.109 -10.866 10.867 1.00 0.00 H new ATOM 0 HG3 MET B 34 2.516 -10.886 10.135 1.00 0.00 H new ATOM 0 HE1 MET B 34 3.697 -9.831 6.821 1.00 0.00 H new ATOM 0 HE2 MET B 34 4.331 -11.183 7.788 1.00 0.00 H new ATOM 0 HE3 MET B 34 2.601 -10.774 7.858 1.00 0.00 H new ATOM 1026 N ASP B 35 -0.136 -8.926 12.749 1.00 0.00 N ATOM 1027 CA ASP B 35 -1.347 -9.530 13.279 1.00 0.00 C ATOM 1028 C ASP B 35 -2.551 -9.041 12.473 1.00 0.00 C ATOM 1029 O ASP B 35 -3.468 -9.811 12.190 1.00 0.00 O ATOM 1030 CB ASP B 35 -1.565 -9.135 14.741 1.00 0.00 C ATOM 1031 CG ASP B 35 -2.480 -10.069 15.534 1.00 0.00 C ATOM 1032 OD1 ASP B 35 -3.712 -9.911 15.393 1.00 0.00 O ATOM 1033 OD2 ASP B 35 -1.928 -10.920 16.264 1.00 0.00 O ATOM 0 H ASP B 35 0.330 -8.278 13.383 1.00 0.00 H new ATOM 0 HA ASP B 35 -1.242 -10.613 13.209 1.00 0.00 H new ATOM 0 HB2 ASP B 35 -0.596 -9.092 15.238 1.00 0.00 H new ATOM 0 HB3 ASP B 35 -1.984 -8.129 14.771 1.00 0.00 H new ATOM 1038 N THR B 36 -2.511 -7.763 12.125 1.00 0.00 N ATOM 1039 CA THR B 36 -3.587 -7.162 11.356 1.00 0.00 C ATOM 1040 C THR B 36 -3.522 -7.621 9.898 1.00 0.00 C ATOM 1041 O THR B 36 -4.545 -7.684 9.217 1.00 0.00 O ATOM 1042 CB THR B 36 -3.495 -5.644 11.520 1.00 0.00 C ATOM 1043 OG1 THR B 36 -3.955 -5.409 12.848 1.00 0.00 O ATOM 1044 CG2 THR B 36 -4.500 -4.898 10.640 1.00 0.00 C ATOM 0 H THR B 36 -1.750 -7.127 12.362 1.00 0.00 H new ATOM 0 HA THR B 36 -4.562 -7.484 11.722 1.00 0.00 H new ATOM 0 HB THR B 36 -2.485 -5.314 11.278 1.00 0.00 H new ATOM 0 HG1 THR B 36 -3.927 -4.448 13.039 1.00 0.00 H new ATOM 0 HG21 THR B 36 -4.393 -3.824 10.795 1.00 0.00 H new ATOM 0 HG22 THR B 36 -4.312 -5.134 9.593 1.00 0.00 H new ATOM 0 HG23 THR B 36 -5.512 -5.203 10.905 1.00 0.00 H new ATOM 1052 N LEU B 37 -2.310 -7.931 9.462 1.00 0.00 N ATOM 1053 CA LEU B 37 -2.098 -8.383 8.097 1.00 0.00 C ATOM 1054 C LEU B 37 -2.661 -9.797 7.939 1.00 0.00 C ATOM 1055 O LEU B 37 -3.632 -10.005 7.214 1.00 0.00 O ATOM 1056 CB LEU B 37 -0.622 -8.262 7.716 1.00 0.00 C ATOM 1057 CG LEU B 37 -0.281 -8.549 6.252 1.00 0.00 C ATOM 1058 CD1 LEU B 37 -0.461 -7.298 5.392 1.00 0.00 C ATOM 1059 CD2 LEU B 37 1.126 -9.137 6.122 1.00 0.00 C ATOM 0 H LEU B 37 -1.464 -7.878 10.030 1.00 0.00 H new ATOM 0 HA LEU B 37 -2.637 -7.745 7.396 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -0.287 -7.253 7.955 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -0.048 -8.945 8.343 1.00 0.00 H new ATOM 0 HG LEU B 37 -0.979 -9.299 5.879 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -0.212 -7.530 4.356 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -1.496 -6.962 5.450 1.00 0.00 H new ATOM 0 HD13 LEU B 37 0.197 -6.509 5.756 1.00 0.00 H new ATOM 0 HD21 LEU B 37 1.343 -9.332 5.072 1.00 0.00 H new ATOM 0 HD22 LEU B 37 1.854 -8.429 6.518 1.00 0.00 H new ATOM 0 HD23 LEU B 37 1.184 -10.069 6.683 1.00 0.00 H new ATOM 1071 N ASN B 38 -2.026 -10.732 8.631 1.00 0.00 N ATOM 1072 CA ASN B 38 -2.451 -12.121 8.576 1.00 0.00 C ATOM 1073 C ASN B 38 -3.973 -12.190 8.721 1.00 0.00 C ATOM 1074 O ASN B 38 -4.639 -12.904 7.975 1.00 0.00 O ATOM 1075 CB ASN B 38 -1.830 -12.932 9.715 1.00 0.00 C ATOM 1076 CG ASN B 38 -0.703 -13.828 9.199 1.00 0.00 C ATOM 1077 OD1 ASN B 38 -0.926 -14.878 8.619 1.00 0.00 O ATOM 1078 ND2 ASN B 38 0.517 -13.357 9.441 1.00 0.00 N ATOM 0 H ASN B 38 -1.221 -10.555 9.232 1.00 0.00 H new ATOM 0 HA ASN B 38 -2.128 -12.535 7.621 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -1.442 -12.257 10.478 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -2.597 -13.544 10.191 1.00 0.00 H new ATOM 0 HD21 ASN B 38 1.336 -13.882 9.136 1.00 0.00 H new ATOM 0 HD22 ASN B 38 0.633 -12.470 9.932 1.00 0.00 H new ATOM 1085 N SER B 39 -4.478 -11.437 9.688 1.00 0.00 N ATOM 1086 CA SER B 39 -5.908 -11.404 9.941 1.00 0.00 C ATOM 1087 C SER B 39 -6.674 -11.398 8.616 1.00 0.00 C ATOM 1088 O SER B 39 -7.615 -12.168 8.435 1.00 0.00 O ATOM 1089 CB SER B 39 -6.291 -10.184 10.781 1.00 0.00 C ATOM 1090 OG SER B 39 -7.673 -10.189 11.129 1.00 0.00 O ATOM 0 H SER B 39 -3.922 -10.845 10.305 1.00 0.00 H new ATOM 0 HA SER B 39 -6.176 -12.298 10.504 1.00 0.00 H new ATOM 0 HB2 SER B 39 -5.688 -10.165 11.689 1.00 0.00 H new ATOM 0 HB3 SER B 39 -6.060 -9.275 10.226 1.00 0.00 H new ATOM 0 HG SER B 39 -7.878 -9.395 11.666 1.00 0.00 H new ATOM 1096 N ALA B 40 -6.241 -10.519 7.724 1.00 0.00 N ATOM 1097 CA ALA B 40 -6.874 -10.402 6.421 1.00 0.00 C ATOM 1098 C ALA B 40 -6.735 -11.728 5.670 1.00 0.00 C ATOM 1099 O ALA B 40 -7.730 -12.392 5.387 1.00 0.00 O ATOM 1100 CB ALA B 40 -6.254 -9.231 5.656 1.00 0.00 C ATOM 0 H ALA B 40 -5.460 -9.881 7.878 1.00 0.00 H new ATOM 0 HA ALA B 40 -7.939 -10.194 6.529 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -6.728 -9.143 4.679 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -6.405 -8.309 6.217 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -5.186 -9.406 5.526 1.00 0.00 H new ATOM 1106 N ILE B 41 -5.491 -12.073 5.369 1.00 0.00 N ATOM 1107 CA ILE B 41 -5.209 -13.307 4.656 1.00 0.00 C ATOM 1108 C ILE B 41 -6.087 -14.427 5.218 1.00 0.00 C ATOM 1109 O ILE B 41 -6.799 -15.097 4.471 1.00 0.00 O ATOM 1110 CB ILE B 41 -3.712 -13.620 4.698 1.00 0.00 C ATOM 1111 CG1 ILE B 41 -2.902 -12.511 4.024 1.00 0.00 C ATOM 1112 CG2 ILE B 41 -3.421 -14.993 4.088 1.00 0.00 C ATOM 1113 CD1 ILE B 41 -1.550 -12.322 4.716 1.00 0.00 C ATOM 0 H ILE B 41 -4.668 -11.519 5.606 1.00 0.00 H new ATOM 0 HA ILE B 41 -5.460 -13.203 3.600 1.00 0.00 H new ATOM 0 HB ILE B 41 -3.400 -13.659 5.742 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -2.746 -12.757 2.974 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -3.463 -11.577 4.053 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -2.350 -15.190 4.131 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -3.954 -15.761 4.649 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -3.752 -15.007 3.049 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -0.994 -11.528 4.218 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -1.710 -12.053 5.760 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -0.982 -13.251 4.664 1.00 0.00 H new ATOM 1125 N GLU B 42 -6.008 -14.597 6.530 1.00 0.00 N ATOM 1126 CA GLU B 42 -6.786 -15.624 7.201 1.00 0.00 C ATOM 1127 C GLU B 42 -8.280 -15.404 6.953 1.00 0.00 C ATOM 1128 O GLU B 42 -9.031 -16.362 6.778 1.00 0.00 O ATOM 1129 CB GLU B 42 -6.477 -15.655 8.699 1.00 0.00 C ATOM 1130 CG GLU B 42 -5.027 -16.072 8.951 1.00 0.00 C ATOM 1131 CD GLU B 42 -4.848 -16.600 10.376 1.00 0.00 C ATOM 1132 OE1 GLU B 42 -5.612 -17.520 10.741 1.00 0.00 O ATOM 1133 OE2 GLU B 42 -3.951 -16.072 11.068 1.00 0.00 O ATOM 0 H GLU B 42 -5.416 -14.040 7.146 1.00 0.00 H new ATOM 0 HA GLU B 42 -6.507 -16.593 6.787 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -6.656 -14.671 9.131 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -7.151 -16.350 9.199 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -4.736 -16.841 8.235 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -4.367 -15.220 8.789 1.00 0.00 H new ATOM 1140 N ASN B 43 -8.666 -14.137 6.947 1.00 0.00 N ATOM 1141 CA ASN B 43 -10.057 -13.779 6.724 1.00 0.00 C ATOM 1142 C ASN B 43 -10.451 -14.152 5.294 1.00 0.00 C ATOM 1143 O ASN B 43 -11.213 -15.094 5.082 1.00 0.00 O ATOM 1144 CB ASN B 43 -10.273 -12.275 6.897 1.00 0.00 C ATOM 1145 CG ASN B 43 -11.241 -11.989 8.047 1.00 0.00 C ATOM 1146 OD1 ASN B 43 -10.884 -12.011 9.214 1.00 0.00 O ATOM 1147 ND2 ASN B 43 -12.483 -11.720 7.655 1.00 0.00 N ATOM 0 H ASN B 43 -8.040 -13.345 7.093 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.665 -14.316 7.452 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -9.318 -11.787 7.091 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -10.666 -11.852 5.973 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -13.203 -11.516 8.348 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -12.715 -11.718 6.662 1.00 0.00 H new ATOM 1154 N LEU B 44 -9.915 -13.394 4.349 1.00 0.00 N ATOM 1155 CA LEU B 44 -10.202 -13.633 2.945 1.00 0.00 C ATOM 1156 C LEU B 44 -10.135 -15.135 2.663 1.00 0.00 C ATOM 1157 O LEU B 44 -10.950 -15.667 1.911 1.00 0.00 O ATOM 1158 CB LEU B 44 -9.274 -12.799 2.059 1.00 0.00 C ATOM 1159 CG LEU B 44 -9.644 -11.322 1.903 1.00 0.00 C ATOM 1160 CD1 LEU B 44 -8.463 -10.516 1.359 1.00 0.00 C ATOM 1161 CD2 LEU B 44 -10.896 -11.159 1.039 1.00 0.00 C ATOM 0 H LEU B 44 -9.283 -12.614 4.528 1.00 0.00 H new ATOM 0 HA LEU B 44 -11.214 -13.308 2.703 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -8.265 -12.859 2.466 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -9.246 -13.253 1.068 1.00 0.00 H new ATOM 0 HG LEU B 44 -9.879 -10.922 2.889 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.752 -9.470 1.258 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.621 -10.595 2.047 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -8.173 -10.908 0.384 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -11.137 -10.100 0.944 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -10.713 -11.580 0.050 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -11.731 -11.681 1.506 1.00 0.00 H new ATOM 1173 N MET B 45 -9.155 -15.777 3.282 1.00 0.00 N ATOM 1174 CA MET B 45 -8.970 -17.208 3.108 1.00 0.00 C ATOM 1175 C MET B 45 -10.279 -17.963 3.348 1.00 0.00 C ATOM 1176 O MET B 45 -10.622 -18.874 2.595 1.00 0.00 O ATOM 1177 CB MET B 45 -7.905 -17.709 4.085 1.00 0.00 C ATOM 1178 CG MET B 45 -6.505 -17.589 3.480 1.00 0.00 C ATOM 1179 SD MET B 45 -6.154 -19.018 2.469 1.00 0.00 S ATOM 1180 CE MET B 45 -5.122 -18.268 1.220 1.00 0.00 C ATOM 0 H MET B 45 -8.481 -15.332 3.905 1.00 0.00 H new ATOM 0 HA MET B 45 -8.649 -17.391 2.083 1.00 0.00 H new ATOM 0 HB2 MET B 45 -7.956 -17.134 5.010 1.00 0.00 H new ATOM 0 HB3 MET B 45 -8.105 -18.749 4.344 1.00 0.00 H new ATOM 0 HG2 MET B 45 -6.436 -16.682 2.879 1.00 0.00 H new ATOM 0 HG3 MET B 45 -5.763 -17.503 4.274 1.00 0.00 H new ATOM 0 HE1 MET B 45 -5.546 -18.460 0.234 1.00 0.00 H new ATOM 0 HE2 MET B 45 -5.070 -17.192 1.389 1.00 0.00 H new ATOM 0 HE3 MET B 45 -4.120 -18.693 1.273 1.00 0.00 H new ATOM 1190 N THR B 46 -10.975 -17.556 4.399 1.00 0.00 N ATOM 1191 CA THR B 46 -12.239 -18.183 4.748 1.00 0.00 C ATOM 1192 C THR B 46 -13.411 -17.331 4.256 1.00 0.00 C ATOM 1193 O THR B 46 -14.563 -17.757 4.319 1.00 0.00 O ATOM 1194 CB THR B 46 -12.250 -18.416 6.260 1.00 0.00 C ATOM 1195 OG1 THR B 46 -13.580 -18.846 6.535 1.00 0.00 O ATOM 1196 CG2 THR B 46 -12.108 -17.115 7.054 1.00 0.00 C ATOM 0 H THR B 46 -10.688 -16.800 5.020 1.00 0.00 H new ATOM 0 HA THR B 46 -12.351 -19.149 4.255 1.00 0.00 H new ATOM 0 HB THR B 46 -11.441 -19.096 6.528 1.00 0.00 H new ATOM 0 HG1 THR B 46 -14.120 -18.780 5.720 1.00 0.00 H new ATOM 0 HG21 THR B 46 -12.122 -17.337 8.121 1.00 0.00 H new ATOM 0 HG22 THR B 46 -11.166 -16.632 6.796 1.00 0.00 H new ATOM 0 HG23 THR B 46 -12.936 -16.448 6.811 1.00 0.00 H new ATOM 1204 N SER B 47 -13.076 -16.142 3.776 1.00 0.00 N ATOM 1205 CA SER B 47 -14.085 -15.227 3.273 1.00 0.00 C ATOM 1206 C SER B 47 -14.253 -15.410 1.763 1.00 0.00 C ATOM 1207 O SER B 47 -14.901 -14.599 1.104 1.00 0.00 O ATOM 1208 CB SER B 47 -13.722 -13.776 3.594 1.00 0.00 C ATOM 1209 OG SER B 47 -13.735 -12.952 2.431 1.00 0.00 O ATOM 0 H SER B 47 -12.119 -15.792 3.725 1.00 0.00 H new ATOM 0 HA SER B 47 -15.029 -15.455 3.767 1.00 0.00 H new ATOM 0 HB2 SER B 47 -14.425 -13.380 4.327 1.00 0.00 H new ATOM 0 HB3 SER B 47 -12.733 -13.742 4.051 1.00 0.00 H new ATOM 0 HG SER B 47 -14.574 -13.088 1.943 1.00 0.00 H new ATOM 1215 N SER B 48 -13.657 -16.481 1.260 1.00 0.00 N ATOM 1216 CA SER B 48 -13.732 -16.782 -0.160 1.00 0.00 C ATOM 1217 C SER B 48 -12.952 -18.061 -0.466 1.00 0.00 C ATOM 1218 O SER B 48 -12.005 -18.400 0.242 1.00 0.00 O ATOM 1219 CB SER B 48 -13.196 -15.619 -0.998 1.00 0.00 C ATOM 1220 OG SER B 48 -14.224 -14.698 -1.353 1.00 0.00 O ATOM 0 H SER B 48 -13.120 -17.151 1.810 1.00 0.00 H new ATOM 0 HA SER B 48 -14.779 -16.932 -0.423 1.00 0.00 H new ATOM 0 HB2 SER B 48 -12.419 -15.097 -0.439 1.00 0.00 H new ATOM 0 HB3 SER B 48 -12.730 -16.009 -1.903 1.00 0.00 H new ATOM 0 HG SER B 48 -14.617 -14.317 -0.540 1.00 0.00 H new ATOM 1226 N SER B 49 -13.378 -18.738 -1.523 1.00 0.00 N ATOM 1227 CA SER B 49 -12.730 -19.973 -1.932 1.00 0.00 C ATOM 1228 C SER B 49 -11.505 -19.661 -2.793 1.00 0.00 C ATOM 1229 O SER B 49 -11.264 -18.506 -3.141 1.00 0.00 O ATOM 1230 CB SER B 49 -13.700 -20.876 -2.696 1.00 0.00 C ATOM 1231 OG SER B 49 -14.870 -21.167 -1.936 1.00 0.00 O ATOM 0 H SER B 49 -14.164 -18.455 -2.108 1.00 0.00 H new ATOM 0 HA SER B 49 -12.410 -20.505 -1.036 1.00 0.00 H new ATOM 0 HB2 SER B 49 -13.986 -20.393 -3.630 1.00 0.00 H new ATOM 0 HB3 SER B 49 -13.198 -21.807 -2.959 1.00 0.00 H new ATOM 0 HG SER B 49 -15.465 -21.744 -2.459 1.00 0.00 H new ATOM 1237 N LYS B 50 -10.762 -20.711 -3.111 1.00 0.00 N ATOM 1238 CA LYS B 50 -9.568 -20.564 -3.925 1.00 0.00 C ATOM 1239 C LYS B 50 -9.974 -20.281 -5.373 1.00 0.00 C ATOM 1240 O LYS B 50 -9.279 -19.559 -6.086 1.00 0.00 O ATOM 1241 CB LYS B 50 -8.659 -21.784 -3.768 1.00 0.00 C ATOM 1242 CG LYS B 50 -7.852 -22.035 -5.044 1.00 0.00 C ATOM 1243 CD LYS B 50 -6.478 -22.624 -4.717 1.00 0.00 C ATOM 1244 CE LYS B 50 -5.421 -21.524 -4.610 1.00 0.00 C ATOM 1245 NZ LYS B 50 -4.244 -21.852 -5.445 1.00 0.00 N ATOM 0 H LYS B 50 -10.964 -21.667 -2.819 1.00 0.00 H new ATOM 0 HA LYS B 50 -8.979 -19.711 -3.587 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -7.981 -21.631 -2.929 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -9.261 -22.663 -3.535 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -8.398 -22.717 -5.696 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -7.730 -21.100 -5.591 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -6.529 -23.176 -3.779 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -6.190 -23.336 -5.491 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -5.845 -20.572 -4.928 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -5.115 -21.406 -3.571 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -3.423 -21.304 -5.118 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -4.036 -22.868 -5.368 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -4.445 -21.614 -6.437 1.00 0.00 H new ATOM 1259 N GLU B 51 -11.096 -20.866 -5.764 1.00 0.00 N ATOM 1260 CA GLU B 51 -11.603 -20.687 -7.114 1.00 0.00 C ATOM 1261 C GLU B 51 -12.446 -19.412 -7.199 1.00 0.00 C ATOM 1262 O GLU B 51 -12.942 -19.063 -8.269 1.00 0.00 O ATOM 1263 CB GLU B 51 -12.407 -21.907 -7.565 1.00 0.00 C ATOM 1264 CG GLU B 51 -11.537 -23.165 -7.572 1.00 0.00 C ATOM 1265 CD GLU B 51 -12.264 -24.331 -8.246 1.00 0.00 C ATOM 1266 OE1 GLU B 51 -13.273 -24.783 -7.663 1.00 0.00 O ATOM 1267 OE2 GLU B 51 -11.793 -24.744 -9.328 1.00 0.00 O ATOM 0 H GLU B 51 -11.669 -21.465 -5.169 1.00 0.00 H new ATOM 0 HA GLU B 51 -10.754 -20.584 -7.789 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -13.258 -22.053 -6.899 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -12.809 -21.733 -8.563 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -10.603 -22.963 -8.096 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -11.276 -23.437 -6.549 1.00 0.00 H new ATOM 1274 N ASP B 52 -12.582 -18.753 -6.058 1.00 0.00 N ATOM 1275 CA ASP B 52 -13.356 -17.526 -5.990 1.00 0.00 C ATOM 1276 C ASP B 52 -12.422 -16.328 -6.175 1.00 0.00 C ATOM 1277 O ASP B 52 -12.877 -15.188 -6.256 1.00 0.00 O ATOM 1278 CB ASP B 52 -14.044 -17.383 -4.632 1.00 0.00 C ATOM 1279 CG ASP B 52 -15.522 -17.777 -4.611 1.00 0.00 C ATOM 1280 OD1 ASP B 52 -16.327 -16.992 -5.158 1.00 0.00 O ATOM 1281 OD2 ASP B 52 -15.814 -18.855 -4.049 1.00 0.00 O ATOM 0 H ASP B 52 -12.169 -19.046 -5.173 1.00 0.00 H new ATOM 0 HA ASP B 52 -14.111 -17.560 -6.775 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -13.510 -17.995 -3.905 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -13.955 -16.347 -4.304 1.00 0.00 H new ATOM 1286 N TRP B 53 -11.133 -16.627 -6.237 1.00 0.00 N ATOM 1287 CA TRP B 53 -10.131 -15.590 -6.411 1.00 0.00 C ATOM 1288 C TRP B 53 -9.881 -15.420 -7.910 1.00 0.00 C ATOM 1289 O TRP B 53 -9.351 -16.320 -8.561 1.00 0.00 O ATOM 1290 CB TRP B 53 -8.859 -15.918 -5.626 1.00 0.00 C ATOM 1291 CG TRP B 53 -9.103 -16.237 -4.150 1.00 0.00 C ATOM 1292 CD1 TRP B 53 -10.008 -15.690 -3.326 1.00 0.00 C ATOM 1293 CD2 TRP B 53 -8.392 -17.205 -3.350 1.00 0.00 C ATOM 1294 NE1 TRP B 53 -9.933 -16.233 -2.060 1.00 0.00 N ATOM 1295 CE2 TRP B 53 -8.919 -17.184 -2.075 1.00 0.00 C ATOM 1296 CE3 TRP B 53 -7.339 -18.071 -3.693 1.00 0.00 C ATOM 1297 CZ2 TRP B 53 -8.455 -18.005 -1.040 1.00 0.00 C ATOM 1298 CZ3 TRP B 53 -6.887 -18.886 -2.648 1.00 0.00 C ATOM 1299 CH2 TRP B 53 -7.406 -18.876 -1.359 1.00 0.00 C ATOM 0 H TRP B 53 -10.759 -17.574 -6.170 1.00 0.00 H new ATOM 0 HA TRP B 53 -10.485 -14.641 -6.008 1.00 0.00 H new ATOM 0 HB2 TRP B 53 -8.365 -16.769 -6.094 1.00 0.00 H new ATOM 0 HB3 TRP B 53 -8.173 -15.074 -5.696 1.00 0.00 H new ATOM 0 HD1 TRP B 53 -10.708 -14.921 -3.617 1.00 0.00 H new ATOM 0 HE1 TRP B 53 -10.514 -15.983 -1.260 1.00 0.00 H new ATOM 0 HE3 TRP B 53 -6.912 -18.105 -4.685 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 -8.883 -17.968 -0.049 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 -6.078 -19.570 -2.859 1.00 0.00 H new ATOM 0 HH2 TRP B 53 -7.002 -19.537 -0.607 1.00 0.00 H new ATOM 1310 N PRO B 54 -10.284 -14.229 -8.429 1.00 0.00 N ATOM 1311 CA PRO B 54 -10.110 -13.931 -9.841 1.00 0.00 C ATOM 1312 C PRO B 54 -8.647 -13.612 -10.157 1.00 0.00 C ATOM 1313 O PRO B 54 -7.902 -13.169 -9.284 1.00 0.00 O ATOM 1314 CB PRO B 54 -11.044 -12.763 -10.114 1.00 0.00 C ATOM 1315 CG PRO B 54 -11.358 -12.154 -8.757 1.00 0.00 C ATOM 1316 CD PRO B 54 -10.915 -13.140 -7.689 1.00 0.00 C ATOM 0 HA PRO B 54 -10.353 -14.778 -10.483 1.00 0.00 H new ATOM 0 HB2 PRO B 54 -10.573 -12.032 -10.771 1.00 0.00 H new ATOM 0 HB3 PRO B 54 -11.954 -13.099 -10.611 1.00 0.00 H new ATOM 0 HG2 PRO B 54 -10.840 -11.203 -8.637 1.00 0.00 H new ATOM 0 HG3 PRO B 54 -12.425 -11.949 -8.668 1.00 0.00 H new ATOM 0 HD2 PRO B 54 -10.217 -12.679 -6.990 1.00 0.00 H new ATOM 0 HD3 PRO B 54 -11.762 -13.498 -7.104 1.00 0.00 H new ATOM 1324 N SER B 55 -8.279 -13.850 -11.407 1.00 0.00 N ATOM 1325 CA SER B 55 -6.919 -13.594 -11.849 1.00 0.00 C ATOM 1326 C SER B 55 -6.743 -12.108 -12.165 1.00 0.00 C ATOM 1327 O SER B 55 -7.646 -11.473 -12.708 1.00 0.00 O ATOM 1328 CB SER B 55 -6.569 -14.442 -13.073 1.00 0.00 C ATOM 1329 OG SER B 55 -7.708 -14.692 -13.894 1.00 0.00 O ATOM 0 H SER B 55 -8.900 -14.218 -12.128 1.00 0.00 H new ATOM 0 HA SER B 55 -6.239 -13.871 -11.043 1.00 0.00 H new ATOM 0 HB2 SER B 55 -5.804 -13.933 -13.660 1.00 0.00 H new ATOM 0 HB3 SER B 55 -6.142 -15.390 -12.747 1.00 0.00 H new ATOM 0 HG SER B 55 -7.442 -15.235 -14.665 1.00 0.00 H new ATOM 1335 N VAL B 56 -5.573 -11.595 -11.812 1.00 0.00 N ATOM 1336 CA VAL B 56 -5.267 -10.195 -12.051 1.00 0.00 C ATOM 1337 C VAL B 56 -3.793 -10.059 -12.440 1.00 0.00 C ATOM 1338 O VAL B 56 -3.058 -11.045 -12.455 1.00 0.00 O ATOM 1339 CB VAL B 56 -5.641 -9.360 -10.825 1.00 0.00 C ATOM 1340 CG1 VAL B 56 -7.137 -9.470 -10.523 1.00 0.00 C ATOM 1341 CG2 VAL B 56 -4.805 -9.767 -9.609 1.00 0.00 C ATOM 0 H VAL B 56 -4.826 -12.124 -11.362 1.00 0.00 H new ATOM 0 HA VAL B 56 -5.860 -9.811 -12.881 1.00 0.00 H new ATOM 0 HB VAL B 56 -5.420 -8.317 -11.050 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -7.377 -8.867 -9.647 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -7.708 -9.110 -11.379 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -7.393 -10.511 -10.328 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -5.090 -9.158 -8.751 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -4.980 -10.819 -9.382 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -3.748 -9.614 -9.827 1.00 0.00 H new ATOM 1351 N ASN B 57 -3.405 -8.829 -12.744 1.00 0.00 N ATOM 1352 CA ASN B 57 -2.033 -8.552 -13.131 1.00 0.00 C ATOM 1353 C ASN B 57 -1.455 -7.476 -12.210 1.00 0.00 C ATOM 1354 O ASN B 57 -1.839 -6.310 -12.294 1.00 0.00 O ATOM 1355 CB ASN B 57 -1.960 -8.032 -14.569 1.00 0.00 C ATOM 1356 CG ASN B 57 -2.461 -9.086 -15.558 1.00 0.00 C ATOM 1357 OD1 ASN B 57 -2.439 -10.278 -15.300 1.00 0.00 O ATOM 1358 ND2 ASN B 57 -2.911 -8.582 -16.704 1.00 0.00 N ATOM 0 H ASN B 57 -4.017 -8.013 -12.730 1.00 0.00 H new ATOM 0 HA ASN B 57 -1.467 -9.481 -13.054 1.00 0.00 H new ATOM 0 HB2 ASN B 57 -2.559 -7.126 -14.663 1.00 0.00 H new ATOM 0 HB3 ASN B 57 -0.932 -7.761 -14.810 1.00 0.00 H new ATOM 0 HD21 ASN B 57 -3.266 -9.204 -17.430 1.00 0.00 H new ATOM 0 HD22 ASN B 57 -2.902 -7.573 -16.856 1.00 0.00 H new ATOM 1365 N MET B 58 -0.541 -7.905 -11.352 1.00 0.00 N ATOM 1366 CA MET B 58 0.094 -6.992 -10.416 1.00 0.00 C ATOM 1367 C MET B 58 1.272 -6.268 -11.070 1.00 0.00 C ATOM 1368 O MET B 58 2.367 -6.819 -11.169 1.00 0.00 O ATOM 1369 CB MET B 58 0.588 -7.774 -9.197 1.00 0.00 C ATOM 1370 CG MET B 58 1.494 -6.906 -8.321 1.00 0.00 C ATOM 1371 SD MET B 58 1.812 -7.730 -6.769 1.00 0.00 S ATOM 1372 CE MET B 58 0.137 -8.028 -6.228 1.00 0.00 C ATOM 0 H MET B 58 -0.225 -8.872 -11.285 1.00 0.00 H new ATOM 0 HA MET B 58 -0.640 -6.247 -10.109 1.00 0.00 H new ATOM 0 HB2 MET B 58 -0.264 -8.121 -8.613 1.00 0.00 H new ATOM 0 HB3 MET B 58 1.132 -8.660 -9.524 1.00 0.00 H new ATOM 0 HG2 MET B 58 2.434 -6.710 -8.837 1.00 0.00 H new ATOM 0 HG3 MET B 58 1.022 -5.940 -8.140 1.00 0.00 H new ATOM 0 HE1 MET B 58 0.087 -7.956 -5.142 1.00 0.00 H new ATOM 0 HE2 MET B 58 -0.526 -7.286 -6.672 1.00 0.00 H new ATOM 0 HE3 MET B 58 -0.174 -9.025 -6.540 1.00 0.00 H new ATOM 1382 N ASN B 59 1.007 -5.043 -11.500 1.00 0.00 N ATOM 1383 CA ASN B 59 2.032 -4.237 -12.141 1.00 0.00 C ATOM 1384 C ASN B 59 2.965 -3.661 -11.074 1.00 0.00 C ATOM 1385 O ASN B 59 2.509 -3.027 -10.123 1.00 0.00 O ATOM 1386 CB ASN B 59 1.413 -3.067 -12.909 1.00 0.00 C ATOM 1387 CG ASN B 59 0.687 -3.558 -14.163 1.00 0.00 C ATOM 1388 OD1 ASN B 59 0.363 -4.725 -14.308 1.00 0.00 O ATOM 1389 ND2 ASN B 59 0.450 -2.604 -15.059 1.00 0.00 N ATOM 0 H ASN B 59 0.097 -4.589 -11.417 1.00 0.00 H new ATOM 0 HA ASN B 59 2.577 -4.876 -12.835 1.00 0.00 H new ATOM 0 HB2 ASN B 59 0.714 -2.534 -12.265 1.00 0.00 H new ATOM 0 HB3 ASN B 59 2.192 -2.358 -13.189 1.00 0.00 H new ATOM 0 HD21 ASN B 59 -0.030 -2.830 -15.930 1.00 0.00 H new ATOM 0 HD22 ASN B 59 0.748 -1.646 -14.875 1.00 0.00 H new ATOM 1396 N VAL B 60 4.253 -3.901 -11.267 1.00 0.00 N ATOM 1397 CA VAL B 60 5.254 -3.414 -10.333 1.00 0.00 C ATOM 1398 C VAL B 60 6.376 -2.721 -11.109 1.00 0.00 C ATOM 1399 O VAL B 60 7.223 -3.384 -11.705 1.00 0.00 O ATOM 1400 CB VAL B 60 5.754 -4.563 -9.456 1.00 0.00 C ATOM 1401 CG1 VAL B 60 6.702 -4.052 -8.370 1.00 0.00 C ATOM 1402 CG2 VAL B 60 4.584 -5.336 -8.844 1.00 0.00 C ATOM 0 H VAL B 60 4.627 -4.427 -12.057 1.00 0.00 H new ATOM 0 HA VAL B 60 4.820 -2.674 -9.660 1.00 0.00 H new ATOM 0 HB VAL B 60 6.313 -5.250 -10.092 1.00 0.00 H new ATOM 0 HG11 VAL B 60 7.043 -4.889 -7.761 1.00 0.00 H new ATOM 0 HG12 VAL B 60 7.561 -3.568 -8.835 1.00 0.00 H new ATOM 0 HG13 VAL B 60 6.179 -3.333 -7.739 1.00 0.00 H new ATOM 0 HG21 VAL B 60 4.968 -6.147 -8.225 1.00 0.00 H new ATOM 0 HG22 VAL B 60 3.985 -4.663 -8.230 1.00 0.00 H new ATOM 0 HG23 VAL B 60 3.964 -5.749 -9.640 1.00 0.00 H new ATOM 1412 N ALA B 61 6.344 -1.397 -11.076 1.00 0.00 N ATOM 1413 CA ALA B 61 7.348 -0.608 -11.769 1.00 0.00 C ATOM 1414 C ALA B 61 8.281 0.039 -10.742 1.00 0.00 C ATOM 1415 O ALA B 61 8.519 -0.524 -9.675 1.00 0.00 O ATOM 1416 CB ALA B 61 6.658 0.426 -12.662 1.00 0.00 C ATOM 0 H ALA B 61 5.639 -0.851 -10.581 1.00 0.00 H new ATOM 0 HA ALA B 61 7.956 -1.242 -12.414 1.00 0.00 H new ATOM 0 HB1 ALA B 61 7.411 1.018 -13.182 1.00 0.00 H new ATOM 0 HB2 ALA B 61 6.030 -0.085 -13.392 1.00 0.00 H new ATOM 0 HB3 ALA B 61 6.041 1.082 -12.049 1.00 0.00 H new ATOM 1422 N ASP B 62 8.783 1.211 -11.102 1.00 0.00 N ATOM 1423 CA ASP B 62 9.684 1.939 -10.225 1.00 0.00 C ATOM 1424 C ASP B 62 9.246 1.742 -8.772 1.00 0.00 C ATOM 1425 O ASP B 62 9.759 0.865 -8.079 1.00 0.00 O ATOM 1426 CB ASP B 62 9.654 3.439 -10.528 1.00 0.00 C ATOM 1427 CG ASP B 62 8.471 3.903 -11.379 1.00 0.00 C ATOM 1428 OD1 ASP B 62 7.351 3.934 -10.824 1.00 0.00 O ATOM 1429 OD2 ASP B 62 8.713 4.218 -12.564 1.00 0.00 O ATOM 0 H ASP B 62 8.583 1.674 -11.988 1.00 0.00 H new ATOM 0 HA ASP B 62 10.692 1.558 -10.386 1.00 0.00 H new ATOM 0 HB2 ASP B 62 9.640 3.985 -9.585 1.00 0.00 H new ATOM 0 HB3 ASP B 62 10.578 3.710 -11.039 1.00 0.00 H new ATOM 1434 N ALA B 63 8.301 2.572 -8.354 1.00 0.00 N ATOM 1435 CA ALA B 63 7.788 2.499 -6.997 1.00 0.00 C ATOM 1436 C ALA B 63 6.262 2.595 -7.027 1.00 0.00 C ATOM 1437 O ALA B 63 5.688 3.570 -6.544 1.00 0.00 O ATOM 1438 CB ALA B 63 8.425 3.604 -6.151 1.00 0.00 C ATOM 0 H ALA B 63 7.878 3.298 -8.932 1.00 0.00 H new ATOM 0 HA ALA B 63 8.049 1.545 -6.539 1.00 0.00 H new ATOM 0 HB1 ALA B 63 8.040 3.550 -5.133 1.00 0.00 H new ATOM 0 HB2 ALA B 63 9.507 3.474 -6.138 1.00 0.00 H new ATOM 0 HB3 ALA B 63 8.182 4.576 -6.579 1.00 0.00 H new ATOM 1444 N THR B 64 5.648 1.570 -7.600 1.00 0.00 N ATOM 1445 CA THR B 64 4.199 1.527 -7.700 1.00 0.00 C ATOM 1446 C THR B 64 3.718 0.083 -7.857 1.00 0.00 C ATOM 1447 O THR B 64 4.396 -0.737 -8.474 1.00 0.00 O ATOM 1448 CB THR B 64 3.777 2.437 -8.855 1.00 0.00 C ATOM 1449 OG1 THR B 64 4.146 3.743 -8.420 1.00 0.00 O ATOM 1450 CG2 THR B 64 2.257 2.514 -9.015 1.00 0.00 C ATOM 0 H THR B 64 6.127 0.763 -8.000 1.00 0.00 H new ATOM 0 HA THR B 64 3.729 1.896 -6.789 1.00 0.00 H new ATOM 0 HB THR B 64 4.222 2.076 -9.782 1.00 0.00 H new ATOM 0 HG1 THR B 64 4.197 3.760 -7.441 1.00 0.00 H new ATOM 0 HG21 THR B 64 2.012 3.173 -9.848 1.00 0.00 H new ATOM 0 HG22 THR B 64 1.861 1.518 -9.211 1.00 0.00 H new ATOM 0 HG23 THR B 64 1.814 2.907 -8.100 1.00 0.00 H new ATOM 1458 N VAL B 65 2.551 -0.184 -7.289 1.00 0.00 N ATOM 1459 CA VAL B 65 1.972 -1.515 -7.359 1.00 0.00 C ATOM 1460 C VAL B 65 0.500 -1.405 -7.760 1.00 0.00 C ATOM 1461 O VAL B 65 -0.359 -1.140 -6.920 1.00 0.00 O ATOM 1462 CB VAL B 65 2.176 -2.245 -6.030 1.00 0.00 C ATOM 1463 CG1 VAL B 65 1.314 -3.507 -5.959 1.00 0.00 C ATOM 1464 CG2 VAL B 65 3.653 -2.577 -5.808 1.00 0.00 C ATOM 0 H VAL B 65 1.991 0.499 -6.778 1.00 0.00 H new ATOM 0 HA VAL B 65 2.474 -2.110 -8.122 1.00 0.00 H new ATOM 0 HB VAL B 65 1.858 -1.577 -5.229 1.00 0.00 H new ATOM 0 HG11 VAL B 65 1.478 -4.007 -5.004 1.00 0.00 H new ATOM 0 HG12 VAL B 65 0.262 -3.235 -6.050 1.00 0.00 H new ATOM 0 HG13 VAL B 65 1.586 -4.180 -6.772 1.00 0.00 H new ATOM 0 HG21 VAL B 65 3.770 -3.095 -4.856 1.00 0.00 H new ATOM 0 HG22 VAL B 65 4.008 -3.217 -6.616 1.00 0.00 H new ATOM 0 HG23 VAL B 65 4.235 -1.655 -5.793 1.00 0.00 H new ATOM 1474 N THR B 66 0.252 -1.613 -9.045 1.00 0.00 N ATOM 1475 CA THR B 66 -1.101 -1.541 -9.568 1.00 0.00 C ATOM 1476 C THR B 66 -1.604 -2.937 -9.943 1.00 0.00 C ATOM 1477 O THR B 66 -0.842 -3.760 -10.448 1.00 0.00 O ATOM 1478 CB THR B 66 -1.103 -0.560 -10.742 1.00 0.00 C ATOM 1479 OG1 THR B 66 -0.693 0.676 -10.162 1.00 0.00 O ATOM 1480 CG2 THR B 66 -2.512 -0.275 -11.265 1.00 0.00 C ATOM 0 H THR B 66 0.966 -1.832 -9.740 1.00 0.00 H new ATOM 0 HA THR B 66 -1.796 -1.171 -8.814 1.00 0.00 H new ATOM 0 HB THR B 66 -0.490 -0.960 -11.550 1.00 0.00 H new ATOM 0 HG1 THR B 66 -0.665 1.369 -10.854 1.00 0.00 H new ATOM 0 HG21 THR B 66 -2.456 0.427 -12.097 1.00 0.00 H new ATOM 0 HG22 THR B 66 -2.969 -1.205 -11.604 1.00 0.00 H new ATOM 0 HG23 THR B 66 -3.116 0.156 -10.467 1.00 0.00 H new ATOM 1488 N VAL B 67 -2.883 -3.161 -9.680 1.00 0.00 N ATOM 1489 CA VAL B 67 -3.496 -4.443 -9.983 1.00 0.00 C ATOM 1490 C VAL B 67 -4.528 -4.259 -11.097 1.00 0.00 C ATOM 1491 O VAL B 67 -5.688 -3.949 -10.830 1.00 0.00 O ATOM 1492 CB VAL B 67 -4.091 -5.052 -8.712 1.00 0.00 C ATOM 1493 CG1 VAL B 67 -4.983 -6.250 -9.044 1.00 0.00 C ATOM 1494 CG2 VAL B 67 -2.990 -5.445 -7.725 1.00 0.00 C ATOM 0 H VAL B 67 -3.512 -2.476 -9.260 1.00 0.00 H new ATOM 0 HA VAL B 67 -2.748 -5.148 -10.346 1.00 0.00 H new ATOM 0 HB VAL B 67 -4.712 -4.293 -8.236 1.00 0.00 H new ATOM 0 HG11 VAL B 67 -5.393 -6.664 -8.123 1.00 0.00 H new ATOM 0 HG12 VAL B 67 -5.798 -5.928 -9.692 1.00 0.00 H new ATOM 0 HG13 VAL B 67 -4.394 -7.012 -9.554 1.00 0.00 H new ATOM 0 HG21 VAL B 67 -3.440 -5.875 -6.830 1.00 0.00 H new ATOM 0 HG22 VAL B 67 -2.331 -6.179 -8.189 1.00 0.00 H new ATOM 0 HG23 VAL B 67 -2.414 -4.561 -7.452 1.00 0.00 H new ATOM 1504 N ILE B 68 -4.068 -4.458 -12.324 1.00 0.00 N ATOM 1505 CA ILE B 68 -4.937 -4.318 -13.480 1.00 0.00 C ATOM 1506 C ILE B 68 -5.588 -5.667 -13.790 1.00 0.00 C ATOM 1507 O ILE B 68 -4.993 -6.717 -13.551 1.00 0.00 O ATOM 1508 CB ILE B 68 -4.166 -3.722 -14.660 1.00 0.00 C ATOM 1509 CG1 ILE B 68 -3.255 -2.582 -14.201 1.00 0.00 C ATOM 1510 CG2 ILE B 68 -5.121 -3.280 -15.771 1.00 0.00 C ATOM 1511 CD1 ILE B 68 -2.443 -2.023 -15.371 1.00 0.00 C ATOM 0 H ILE B 68 -3.105 -4.715 -12.542 1.00 0.00 H new ATOM 0 HA ILE B 68 -5.743 -3.616 -13.268 1.00 0.00 H new ATOM 0 HB ILE B 68 -3.524 -4.499 -15.076 1.00 0.00 H new ATOM 0 HG12 ILE B 68 -3.856 -1.788 -13.758 1.00 0.00 H new ATOM 0 HG13 ILE B 68 -2.580 -2.942 -13.424 1.00 0.00 H new ATOM 0 HG21 ILE B 68 -4.548 -2.860 -16.598 1.00 0.00 H new ATOM 0 HG22 ILE B 68 -5.691 -4.139 -16.124 1.00 0.00 H new ATOM 0 HG23 ILE B 68 -5.805 -2.525 -15.384 1.00 0.00 H new ATOM 0 HD11 ILE B 68 -1.804 -1.214 -15.017 1.00 0.00 H new ATOM 0 HD12 ILE B 68 -1.825 -2.814 -15.796 1.00 0.00 H new ATOM 0 HD13 ILE B 68 -3.121 -1.642 -16.135 1.00 0.00 H new ATOM 1523 N SER B 69 -6.801 -5.596 -14.318 1.00 0.00 N ATOM 1524 CA SER B 69 -7.540 -6.799 -14.662 1.00 0.00 C ATOM 1525 C SER B 69 -6.727 -7.650 -15.639 1.00 0.00 C ATOM 1526 O SER B 69 -5.966 -7.119 -16.447 1.00 0.00 O ATOM 1527 CB SER B 69 -8.903 -6.454 -15.266 1.00 0.00 C ATOM 1528 OG SER B 69 -9.935 -7.304 -14.773 1.00 0.00 O ATOM 0 H SER B 69 -7.291 -4.724 -14.516 1.00 0.00 H new ATOM 0 HA SER B 69 -7.711 -7.369 -13.749 1.00 0.00 H new ATOM 0 HB2 SER B 69 -9.148 -5.417 -15.039 1.00 0.00 H new ATOM 0 HB3 SER B 69 -8.851 -6.539 -16.351 1.00 0.00 H new ATOM 0 HG SER B 69 -10.790 -7.051 -15.181 1.00 0.00 H new ATOM 1534 N GLU B 70 -6.915 -8.957 -15.534 1.00 0.00 N ATOM 1535 CA GLU B 70 -6.208 -9.887 -16.398 1.00 0.00 C ATOM 1536 C GLU B 70 -6.689 -9.739 -17.843 1.00 0.00 C ATOM 1537 O GLU B 70 -5.889 -9.494 -18.745 1.00 0.00 O ATOM 1538 CB GLU B 70 -6.377 -11.327 -15.909 1.00 0.00 C ATOM 1539 CG GLU B 70 -5.025 -12.035 -15.809 1.00 0.00 C ATOM 1540 CD GLU B 70 -5.163 -13.527 -16.119 1.00 0.00 C ATOM 1541 OE1 GLU B 70 -5.911 -13.843 -17.069 1.00 0.00 O ATOM 1542 OE2 GLU B 70 -4.517 -14.318 -15.398 1.00 0.00 O ATOM 0 H GLU B 70 -7.547 -9.394 -14.863 1.00 0.00 H new ATOM 0 HA GLU B 70 -5.145 -9.649 -16.363 1.00 0.00 H new ATOM 0 HB2 GLU B 70 -6.865 -11.329 -14.934 1.00 0.00 H new ATOM 0 HB3 GLU B 70 -7.028 -11.873 -16.592 1.00 0.00 H new ATOM 0 HG2 GLU B 70 -4.320 -11.579 -16.504 1.00 0.00 H new ATOM 0 HG3 GLU B 70 -4.615 -11.904 -14.807 1.00 0.00 H new ATOM 1549 N LYS B 71 -7.993 -9.894 -18.018 1.00 0.00 N ATOM 1550 CA LYS B 71 -8.590 -9.780 -19.338 1.00 0.00 C ATOM 1551 C LYS B 71 -8.700 -8.302 -19.717 1.00 0.00 C ATOM 1552 O LYS B 71 -9.788 -7.817 -20.025 1.00 0.00 O ATOM 1553 CB LYS B 71 -9.922 -10.530 -19.390 1.00 0.00 C ATOM 1554 CG LYS B 71 -9.989 -11.446 -20.614 1.00 0.00 C ATOM 1555 CD LYS B 71 -10.978 -12.591 -20.389 1.00 0.00 C ATOM 1556 CE LYS B 71 -10.243 -13.915 -20.169 1.00 0.00 C ATOM 1557 NZ LYS B 71 -10.503 -14.845 -21.291 1.00 0.00 N ATOM 0 H LYS B 71 -8.653 -10.098 -17.268 1.00 0.00 H new ATOM 0 HA LYS B 71 -7.955 -10.254 -20.086 1.00 0.00 H new ATOM 0 HB2 LYS B 71 -10.046 -11.121 -18.482 1.00 0.00 H new ATOM 0 HB3 LYS B 71 -10.745 -9.816 -19.421 1.00 0.00 H new ATOM 0 HG2 LYS B 71 -10.289 -10.869 -21.489 1.00 0.00 H new ATOM 0 HG3 LYS B 71 -8.999 -11.852 -20.824 1.00 0.00 H new ATOM 0 HD2 LYS B 71 -11.604 -12.371 -19.525 1.00 0.00 H new ATOM 0 HD3 LYS B 71 -11.641 -12.678 -21.250 1.00 0.00 H new ATOM 0 HE2 LYS B 71 -9.172 -13.733 -20.081 1.00 0.00 H new ATOM 0 HE3 LYS B 71 -10.568 -14.367 -19.232 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 -9.997 -15.738 -21.126 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 -11.524 -15.032 -21.357 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 -10.171 -14.418 -22.180 1.00 0.00 H new ATOM 1571 N ASN B 72 -7.560 -7.628 -19.684 1.00 0.00 N ATOM 1572 CA ASN B 72 -7.516 -6.216 -20.020 1.00 0.00 C ATOM 1573 C ASN B 72 -6.199 -5.618 -19.521 1.00 0.00 C ATOM 1574 O ASN B 72 -5.577 -6.155 -18.605 1.00 0.00 O ATOM 1575 CB ASN B 72 -8.663 -5.454 -19.353 1.00 0.00 C ATOM 1576 CG ASN B 72 -9.812 -5.221 -20.337 1.00 0.00 C ATOM 1577 OD1 ASN B 72 -9.664 -5.338 -21.542 1.00 0.00 O ATOM 1578 ND2 ASN B 72 -10.961 -4.887 -19.757 1.00 0.00 N ATOM 0 H ASN B 72 -6.660 -8.034 -19.430 1.00 0.00 H new ATOM 0 HA ASN B 72 -7.604 -6.125 -21.103 1.00 0.00 H new ATOM 0 HB2 ASN B 72 -9.025 -6.016 -18.492 1.00 0.00 H new ATOM 0 HB3 ASN B 72 -8.300 -4.497 -18.979 1.00 0.00 H new ATOM 0 HD21 ASN B 72 -11.788 -4.711 -20.327 1.00 0.00 H new ATOM 0 HD22 ASN B 72 -11.015 -4.807 -18.742 1.00 0.00 H new ATOM 1585 N GLU B 73 -5.812 -4.516 -20.146 1.00 0.00 N ATOM 1586 CA GLU B 73 -4.579 -3.840 -19.777 1.00 0.00 C ATOM 1587 C GLU B 73 -4.868 -2.391 -19.380 1.00 0.00 C ATOM 1588 O GLU B 73 -3.966 -1.667 -18.961 1.00 0.00 O ATOM 1589 CB GLU B 73 -3.557 -3.904 -20.913 1.00 0.00 C ATOM 1590 CG GLU B 73 -2.177 -3.449 -20.435 1.00 0.00 C ATOM 1591 CD GLU B 73 -1.654 -2.292 -21.290 1.00 0.00 C ATOM 1592 OE1 GLU B 73 -1.220 -2.578 -22.427 1.00 0.00 O ATOM 1593 OE2 GLU B 73 -1.701 -1.149 -20.787 1.00 0.00 O ATOM 0 H GLU B 73 -6.330 -4.074 -20.905 1.00 0.00 H new ATOM 0 HA GLU B 73 -4.149 -4.354 -18.917 1.00 0.00 H new ATOM 0 HB2 GLU B 73 -3.496 -4.923 -21.295 1.00 0.00 H new ATOM 0 HB3 GLU B 73 -3.886 -3.273 -21.739 1.00 0.00 H new ATOM 0 HG2 GLU B 73 -2.234 -3.138 -19.392 1.00 0.00 H new ATOM 0 HG3 GLU B 73 -1.479 -4.285 -20.481 1.00 0.00 H new ATOM 1600 N GLU B 74 -6.129 -2.010 -19.525 1.00 0.00 N ATOM 1601 CA GLU B 74 -6.547 -0.661 -19.186 1.00 0.00 C ATOM 1602 C GLU B 74 -7.588 -0.693 -18.066 1.00 0.00 C ATOM 1603 O GLU B 74 -8.099 0.349 -17.658 1.00 0.00 O ATOM 1604 CB GLU B 74 -7.088 0.070 -20.417 1.00 0.00 C ATOM 1605 CG GLU B 74 -8.230 -0.716 -21.064 1.00 0.00 C ATOM 1606 CD GLU B 74 -9.500 0.132 -21.150 1.00 0.00 C ATOM 1607 OE1 GLU B 74 -9.351 1.361 -21.319 1.00 0.00 O ATOM 1608 OE2 GLU B 74 -10.592 -0.468 -21.046 1.00 0.00 O ATOM 0 H GLU B 74 -6.875 -2.613 -19.873 1.00 0.00 H new ATOM 0 HA GLU B 74 -5.676 -0.110 -18.830 1.00 0.00 H new ATOM 0 HB2 GLU B 74 -7.441 1.061 -20.130 1.00 0.00 H new ATOM 0 HB3 GLU B 74 -6.286 0.214 -21.140 1.00 0.00 H new ATOM 0 HG2 GLU B 74 -7.935 -1.037 -22.063 1.00 0.00 H new ATOM 0 HG3 GLU B 74 -8.429 -1.618 -20.485 1.00 0.00 H new ATOM 1615 N GLU B 75 -7.872 -1.900 -17.599 1.00 0.00 N ATOM 1616 CA GLU B 75 -8.843 -2.082 -16.534 1.00 0.00 C ATOM 1617 C GLU B 75 -8.132 -2.217 -15.185 1.00 0.00 C ATOM 1618 O GLU B 75 -7.754 -3.317 -14.787 1.00 0.00 O ATOM 1619 CB GLU B 75 -9.736 -3.294 -16.807 1.00 0.00 C ATOM 1620 CG GLU B 75 -10.979 -3.270 -15.915 1.00 0.00 C ATOM 1621 CD GLU B 75 -12.027 -4.270 -16.409 1.00 0.00 C ATOM 1622 OE1 GLU B 75 -12.427 -4.138 -17.586 1.00 0.00 O ATOM 1623 OE2 GLU B 75 -12.404 -5.144 -15.598 1.00 0.00 O ATOM 0 H GLU B 75 -7.446 -2.762 -17.939 1.00 0.00 H new ATOM 0 HA GLU B 75 -9.484 -1.201 -16.499 1.00 0.00 H new ATOM 0 HB2 GLU B 75 -10.036 -3.301 -17.855 1.00 0.00 H new ATOM 0 HB3 GLU B 75 -9.175 -4.211 -16.630 1.00 0.00 H new ATOM 0 HG2 GLU B 75 -10.699 -3.508 -14.889 1.00 0.00 H new ATOM 0 HG3 GLU B 75 -11.405 -2.267 -15.905 1.00 0.00 H new ATOM 1630 N VAL B 76 -7.972 -1.082 -14.521 1.00 0.00 N ATOM 1631 CA VAL B 76 -7.313 -1.060 -13.226 1.00 0.00 C ATOM 1632 C VAL B 76 -8.275 -1.587 -12.160 1.00 0.00 C ATOM 1633 O VAL B 76 -9.471 -1.302 -12.203 1.00 0.00 O ATOM 1634 CB VAL B 76 -6.800 0.350 -12.924 1.00 0.00 C ATOM 1635 CG1 VAL B 76 -7.958 1.346 -12.833 1.00 0.00 C ATOM 1636 CG2 VAL B 76 -5.962 0.366 -11.644 1.00 0.00 C ATOM 0 H VAL B 76 -8.287 -0.171 -14.855 1.00 0.00 H new ATOM 0 HA VAL B 76 -6.442 -1.715 -13.230 1.00 0.00 H new ATOM 0 HB VAL B 76 -6.157 0.657 -13.749 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -7.567 2.340 -12.618 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -8.497 1.365 -13.780 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -8.637 1.043 -12.036 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -5.610 1.380 -11.452 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -6.572 0.029 -10.806 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -5.107 -0.299 -11.761 1.00 0.00 H new ATOM 1646 N LEU B 77 -7.718 -2.347 -11.229 1.00 0.00 N ATOM 1647 CA LEU B 77 -8.512 -2.917 -10.154 1.00 0.00 C ATOM 1648 C LEU B 77 -8.113 -2.263 -8.829 1.00 0.00 C ATOM 1649 O LEU B 77 -8.967 -1.767 -8.096 1.00 0.00 O ATOM 1650 CB LEU B 77 -8.390 -4.442 -10.148 1.00 0.00 C ATOM 1651 CG LEU B 77 -8.518 -5.130 -11.508 1.00 0.00 C ATOM 1652 CD1 LEU B 77 -8.300 -6.639 -11.382 1.00 0.00 C ATOM 1653 CD2 LEU B 77 -9.859 -4.798 -12.167 1.00 0.00 C ATOM 0 H LEU B 77 -6.726 -2.581 -11.197 1.00 0.00 H new ATOM 0 HA LEU B 77 -9.570 -2.706 -10.309 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -7.424 -4.708 -9.718 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -9.156 -4.845 -9.485 1.00 0.00 H new ATOM 0 HG LEU B 77 -7.734 -4.745 -12.160 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -8.397 -7.104 -12.363 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -7.303 -6.831 -10.986 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -9.045 -7.059 -10.707 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -9.924 -5.300 -13.132 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -10.673 -5.137 -11.526 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -9.936 -3.720 -12.312 1.00 0.00 H new ATOM 1665 N VAL B 78 -6.815 -2.285 -8.563 1.00 0.00 N ATOM 1666 CA VAL B 78 -6.293 -1.700 -7.339 1.00 0.00 C ATOM 1667 C VAL B 78 -4.992 -0.957 -7.649 1.00 0.00 C ATOM 1668 O VAL B 78 -4.209 -1.393 -8.492 1.00 0.00 O ATOM 1669 CB VAL B 78 -6.122 -2.784 -6.273 1.00 0.00 C ATOM 1670 CG1 VAL B 78 -4.921 -2.484 -5.373 1.00 0.00 C ATOM 1671 CG2 VAL B 78 -7.400 -2.946 -5.446 1.00 0.00 C ATOM 0 H VAL B 78 -6.110 -2.698 -9.173 1.00 0.00 H new ATOM 0 HA VAL B 78 -6.995 -0.972 -6.934 1.00 0.00 H new ATOM 0 HB VAL B 78 -5.931 -3.728 -6.783 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -4.822 -3.270 -4.624 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -4.015 -2.443 -5.977 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -5.069 -1.526 -4.876 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -7.252 -3.723 -4.696 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -7.635 -2.004 -4.951 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -8.224 -3.227 -6.101 1.00 0.00 H new ATOM 1681 N GLU B 79 -4.801 0.153 -6.951 1.00 0.00 N ATOM 1682 CA GLU B 79 -3.609 0.961 -7.142 1.00 0.00 C ATOM 1683 C GLU B 79 -2.878 1.150 -5.811 1.00 0.00 C ATOM 1684 O GLU B 79 -3.199 2.058 -5.045 1.00 0.00 O ATOM 1685 CB GLU B 79 -3.956 2.311 -7.772 1.00 0.00 C ATOM 1686 CG GLU B 79 -2.755 2.891 -8.522 1.00 0.00 C ATOM 1687 CD GLU B 79 -2.958 4.380 -8.814 1.00 0.00 C ATOM 1688 OE1 GLU B 79 -3.298 5.105 -7.855 1.00 0.00 O ATOM 1689 OE2 GLU B 79 -2.768 4.758 -9.990 1.00 0.00 O ATOM 0 H GLU B 79 -5.452 0.512 -6.252 1.00 0.00 H new ATOM 0 HA GLU B 79 -2.945 0.437 -7.829 1.00 0.00 H new ATOM 0 HB2 GLU B 79 -4.795 2.191 -8.458 1.00 0.00 H new ATOM 0 HB3 GLU B 79 -4.276 3.007 -6.996 1.00 0.00 H new ATOM 0 HG2 GLU B 79 -1.850 2.753 -7.930 1.00 0.00 H new ATOM 0 HG3 GLU B 79 -2.610 2.350 -9.457 1.00 0.00 H new ATOM 1696 N CYS B 80 -1.908 0.278 -5.576 1.00 0.00 N ATOM 1697 CA CYS B 80 -1.129 0.337 -4.351 1.00 0.00 C ATOM 1698 C CYS B 80 0.159 1.112 -4.638 1.00 0.00 C ATOM 1699 O CYS B 80 1.126 0.548 -5.148 1.00 0.00 O ATOM 1700 CB CYS B 80 -0.843 -1.059 -3.794 1.00 0.00 C ATOM 1701 SG CYS B 80 -0.332 -0.941 -2.041 1.00 0.00 S ATOM 0 H CYS B 80 -1.644 -0.473 -6.213 1.00 0.00 H new ATOM 0 HA CYS B 80 -1.699 0.854 -3.579 1.00 0.00 H new ATOM 0 HB2 CYS B 80 -1.732 -1.683 -3.881 1.00 0.00 H new ATOM 0 HB3 CYS B 80 -0.058 -1.539 -4.379 1.00 0.00 H new ATOM 0 HG CYS B 80 -0.865 -1.916 -1.367 1.00 0.00 H new ATOM 1707 N ARG B 81 0.131 2.392 -4.298 1.00 0.00 N ATOM 1708 CA ARG B 81 1.284 3.250 -4.513 1.00 0.00 C ATOM 1709 C ARG B 81 2.332 3.012 -3.424 1.00 0.00 C ATOM 1710 O ARG B 81 2.064 3.225 -2.243 1.00 0.00 O ATOM 1711 CB ARG B 81 0.881 4.726 -4.510 1.00 0.00 C ATOM 1712 CG ARG B 81 0.401 5.166 -5.895 1.00 0.00 C ATOM 1713 CD ARG B 81 1.571 5.257 -6.877 1.00 0.00 C ATOM 1714 NE ARG B 81 1.065 5.272 -8.267 1.00 0.00 N ATOM 1715 CZ ARG B 81 1.787 5.666 -9.325 1.00 0.00 C ATOM 1716 NH1 ARG B 81 3.050 6.080 -9.158 1.00 0.00 N ATOM 1717 NH2 ARG B 81 1.245 5.647 -10.551 1.00 0.00 N ATOM 0 H ARG B 81 -0.673 2.856 -3.875 1.00 0.00 H new ATOM 0 HA ARG B 81 1.705 3.003 -5.488 1.00 0.00 H new ATOM 0 HB2 ARG B 81 0.090 4.889 -3.778 1.00 0.00 H new ATOM 0 HB3 ARG B 81 1.730 5.338 -4.204 1.00 0.00 H new ATOM 0 HG2 ARG B 81 -0.339 4.458 -6.269 1.00 0.00 H new ATOM 0 HG3 ARG B 81 -0.093 6.135 -5.822 1.00 0.00 H new ATOM 0 HD2 ARG B 81 2.150 6.160 -6.682 1.00 0.00 H new ATOM 0 HD3 ARG B 81 2.243 4.410 -6.735 1.00 0.00 H new ATOM 0 HE ARG B 81 0.107 4.963 -8.430 1.00 0.00 H new ATOM 0 HH11 ARG B 81 3.463 6.095 -8.225 1.00 0.00 H new ATOM 0 HH12 ARG B 81 3.599 6.380 -9.964 1.00 0.00 H new ATOM 0 HH21 ARG B 81 0.283 5.333 -10.679 1.00 0.00 H new ATOM 0 HH22 ARG B 81 1.795 5.947 -11.356 1.00 0.00 H new ATOM 1731 N VAL B 82 3.504 2.575 -3.861 1.00 0.00 N ATOM 1732 CA VAL B 82 4.594 2.306 -2.938 1.00 0.00 C ATOM 1733 C VAL B 82 4.751 3.491 -1.983 1.00 0.00 C ATOM 1734 O VAL B 82 5.223 3.328 -0.859 1.00 0.00 O ATOM 1735 CB VAL B 82 5.873 1.991 -3.716 1.00 0.00 C ATOM 1736 CG1 VAL B 82 6.974 3.004 -3.394 1.00 0.00 C ATOM 1737 CG2 VAL B 82 6.344 0.562 -3.442 1.00 0.00 C ATOM 0 H VAL B 82 3.723 2.400 -4.842 1.00 0.00 H new ATOM 0 HA VAL B 82 4.374 1.427 -2.332 1.00 0.00 H new ATOM 0 HB VAL B 82 5.646 2.070 -4.779 1.00 0.00 H new ATOM 0 HG11 VAL B 82 7.872 2.757 -3.960 1.00 0.00 H new ATOM 0 HG12 VAL B 82 6.638 4.005 -3.665 1.00 0.00 H new ATOM 0 HG13 VAL B 82 7.197 2.972 -2.328 1.00 0.00 H new ATOM 0 HG21 VAL B 82 7.255 0.364 -4.007 1.00 0.00 H new ATOM 0 HG22 VAL B 82 6.545 0.443 -2.377 1.00 0.00 H new ATOM 0 HG23 VAL B 82 5.569 -0.141 -3.746 1.00 0.00 H new ATOM 1747 N ARG B 83 4.347 4.657 -2.466 1.00 0.00 N ATOM 1748 CA ARG B 83 4.438 5.869 -1.669 1.00 0.00 C ATOM 1749 C ARG B 83 3.364 5.868 -0.579 1.00 0.00 C ATOM 1750 O ARG B 83 3.606 6.331 0.535 1.00 0.00 O ATOM 1751 CB ARG B 83 4.269 7.115 -2.540 1.00 0.00 C ATOM 1752 CG ARG B 83 5.440 7.265 -3.514 1.00 0.00 C ATOM 1753 CD ARG B 83 6.550 8.127 -2.908 1.00 0.00 C ATOM 1754 NE ARG B 83 7.660 8.276 -3.876 1.00 0.00 N ATOM 1755 CZ ARG B 83 8.674 9.138 -3.728 1.00 0.00 C ATOM 1756 NH1 ARG B 83 8.725 9.935 -2.651 1.00 0.00 N ATOM 1757 NH2 ARG B 83 9.638 9.205 -4.657 1.00 0.00 N ATOM 0 H ARG B 83 3.956 4.788 -3.399 1.00 0.00 H new ATOM 0 HA ARG B 83 5.427 5.892 -1.211 1.00 0.00 H new ATOM 0 HB2 ARG B 83 3.334 7.050 -3.097 1.00 0.00 H new ATOM 0 HB3 ARG B 83 4.202 8.000 -1.907 1.00 0.00 H new ATOM 0 HG2 ARG B 83 5.836 6.281 -3.767 1.00 0.00 H new ATOM 0 HG3 ARG B 83 5.090 7.716 -4.442 1.00 0.00 H new ATOM 0 HD2 ARG B 83 6.156 9.107 -2.641 1.00 0.00 H new ATOM 0 HD3 ARG B 83 6.917 7.669 -1.989 1.00 0.00 H new ATOM 0 HE ARG B 83 7.652 7.685 -4.708 1.00 0.00 H new ATOM 0 HH11 ARG B 83 7.991 9.885 -1.944 1.00 0.00 H new ATOM 0 HH12 ARG B 83 9.497 10.591 -2.538 1.00 0.00 H new ATOM 0 HH21 ARG B 83 9.599 8.599 -5.477 1.00 0.00 H new ATOM 0 HH22 ARG B 83 10.410 9.862 -4.544 1.00 0.00 H new ATOM 1771 N PHE B 84 2.202 5.344 -0.938 1.00 0.00 N ATOM 1772 CA PHE B 84 1.090 5.277 -0.004 1.00 0.00 C ATOM 1773 C PHE B 84 1.186 4.027 0.873 1.00 0.00 C ATOM 1774 O PHE B 84 0.802 4.054 2.042 1.00 0.00 O ATOM 1775 CB PHE B 84 -0.191 5.204 -0.837 1.00 0.00 C ATOM 1776 CG PHE B 84 -0.551 6.515 -1.539 1.00 0.00 C ATOM 1777 CD1 PHE B 84 0.306 7.061 -2.443 1.00 0.00 C ATOM 1778 CD2 PHE B 84 -1.730 7.134 -1.260 1.00 0.00 C ATOM 1779 CE1 PHE B 84 -0.029 8.277 -3.095 1.00 0.00 C ATOM 1780 CE2 PHE B 84 -2.064 8.351 -1.911 1.00 0.00 C ATOM 1781 CZ PHE B 84 -1.207 8.896 -2.815 1.00 0.00 C ATOM 0 H PHE B 84 2.006 4.962 -1.863 1.00 0.00 H new ATOM 0 HA PHE B 84 1.100 6.149 0.650 1.00 0.00 H new ATOM 0 HB2 PHE B 84 -0.081 4.420 -1.587 1.00 0.00 H new ATOM 0 HB3 PHE B 84 -1.017 4.911 -0.189 1.00 0.00 H new ATOM 0 HD1 PHE B 84 1.242 6.569 -2.665 1.00 0.00 H new ATOM 0 HD2 PHE B 84 -2.412 6.700 -0.544 1.00 0.00 H new ATOM 0 HE1 PHE B 84 0.652 8.710 -3.813 1.00 0.00 H new ATOM 0 HE2 PHE B 84 -2.999 8.844 -1.688 1.00 0.00 H new ATOM 0 HZ PHE B 84 -1.462 9.821 -3.311 1.00 0.00 H new ATOM 1791 N LEU B 85 1.700 2.962 0.276 1.00 0.00 N ATOM 1792 CA LEU B 85 1.851 1.705 0.989 1.00 0.00 C ATOM 1793 C LEU B 85 2.403 1.980 2.389 1.00 0.00 C ATOM 1794 O LEU B 85 3.126 2.953 2.594 1.00 0.00 O ATOM 1795 CB LEU B 85 2.698 0.726 0.174 1.00 0.00 C ATOM 1796 CG LEU B 85 2.257 -0.739 0.215 1.00 0.00 C ATOM 1797 CD1 LEU B 85 2.484 -1.418 -1.137 1.00 0.00 C ATOM 1798 CD2 LEU B 85 2.947 -1.488 1.356 1.00 0.00 C ATOM 0 H LEU B 85 2.017 2.944 -0.693 1.00 0.00 H new ATOM 0 HA LEU B 85 0.883 1.221 1.118 1.00 0.00 H new ATOM 0 HB2 LEU B 85 2.699 1.055 -0.865 1.00 0.00 H new ATOM 0 HB3 LEU B 85 3.727 0.785 0.528 1.00 0.00 H new ATOM 0 HG LEU B 85 1.186 -0.768 0.414 1.00 0.00 H new ATOM 0 HD11 LEU B 85 2.162 -2.458 -1.080 1.00 0.00 H new ATOM 0 HD12 LEU B 85 1.908 -0.901 -1.905 1.00 0.00 H new ATOM 0 HD13 LEU B 85 3.543 -1.379 -1.390 1.00 0.00 H new ATOM 0 HD21 LEU B 85 2.616 -2.526 1.362 1.00 0.00 H new ATOM 0 HD22 LEU B 85 4.027 -1.452 1.214 1.00 0.00 H new ATOM 0 HD23 LEU B 85 2.691 -1.020 2.306 1.00 0.00 H new ATOM 1810 N SER B 86 2.042 1.104 3.315 1.00 0.00 N ATOM 1811 CA SER B 86 2.492 1.241 4.690 1.00 0.00 C ATOM 1812 C SER B 86 3.064 -0.089 5.188 1.00 0.00 C ATOM 1813 O SER B 86 4.182 -0.136 5.697 1.00 0.00 O ATOM 1814 CB SER B 86 1.353 1.702 5.600 1.00 0.00 C ATOM 1815 OG SER B 86 0.271 0.774 5.615 1.00 0.00 O ATOM 0 H SER B 86 1.443 0.297 3.140 1.00 0.00 H new ATOM 0 HA SER B 86 3.274 2.000 4.720 1.00 0.00 H new ATOM 0 HB2 SER B 86 1.730 1.835 6.614 1.00 0.00 H new ATOM 0 HB3 SER B 86 0.992 2.674 5.264 1.00 0.00 H new ATOM 0 HG SER B 86 0.258 0.300 6.473 1.00 0.00 H new ATOM 1821 N PHE B 87 2.270 -1.136 5.022 1.00 0.00 N ATOM 1822 CA PHE B 87 2.682 -2.463 5.448 1.00 0.00 C ATOM 1823 C PHE B 87 2.479 -3.486 4.329 1.00 0.00 C ATOM 1824 O PHE B 87 1.522 -3.390 3.562 1.00 0.00 O ATOM 1825 CB PHE B 87 1.801 -2.845 6.639 1.00 0.00 C ATOM 1826 CG PHE B 87 2.433 -3.877 7.575 1.00 0.00 C ATOM 1827 CD1 PHE B 87 3.462 -3.518 8.388 1.00 0.00 C ATOM 1828 CD2 PHE B 87 1.965 -5.154 7.595 1.00 0.00 C ATOM 1829 CE1 PHE B 87 4.049 -4.476 9.257 1.00 0.00 C ATOM 1830 CE2 PHE B 87 2.551 -6.112 8.464 1.00 0.00 C ATOM 1831 CZ PHE B 87 3.581 -5.752 9.276 1.00 0.00 C ATOM 0 H PHE B 87 1.343 -1.093 4.598 1.00 0.00 H new ATOM 0 HA PHE B 87 3.740 -2.457 5.711 1.00 0.00 H new ATOM 0 HB2 PHE B 87 1.570 -1.946 7.210 1.00 0.00 H new ATOM 0 HB3 PHE B 87 0.855 -3.238 6.267 1.00 0.00 H new ATOM 0 HD1 PHE B 87 3.833 -2.504 8.373 1.00 0.00 H new ATOM 0 HD2 PHE B 87 1.147 -5.439 6.950 1.00 0.00 H new ATOM 0 HE1 PHE B 87 4.867 -4.191 9.902 1.00 0.00 H new ATOM 0 HE2 PHE B 87 2.179 -7.126 8.480 1.00 0.00 H new ATOM 0 HZ PHE B 87 4.027 -6.481 9.936 1.00 0.00 H new ATOM 1841 N MET B 88 3.394 -4.443 4.272 1.00 0.00 N ATOM 1842 CA MET B 88 3.326 -5.483 3.260 1.00 0.00 C ATOM 1843 C MET B 88 4.175 -6.692 3.659 1.00 0.00 C ATOM 1844 O MET B 88 5.354 -6.548 3.979 1.00 0.00 O ATOM 1845 CB MET B 88 3.824 -4.928 1.924 1.00 0.00 C ATOM 1846 CG MET B 88 5.227 -4.334 2.065 1.00 0.00 C ATOM 1847 SD MET B 88 6.298 -4.990 0.796 1.00 0.00 S ATOM 1848 CE MET B 88 7.163 -3.503 0.321 1.00 0.00 C ATOM 0 H MET B 88 4.186 -4.520 4.910 1.00 0.00 H new ATOM 0 HA MET B 88 2.289 -5.806 3.166 1.00 0.00 H new ATOM 0 HB2 MET B 88 3.835 -5.722 1.178 1.00 0.00 H new ATOM 0 HB3 MET B 88 3.136 -4.163 1.565 1.00 0.00 H new ATOM 0 HG2 MET B 88 5.180 -3.248 1.987 1.00 0.00 H new ATOM 0 HG3 MET B 88 5.632 -4.566 3.050 1.00 0.00 H new ATOM 0 HE1 MET B 88 6.956 -3.280 -0.726 1.00 0.00 H new ATOM 0 HE2 MET B 88 6.827 -2.673 0.942 1.00 0.00 H new ATOM 0 HE3 MET B 88 8.235 -3.647 0.456 1.00 0.00 H new ATOM 1858 N GLY B 89 3.543 -7.856 3.626 1.00 0.00 N ATOM 1859 CA GLY B 89 4.226 -9.089 3.980 1.00 0.00 C ATOM 1860 C GLY B 89 3.415 -10.310 3.540 1.00 0.00 C ATOM 1861 O GLY B 89 2.682 -10.250 2.554 1.00 0.00 O ATOM 0 H GLY B 89 2.565 -7.971 3.360 1.00 0.00 H new ATOM 0 HA2 GLY B 89 5.209 -9.112 3.510 1.00 0.00 H new ATOM 0 HA3 GLY B 89 4.387 -9.124 5.058 1.00 0.00 H new ATOM 1865 N VAL B 90 3.575 -11.388 4.292 1.00 0.00 N ATOM 1866 CA VAL B 90 2.867 -12.621 3.992 1.00 0.00 C ATOM 1867 C VAL B 90 2.187 -13.136 5.263 1.00 0.00 C ATOM 1868 O VAL B 90 2.550 -12.740 6.369 1.00 0.00 O ATOM 1869 CB VAL B 90 3.828 -13.639 3.374 1.00 0.00 C ATOM 1870 CG1 VAL B 90 5.199 -13.011 3.115 1.00 0.00 C ATOM 1871 CG2 VAL B 90 3.953 -14.882 4.257 1.00 0.00 C ATOM 0 H VAL B 90 4.184 -11.434 5.109 1.00 0.00 H new ATOM 0 HA VAL B 90 2.085 -12.442 3.254 1.00 0.00 H new ATOM 0 HB VAL B 90 3.415 -13.950 2.415 1.00 0.00 H new ATOM 0 HG11 VAL B 90 5.863 -13.755 2.676 1.00 0.00 H new ATOM 0 HG12 VAL B 90 5.091 -12.171 2.429 1.00 0.00 H new ATOM 0 HG13 VAL B 90 5.621 -12.658 4.056 1.00 0.00 H new ATOM 0 HG21 VAL B 90 4.642 -15.589 3.795 1.00 0.00 H new ATOM 0 HG22 VAL B 90 4.332 -14.595 5.238 1.00 0.00 H new ATOM 0 HG23 VAL B 90 2.974 -15.349 4.369 1.00 0.00 H new ATOM 1881 N GLY B 91 1.213 -14.011 5.061 1.00 0.00 N ATOM 1882 CA GLY B 91 0.479 -14.585 6.176 1.00 0.00 C ATOM 1883 C GLY B 91 1.182 -15.835 6.710 1.00 0.00 C ATOM 1884 O GLY B 91 2.333 -15.769 7.139 1.00 0.00 O ATOM 0 H GLY B 91 0.915 -14.337 4.141 1.00 0.00 H new ATOM 0 HA2 GLY B 91 0.386 -13.847 6.973 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -0.532 -14.840 5.858 1.00 0.00 H new ATOM 1888 N LYS B 92 0.459 -16.945 6.666 1.00 0.00 N ATOM 1889 CA LYS B 92 0.999 -18.208 7.140 1.00 0.00 C ATOM 1890 C LYS B 92 1.726 -18.910 5.992 1.00 0.00 C ATOM 1891 O LYS B 92 2.552 -19.791 6.222 1.00 0.00 O ATOM 1892 CB LYS B 92 -0.103 -19.055 7.780 1.00 0.00 C ATOM 1893 CG LYS B 92 -0.910 -18.234 8.788 1.00 0.00 C ATOM 1894 CD LYS B 92 -0.472 -18.542 10.221 1.00 0.00 C ATOM 1895 CE LYS B 92 -0.570 -17.297 11.104 1.00 0.00 C ATOM 1896 NZ LYS B 92 0.017 -17.559 12.437 1.00 0.00 N ATOM 0 H LYS B 92 -0.495 -16.996 6.310 1.00 0.00 H new ATOM 0 HA LYS B 92 1.735 -18.037 7.926 1.00 0.00 H new ATOM 0 HB2 LYS B 92 -0.766 -19.441 7.006 1.00 0.00 H new ATOM 0 HB3 LYS B 92 0.340 -19.917 8.279 1.00 0.00 H new ATOM 0 HG2 LYS B 92 -0.779 -17.171 8.584 1.00 0.00 H new ATOM 0 HG3 LYS B 92 -1.972 -18.452 8.673 1.00 0.00 H new ATOM 0 HD2 LYS B 92 -1.096 -19.335 10.633 1.00 0.00 H new ATOM 0 HD3 LYS B 92 0.553 -18.912 10.220 1.00 0.00 H new ATOM 0 HE2 LYS B 92 -0.050 -16.465 10.629 1.00 0.00 H new ATOM 0 HE3 LYS B 92 -1.614 -17.001 11.211 1.00 0.00 H new ATOM 0 HZ1 LYS B 92 -0.058 -16.703 13.024 1.00 0.00 H new ATOM 0 HZ2 LYS B 92 -0.496 -18.339 12.895 1.00 0.00 H new ATOM 0 HZ3 LYS B 92 1.018 -17.819 12.330 1.00 0.00 H new ATOM 1910 N ASP B 93 1.391 -18.493 4.779 1.00 0.00 N ATOM 1911 CA ASP B 93 2.002 -19.071 3.594 1.00 0.00 C ATOM 1912 C ASP B 93 2.716 -17.971 2.806 1.00 0.00 C ATOM 1913 O ASP B 93 2.197 -16.865 2.667 1.00 0.00 O ATOM 1914 CB ASP B 93 0.947 -19.698 2.681 1.00 0.00 C ATOM 1915 CG ASP B 93 1.014 -21.222 2.567 1.00 0.00 C ATOM 1916 OD1 ASP B 93 2.138 -21.753 2.704 1.00 0.00 O ATOM 1917 OD2 ASP B 93 -0.060 -21.823 2.346 1.00 0.00 O ATOM 0 H ASP B 93 0.705 -17.762 4.592 1.00 0.00 H new ATOM 0 HA ASP B 93 2.703 -19.841 3.917 1.00 0.00 H new ATOM 0 HB2 ASP B 93 -0.041 -19.419 3.048 1.00 0.00 H new ATOM 0 HB3 ASP B 93 1.050 -19.269 1.684 1.00 0.00 H new ATOM 1922 N VAL B 94 3.896 -18.314 2.310 1.00 0.00 N ATOM 1923 CA VAL B 94 4.687 -17.370 1.540 1.00 0.00 C ATOM 1924 C VAL B 94 4.091 -17.238 0.137 1.00 0.00 C ATOM 1925 O VAL B 94 4.578 -16.454 -0.677 1.00 0.00 O ATOM 1926 CB VAL B 94 6.154 -17.803 1.527 1.00 0.00 C ATOM 1927 CG1 VAL B 94 6.695 -17.946 2.952 1.00 0.00 C ATOM 1928 CG2 VAL B 94 6.336 -19.101 0.738 1.00 0.00 C ATOM 0 H VAL B 94 4.323 -19.233 2.427 1.00 0.00 H new ATOM 0 HA VAL B 94 4.658 -16.383 2.001 1.00 0.00 H new ATOM 0 HB VAL B 94 6.729 -17.024 1.026 1.00 0.00 H new ATOM 0 HG11 VAL B 94 7.740 -18.255 2.915 1.00 0.00 H new ATOM 0 HG12 VAL B 94 6.617 -16.989 3.468 1.00 0.00 H new ATOM 0 HG13 VAL B 94 6.114 -18.696 3.488 1.00 0.00 H new ATOM 0 HG21 VAL B 94 7.388 -19.386 0.745 1.00 0.00 H new ATOM 0 HG22 VAL B 94 5.743 -19.892 1.197 1.00 0.00 H new ATOM 0 HG23 VAL B 94 6.007 -18.951 -0.290 1.00 0.00 H new ATOM 1938 N HIS B 95 3.046 -18.016 -0.103 1.00 0.00 N ATOM 1939 CA HIS B 95 2.379 -17.996 -1.394 1.00 0.00 C ATOM 1940 C HIS B 95 1.337 -16.876 -1.416 1.00 0.00 C ATOM 1941 O HIS B 95 0.798 -16.545 -2.470 1.00 0.00 O ATOM 1942 CB HIS B 95 1.782 -19.367 -1.718 1.00 0.00 C ATOM 1943 CG HIS B 95 2.782 -20.498 -1.676 1.00 0.00 C ATOM 1944 ND1 HIS B 95 3.752 -20.605 -0.694 1.00 0.00 N ATOM 1945 CD2 HIS B 95 2.953 -21.569 -2.503 1.00 0.00 C ATOM 1946 CE1 HIS B 95 4.468 -21.694 -0.930 1.00 0.00 C ATOM 1947 NE2 HIS B 95 3.971 -22.290 -2.052 1.00 0.00 N ATOM 0 H HIS B 95 2.645 -18.664 0.575 1.00 0.00 H new ATOM 0 HA HIS B 95 3.105 -17.785 -2.179 1.00 0.00 H new ATOM 0 HB2 HIS B 95 0.980 -19.579 -1.011 1.00 0.00 H new ATOM 0 HB3 HIS B 95 1.332 -19.331 -2.710 1.00 0.00 H new ATOM 0 HD2 HIS B 95 2.360 -21.792 -3.377 1.00 0.00 H new ATOM 0 HE1 HIS B 95 5.299 -22.048 -0.338 1.00 0.00 H new ATOM 0 HE2 HIS B 95 4.324 -23.149 -2.475 1.00 0.00 H new ATOM 1955 N THR B 96 1.084 -16.324 -0.238 1.00 0.00 N ATOM 1956 CA THR B 96 0.116 -15.248 -0.108 1.00 0.00 C ATOM 1957 C THR B 96 0.813 -13.952 0.310 1.00 0.00 C ATOM 1958 O THR B 96 1.508 -13.915 1.324 1.00 0.00 O ATOM 1959 CB THR B 96 -0.965 -15.701 0.874 1.00 0.00 C ATOM 1960 OG1 THR B 96 -0.247 -15.997 2.069 1.00 0.00 O ATOM 1961 CG2 THR B 96 -1.595 -17.038 0.477 1.00 0.00 C ATOM 0 H THR B 96 1.533 -16.602 0.635 1.00 0.00 H new ATOM 0 HA THR B 96 -0.363 -15.029 -1.062 1.00 0.00 H new ATOM 0 HB THR B 96 -1.741 -14.938 0.935 1.00 0.00 H new ATOM 0 HG1 THR B 96 0.596 -15.498 2.076 1.00 0.00 H new ATOM 0 HG21 THR B 96 -2.356 -17.313 1.208 1.00 0.00 H new ATOM 0 HG22 THR B 96 -2.054 -16.946 -0.507 1.00 0.00 H new ATOM 0 HG23 THR B 96 -0.825 -17.809 0.448 1.00 0.00 H new ATOM 1969 N PHE B 97 0.602 -12.919 -0.493 1.00 0.00 N ATOM 1970 CA PHE B 97 1.201 -11.623 -0.219 1.00 0.00 C ATOM 1971 C PHE B 97 0.127 -10.546 -0.058 1.00 0.00 C ATOM 1972 O PHE B 97 -0.587 -10.229 -1.009 1.00 0.00 O ATOM 1973 CB PHE B 97 2.081 -11.275 -1.421 1.00 0.00 C ATOM 1974 CG PHE B 97 2.567 -9.824 -1.436 1.00 0.00 C ATOM 1975 CD1 PHE B 97 3.234 -9.319 -0.363 1.00 0.00 C ATOM 1976 CD2 PHE B 97 2.332 -9.039 -2.521 1.00 0.00 C ATOM 1977 CE1 PHE B 97 3.685 -7.973 -0.377 1.00 0.00 C ATOM 1978 CE2 PHE B 97 2.783 -7.693 -2.535 1.00 0.00 C ATOM 1979 CZ PHE B 97 3.450 -7.188 -1.462 1.00 0.00 C ATOM 0 H PHE B 97 0.025 -12.953 -1.333 1.00 0.00 H new ATOM 0 HA PHE B 97 1.775 -11.666 0.707 1.00 0.00 H new ATOM 0 HB2 PHE B 97 2.946 -11.938 -1.429 1.00 0.00 H new ATOM 0 HB3 PHE B 97 1.522 -11.470 -2.336 1.00 0.00 H new ATOM 0 HD1 PHE B 97 3.420 -9.942 0.499 1.00 0.00 H new ATOM 0 HD2 PHE B 97 1.802 -9.440 -3.372 1.00 0.00 H new ATOM 0 HE1 PHE B 97 4.215 -7.572 0.474 1.00 0.00 H new ATOM 0 HE2 PHE B 97 2.597 -7.070 -3.397 1.00 0.00 H new ATOM 0 HZ PHE B 97 3.793 -6.164 -1.472 1.00 0.00 H new ATOM 1989 N ALA B 98 0.046 -10.012 1.152 1.00 0.00 N ATOM 1990 CA ALA B 98 -0.929 -8.976 1.449 1.00 0.00 C ATOM 1991 C ALA B 98 -0.198 -7.670 1.768 1.00 0.00 C ATOM 1992 O ALA B 98 0.926 -7.690 2.267 1.00 0.00 O ATOM 1993 CB ALA B 98 -1.829 -9.437 2.598 1.00 0.00 C ATOM 0 H ALA B 98 0.639 -10.277 1.938 1.00 0.00 H new ATOM 0 HA ALA B 98 -1.570 -8.792 0.586 1.00 0.00 H new ATOM 0 HB1 ALA B 98 -2.561 -8.660 2.821 1.00 0.00 H new ATOM 0 HB2 ALA B 98 -2.347 -10.352 2.310 1.00 0.00 H new ATOM 0 HB3 ALA B 98 -1.221 -9.628 3.482 1.00 0.00 H new ATOM 1999 N PHE B 99 -0.867 -6.567 1.467 1.00 0.00 N ATOM 2000 CA PHE B 99 -0.295 -5.254 1.715 1.00 0.00 C ATOM 2001 C PHE B 99 -1.381 -4.245 2.092 1.00 0.00 C ATOM 2002 O PHE B 99 -2.482 -4.279 1.544 1.00 0.00 O ATOM 2003 CB PHE B 99 0.374 -4.804 0.415 1.00 0.00 C ATOM 2004 CG PHE B 99 -0.610 -4.499 -0.717 1.00 0.00 C ATOM 2005 CD1 PHE B 99 -1.384 -3.383 -0.663 1.00 0.00 C ATOM 2006 CD2 PHE B 99 -0.709 -5.344 -1.778 1.00 0.00 C ATOM 2007 CE1 PHE B 99 -2.297 -3.100 -1.713 1.00 0.00 C ATOM 2008 CE2 PHE B 99 -1.621 -5.061 -2.829 1.00 0.00 C ATOM 2009 CZ PHE B 99 -2.396 -3.945 -2.774 1.00 0.00 C ATOM 0 H PHE B 99 -1.799 -6.555 1.054 1.00 0.00 H new ATOM 0 HA PHE B 99 0.415 -5.308 2.540 1.00 0.00 H new ATOM 0 HB2 PHE B 99 0.970 -3.914 0.614 1.00 0.00 H new ATOM 0 HB3 PHE B 99 1.063 -5.581 0.085 1.00 0.00 H new ATOM 0 HD1 PHE B 99 -1.305 -2.711 0.179 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -0.094 -6.231 -1.821 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -2.913 -2.214 -1.669 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -1.699 -5.732 -3.672 1.00 0.00 H new ATOM 0 HZ PHE B 99 -3.090 -3.730 -3.573 1.00 0.00 H new ATOM 2019 N ILE B 100 -1.034 -3.371 3.025 1.00 0.00 N ATOM 2020 CA ILE B 100 -1.966 -2.353 3.481 1.00 0.00 C ATOM 2021 C ILE B 100 -1.708 -1.052 2.718 1.00 0.00 C ATOM 2022 O ILE B 100 -0.596 -0.528 2.737 1.00 0.00 O ATOM 2023 CB ILE B 100 -1.890 -2.201 5.001 1.00 0.00 C ATOM 2024 CG1 ILE B 100 -2.587 -3.366 5.705 1.00 0.00 C ATOM 2025 CG2 ILE B 100 -2.448 -0.847 5.445 1.00 0.00 C ATOM 2026 CD1 ILE B 100 -1.780 -3.837 6.917 1.00 0.00 C ATOM 0 H ILE B 100 -0.120 -3.346 3.478 1.00 0.00 H new ATOM 0 HA ILE B 100 -2.992 -2.651 3.264 1.00 0.00 H new ATOM 0 HB ILE B 100 -0.841 -2.229 5.294 1.00 0.00 H new ATOM 0 HG12 ILE B 100 -3.583 -3.059 6.024 1.00 0.00 H new ATOM 0 HG13 ILE B 100 -2.716 -4.193 5.006 1.00 0.00 H new ATOM 0 HG21 ILE B 100 -2.382 -0.764 6.530 1.00 0.00 H new ATOM 0 HG22 ILE B 100 -1.869 -0.046 4.984 1.00 0.00 H new ATOM 0 HG23 ILE B 100 -3.490 -0.764 5.137 1.00 0.00 H new ATOM 0 HD11 ILE B 100 -2.298 -4.666 7.399 1.00 0.00 H new ATOM 0 HD12 ILE B 100 -0.793 -4.166 6.591 1.00 0.00 H new ATOM 0 HD13 ILE B 100 -1.673 -3.015 7.625 1.00 0.00 H new ATOM 2038 N MET B 101 -2.755 -0.569 2.065 1.00 0.00 N ATOM 2039 CA MET B 101 -2.656 0.660 1.298 1.00 0.00 C ATOM 2040 C MET B 101 -3.598 1.731 1.852 1.00 0.00 C ATOM 2041 O MET B 101 -4.736 1.434 2.214 1.00 0.00 O ATOM 2042 CB MET B 101 -3.006 0.379 -0.165 1.00 0.00 C ATOM 2043 CG MET B 101 -4.483 0.006 -0.313 1.00 0.00 C ATOM 2044 SD MET B 101 -4.888 -0.208 -2.038 1.00 0.00 S ATOM 2045 CE MET B 101 -4.542 1.434 -2.644 1.00 0.00 C ATOM 0 H MET B 101 -3.676 -1.007 2.052 1.00 0.00 H new ATOM 0 HA MET B 101 -1.633 1.030 1.372 1.00 0.00 H new ATOM 0 HB2 MET B 101 -2.787 1.258 -0.771 1.00 0.00 H new ATOM 0 HB3 MET B 101 -2.383 -0.432 -0.543 1.00 0.00 H new ATOM 0 HG2 MET B 101 -4.691 -0.913 0.235 1.00 0.00 H new ATOM 0 HG3 MET B 101 -5.109 0.785 0.122 1.00 0.00 H new ATOM 0 HE1 MET B 101 -4.985 1.558 -3.632 1.00 0.00 H new ATOM 0 HE2 MET B 101 -4.965 2.171 -1.961 1.00 0.00 H new ATOM 0 HE3 MET B 101 -3.464 1.578 -2.710 1.00 0.00 H new ATOM 2055 N ASP B 102 -3.090 2.953 1.901 1.00 0.00 N ATOM 2056 CA ASP B 102 -3.873 4.069 2.405 1.00 0.00 C ATOM 2057 C ASP B 102 -4.852 4.529 1.324 1.00 0.00 C ATOM 2058 O ASP B 102 -4.439 5.025 0.276 1.00 0.00 O ATOM 2059 CB ASP B 102 -2.974 5.254 2.764 1.00 0.00 C ATOM 2060 CG ASP B 102 -3.716 6.539 3.137 1.00 0.00 C ATOM 2061 OD1 ASP B 102 -4.512 6.476 4.099 1.00 0.00 O ATOM 2062 OD2 ASP B 102 -3.471 7.555 2.452 1.00 0.00 O ATOM 0 H ASP B 102 -2.146 3.195 1.600 1.00 0.00 H new ATOM 0 HA ASP B 102 -4.402 3.734 3.297 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -2.335 4.966 3.599 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -2.319 5.463 1.918 1.00 0.00 H new ATOM 2143 N PHE B 108 -7.296 2.441 5.594 1.00 0.00 N ATOM 2144 CA PHE B 108 -6.383 1.380 5.205 1.00 0.00 C ATOM 2145 C PHE B 108 -7.142 0.193 4.610 1.00 0.00 C ATOM 2146 O PHE B 108 -8.275 -0.083 5.000 1.00 0.00 O ATOM 2147 CB PHE B 108 -5.661 0.923 6.475 1.00 0.00 C ATOM 2148 CG PHE B 108 -5.011 2.061 7.264 1.00 0.00 C ATOM 2149 CD1 PHE B 108 -4.320 3.034 6.611 1.00 0.00 C ATOM 2150 CD2 PHE B 108 -5.123 2.100 8.619 1.00 0.00 C ATOM 2151 CE1 PHE B 108 -3.717 4.090 7.344 1.00 0.00 C ATOM 2152 CE2 PHE B 108 -4.519 3.156 9.352 1.00 0.00 C ATOM 2153 CZ PHE B 108 -3.829 4.129 8.698 1.00 0.00 C ATOM 0 HA PHE B 108 -5.687 1.747 4.450 1.00 0.00 H new ATOM 0 HB2 PHE B 108 -6.373 0.408 7.120 1.00 0.00 H new ATOM 0 HB3 PHE B 108 -4.894 0.198 6.204 1.00 0.00 H new ATOM 0 HD1 PHE B 108 -4.230 3.003 5.535 1.00 0.00 H new ATOM 0 HD2 PHE B 108 -5.671 1.328 9.138 1.00 0.00 H new ATOM 0 HE1 PHE B 108 -3.169 4.863 6.825 1.00 0.00 H new ATOM 0 HE2 PHE B 108 -4.607 3.186 10.428 1.00 0.00 H new ATOM 0 HZ PHE B 108 -3.370 4.933 9.255 1.00 0.00 H new ATOM 2163 N GLU B 109 -6.487 -0.478 3.673 1.00 0.00 N ATOM 2164 CA GLU B 109 -7.086 -1.629 3.020 1.00 0.00 C ATOM 2165 C GLU B 109 -6.036 -2.720 2.798 1.00 0.00 C ATOM 2166 O GLU B 109 -4.956 -2.449 2.276 1.00 0.00 O ATOM 2167 CB GLU B 109 -7.747 -1.228 1.700 1.00 0.00 C ATOM 2168 CG GLU B 109 -9.074 -0.508 1.948 1.00 0.00 C ATOM 2169 CD GLU B 109 -9.892 -0.406 0.658 1.00 0.00 C ATOM 2170 OE1 GLU B 109 -9.263 -0.476 -0.420 1.00 0.00 O ATOM 2171 OE2 GLU B 109 -11.127 -0.260 0.780 1.00 0.00 O ATOM 0 H GLU B 109 -5.547 -0.246 3.351 1.00 0.00 H new ATOM 0 HA GLU B 109 -7.864 -2.028 3.672 1.00 0.00 H new ATOM 0 HB2 GLU B 109 -7.077 -0.579 1.136 1.00 0.00 H new ATOM 0 HB3 GLU B 109 -7.919 -2.115 1.091 1.00 0.00 H new ATOM 0 HG2 GLU B 109 -9.647 -1.044 2.705 1.00 0.00 H new ATOM 0 HG3 GLU B 109 -8.882 0.490 2.341 1.00 0.00 H new ATOM 2178 N CYS B 110 -6.391 -3.930 3.206 1.00 0.00 N ATOM 2179 CA CYS B 110 -5.493 -5.062 3.058 1.00 0.00 C ATOM 2180 C CYS B 110 -5.871 -5.812 1.779 1.00 0.00 C ATOM 2181 O CYS B 110 -7.003 -6.271 1.636 1.00 0.00 O ATOM 2182 CB CYS B 110 -5.527 -5.975 4.285 1.00 0.00 C ATOM 2183 SG CYS B 110 -4.242 -7.270 4.138 1.00 0.00 S ATOM 0 H CYS B 110 -7.288 -4.151 3.639 1.00 0.00 H new ATOM 0 HA CYS B 110 -4.466 -4.706 2.979 1.00 0.00 H new ATOM 0 HB2 CYS B 110 -5.362 -5.389 5.189 1.00 0.00 H new ATOM 0 HB3 CYS B 110 -6.510 -6.436 4.378 1.00 0.00 H new ATOM 0 HG CYS B 110 -3.831 -7.610 5.324 1.00 0.00 H new ATOM 2189 N HIS B 111 -4.901 -5.912 0.881 1.00 0.00 N ATOM 2190 CA HIS B 111 -5.118 -6.597 -0.381 1.00 0.00 C ATOM 2191 C HIS B 111 -4.227 -7.839 -0.451 1.00 0.00 C ATOM 2192 O HIS B 111 -3.014 -7.728 -0.625 1.00 0.00 O ATOM 2193 CB HIS B 111 -4.903 -5.646 -1.560 1.00 0.00 C ATOM 2194 CG HIS B 111 -5.849 -4.470 -1.580 1.00 0.00 C ATOM 2195 ND1 HIS B 111 -7.150 -4.561 -2.044 1.00 0.00 N ATOM 2196 CD2 HIS B 111 -5.670 -3.175 -1.189 1.00 0.00 C ATOM 2197 CE1 HIS B 111 -7.718 -3.370 -1.933 1.00 0.00 C ATOM 2198 NE2 HIS B 111 -6.799 -2.512 -1.404 1.00 0.00 N ATOM 0 H HIS B 111 -3.963 -5.530 1.003 1.00 0.00 H new ATOM 0 HA HIS B 111 -6.154 -6.931 -0.443 1.00 0.00 H new ATOM 0 HB2 HIS B 111 -3.879 -5.275 -1.532 1.00 0.00 H new ATOM 0 HB3 HIS B 111 -5.014 -6.205 -2.489 1.00 0.00 H new ATOM 0 HD2 HIS B 111 -4.763 -2.760 -0.775 1.00 0.00 H new ATOM 0 HE1 HIS B 111 -8.731 -3.122 -2.212 1.00 0.00 H new ATOM 0 HE2 HIS B 111 -6.954 -1.523 -1.206 1.00 0.00 H new ATOM 2206 N VAL B 112 -4.862 -8.993 -0.311 1.00 0.00 N ATOM 2207 CA VAL B 112 -4.142 -10.254 -0.356 1.00 0.00 C ATOM 2208 C VAL B 112 -4.101 -10.762 -1.798 1.00 0.00 C ATOM 2209 O VAL B 112 -4.842 -10.278 -2.652 1.00 0.00 O ATOM 2210 CB VAL B 112 -4.777 -11.254 0.612 1.00 0.00 C ATOM 2211 CG1 VAL B 112 -3.940 -12.531 0.709 1.00 0.00 C ATOM 2212 CG2 VAL B 112 -4.982 -10.627 1.993 1.00 0.00 C ATOM 0 H VAL B 112 -5.868 -9.081 -0.166 1.00 0.00 H new ATOM 0 HA VAL B 112 -3.111 -10.117 -0.030 1.00 0.00 H new ATOM 0 HB VAL B 112 -5.757 -11.525 0.218 1.00 0.00 H new ATOM 0 HG11 VAL B 112 -4.414 -13.225 1.404 1.00 0.00 H new ATOM 0 HG12 VAL B 112 -3.868 -12.995 -0.275 1.00 0.00 H new ATOM 0 HG13 VAL B 112 -2.941 -12.285 1.068 1.00 0.00 H new ATOM 0 HG21 VAL B 112 -5.435 -11.359 2.661 1.00 0.00 H new ATOM 0 HG22 VAL B 112 -4.019 -10.313 2.397 1.00 0.00 H new ATOM 0 HG23 VAL B 112 -5.638 -9.761 1.906 1.00 0.00 H new ATOM 2222 N PHE B 113 -3.228 -11.732 -2.026 1.00 0.00 N ATOM 2223 CA PHE B 113 -3.081 -12.311 -3.350 1.00 0.00 C ATOM 2224 C PHE B 113 -2.494 -13.722 -3.270 1.00 0.00 C ATOM 2225 O PHE B 113 -1.904 -14.096 -2.257 1.00 0.00 O ATOM 2226 CB PHE B 113 -2.115 -11.414 -4.126 1.00 0.00 C ATOM 2227 CG PHE B 113 -2.643 -9.999 -4.373 1.00 0.00 C ATOM 2228 CD1 PHE B 113 -2.599 -9.073 -3.377 1.00 0.00 C ATOM 2229 CD2 PHE B 113 -3.156 -9.666 -5.588 1.00 0.00 C ATOM 2230 CE1 PHE B 113 -3.088 -7.760 -3.606 1.00 0.00 C ATOM 2231 CE2 PHE B 113 -3.645 -8.353 -5.816 1.00 0.00 C ATOM 2232 CZ PHE B 113 -3.602 -7.428 -4.820 1.00 0.00 C ATOM 0 H PHE B 113 -2.615 -12.132 -1.315 1.00 0.00 H new ATOM 0 HA PHE B 113 -4.054 -12.378 -3.836 1.00 0.00 H new ATOM 0 HB2 PHE B 113 -1.175 -11.350 -3.578 1.00 0.00 H new ATOM 0 HB3 PHE B 113 -1.893 -11.881 -5.086 1.00 0.00 H new ATOM 0 HD1 PHE B 113 -2.192 -9.337 -2.412 1.00 0.00 H new ATOM 0 HD2 PHE B 113 -3.191 -10.400 -6.379 1.00 0.00 H new ATOM 0 HE1 PHE B 113 -3.052 -7.025 -2.816 1.00 0.00 H new ATOM 0 HE2 PHE B 113 -4.051 -8.088 -6.781 1.00 0.00 H new ATOM 0 HZ PHE B 113 -3.976 -6.430 -4.993 1.00 0.00 H new ATOM 2242 N TRP B 114 -2.676 -14.467 -4.351 1.00 0.00 N ATOM 2243 CA TRP B 114 -2.172 -15.828 -4.415 1.00 0.00 C ATOM 2244 C TRP B 114 -1.062 -15.872 -5.468 1.00 0.00 C ATOM 2245 O TRP B 114 -1.331 -15.759 -6.663 1.00 0.00 O ATOM 2246 CB TRP B 114 -3.303 -16.819 -4.697 1.00 0.00 C ATOM 2247 CG TRP B 114 -2.890 -18.287 -4.571 1.00 0.00 C ATOM 2248 CD1 TRP B 114 -2.370 -19.082 -5.516 1.00 0.00 C ATOM 2249 CD2 TRP B 114 -2.985 -19.108 -3.388 1.00 0.00 C ATOM 2250 NE1 TRP B 114 -2.123 -20.350 -5.031 1.00 0.00 N ATOM 2251 CE2 TRP B 114 -2.509 -20.366 -3.695 1.00 0.00 C ATOM 2252 CE3 TRP B 114 -3.457 -18.798 -2.100 1.00 0.00 C ATOM 2253 CZ2 TRP B 114 -2.460 -21.415 -2.769 1.00 0.00 C ATOM 2254 CZ3 TRP B 114 -3.401 -19.856 -1.186 1.00 0.00 C ATOM 2255 CH2 TRP B 114 -2.925 -21.129 -1.480 1.00 0.00 C ATOM 0 H TRP B 114 -3.165 -14.153 -5.189 1.00 0.00 H new ATOM 0 HA TRP B 114 -1.754 -16.130 -3.455 1.00 0.00 H new ATOM 0 HB2 TRP B 114 -4.124 -16.623 -4.008 1.00 0.00 H new ATOM 0 HB3 TRP B 114 -3.683 -16.644 -5.704 1.00 0.00 H new ATOM 0 HD1 TRP B 114 -2.169 -18.770 -6.530 1.00 0.00 H new ATOM 0 HE1 TRP B 114 -1.730 -21.131 -5.556 1.00 0.00 H new ATOM 0 HE3 TRP B 114 -3.833 -17.820 -1.837 1.00 0.00 H new ATOM 0 HZ2 TRP B 114 -2.084 -22.392 -3.035 1.00 0.00 H new ATOM 0 HZ3 TRP B 114 -3.752 -19.671 -0.182 1.00 0.00 H new ATOM 0 HH2 TRP B 114 -2.914 -21.894 -0.717 1.00 0.00 H new ATOM 2266 N CYS B 115 0.161 -16.036 -4.986 1.00 0.00 N ATOM 2267 CA CYS B 115 1.312 -16.096 -5.870 1.00 0.00 C ATOM 2268 C CYS B 115 1.725 -17.561 -6.022 1.00 0.00 C ATOM 2269 O CYS B 115 1.569 -18.353 -5.094 1.00 0.00 O ATOM 2270 CB CYS B 115 2.464 -15.228 -5.359 1.00 0.00 C ATOM 2271 SG CYS B 115 1.807 -13.694 -4.609 1.00 0.00 S ATOM 0 H CYS B 115 0.380 -16.129 -3.994 1.00 0.00 H new ATOM 0 HA CYS B 115 1.045 -15.692 -6.846 1.00 0.00 H new ATOM 0 HB2 CYS B 115 3.048 -15.781 -4.623 1.00 0.00 H new ATOM 0 HB3 CYS B 115 3.137 -14.982 -6.180 1.00 0.00 H new ATOM 0 HG CYS B 115 2.793 -12.966 -4.176 1.00 0.00 H new ATOM 2277 N GLU B 116 2.245 -17.877 -7.199 1.00 0.00 N ATOM 2278 CA GLU B 116 2.681 -19.234 -7.485 1.00 0.00 C ATOM 2279 C GLU B 116 4.087 -19.223 -8.089 1.00 0.00 C ATOM 2280 O GLU B 116 4.354 -18.484 -9.036 1.00 0.00 O ATOM 2281 CB GLU B 116 1.692 -19.945 -8.411 1.00 0.00 C ATOM 2282 CG GLU B 116 0.374 -20.232 -7.688 1.00 0.00 C ATOM 2283 CD GLU B 116 -0.439 -21.293 -8.433 1.00 0.00 C ATOM 2284 OE1 GLU B 116 0.203 -22.168 -9.053 1.00 0.00 O ATOM 2285 OE2 GLU B 116 -1.684 -21.204 -8.365 1.00 0.00 O ATOM 0 H GLU B 116 2.374 -17.217 -7.966 1.00 0.00 H new ATOM 0 HA GLU B 116 2.713 -19.789 -6.548 1.00 0.00 H new ATOM 0 HB2 GLU B 116 1.502 -19.328 -9.289 1.00 0.00 H new ATOM 0 HB3 GLU B 116 2.127 -20.879 -8.766 1.00 0.00 H new ATOM 0 HG2 GLU B 116 0.578 -20.572 -6.673 1.00 0.00 H new ATOM 0 HG3 GLU B 116 -0.208 -19.314 -7.606 1.00 0.00 H new ATOM 2292 N PRO B 117 4.972 -20.072 -7.501 1.00 0.00 N ATOM 2293 CA PRO B 117 4.574 -20.912 -6.385 1.00 0.00 C ATOM 2294 C PRO B 117 4.453 -20.094 -5.098 1.00 0.00 C ATOM 2295 O PRO B 117 3.391 -20.058 -4.478 1.00 0.00 O ATOM 2296 CB PRO B 117 5.641 -21.991 -6.304 1.00 0.00 C ATOM 2297 CG PRO B 117 6.837 -21.453 -7.073 1.00 0.00 C ATOM 2298 CD PRO B 117 6.369 -20.255 -7.883 1.00 0.00 C ATOM 0 HA PRO B 117 3.588 -21.355 -6.524 1.00 0.00 H new ATOM 0 HB2 PRO B 117 5.906 -22.202 -5.268 1.00 0.00 H new ATOM 0 HB3 PRO B 117 5.285 -22.925 -6.738 1.00 0.00 H new ATOM 0 HG2 PRO B 117 7.633 -21.163 -6.387 1.00 0.00 H new ATOM 0 HG3 PRO B 117 7.246 -22.221 -7.729 1.00 0.00 H new ATOM 0 HD2 PRO B 117 6.961 -19.368 -7.656 1.00 0.00 H new ATOM 0 HD3 PRO B 117 6.466 -20.438 -8.953 1.00 0.00 H new ATOM 2306 N ASN B 118 5.556 -19.455 -4.735 1.00 0.00 N ATOM 2307 CA ASN B 118 5.587 -18.639 -3.534 1.00 0.00 C ATOM 2308 C ASN B 118 5.553 -17.160 -3.926 1.00 0.00 C ATOM 2309 O ASN B 118 5.457 -16.829 -5.107 1.00 0.00 O ATOM 2310 CB ASN B 118 6.866 -18.886 -2.732 1.00 0.00 C ATOM 2311 CG ASN B 118 8.089 -18.931 -3.651 1.00 0.00 C ATOM 2312 OD1 ASN B 118 8.049 -18.523 -4.800 1.00 0.00 O ATOM 2313 ND2 ASN B 118 9.174 -19.448 -3.083 1.00 0.00 N ATOM 0 H ASN B 118 6.435 -19.486 -5.252 1.00 0.00 H new ATOM 0 HA ASN B 118 4.723 -18.904 -2.925 1.00 0.00 H new ATOM 0 HB2 ASN B 118 6.993 -18.097 -1.990 1.00 0.00 H new ATOM 0 HB3 ASN B 118 6.782 -19.826 -2.186 1.00 0.00 H new ATOM 0 HD21 ASN B 118 10.042 -19.522 -3.614 1.00 0.00 H new ATOM 0 HD22 ASN B 118 9.139 -19.771 -2.116 1.00 0.00 H new ATOM 2320 N ALA B 119 5.635 -16.310 -2.913 1.00 0.00 N ATOM 2321 CA ALA B 119 5.615 -14.875 -3.137 1.00 0.00 C ATOM 2322 C ALA B 119 7.023 -14.311 -2.931 1.00 0.00 C ATOM 2323 O ALA B 119 7.219 -13.399 -2.129 1.00 0.00 O ATOM 2324 CB ALA B 119 4.587 -14.227 -2.208 1.00 0.00 C ATOM 0 H ALA B 119 5.715 -16.588 -1.935 1.00 0.00 H new ATOM 0 HA ALA B 119 5.316 -14.651 -4.161 1.00 0.00 H new ATOM 0 HB1 ALA B 119 4.572 -13.150 -2.376 1.00 0.00 H new ATOM 0 HB2 ALA B 119 3.599 -14.640 -2.414 1.00 0.00 H new ATOM 0 HB3 ALA B 119 4.856 -14.428 -1.171 1.00 0.00 H new ATOM 2330 N ALA B 120 7.966 -14.878 -3.670 1.00 0.00 N ATOM 2331 CA ALA B 120 9.349 -14.443 -3.578 1.00 0.00 C ATOM 2332 C ALA B 120 9.579 -13.279 -4.544 1.00 0.00 C ATOM 2333 O ALA B 120 10.163 -12.264 -4.170 1.00 0.00 O ATOM 2334 CB ALA B 120 10.276 -15.627 -3.862 1.00 0.00 C ATOM 0 H ALA B 120 7.799 -15.634 -4.334 1.00 0.00 H new ATOM 0 HA ALA B 120 9.573 -14.086 -2.573 1.00 0.00 H new ATOM 0 HB1 ALA B 120 11.314 -15.301 -3.793 1.00 0.00 H new ATOM 0 HB2 ALA B 120 10.094 -16.415 -3.131 1.00 0.00 H new ATOM 0 HB3 ALA B 120 10.081 -16.009 -4.864 1.00 0.00 H new ATOM 2340 N ASN B 121 9.106 -13.466 -5.768 1.00 0.00 N ATOM 2341 CA ASN B 121 9.253 -12.444 -6.790 1.00 0.00 C ATOM 2342 C ASN B 121 8.339 -11.262 -6.459 1.00 0.00 C ATOM 2343 O ASN B 121 8.782 -10.115 -6.442 1.00 0.00 O ATOM 2344 CB ASN B 121 8.852 -12.980 -8.166 1.00 0.00 C ATOM 2345 CG ASN B 121 10.073 -13.496 -8.930 1.00 0.00 C ATOM 2346 OD1 ASN B 121 10.443 -14.656 -8.850 1.00 0.00 O ATOM 2347 ND2 ASN B 121 10.676 -12.573 -9.674 1.00 0.00 N ATOM 0 H ASN B 121 8.621 -14.309 -6.074 1.00 0.00 H new ATOM 0 HA ASN B 121 10.299 -12.138 -6.812 1.00 0.00 H new ATOM 0 HB2 ASN B 121 8.125 -13.784 -8.050 1.00 0.00 H new ATOM 0 HB3 ASN B 121 8.366 -12.191 -8.740 1.00 0.00 H new ATOM 0 HD21 ASN B 121 11.500 -12.819 -10.222 1.00 0.00 H new ATOM 0 HD22 ASN B 121 10.314 -11.620 -9.696 1.00 0.00 H new ATOM 2354 N VAL B 122 7.079 -11.584 -6.204 1.00 0.00 N ATOM 2355 CA VAL B 122 6.098 -10.563 -5.874 1.00 0.00 C ATOM 2356 C VAL B 122 6.614 -9.728 -4.700 1.00 0.00 C ATOM 2357 O VAL B 122 6.982 -8.567 -4.874 1.00 0.00 O ATOM 2358 CB VAL B 122 4.741 -11.212 -5.596 1.00 0.00 C ATOM 2359 CG1 VAL B 122 3.887 -10.328 -4.685 1.00 0.00 C ATOM 2360 CG2 VAL B 122 4.006 -11.527 -6.900 1.00 0.00 C ATOM 0 H VAL B 122 6.715 -12.537 -6.219 1.00 0.00 H new ATOM 0 HA VAL B 122 5.952 -9.886 -6.716 1.00 0.00 H new ATOM 0 HB VAL B 122 4.920 -12.154 -5.077 1.00 0.00 H new ATOM 0 HG11 VAL B 122 2.928 -10.812 -4.503 1.00 0.00 H new ATOM 0 HG12 VAL B 122 4.403 -10.177 -3.737 1.00 0.00 H new ATOM 0 HG13 VAL B 122 3.721 -9.364 -5.165 1.00 0.00 H new ATOM 0 HG21 VAL B 122 3.044 -11.988 -6.674 1.00 0.00 H new ATOM 0 HG22 VAL B 122 3.844 -10.605 -7.458 1.00 0.00 H new ATOM 0 HG23 VAL B 122 4.605 -12.213 -7.499 1.00 0.00 H new ATOM 2370 N SER B 123 6.623 -10.351 -3.531 1.00 0.00 N ATOM 2371 CA SER B 123 7.087 -9.679 -2.329 1.00 0.00 C ATOM 2372 C SER B 123 8.296 -8.801 -2.654 1.00 0.00 C ATOM 2373 O SER B 123 8.327 -7.624 -2.297 1.00 0.00 O ATOM 2374 CB SER B 123 7.443 -10.689 -1.236 1.00 0.00 C ATOM 2375 OG SER B 123 8.650 -11.388 -1.528 1.00 0.00 O ATOM 0 H SER B 123 6.317 -11.314 -3.390 1.00 0.00 H new ATOM 0 HA SER B 123 6.279 -9.050 -1.956 1.00 0.00 H new ATOM 0 HB2 SER B 123 7.546 -10.170 -0.283 1.00 0.00 H new ATOM 0 HB3 SER B 123 6.628 -11.404 -1.124 1.00 0.00 H new ATOM 0 HG SER B 123 8.439 -12.230 -1.983 1.00 0.00 H new ATOM 2381 N GLU B 124 9.263 -9.406 -3.328 1.00 0.00 N ATOM 2382 CA GLU B 124 10.472 -8.693 -3.705 1.00 0.00 C ATOM 2383 C GLU B 124 10.129 -7.511 -4.613 1.00 0.00 C ATOM 2384 O GLU B 124 10.445 -6.366 -4.294 1.00 0.00 O ATOM 2385 CB GLU B 124 11.474 -9.632 -4.381 1.00 0.00 C ATOM 2386 CG GLU B 124 12.524 -8.841 -5.163 1.00 0.00 C ATOM 2387 CD GLU B 124 13.597 -9.770 -5.734 1.00 0.00 C ATOM 2388 OE1 GLU B 124 14.535 -10.090 -4.972 1.00 0.00 O ATOM 2389 OE2 GLU B 124 13.455 -10.140 -6.920 1.00 0.00 O ATOM 0 H GLU B 124 9.234 -10.382 -3.623 1.00 0.00 H new ATOM 0 HA GLU B 124 10.940 -8.307 -2.800 1.00 0.00 H new ATOM 0 HB2 GLU B 124 11.964 -10.249 -3.628 1.00 0.00 H new ATOM 0 HB3 GLU B 124 10.947 -10.308 -5.054 1.00 0.00 H new ATOM 0 HG2 GLU B 124 12.043 -8.294 -5.974 1.00 0.00 H new ATOM 0 HG3 GLU B 124 12.988 -8.101 -4.510 1.00 0.00 H new ATOM 2396 N ALA B 125 9.488 -7.829 -5.728 1.00 0.00 N ATOM 2397 CA ALA B 125 9.099 -6.807 -6.685 1.00 0.00 C ATOM 2398 C ALA B 125 8.527 -5.603 -5.934 1.00 0.00 C ATOM 2399 O ALA B 125 8.607 -4.473 -6.414 1.00 0.00 O ATOM 2400 CB ALA B 125 8.102 -7.397 -7.685 1.00 0.00 C ATOM 0 H ALA B 125 9.228 -8.780 -5.990 1.00 0.00 H new ATOM 0 HA ALA B 125 9.964 -6.462 -7.251 1.00 0.00 H new ATOM 0 HB1 ALA B 125 7.810 -6.631 -8.403 1.00 0.00 H new ATOM 0 HB2 ALA B 125 8.566 -8.231 -8.212 1.00 0.00 H new ATOM 0 HB3 ALA B 125 7.219 -7.751 -7.153 1.00 0.00 H new ATOM 2406 N VAL B 126 7.963 -5.885 -4.769 1.00 0.00 N ATOM 2407 CA VAL B 126 7.379 -4.839 -3.948 1.00 0.00 C ATOM 2408 C VAL B 126 8.422 -4.340 -2.946 1.00 0.00 C ATOM 2409 O VAL B 126 8.519 -3.140 -2.691 1.00 0.00 O ATOM 2410 CB VAL B 126 6.103 -5.352 -3.277 1.00 0.00 C ATOM 2411 CG1 VAL B 126 5.271 -4.193 -2.722 1.00 0.00 C ATOM 2412 CG2 VAL B 126 5.279 -6.204 -4.244 1.00 0.00 C ATOM 0 H VAL B 126 7.898 -6.823 -4.374 1.00 0.00 H new ATOM 0 HA VAL B 126 7.087 -3.988 -4.564 1.00 0.00 H new ATOM 0 HB VAL B 126 6.397 -5.985 -2.440 1.00 0.00 H new ATOM 0 HG11 VAL B 126 4.370 -4.585 -2.251 1.00 0.00 H new ATOM 0 HG12 VAL B 126 5.857 -3.645 -1.985 1.00 0.00 H new ATOM 0 HG13 VAL B 126 4.993 -3.523 -3.535 1.00 0.00 H new ATOM 0 HG21 VAL B 126 4.378 -6.556 -3.742 1.00 0.00 H new ATOM 0 HG22 VAL B 126 5.001 -5.604 -5.111 1.00 0.00 H new ATOM 0 HG23 VAL B 126 5.870 -7.060 -4.570 1.00 0.00 H new ATOM 2422 N GLN B 127 9.176 -5.286 -2.405 1.00 0.00 N ATOM 2423 CA GLN B 127 10.209 -4.957 -1.437 1.00 0.00 C ATOM 2424 C GLN B 127 11.263 -4.048 -2.073 1.00 0.00 C ATOM 2425 O GLN B 127 11.855 -3.210 -1.395 1.00 0.00 O ATOM 2426 CB GLN B 127 10.850 -6.224 -0.868 1.00 0.00 C ATOM 2427 CG GLN B 127 11.681 -5.907 0.377 1.00 0.00 C ATOM 2428 CD GLN B 127 11.925 -7.167 1.210 1.00 0.00 C ATOM 2429 OE1 GLN B 127 11.467 -8.252 0.889 1.00 0.00 O ATOM 2430 NE2 GLN B 127 12.669 -6.964 2.293 1.00 0.00 N ATOM 0 H GLN B 127 9.092 -6.280 -2.618 1.00 0.00 H new ATOM 0 HA GLN B 127 9.746 -4.420 -0.609 1.00 0.00 H new ATOM 0 HB2 GLN B 127 10.074 -6.947 -0.617 1.00 0.00 H new ATOM 0 HB3 GLN B 127 11.484 -6.686 -1.625 1.00 0.00 H new ATOM 0 HG2 GLN B 127 12.636 -5.473 0.080 1.00 0.00 H new ATOM 0 HG3 GLN B 127 11.166 -5.161 0.982 1.00 0.00 H new ATOM 0 HE21 GLN B 127 13.020 -6.030 2.503 1.00 0.00 H new ATOM 0 HE22 GLN B 127 12.888 -7.743 2.914 1.00 0.00 H new ATOM 2439 N ALA B 128 11.464 -4.245 -3.368 1.00 0.00 N ATOM 2440 CA ALA B 128 12.436 -3.453 -4.102 1.00 0.00 C ATOM 2441 C ALA B 128 11.761 -2.185 -4.629 1.00 0.00 C ATOM 2442 O ALA B 128 12.434 -1.207 -4.950 1.00 0.00 O ATOM 2443 CB ALA B 128 13.042 -4.300 -5.223 1.00 0.00 C ATOM 0 H ALA B 128 10.971 -4.941 -3.927 1.00 0.00 H new ATOM 0 HA ALA B 128 13.252 -3.144 -3.449 1.00 0.00 H new ATOM 0 HB1 ALA B 128 13.771 -3.706 -5.774 1.00 0.00 H new ATOM 0 HB2 ALA B 128 13.534 -5.173 -4.794 1.00 0.00 H new ATOM 0 HB3 ALA B 128 12.253 -4.625 -5.901 1.00 0.00 H new ATOM 2449 N ALA B 129 10.440 -2.243 -4.702 1.00 0.00 N ATOM 2450 CA ALA B 129 9.666 -1.112 -5.184 1.00 0.00 C ATOM 2451 C ALA B 129 9.686 0.000 -4.133 1.00 0.00 C ATOM 2452 O ALA B 129 9.893 1.167 -4.462 1.00 0.00 O ATOM 2453 CB ALA B 129 8.246 -1.570 -5.521 1.00 0.00 C ATOM 0 H ALA B 129 9.885 -3.056 -4.435 1.00 0.00 H new ATOM 0 HA ALA B 129 10.104 -0.710 -6.098 1.00 0.00 H new ATOM 0 HB1 ALA B 129 7.666 -0.721 -5.883 1.00 0.00 H new ATOM 0 HB2 ALA B 129 8.285 -2.338 -6.293 1.00 0.00 H new ATOM 0 HB3 ALA B 129 7.774 -1.978 -4.627 1.00 0.00 H new ATOM 2459 N CYS B 130 9.468 -0.402 -2.889 1.00 0.00 N ATOM 2460 CA CYS B 130 9.458 0.545 -1.788 1.00 0.00 C ATOM 2461 C CYS B 130 10.811 1.259 -1.755 1.00 0.00 C ATOM 2462 O CYS B 130 10.870 2.478 -1.607 1.00 0.00 O ATOM 2463 CB CYS B 130 9.141 -0.139 -0.456 1.00 0.00 C ATOM 2464 SG CYS B 130 7.330 -0.259 -0.229 1.00 0.00 S ATOM 0 H CYS B 130 9.297 -1.371 -2.620 1.00 0.00 H new ATOM 0 HA CYS B 130 8.666 1.277 -1.943 1.00 0.00 H new ATOM 0 HB2 CYS B 130 9.585 -1.134 -0.434 1.00 0.00 H new ATOM 0 HB3 CYS B 130 9.582 0.425 0.366 1.00 0.00 H new ATOM 0 HG CYS B 130 7.064 -0.500 1.020 1.00 0.00 H new