USER MOD reduce.3.24.130724 H: found=0, std=0, add=680, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 679 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 45 LYS NZ :NH3+ 153:sc= 2.71 (180deg=1.84) USER MOD Set 1.2: A 59 MET CE :methyl -154:sc= -0.903 (180deg=-2.1!) USER MOD Set 2.1: A 29 GLN : amide:sc= 1.14 K(o=2.3,f=-1.3) USER MOD Set 2.2: A 91 TYR OH : rot 36:sc= 1.21 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -124:sc= 1.49 (180deg=-1.8!) USER MOD Single : A 25 LYS NZ :NH3+ 153:sc= 1.2 (180deg=1.01) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -118:sc= 1.15 USER MOD Single : A 35 HIS : no HD1:sc= 0.19 K(o=0.19,f=-3.6!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 147:sc= -0.222 (180deg=-0.818) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.188 USER MOD Single : A 43 HIS : no HD1:sc= -0.141 X(o=-0.14,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 151:sc= 1.22 (180deg=0.951) USER MOD Single : A 48 LYS NZ :NH3+ 164:sc= 2.07 (180deg=1.23) USER MOD Single : A 50 SER OG : rot 80:sc= 1.29 USER MOD Single : A 51 TYR OH : rot 30:sc= 0 USER MOD Single : A 52 CYS SG : rot 52:sc= 0.702 USER MOD Single : A 53 GLN : amide:sc= -0.0201 K(o=-0.02,f=-2.5!) USER MOD Single : A 55 GLN : amide:sc= -0.561 K(o=-0.56,f=-3.8!) USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 SER OG : rot -115:sc= 1.2 USER MOD Single : A 69 GLN : amide:sc= -0.0199 K(o=-0.02,f=-1.1) USER MOD Single : A 74 ASN : amide:sc= -0.0579 K(o=-0.058,f=-0.62) USER MOD Single : A 75 HIS : no HD1:sc= 0.615 K(o=0.61,f=-5.6!) USER MOD Single : A 76 THR OG1 : rot 47:sc= 1.15 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl -143:sc= 0 (180deg=-0.214) USER MOD Single : A 92 GLN : amide:sc= 0.447 X(o=0.45,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.148 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 14.219 -5.072 -1.646 1.00 10.00 N ATOM 2 CA TYR A 21 12.976 -4.283 -1.509 1.00 10.00 C ATOM 3 C TYR A 21 12.110 -4.857 -0.396 1.00 10.00 C ATOM 4 O TYR A 21 12.240 -6.029 -0.049 1.00 10.00 O ATOM 5 CB TYR A 21 12.202 -4.280 -2.832 1.00 10.00 C ATOM 6 CG TYR A 21 12.908 -3.563 -3.964 1.00 10.00 C ATOM 7 CD1 TYR A 21 13.388 -2.270 -3.803 1.00 10.00 C ATOM 8 CD2 TYR A 21 13.089 -4.178 -5.200 1.00 10.00 C ATOM 9 CE1 TYR A 21 14.026 -1.611 -4.837 1.00 10.00 C ATOM 10 CE2 TYR A 21 13.727 -3.524 -6.236 1.00 10.00 C ATOM 11 CZ TYR A 21 14.194 -2.241 -6.048 1.00 10.00 C ATOM 12 OH TYR A 21 14.827 -1.583 -7.080 1.00 10.00 O ATOM 0 HA TYR A 21 13.239 -3.256 -1.255 1.00 10.00 H new ATOM 0 HB2 TYR A 21 12.013 -5.311 -3.132 1.00 10.00 H new ATOM 0 HB3 TYR A 21 11.231 -3.812 -2.671 1.00 10.00 H new ATOM 0 HD1 TYR A 21 13.261 -1.771 -2.854 1.00 10.00 H new ATOM 0 HD2 TYR A 21 12.724 -5.183 -5.351 1.00 10.00 H new ATOM 0 HE1 TYR A 21 14.391 -0.605 -4.694 1.00 10.00 H new ATOM 0 HE2 TYR A 21 13.859 -4.016 -7.189 1.00 10.00 H new ATOM 0 HH TYR A 21 14.865 -2.167 -7.866 1.00 10.00 H new ATOM 22 N ILE A 22 11.229 -4.031 0.155 1.00 10.00 N ATOM 23 CA ILE A 22 10.351 -4.454 1.239 1.00 10.00 C ATOM 24 C ILE A 22 8.970 -4.818 0.699 1.00 10.00 C ATOM 25 O ILE A 22 8.427 -4.117 -0.157 1.00 10.00 O ATOM 26 CB ILE A 22 10.225 -3.347 2.315 1.00 10.00 C ATOM 27 CG1 ILE A 22 11.605 -2.983 2.884 1.00 10.00 C ATOM 28 CG2 ILE A 22 9.286 -3.775 3.434 1.00 10.00 C ATOM 29 CD1 ILE A 22 12.315 -4.136 3.564 1.00 10.00 C ATOM 0 H ILE A 22 11.103 -3.060 -0.133 1.00 10.00 H new ATOM 0 HA ILE A 22 10.792 -5.336 1.702 1.00 10.00 H new ATOM 0 HB ILE A 22 9.803 -2.463 1.837 1.00 10.00 H new ATOM 0 HG12 ILE A 22 12.233 -2.609 2.075 1.00 10.00 H new ATOM 0 HG13 ILE A 22 11.488 -2.169 3.599 1.00 10.00 H new ATOM 0 HG21 ILE A 22 9.216 -2.979 4.175 1.00 10.00 H new ATOM 0 HG22 ILE A 22 8.297 -3.975 3.022 1.00 10.00 H new ATOM 0 HG23 ILE A 22 9.671 -4.678 3.907 1.00 10.00 H new ATOM 0 HD11 ILE A 22 13.281 -3.798 3.938 1.00 10.00 H new ATOM 0 HD12 ILE A 22 11.709 -4.497 4.396 1.00 10.00 H new ATOM 0 HD13 ILE A 22 12.466 -4.944 2.848 1.00 10.00 H new ATOM 41 N LYS A 23 8.418 -5.923 1.184 1.00 10.00 N ATOM 42 CA LYS A 23 7.109 -6.381 0.746 1.00 10.00 C ATOM 43 C LYS A 23 6.056 -6.131 1.815 1.00 10.00 C ATOM 44 O LYS A 23 6.137 -6.664 2.923 1.00 10.00 O ATOM 45 CB LYS A 23 7.154 -7.869 0.415 1.00 10.00 C ATOM 46 CG LYS A 23 7.822 -8.185 -0.915 1.00 10.00 C ATOM 47 CD LYS A 23 8.637 -9.470 -0.848 1.00 10.00 C ATOM 48 CE LYS A 23 7.899 -10.575 -0.105 1.00 10.00 C ATOM 49 NZ LYS A 23 8.383 -10.731 1.295 1.00 10.00 N ATOM 0 H LYS A 23 8.860 -6.520 1.884 1.00 10.00 H new ATOM 0 HA LYS A 23 6.840 -5.817 -0.147 1.00 10.00 H new ATOM 0 HB2 LYS A 23 7.685 -8.392 1.210 1.00 10.00 H new ATOM 0 HB3 LYS A 23 6.136 -8.259 0.401 1.00 10.00 H new ATOM 0 HG2 LYS A 23 7.062 -8.277 -1.691 1.00 10.00 H new ATOM 0 HG3 LYS A 23 8.471 -7.357 -1.201 1.00 10.00 H new ATOM 0 HD2 LYS A 23 8.869 -9.805 -1.859 1.00 10.00 H new ATOM 0 HD3 LYS A 23 9.587 -9.271 -0.352 1.00 10.00 H new ATOM 0 HE2 LYS A 23 6.832 -10.355 -0.096 1.00 10.00 H new ATOM 0 HE3 LYS A 23 8.026 -11.517 -0.639 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 8.690 -11.713 1.449 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 9.184 -10.088 1.459 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 7.614 -10.502 1.956 1.00 10.00 H new ATOM 63 N LEU A 24 5.075 -5.313 1.478 1.00 10.00 N ATOM 64 CA LEU A 24 3.989 -5.004 2.393 1.00 10.00 C ATOM 65 C LEU A 24 2.769 -5.838 2.029 1.00 10.00 C ATOM 66 O LEU A 24 2.317 -5.818 0.881 1.00 10.00 O ATOM 67 CB LEU A 24 3.651 -3.512 2.347 1.00 10.00 C ATOM 68 CG LEU A 24 4.760 -2.578 2.837 1.00 10.00 C ATOM 69 CD1 LEU A 24 4.414 -1.129 2.542 1.00 10.00 C ATOM 70 CD2 LEU A 24 4.998 -2.764 4.327 1.00 10.00 C ATOM 0 H LEU A 24 5.008 -4.848 0.573 1.00 10.00 H new ATOM 0 HA LEU A 24 4.300 -5.246 3.409 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.399 -3.244 1.321 1.00 10.00 H new ATOM 0 HB3 LEU A 24 2.759 -3.339 2.950 1.00 10.00 H new ATOM 0 HG LEU A 24 5.675 -2.833 2.302 1.00 10.00 H new ATOM 0 HD11 LEU A 24 5.216 -0.483 2.899 1.00 10.00 H new ATOM 0 HD12 LEU A 24 4.292 -0.996 1.467 1.00 10.00 H new ATOM 0 HD13 LEU A 24 3.485 -0.867 3.048 1.00 10.00 H new ATOM 0 HD21 LEU A 24 5.790 -2.091 4.656 1.00 10.00 H new ATOM 0 HD22 LEU A 24 4.081 -2.540 4.873 1.00 10.00 H new ATOM 0 HD23 LEU A 24 5.293 -3.795 4.522 1.00 10.00 H new ATOM 82 N LYS A 25 2.249 -6.580 2.997 1.00 10.00 N ATOM 83 CA LYS A 25 1.096 -7.436 2.764 1.00 10.00 C ATOM 84 C LYS A 25 -0.201 -6.670 2.984 1.00 10.00 C ATOM 85 O LYS A 25 -0.570 -6.352 4.116 1.00 10.00 O ATOM 86 CB LYS A 25 1.155 -8.668 3.674 1.00 10.00 C ATOM 87 CG LYS A 25 2.458 -9.442 3.552 1.00 10.00 C ATOM 88 CD LYS A 25 2.606 -10.487 4.646 1.00 10.00 C ATOM 89 CE LYS A 25 2.266 -11.880 4.143 1.00 10.00 C ATOM 90 NZ LYS A 25 2.971 -12.930 4.924 1.00 10.00 N ATOM 0 H LYS A 25 2.608 -6.606 3.951 1.00 10.00 H new ATOM 0 HA LYS A 25 1.120 -7.768 1.726 1.00 10.00 H new ATOM 0 HB2 LYS A 25 1.023 -8.354 4.709 1.00 10.00 H new ATOM 0 HB3 LYS A 25 0.323 -9.330 3.433 1.00 10.00 H new ATOM 0 HG2 LYS A 25 2.500 -9.929 2.578 1.00 10.00 H new ATOM 0 HG3 LYS A 25 3.297 -8.748 3.598 1.00 10.00 H new ATOM 0 HD2 LYS A 25 3.628 -10.476 5.024 1.00 10.00 H new ATOM 0 HD3 LYS A 25 1.955 -10.233 5.482 1.00 10.00 H new ATOM 0 HE2 LYS A 25 1.190 -12.038 4.208 1.00 10.00 H new ATOM 0 HE3 LYS A 25 2.538 -11.964 3.091 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 2.419 -13.811 4.898 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 3.911 -13.097 4.511 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 3.077 -12.617 5.910 1.00 10.00 H new ATOM 104 N VAL A 26 -0.876 -6.365 1.888 1.00 10.00 N ATOM 105 CA VAL A 26 -2.132 -5.641 1.936 1.00 10.00 C ATOM 106 C VAL A 26 -3.287 -6.622 2.089 1.00 10.00 C ATOM 107 O VAL A 26 -3.465 -7.519 1.261 1.00 10.00 O ATOM 108 CB VAL A 26 -2.352 -4.785 0.668 1.00 10.00 C ATOM 109 CG1 VAL A 26 -3.360 -3.678 0.937 1.00 10.00 C ATOM 110 CG2 VAL A 26 -1.035 -4.204 0.166 1.00 10.00 C ATOM 0 H VAL A 26 -0.570 -6.611 0.947 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.092 -4.970 2.794 1.00 10.00 H new ATOM 0 HB VAL A 26 -2.753 -5.433 -0.112 1.00 10.00 H new ATOM 0 HG11 VAL A 26 -3.501 -3.087 0.032 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -4.312 -4.117 1.235 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -2.990 -3.036 1.736 1.00 10.00 H new ATOM 0 HG21 VAL A 26 -1.218 -3.606 -0.727 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.596 -3.575 0.940 1.00 10.00 H new ATOM 0 HG23 VAL A 26 -0.348 -5.015 -0.075 1.00 10.00 H new ATOM 120 N ILE A 27 -4.055 -6.460 3.154 1.00 10.00 N ATOM 121 CA ILE A 27 -5.182 -7.339 3.421 1.00 10.00 C ATOM 122 C ILE A 27 -6.475 -6.750 2.867 1.00 10.00 C ATOM 123 O ILE A 27 -6.973 -5.739 3.368 1.00 10.00 O ATOM 124 CB ILE A 27 -5.352 -7.592 4.936 1.00 10.00 C ATOM 125 CG1 ILE A 27 -4.054 -8.139 5.544 1.00 10.00 C ATOM 126 CG2 ILE A 27 -6.511 -8.547 5.198 1.00 10.00 C ATOM 127 CD1 ILE A 27 -3.656 -9.505 5.024 1.00 10.00 C ATOM 0 H ILE A 27 -3.918 -5.726 3.849 1.00 10.00 H new ATOM 0 HA ILE A 27 -4.973 -8.286 2.924 1.00 10.00 H new ATOM 0 HB ILE A 27 -5.580 -6.640 5.415 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -3.246 -7.436 5.342 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -4.167 -8.193 6.627 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -6.612 -8.711 6.271 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -7.433 -8.116 4.808 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -6.318 -9.498 4.702 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -2.729 -9.821 5.503 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -4.444 -10.224 5.250 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -3.509 -9.455 3.945 1.00 10.00 H new ATOM 139 N GLY A 28 -7.000 -7.372 1.820 1.00 10.00 N ATOM 140 CA GLY A 28 -8.242 -6.912 1.232 1.00 10.00 C ATOM 141 C GLY A 28 -9.442 -7.476 1.963 1.00 10.00 C ATOM 142 O GLY A 28 -9.323 -8.467 2.688 1.00 10.00 O ATOM 0 H GLY A 28 -6.587 -8.188 1.367 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -8.277 -5.823 1.258 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -8.281 -7.207 0.183 1.00 10.00 H new ATOM 146 N GLN A 29 -10.604 -6.868 1.761 1.00 10.00 N ATOM 147 CA GLN A 29 -11.825 -7.320 2.423 1.00 10.00 C ATOM 148 C GLN A 29 -12.290 -8.661 1.852 1.00 10.00 C ATOM 149 O GLN A 29 -13.185 -9.308 2.399 1.00 10.00 O ATOM 150 CB GLN A 29 -12.928 -6.262 2.292 1.00 10.00 C ATOM 151 CG GLN A 29 -14.138 -6.510 3.183 1.00 10.00 C ATOM 152 CD GLN A 29 -13.764 -6.779 4.630 1.00 10.00 C ATOM 153 OE1 GLN A 29 -13.642 -5.858 5.432 1.00 10.00 O ATOM 154 NE2 GLN A 29 -13.577 -8.046 4.972 1.00 10.00 N ATOM 0 H GLN A 29 -10.729 -6.063 1.147 1.00 10.00 H new ATOM 0 HA GLN A 29 -11.608 -7.462 3.482 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -12.509 -5.285 2.531 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -13.257 -6.223 1.254 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -14.798 -5.644 3.139 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -14.700 -7.359 2.795 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -13.688 -8.784 4.276 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -13.322 -8.283 5.931 1.00 10.00 H new ATOM 163 N ASP A 30 -11.667 -9.078 0.759 1.00 10.00 N ATOM 164 CA ASP A 30 -11.993 -10.345 0.118 1.00 10.00 C ATOM 165 C ASP A 30 -11.085 -11.445 0.651 1.00 10.00 C ATOM 166 O ASP A 30 -11.091 -12.564 0.137 1.00 10.00 O ATOM 167 CB ASP A 30 -11.832 -10.239 -1.400 1.00 10.00 C ATOM 168 CG ASP A 30 -10.379 -10.118 -1.820 1.00 10.00 C ATOM 169 OD1 ASP A 30 -9.767 -9.067 -1.544 1.00 10.00 O ATOM 170 OD2 ASP A 30 -9.851 -11.070 -2.429 1.00 10.00 O ATOM 0 H ASP A 30 -10.927 -8.553 0.294 1.00 10.00 H new ATOM 0 HA ASP A 30 -13.031 -10.588 0.345 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -12.272 -11.118 -1.872 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -12.385 -9.372 -1.762 1.00 10.00 H new ATOM 175 N SER A 31 -10.315 -11.107 1.688 1.00 10.00 N ATOM 176 CA SER A 31 -9.382 -12.039 2.321 1.00 10.00 C ATOM 177 C SER A 31 -8.215 -12.354 1.384 1.00 10.00 C ATOM 178 O SER A 31 -8.003 -13.501 0.985 1.00 10.00 O ATOM 179 CB SER A 31 -10.101 -13.321 2.758 1.00 10.00 C ATOM 180 OG SER A 31 -11.232 -13.019 3.566 1.00 10.00 O ATOM 0 H SER A 31 -10.322 -10.179 2.112 1.00 10.00 H new ATOM 0 HA SER A 31 -8.978 -11.563 3.215 1.00 10.00 H new ATOM 0 HB2 SER A 31 -10.417 -13.883 1.879 1.00 10.00 H new ATOM 0 HB3 SER A 31 -9.412 -13.958 3.313 1.00 10.00 H new ATOM 0 HG SER A 31 -11.676 -13.851 3.832 1.00 10.00 H new ATOM 186 N SER A 32 -7.469 -11.319 1.036 1.00 10.00 N ATOM 187 CA SER A 32 -6.326 -11.456 0.152 1.00 10.00 C ATOM 188 C SER A 32 -5.042 -11.047 0.870 1.00 10.00 C ATOM 189 O SER A 32 -5.088 -10.419 1.931 1.00 10.00 O ATOM 190 CB SER A 32 -6.541 -10.592 -1.091 1.00 10.00 C ATOM 191 OG SER A 32 -7.238 -9.400 -0.760 1.00 10.00 O ATOM 0 H SER A 32 -7.638 -10.366 1.357 1.00 10.00 H new ATOM 0 HA SER A 32 -6.228 -12.499 -0.148 1.00 10.00 H new ATOM 0 HB2 SER A 32 -5.578 -10.344 -1.538 1.00 10.00 H new ATOM 0 HB3 SER A 32 -7.104 -11.153 -1.837 1.00 10.00 H new ATOM 0 HG SER A 32 -8.092 -9.376 -1.240 1.00 10.00 H new ATOM 197 N GLU A 33 -3.903 -11.415 0.294 1.00 10.00 N ATOM 198 CA GLU A 33 -2.598 -11.086 0.858 1.00 10.00 C ATOM 199 C GLU A 33 -1.700 -10.531 -0.238 1.00 10.00 C ATOM 200 O GLU A 33 -0.806 -11.213 -0.735 1.00 10.00 O ATOM 201 CB GLU A 33 -1.954 -12.324 1.498 1.00 10.00 C ATOM 202 CG GLU A 33 -2.403 -12.578 2.929 1.00 10.00 C ATOM 203 CD GLU A 33 -1.930 -13.916 3.471 1.00 10.00 C ATOM 204 OE1 GLU A 33 -0.703 -14.146 3.540 1.00 10.00 O ATOM 205 OE2 GLU A 33 -2.788 -14.744 3.851 1.00 10.00 O ATOM 0 H GLU A 33 -3.857 -11.948 -0.574 1.00 10.00 H new ATOM 0 HA GLU A 33 -2.728 -10.334 1.636 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -2.190 -13.199 0.892 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -0.870 -12.208 1.482 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -2.027 -11.780 3.569 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -3.491 -12.538 2.975 1.00 10.00 H new ATOM 212 N ILE A 34 -1.957 -9.291 -0.625 1.00 10.00 N ATOM 213 CA ILE A 34 -1.186 -8.644 -1.679 1.00 10.00 C ATOM 214 C ILE A 34 0.251 -8.399 -1.229 1.00 10.00 C ATOM 215 O ILE A 34 0.489 -7.902 -0.132 1.00 10.00 O ATOM 216 CB ILE A 34 -1.827 -7.306 -2.103 1.00 10.00 C ATOM 217 CG1 ILE A 34 -3.324 -7.487 -2.394 1.00 10.00 C ATOM 218 CG2 ILE A 34 -1.111 -6.734 -3.319 1.00 10.00 C ATOM 219 CD1 ILE A 34 -3.620 -8.391 -3.574 1.00 10.00 C ATOM 0 H ILE A 34 -2.694 -8.711 -0.225 1.00 10.00 H new ATOM 0 HA ILE A 34 -1.183 -9.317 -2.536 1.00 10.00 H new ATOM 0 HB ILE A 34 -1.724 -6.601 -1.278 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -3.809 -7.895 -1.507 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -3.768 -6.509 -2.579 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -1.576 -5.790 -3.605 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.062 -6.563 -3.077 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -1.182 -7.439 -4.148 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -4.698 -8.467 -3.713 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -3.167 -7.975 -4.474 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -3.208 -9.382 -3.385 1.00 10.00 H new ATOM 231 N HIS A 35 1.200 -8.742 -2.088 1.00 10.00 N ATOM 232 CA HIS A 35 2.612 -8.571 -1.781 1.00 10.00 C ATOM 233 C HIS A 35 3.185 -7.401 -2.569 1.00 10.00 C ATOM 234 O HIS A 35 3.815 -7.590 -3.609 1.00 10.00 O ATOM 235 CB HIS A 35 3.389 -9.849 -2.108 1.00 10.00 C ATOM 236 CG HIS A 35 3.790 -10.646 -0.905 1.00 10.00 C ATOM 237 ND1 HIS A 35 3.899 -12.013 -0.962 1.00 10.00 N ATOM 238 CD2 HIS A 35 4.130 -10.225 0.336 1.00 10.00 C ATOM 239 CE1 HIS A 35 4.304 -12.392 0.237 1.00 10.00 C ATOM 240 NE2 HIS A 35 4.459 -11.344 1.060 1.00 10.00 N ATOM 0 H HIS A 35 1.016 -9.142 -3.008 1.00 10.00 H new ATOM 0 HA HIS A 35 2.710 -8.363 -0.715 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.779 -10.476 -2.759 1.00 10.00 H new ATOM 0 HB3 HIS A 35 4.285 -9.583 -2.669 1.00 10.00 H new ATOM 0 HD2 HIS A 35 4.140 -9.204 0.689 1.00 10.00 H new ATOM 0 HE1 HIS A 35 4.488 -13.418 0.520 1.00 10.00 H new ATOM 0 HE2 HIS A 35 4.762 -11.373 2.033 1.00 10.00 H new ATOM 248 N PHE A 36 2.960 -6.193 -2.084 1.00 10.00 N ATOM 249 CA PHE A 36 3.458 -5.009 -2.767 1.00 10.00 C ATOM 250 C PHE A 36 4.938 -4.803 -2.466 1.00 10.00 C ATOM 251 O PHE A 36 5.332 -4.658 -1.307 1.00 10.00 O ATOM 252 CB PHE A 36 2.653 -3.769 -2.364 1.00 10.00 C ATOM 253 CG PHE A 36 2.457 -2.796 -3.491 1.00 10.00 C ATOM 254 CD1 PHE A 36 3.543 -2.204 -4.117 1.00 10.00 C ATOM 255 CD2 PHE A 36 1.185 -2.480 -3.928 1.00 10.00 C ATOM 256 CE1 PHE A 36 3.360 -1.318 -5.158 1.00 10.00 C ATOM 257 CE2 PHE A 36 0.995 -1.593 -4.969 1.00 10.00 C ATOM 258 CZ PHE A 36 2.084 -1.011 -5.584 1.00 10.00 C ATOM 0 H PHE A 36 2.440 -6.005 -1.227 1.00 10.00 H new ATOM 0 HA PHE A 36 3.339 -5.160 -3.840 1.00 10.00 H new ATOM 0 HB2 PHE A 36 1.678 -4.083 -1.990 1.00 10.00 H new ATOM 0 HB3 PHE A 36 3.162 -3.265 -1.542 1.00 10.00 H new ATOM 0 HD1 PHE A 36 4.544 -2.439 -3.786 1.00 10.00 H new ATOM 0 HD2 PHE A 36 0.329 -2.932 -3.450 1.00 10.00 H new ATOM 0 HE1 PHE A 36 4.214 -0.865 -5.639 1.00 10.00 H new ATOM 0 HE2 PHE A 36 -0.005 -1.355 -5.301 1.00 10.00 H new ATOM 0 HZ PHE A 36 1.938 -0.316 -6.398 1.00 10.00 H new ATOM 268 N LYS A 37 5.754 -4.810 -3.514 1.00 10.00 N ATOM 269 CA LYS A 37 7.189 -4.619 -3.365 1.00 10.00 C ATOM 270 C LYS A 37 7.525 -3.140 -3.539 1.00 10.00 C ATOM 271 O LYS A 37 7.514 -2.617 -4.655 1.00 10.00 O ATOM 272 CB LYS A 37 7.945 -5.475 -4.385 1.00 10.00 C ATOM 273 CG LYS A 37 9.334 -5.883 -3.925 1.00 10.00 C ATOM 274 CD LYS A 37 9.968 -6.901 -4.864 1.00 10.00 C ATOM 275 CE LYS A 37 9.275 -8.256 -4.794 1.00 10.00 C ATOM 276 NZ LYS A 37 10.080 -9.328 -5.439 1.00 10.00 N ATOM 0 H LYS A 37 5.444 -4.946 -4.476 1.00 10.00 H new ATOM 0 HA LYS A 37 7.497 -4.934 -2.368 1.00 10.00 H new ATOM 0 HB2 LYS A 37 7.363 -6.372 -4.596 1.00 10.00 H new ATOM 0 HB3 LYS A 37 8.029 -4.922 -5.320 1.00 10.00 H new ATOM 0 HG2 LYS A 37 9.970 -5.000 -3.864 1.00 10.00 H new ATOM 0 HG3 LYS A 37 9.275 -6.303 -2.921 1.00 10.00 H new ATOM 0 HD2 LYS A 37 9.926 -6.525 -5.886 1.00 10.00 H new ATOM 0 HD3 LYS A 37 11.022 -7.020 -4.611 1.00 10.00 H new ATOM 0 HE2 LYS A 37 9.093 -8.517 -3.751 1.00 10.00 H new ATOM 0 HE3 LYS A 37 8.302 -8.191 -5.281 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 9.572 -10.233 -5.369 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 10.232 -9.093 -6.441 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 10.999 -9.409 -4.959 1.00 10.00 H new ATOM 290 N VAL A 38 7.815 -2.471 -2.433 1.00 10.00 N ATOM 291 CA VAL A 38 8.112 -1.047 -2.463 1.00 10.00 C ATOM 292 C VAL A 38 9.609 -0.763 -2.376 1.00 10.00 C ATOM 293 O VAL A 38 10.398 -1.604 -1.932 1.00 10.00 O ATOM 294 CB VAL A 38 7.389 -0.305 -1.317 1.00 10.00 C ATOM 295 CG1 VAL A 38 5.893 -0.571 -1.368 1.00 10.00 C ATOM 296 CG2 VAL A 38 7.956 -0.709 0.035 1.00 10.00 C ATOM 0 H VAL A 38 7.851 -2.891 -1.504 1.00 10.00 H new ATOM 0 HA VAL A 38 7.750 -0.681 -3.424 1.00 10.00 H new ATOM 0 HB VAL A 38 7.555 0.764 -1.449 1.00 10.00 H new ATOM 0 HG11 VAL A 38 5.401 -0.040 -0.553 1.00 10.00 H new ATOM 0 HG12 VAL A 38 5.494 -0.223 -2.321 1.00 10.00 H new ATOM 0 HG13 VAL A 38 5.710 -1.641 -1.267 1.00 10.00 H new ATOM 0 HG21 VAL A 38 7.430 -0.173 0.825 1.00 10.00 H new ATOM 0 HG22 VAL A 38 7.828 -1.782 0.177 1.00 10.00 H new ATOM 0 HG23 VAL A 38 9.017 -0.462 0.073 1.00 10.00 H new ATOM 306 N LYS A 39 9.986 0.436 -2.806 1.00 10.00 N ATOM 307 CA LYS A 39 11.372 0.878 -2.770 1.00 10.00 C ATOM 308 C LYS A 39 11.601 1.703 -1.509 1.00 10.00 C ATOM 309 O LYS A 39 10.849 2.638 -1.227 1.00 10.00 O ATOM 310 CB LYS A 39 11.702 1.703 -4.020 1.00 10.00 C ATOM 311 CG LYS A 39 13.170 2.082 -4.138 1.00 10.00 C ATOM 312 CD LYS A 39 13.447 2.839 -5.429 1.00 10.00 C ATOM 313 CE LYS A 39 14.870 3.374 -5.473 1.00 10.00 C ATOM 314 NZ LYS A 39 15.121 4.200 -6.683 1.00 10.00 N ATOM 0 H LYS A 39 9.340 1.126 -3.188 1.00 10.00 H new ATOM 0 HA LYS A 39 12.030 0.009 -2.756 1.00 10.00 H new ATOM 0 HB2 LYS A 39 11.411 1.137 -4.905 1.00 10.00 H new ATOM 0 HB3 LYS A 39 11.101 2.613 -4.012 1.00 10.00 H new ATOM 0 HG2 LYS A 39 13.458 2.697 -3.285 1.00 10.00 H new ATOM 0 HG3 LYS A 39 13.783 1.182 -4.104 1.00 10.00 H new ATOM 0 HD2 LYS A 39 13.280 2.180 -6.281 1.00 10.00 H new ATOM 0 HD3 LYS A 39 12.744 3.667 -5.524 1.00 10.00 H new ATOM 0 HE2 LYS A 39 15.060 3.972 -4.581 1.00 10.00 H new ATOM 0 HE3 LYS A 39 15.571 2.540 -5.453 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 16.103 4.543 -6.671 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 14.966 3.624 -7.535 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 14.470 5.011 -6.691 1.00 10.00 H new ATOM 328 N MET A 40 12.635 1.362 -0.756 1.00 10.00 N ATOM 329 CA MET A 40 12.925 2.058 0.493 1.00 10.00 C ATOM 330 C MET A 40 13.603 3.412 0.259 1.00 10.00 C ATOM 331 O MET A 40 14.803 3.565 0.480 1.00 10.00 O ATOM 332 CB MET A 40 13.782 1.178 1.409 1.00 10.00 C ATOM 333 CG MET A 40 13.973 1.750 2.807 1.00 10.00 C ATOM 334 SD MET A 40 12.418 2.166 3.623 1.00 10.00 S ATOM 335 CE MET A 40 11.850 0.543 4.127 1.00 10.00 C ATOM 0 H MET A 40 13.286 0.611 -0.984 1.00 10.00 H new ATOM 0 HA MET A 40 11.971 2.257 0.981 1.00 10.00 H new ATOM 0 HB2 MET A 40 13.319 0.194 1.489 1.00 10.00 H new ATOM 0 HB3 MET A 40 14.759 1.034 0.949 1.00 10.00 H new ATOM 0 HG2 MET A 40 14.514 1.027 3.418 1.00 10.00 H new ATOM 0 HG3 MET A 40 14.594 2.644 2.745 1.00 10.00 H new ATOM 0 HE1 MET A 40 11.302 0.625 5.066 1.00 10.00 H new ATOM 0 HE2 MET A 40 11.195 0.132 3.359 1.00 10.00 H new ATOM 0 HE3 MET A 40 12.707 -0.116 4.264 1.00 10.00 H new ATOM 345 N THR A 41 12.811 4.380 -0.195 1.00 10.00 N ATOM 346 CA THR A 41 13.278 5.743 -0.442 1.00 10.00 C ATOM 347 C THR A 41 12.194 6.537 -1.165 1.00 10.00 C ATOM 348 O THR A 41 12.070 7.747 -0.976 1.00 10.00 O ATOM 349 CB THR A 41 14.607 5.804 -1.248 1.00 10.00 C ATOM 350 OG1 THR A 41 15.209 7.099 -1.103 1.00 10.00 O ATOM 351 CG2 THR A 41 14.394 5.516 -2.726 1.00 10.00 C ATOM 0 H THR A 41 11.822 4.241 -0.403 1.00 10.00 H new ATOM 0 HA THR A 41 13.486 6.185 0.533 1.00 10.00 H new ATOM 0 HB THR A 41 15.265 5.034 -0.845 1.00 10.00 H new ATOM 0 HG1 THR A 41 16.046 7.129 -1.612 1.00 10.00 H new ATOM 0 HG21 THR A 41 15.349 5.570 -3.248 1.00 10.00 H new ATOM 0 HG22 THR A 41 13.971 4.519 -2.845 1.00 10.00 H new ATOM 0 HG23 THR A 41 13.709 6.253 -3.145 1.00 10.00 H new ATOM 359 N THR A 42 11.404 5.844 -1.975 1.00 10.00 N ATOM 360 CA THR A 42 10.329 6.477 -2.714 1.00 10.00 C ATOM 361 C THR A 42 9.138 6.734 -1.798 1.00 10.00 C ATOM 362 O THR A 42 8.806 5.899 -0.954 1.00 10.00 O ATOM 363 CB THR A 42 9.878 5.592 -3.893 1.00 10.00 C ATOM 364 OG1 THR A 42 11.027 5.107 -4.600 1.00 10.00 O ATOM 365 CG2 THR A 42 8.974 6.361 -4.847 1.00 10.00 C ATOM 0 H THR A 42 11.491 4.840 -2.134 1.00 10.00 H new ATOM 0 HA THR A 42 10.703 7.424 -3.103 1.00 10.00 H new ATOM 0 HB THR A 42 9.311 4.752 -3.491 1.00 10.00 H new ATOM 0 HG1 THR A 42 10.737 4.544 -5.348 1.00 10.00 H new ATOM 0 HG21 THR A 42 8.673 5.710 -5.668 1.00 10.00 H new ATOM 0 HG22 THR A 42 8.088 6.704 -4.312 1.00 10.00 H new ATOM 0 HG23 THR A 42 9.513 7.221 -5.245 1.00 10.00 H new ATOM 373 N HIS A 43 8.518 7.897 -1.944 1.00 10.00 N ATOM 374 CA HIS A 43 7.359 8.239 -1.139 1.00 10.00 C ATOM 375 C HIS A 43 6.203 7.312 -1.481 1.00 10.00 C ATOM 376 O HIS A 43 6.032 6.923 -2.640 1.00 10.00 O ATOM 377 CB HIS A 43 6.959 9.698 -1.355 1.00 10.00 C ATOM 378 CG HIS A 43 7.488 10.613 -0.294 1.00 10.00 C ATOM 379 ND1 HIS A 43 8.554 11.446 -0.529 1.00 10.00 N ATOM 380 CD2 HIS A 43 7.070 10.779 0.984 1.00 10.00 C ATOM 381 CE1 HIS A 43 8.764 12.094 0.606 1.00 10.00 C ATOM 382 NE2 HIS A 43 7.889 11.722 1.550 1.00 10.00 N ATOM 0 H HIS A 43 8.799 8.616 -2.611 1.00 10.00 H new ATOM 0 HA HIS A 43 7.615 8.114 -0.087 1.00 10.00 H new ATOM 0 HB2 HIS A 43 7.324 10.029 -2.327 1.00 10.00 H new ATOM 0 HB3 HIS A 43 5.872 9.771 -1.381 1.00 10.00 H new ATOM 0 HD2 HIS A 43 6.249 10.267 1.465 1.00 10.00 H new ATOM 0 HE1 HIS A 43 9.542 12.829 0.752 1.00 10.00 H new ATOM 0 HE2 HIS A 43 7.841 12.073 2.507 1.00 10.00 H new ATOM 390 N LEU A 44 5.401 6.977 -0.479 1.00 10.00 N ATOM 391 CA LEU A 44 4.272 6.072 -0.662 1.00 10.00 C ATOM 392 C LEU A 44 3.223 6.649 -1.610 1.00 10.00 C ATOM 393 O LEU A 44 2.300 5.947 -2.014 1.00 10.00 O ATOM 394 CB LEU A 44 3.648 5.714 0.687 1.00 10.00 C ATOM 395 CG LEU A 44 4.479 4.743 1.530 1.00 10.00 C ATOM 396 CD1 LEU A 44 3.891 4.596 2.921 1.00 10.00 C ATOM 397 CD2 LEU A 44 4.573 3.385 0.847 1.00 10.00 C ATOM 0 H LEU A 44 5.512 7.320 0.475 1.00 10.00 H new ATOM 0 HA LEU A 44 4.654 5.161 -1.123 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.493 6.630 1.257 1.00 10.00 H new ATOM 0 HB3 LEU A 44 2.665 5.276 0.514 1.00 10.00 H new ATOM 0 HG LEU A 44 5.484 5.153 1.625 1.00 10.00 H new ATOM 0 HD11 LEU A 44 4.498 3.901 3.501 1.00 10.00 H new ATOM 0 HD12 LEU A 44 3.879 5.567 3.415 1.00 10.00 H new ATOM 0 HD13 LEU A 44 2.873 4.213 2.847 1.00 10.00 H new ATOM 0 HD21 LEU A 44 5.167 2.709 1.462 1.00 10.00 H new ATOM 0 HD22 LEU A 44 3.572 2.973 0.718 1.00 10.00 H new ATOM 0 HD23 LEU A 44 5.047 3.500 -0.128 1.00 10.00 H new ATOM 409 N LYS A 45 3.384 7.914 -1.978 1.00 10.00 N ATOM 410 CA LYS A 45 2.468 8.568 -2.903 1.00 10.00 C ATOM 411 C LYS A 45 2.433 7.806 -4.229 1.00 10.00 C ATOM 412 O LYS A 45 1.362 7.534 -4.771 1.00 10.00 O ATOM 413 CB LYS A 45 2.907 10.019 -3.134 1.00 10.00 C ATOM 414 CG LYS A 45 2.199 10.714 -4.296 1.00 10.00 C ATOM 415 CD LYS A 45 0.698 10.801 -4.074 1.00 10.00 C ATOM 416 CE LYS A 45 0.028 11.714 -5.090 1.00 10.00 C ATOM 417 NZ LYS A 45 -1.415 11.917 -4.788 1.00 10.00 N ATOM 0 H LYS A 45 4.144 8.509 -1.648 1.00 10.00 H new ATOM 0 HA LYS A 45 1.466 8.569 -2.473 1.00 10.00 H new ATOM 0 HB2 LYS A 45 2.729 10.589 -2.222 1.00 10.00 H new ATOM 0 HB3 LYS A 45 3.982 10.036 -3.316 1.00 10.00 H new ATOM 0 HG2 LYS A 45 2.606 11.717 -4.422 1.00 10.00 H new ATOM 0 HG3 LYS A 45 2.399 10.171 -5.220 1.00 10.00 H new ATOM 0 HD2 LYS A 45 0.263 9.804 -4.139 1.00 10.00 H new ATOM 0 HD3 LYS A 45 0.500 11.170 -3.068 1.00 10.00 H new ATOM 0 HE2 LYS A 45 0.536 12.679 -5.101 1.00 10.00 H new ATOM 0 HE3 LYS A 45 0.133 11.287 -6.087 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 -1.723 12.835 -5.167 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 -1.972 11.156 -5.227 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 -1.560 11.902 -3.758 1.00 10.00 H new ATOM 431 N LYS A 46 3.614 7.422 -4.712 1.00 10.00 N ATOM 432 CA LYS A 46 3.735 6.702 -5.975 1.00 10.00 C ATOM 433 C LYS A 46 3.265 5.255 -5.830 1.00 10.00 C ATOM 434 O LYS A 46 2.891 4.609 -6.809 1.00 10.00 O ATOM 435 CB LYS A 46 5.188 6.731 -6.466 1.00 10.00 C ATOM 436 CG LYS A 46 5.330 6.595 -7.976 1.00 10.00 C ATOM 437 CD LYS A 46 4.899 7.864 -8.695 1.00 10.00 C ATOM 438 CE LYS A 46 4.972 7.708 -10.205 1.00 10.00 C ATOM 439 NZ LYS A 46 3.953 6.756 -10.722 1.00 10.00 N ATOM 0 H LYS A 46 4.503 7.599 -4.244 1.00 10.00 H new ATOM 0 HA LYS A 46 3.098 7.199 -6.707 1.00 10.00 H new ATOM 0 HB2 LYS A 46 5.650 7.666 -6.150 1.00 10.00 H new ATOM 0 HB3 LYS A 46 5.740 5.924 -5.984 1.00 10.00 H new ATOM 0 HG2 LYS A 46 6.367 6.369 -8.226 1.00 10.00 H new ATOM 0 HG3 LYS A 46 4.728 5.756 -8.325 1.00 10.00 H new ATOM 0 HD2 LYS A 46 3.880 8.118 -8.404 1.00 10.00 H new ATOM 0 HD3 LYS A 46 5.535 8.692 -8.384 1.00 10.00 H new ATOM 0 HE2 LYS A 46 4.830 8.681 -10.676 1.00 10.00 H new ATOM 0 HE3 LYS A 46 5.966 7.360 -10.485 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 3.691 7.021 -11.693 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 4.345 5.793 -10.720 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 3.109 6.788 -10.115 1.00 10.00 H new ATOM 453 N LEU A 47 3.282 4.750 -4.606 1.00 10.00 N ATOM 454 CA LEU A 47 2.861 3.382 -4.340 1.00 10.00 C ATOM 455 C LEU A 47 1.343 3.302 -4.221 1.00 10.00 C ATOM 456 O LEU A 47 0.712 2.403 -4.777 1.00 10.00 O ATOM 457 CB LEU A 47 3.516 2.853 -3.054 1.00 10.00 C ATOM 458 CG LEU A 47 4.992 2.435 -3.169 1.00 10.00 C ATOM 459 CD1 LEU A 47 5.205 1.520 -4.363 1.00 10.00 C ATOM 460 CD2 LEU A 47 5.903 3.650 -3.258 1.00 10.00 C ATOM 0 H LEU A 47 3.583 5.267 -3.780 1.00 10.00 H new ATOM 0 HA LEU A 47 3.181 2.761 -5.177 1.00 10.00 H new ATOM 0 HB2 LEU A 47 3.436 3.623 -2.287 1.00 10.00 H new ATOM 0 HB3 LEU A 47 2.942 1.994 -2.705 1.00 10.00 H new ATOM 0 HG LEU A 47 5.251 1.885 -2.264 1.00 10.00 H new ATOM 0 HD11 LEU A 47 6.256 1.238 -4.423 1.00 10.00 H new ATOM 0 HD12 LEU A 47 4.595 0.624 -4.248 1.00 10.00 H new ATOM 0 HD13 LEU A 47 4.916 2.040 -5.276 1.00 10.00 H new ATOM 0 HD21 LEU A 47 6.940 3.322 -3.338 1.00 10.00 H new ATOM 0 HD22 LEU A 47 5.639 4.239 -4.137 1.00 10.00 H new ATOM 0 HD23 LEU A 47 5.784 4.261 -2.363 1.00 10.00 H new ATOM 472 N LYS A 48 0.766 4.262 -3.506 1.00 10.00 N ATOM 473 CA LYS A 48 -0.675 4.309 -3.293 1.00 10.00 C ATOM 474 C LYS A 48 -1.433 4.451 -4.611 1.00 10.00 C ATOM 475 O LYS A 48 -2.441 3.774 -4.828 1.00 10.00 O ATOM 476 CB LYS A 48 -1.034 5.461 -2.349 1.00 10.00 C ATOM 477 CG LYS A 48 -0.547 5.254 -0.920 1.00 10.00 C ATOM 478 CD LYS A 48 -0.629 6.536 -0.102 1.00 10.00 C ATOM 479 CE LYS A 48 -2.056 6.848 0.316 1.00 10.00 C ATOM 480 NZ LYS A 48 -2.149 8.139 1.046 1.00 10.00 N ATOM 0 H LYS A 48 1.279 5.023 -3.061 1.00 10.00 H new ATOM 0 HA LYS A 48 -0.975 3.366 -2.837 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -0.608 6.385 -2.739 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -2.117 5.588 -2.340 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -1.145 4.479 -0.441 1.00 10.00 H new ATOM 0 HG3 LYS A 48 0.483 4.898 -0.935 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -0.003 6.442 0.785 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -0.232 7.366 -0.686 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -2.694 6.883 -0.567 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -2.433 6.045 0.949 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -3.141 8.450 1.076 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -1.795 8.016 2.016 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -1.576 8.856 0.557 1.00 10.00 H new ATOM 494 N GLU A 49 -0.946 5.321 -5.493 1.00 10.00 N ATOM 495 CA GLU A 49 -1.598 5.531 -6.781 1.00 10.00 C ATOM 496 C GLU A 49 -1.519 4.270 -7.638 1.00 10.00 C ATOM 497 O GLU A 49 -2.490 3.899 -8.297 1.00 10.00 O ATOM 498 CB GLU A 49 -0.986 6.725 -7.526 1.00 10.00 C ATOM 499 CG GLU A 49 0.526 6.660 -7.676 1.00 10.00 C ATOM 500 CD GLU A 49 1.072 7.749 -8.577 1.00 10.00 C ATOM 501 OE1 GLU A 49 0.927 8.942 -8.242 1.00 10.00 O ATOM 502 OE2 GLU A 49 1.646 7.419 -9.633 1.00 10.00 O ATOM 0 H GLU A 49 -0.111 5.886 -5.341 1.00 10.00 H new ATOM 0 HA GLU A 49 -2.647 5.755 -6.589 1.00 10.00 H new ATOM 0 HB2 GLU A 49 -1.435 6.789 -8.517 1.00 10.00 H new ATOM 0 HB3 GLU A 49 -1.248 7.641 -6.997 1.00 10.00 H new ATOM 0 HG2 GLU A 49 0.988 6.742 -6.692 1.00 10.00 H new ATOM 0 HG3 GLU A 49 0.805 5.687 -8.079 1.00 10.00 H new ATOM 509 N SER A 50 -0.374 3.599 -7.594 1.00 10.00 N ATOM 510 CA SER A 50 -0.169 2.379 -8.364 1.00 10.00 C ATOM 511 C SER A 50 -1.139 1.281 -7.922 1.00 10.00 C ATOM 512 O SER A 50 -1.645 0.520 -8.748 1.00 10.00 O ATOM 513 CB SER A 50 1.277 1.905 -8.226 1.00 10.00 C ATOM 514 OG SER A 50 2.178 2.878 -8.729 1.00 10.00 O ATOM 0 H SER A 50 0.429 3.881 -7.031 1.00 10.00 H new ATOM 0 HA SER A 50 -0.368 2.599 -9.413 1.00 10.00 H new ATOM 0 HB2 SER A 50 1.500 1.704 -7.178 1.00 10.00 H new ATOM 0 HB3 SER A 50 1.410 0.967 -8.765 1.00 10.00 H new ATOM 0 HG SER A 50 2.311 3.579 -8.057 1.00 10.00 H new ATOM 520 N TYR A 51 -1.401 1.216 -6.620 1.00 10.00 N ATOM 521 CA TYR A 51 -2.318 0.222 -6.076 1.00 10.00 C ATOM 522 C TYR A 51 -3.728 0.469 -6.598 1.00 10.00 C ATOM 523 O TYR A 51 -4.415 -0.462 -7.026 1.00 10.00 O ATOM 524 CB TYR A 51 -2.313 0.260 -4.545 1.00 10.00 C ATOM 525 CG TYR A 51 -3.072 -0.885 -3.907 1.00 10.00 C ATOM 526 CD1 TYR A 51 -2.479 -2.130 -3.748 1.00 10.00 C ATOM 527 CD2 TYR A 51 -4.381 -0.721 -3.468 1.00 10.00 C ATOM 528 CE1 TYR A 51 -3.164 -3.177 -3.162 1.00 10.00 C ATOM 529 CE2 TYR A 51 -5.072 -1.765 -2.881 1.00 10.00 C ATOM 530 CZ TYR A 51 -4.458 -2.991 -2.733 1.00 10.00 C ATOM 531 OH TYR A 51 -5.139 -4.032 -2.150 1.00 10.00 O ATOM 0 H TYR A 51 -0.992 1.839 -5.924 1.00 10.00 H new ATOM 0 HA TYR A 51 -1.985 -0.765 -6.398 1.00 10.00 H new ATOM 0 HB2 TYR A 51 -1.282 0.242 -4.193 1.00 10.00 H new ATOM 0 HB3 TYR A 51 -2.747 1.203 -4.212 1.00 10.00 H new ATOM 0 HD1 TYR A 51 -1.465 -2.283 -4.088 1.00 10.00 H new ATOM 0 HD2 TYR A 51 -4.866 0.237 -3.587 1.00 10.00 H new ATOM 0 HE1 TYR A 51 -2.686 -4.138 -3.041 1.00 10.00 H new ATOM 0 HE2 TYR A 51 -6.087 -1.621 -2.540 1.00 10.00 H new ATOM 0 HH TYR A 51 -4.505 -4.621 -1.691 1.00 10.00 H new ATOM 541 N CYS A 52 -4.144 1.731 -6.574 1.00 10.00 N ATOM 542 CA CYS A 52 -5.467 2.112 -7.048 1.00 10.00 C ATOM 543 C CYS A 52 -5.610 1.792 -8.533 1.00 10.00 C ATOM 544 O CYS A 52 -6.626 1.251 -8.971 1.00 10.00 O ATOM 545 CB CYS A 52 -5.711 3.604 -6.806 1.00 10.00 C ATOM 546 SG CYS A 52 -5.376 4.147 -5.113 1.00 10.00 S ATOM 0 H CYS A 52 -3.581 2.509 -6.230 1.00 10.00 H new ATOM 0 HA CYS A 52 -6.211 1.541 -6.492 1.00 10.00 H new ATOM 0 HB2 CYS A 52 -5.086 4.178 -7.490 1.00 10.00 H new ATOM 0 HB3 CYS A 52 -6.748 3.835 -7.051 1.00 10.00 H new ATOM 0 HG CYS A 52 -4.186 3.759 -4.760 1.00 10.00 H new ATOM 552 N GLN A 53 -4.570 2.104 -9.296 1.00 10.00 N ATOM 553 CA GLN A 53 -4.570 1.857 -10.729 1.00 10.00 C ATOM 554 C GLN A 53 -4.680 0.363 -11.032 1.00 10.00 C ATOM 555 O GLN A 53 -5.409 -0.035 -11.939 1.00 10.00 O ATOM 556 CB GLN A 53 -3.310 2.446 -11.363 1.00 10.00 C ATOM 557 CG GLN A 53 -3.329 3.966 -11.420 1.00 10.00 C ATOM 558 CD GLN A 53 -1.984 4.569 -11.772 1.00 10.00 C ATOM 559 OE1 GLN A 53 -0.933 4.017 -11.446 1.00 10.00 O ATOM 560 NE2 GLN A 53 -2.010 5.708 -12.444 1.00 10.00 N ATOM 0 H GLN A 53 -3.713 2.530 -8.943 1.00 10.00 H new ATOM 0 HA GLN A 53 -5.443 2.347 -11.161 1.00 10.00 H new ATOM 0 HB2 GLN A 53 -2.438 2.120 -10.796 1.00 10.00 H new ATOM 0 HB3 GLN A 53 -3.199 2.051 -12.373 1.00 10.00 H new ATOM 0 HG2 GLN A 53 -4.067 4.286 -12.156 1.00 10.00 H new ATOM 0 HG3 GLN A 53 -3.652 4.355 -10.454 1.00 10.00 H new ATOM 0 HE21 GLN A 53 -2.903 6.132 -12.695 1.00 10.00 H new ATOM 0 HE22 GLN A 53 -1.137 6.162 -12.712 1.00 10.00 H new ATOM 569 N ARG A 54 -3.975 -0.456 -10.257 1.00 10.00 N ATOM 570 CA ARG A 54 -4.011 -1.904 -10.450 1.00 10.00 C ATOM 571 C ARG A 54 -5.406 -2.454 -10.164 1.00 10.00 C ATOM 572 O ARG A 54 -5.864 -3.391 -10.818 1.00 10.00 O ATOM 573 CB ARG A 54 -2.981 -2.601 -9.552 1.00 10.00 C ATOM 574 CG ARG A 54 -2.957 -4.116 -9.717 1.00 10.00 C ATOM 575 CD ARG A 54 -3.274 -4.826 -8.409 1.00 10.00 C ATOM 576 NE ARG A 54 -3.783 -6.186 -8.620 1.00 10.00 N ATOM 577 CZ ARG A 54 -3.023 -7.285 -8.624 1.00 10.00 C ATOM 578 NH1 ARG A 54 -1.711 -7.194 -8.449 1.00 10.00 N ATOM 579 NH2 ARG A 54 -3.580 -8.478 -8.807 1.00 10.00 N ATOM 0 H ARG A 54 -3.375 -0.145 -9.493 1.00 10.00 H new ATOM 0 HA ARG A 54 -3.760 -2.107 -11.491 1.00 10.00 H new ATOM 0 HB2 ARG A 54 -1.990 -2.204 -9.773 1.00 10.00 H new ATOM 0 HB3 ARG A 54 -3.196 -2.360 -8.511 1.00 10.00 H new ATOM 0 HG2 ARG A 54 -3.680 -4.411 -10.477 1.00 10.00 H new ATOM 0 HG3 ARG A 54 -1.975 -4.429 -10.073 1.00 10.00 H new ATOM 0 HD2 ARG A 54 -2.375 -4.869 -7.795 1.00 10.00 H new ATOM 0 HD3 ARG A 54 -4.012 -4.247 -7.854 1.00 10.00 H new ATOM 0 HE ARG A 54 -4.785 -6.300 -8.774 1.00 10.00 H new ATOM 0 HH11 ARG A 54 -1.277 -6.281 -8.310 1.00 10.00 H new ATOM 0 HH12 ARG A 54 -1.136 -8.037 -8.453 1.00 10.00 H new ATOM 0 HH21 ARG A 54 -4.588 -8.555 -8.944 1.00 10.00 H new ATOM 0 HH22 ARG A 54 -3.000 -9.317 -8.810 1.00 10.00 H new ATOM 593 N GLN A 55 -6.080 -1.865 -9.183 1.00 10.00 N ATOM 594 CA GLN A 55 -7.422 -2.299 -8.818 1.00 10.00 C ATOM 595 C GLN A 55 -8.459 -1.738 -9.788 1.00 10.00 C ATOM 596 O GLN A 55 -9.624 -2.139 -9.766 1.00 10.00 O ATOM 597 CB GLN A 55 -7.753 -1.872 -7.388 1.00 10.00 C ATOM 598 CG GLN A 55 -6.938 -2.599 -6.327 1.00 10.00 C ATOM 599 CD GLN A 55 -7.031 -4.111 -6.451 1.00 10.00 C ATOM 600 OE1 GLN A 55 -6.218 -4.744 -7.122 1.00 10.00 O ATOM 601 NE2 GLN A 55 -8.024 -4.698 -5.801 1.00 10.00 N ATOM 0 H GLN A 55 -5.720 -1.088 -8.628 1.00 10.00 H new ATOM 0 HA GLN A 55 -7.451 -3.387 -8.875 1.00 10.00 H new ATOM 0 HB2 GLN A 55 -7.585 -0.799 -7.291 1.00 10.00 H new ATOM 0 HB3 GLN A 55 -8.813 -2.047 -7.202 1.00 10.00 H new ATOM 0 HG2 GLN A 55 -5.894 -2.296 -6.405 1.00 10.00 H new ATOM 0 HG3 GLN A 55 -7.284 -2.297 -5.338 1.00 10.00 H new ATOM 0 HE21 GLN A 55 -8.678 -4.137 -5.255 1.00 10.00 H new ATOM 0 HE22 GLN A 55 -8.135 -5.711 -5.846 1.00 10.00 H new ATOM 610 N GLY A 56 -8.031 -0.810 -10.634 1.00 10.00 N ATOM 611 CA GLY A 56 -8.926 -0.215 -11.605 1.00 10.00 C ATOM 612 C GLY A 56 -9.787 0.880 -11.013 1.00 10.00 C ATOM 613 O GLY A 56 -10.936 1.058 -11.412 1.00 10.00 O ATOM 0 H GLY A 56 -7.074 -0.458 -10.664 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -8.341 0.194 -12.429 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -9.568 -0.990 -12.024 1.00 10.00 H new ATOM 617 N VAL A 57 -9.241 1.612 -10.056 1.00 10.00 N ATOM 618 CA VAL A 57 -9.968 2.701 -9.418 1.00 10.00 C ATOM 619 C VAL A 57 -9.089 3.940 -9.306 1.00 10.00 C ATOM 620 O VAL A 57 -7.861 3.843 -9.371 1.00 10.00 O ATOM 621 CB VAL A 57 -10.471 2.309 -8.006 1.00 10.00 C ATOM 622 CG1 VAL A 57 -11.721 1.446 -8.100 1.00 10.00 C ATOM 623 CG2 VAL A 57 -9.381 1.596 -7.215 1.00 10.00 C ATOM 0 H VAL A 57 -8.295 1.473 -9.702 1.00 10.00 H new ATOM 0 HA VAL A 57 -10.832 2.916 -10.047 1.00 10.00 H new ATOM 0 HB VAL A 57 -10.727 3.225 -7.474 1.00 10.00 H new ATOM 0 HG11 VAL A 57 -12.057 1.182 -7.097 1.00 10.00 H new ATOM 0 HG12 VAL A 57 -12.508 2.000 -8.613 1.00 10.00 H new ATOM 0 HG13 VAL A 57 -11.495 0.537 -8.658 1.00 10.00 H new ATOM 0 HG21 VAL A 57 -9.761 1.332 -6.228 1.00 10.00 H new ATOM 0 HG22 VAL A 57 -9.082 0.690 -7.743 1.00 10.00 H new ATOM 0 HG23 VAL A 57 -8.519 2.255 -7.108 1.00 10.00 H new ATOM 633 N PRO A 58 -9.696 5.129 -9.174 1.00 10.00 N ATOM 634 CA PRO A 58 -8.947 6.378 -9.027 1.00 10.00 C ATOM 635 C PRO A 58 -8.297 6.460 -7.650 1.00 10.00 C ATOM 636 O PRO A 58 -8.628 5.682 -6.756 1.00 10.00 O ATOM 637 CB PRO A 58 -10.020 7.460 -9.185 1.00 10.00 C ATOM 638 CG PRO A 58 -11.289 6.800 -8.775 1.00 10.00 C ATOM 639 CD PRO A 58 -11.156 5.354 -9.170 1.00 10.00 C ATOM 0 HA PRO A 58 -8.136 6.474 -9.749 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -9.804 8.326 -8.559 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -10.074 7.816 -10.214 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -11.449 6.897 -7.701 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -12.145 7.261 -9.268 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -11.661 4.697 -8.462 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -11.594 5.164 -10.150 1.00 10.00 H new ATOM 647 N MET A 59 -7.378 7.391 -7.469 1.00 10.00 N ATOM 648 CA MET A 59 -6.708 7.532 -6.186 1.00 10.00 C ATOM 649 C MET A 59 -7.625 8.217 -5.175 1.00 10.00 C ATOM 650 O MET A 59 -8.583 8.892 -5.556 1.00 10.00 O ATOM 651 CB MET A 59 -5.403 8.319 -6.333 1.00 10.00 C ATOM 652 CG MET A 59 -4.433 8.082 -5.186 1.00 10.00 C ATOM 653 SD MET A 59 -3.094 9.283 -5.126 1.00 10.00 S ATOM 654 CE MET A 59 -2.294 8.779 -3.606 1.00 10.00 C ATOM 0 H MET A 59 -7.080 8.054 -8.184 1.00 10.00 H new ATOM 0 HA MET A 59 -6.467 6.533 -5.821 1.00 10.00 H new ATOM 0 HB2 MET A 59 -4.922 8.042 -7.271 1.00 10.00 H new ATOM 0 HB3 MET A 59 -5.632 9.383 -6.394 1.00 10.00 H new ATOM 0 HG2 MET A 59 -4.981 8.112 -4.244 1.00 10.00 H new ATOM 0 HG3 MET A 59 -4.010 7.081 -5.278 1.00 10.00 H new ATOM 0 HE1 MET A 59 -1.770 9.630 -3.171 1.00 10.00 H new ATOM 0 HE2 MET A 59 -3.044 8.417 -2.903 1.00 10.00 H new ATOM 0 HE3 MET A 59 -1.580 7.983 -3.817 1.00 10.00 H new ATOM 664 N ASN A 60 -7.331 8.001 -3.891 1.00 10.00 N ATOM 665 CA ASN A 60 -8.091 8.586 -2.780 1.00 10.00 C ATOM 666 C ASN A 60 -9.440 7.898 -2.597 1.00 10.00 C ATOM 667 O ASN A 60 -10.298 8.383 -1.860 1.00 10.00 O ATOM 668 CB ASN A 60 -8.281 10.097 -2.958 1.00 10.00 C ATOM 669 CG ASN A 60 -7.053 10.888 -2.551 1.00 10.00 C ATOM 670 OD1 ASN A 60 -6.120 11.061 -3.335 1.00 10.00 O ATOM 671 ND2 ASN A 60 -7.048 11.382 -1.322 1.00 10.00 N ATOM 0 H ASN A 60 -6.555 7.412 -3.589 1.00 10.00 H new ATOM 0 HA ASN A 60 -7.503 8.423 -1.877 1.00 10.00 H new ATOM 0 HB2 ASN A 60 -8.517 10.310 -4.001 1.00 10.00 H new ATOM 0 HB3 ASN A 60 -9.134 10.425 -2.364 1.00 10.00 H new ATOM 0 HD21 ASN A 60 -6.251 11.928 -0.995 1.00 10.00 H new ATOM 0 HD22 ASN A 60 -7.841 11.216 -0.702 1.00 10.00 H new ATOM 678 N SER A 61 -9.622 6.772 -3.268 1.00 10.00 N ATOM 679 CA SER A 61 -10.854 6.009 -3.152 1.00 10.00 C ATOM 680 C SER A 61 -10.717 5.012 -2.010 1.00 10.00 C ATOM 681 O SER A 61 -11.659 4.768 -1.248 1.00 10.00 O ATOM 682 CB SER A 61 -11.138 5.272 -4.459 1.00 10.00 C ATOM 683 OG SER A 61 -10.001 4.532 -4.876 1.00 10.00 O ATOM 0 H SER A 61 -8.931 6.366 -3.899 1.00 10.00 H new ATOM 0 HA SER A 61 -11.684 6.686 -2.947 1.00 10.00 H new ATOM 0 HB2 SER A 61 -11.986 4.600 -4.326 1.00 10.00 H new ATOM 0 HB3 SER A 61 -11.416 5.988 -5.233 1.00 10.00 H new ATOM 0 HG SER A 61 -9.664 4.898 -5.720 1.00 10.00 H new ATOM 689 N LEU A 62 -9.521 4.454 -1.898 1.00 10.00 N ATOM 690 CA LEU A 62 -9.209 3.482 -0.871 1.00 10.00 C ATOM 691 C LEU A 62 -8.236 4.078 0.140 1.00 10.00 C ATOM 692 O LEU A 62 -7.253 4.722 -0.230 1.00 10.00 O ATOM 693 CB LEU A 62 -8.599 2.230 -1.504 1.00 10.00 C ATOM 694 CG LEU A 62 -9.488 1.510 -2.521 1.00 10.00 C ATOM 695 CD1 LEU A 62 -8.666 0.535 -3.353 1.00 10.00 C ATOM 696 CD2 LEU A 62 -10.628 0.784 -1.820 1.00 10.00 C ATOM 0 H LEU A 62 -8.741 4.665 -2.520 1.00 10.00 H new ATOM 0 HA LEU A 62 -10.130 3.209 -0.356 1.00 10.00 H new ATOM 0 HB2 LEU A 62 -7.667 2.509 -1.995 1.00 10.00 H new ATOM 0 HB3 LEU A 62 -8.344 1.529 -0.709 1.00 10.00 H new ATOM 0 HG LEU A 62 -9.917 2.257 -3.189 1.00 10.00 H new ATOM 0 HD11 LEU A 62 -9.315 0.032 -4.071 1.00 10.00 H new ATOM 0 HD12 LEU A 62 -7.887 1.079 -3.887 1.00 10.00 H new ATOM 0 HD13 LEU A 62 -8.207 -0.205 -2.698 1.00 10.00 H new ATOM 0 HD21 LEU A 62 -11.248 0.279 -2.561 1.00 10.00 H new ATOM 0 HD22 LEU A 62 -10.219 0.049 -1.127 1.00 10.00 H new ATOM 0 HD23 LEU A 62 -11.234 1.504 -1.270 1.00 10.00 H new ATOM 708 N ARG A 63 -8.521 3.867 1.413 1.00 10.00 N ATOM 709 CA ARG A 63 -7.678 4.369 2.480 1.00 10.00 C ATOM 710 C ARG A 63 -6.805 3.250 3.036 1.00 10.00 C ATOM 711 O ARG A 63 -7.288 2.146 3.304 1.00 10.00 O ATOM 712 CB ARG A 63 -8.522 4.985 3.605 1.00 10.00 C ATOM 713 CG ARG A 63 -9.562 4.040 4.196 1.00 10.00 C ATOM 714 CD ARG A 63 -10.098 4.560 5.521 1.00 10.00 C ATOM 715 NE ARG A 63 -11.240 3.783 6.002 1.00 10.00 N ATOM 716 CZ ARG A 63 -12.500 4.222 5.987 1.00 10.00 C ATOM 717 NH1 ARG A 63 -12.795 5.410 5.472 1.00 10.00 N ATOM 718 NH2 ARG A 63 -13.470 3.462 6.476 1.00 10.00 N ATOM 0 H ARG A 63 -9.338 3.346 1.733 1.00 10.00 H new ATOM 0 HA ARG A 63 -7.038 5.148 2.066 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -7.857 5.319 4.401 1.00 10.00 H new ATOM 0 HB3 ARG A 63 -9.029 5.870 3.221 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -10.385 3.917 3.492 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -9.119 3.055 4.343 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -9.304 4.534 6.267 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -10.393 5.603 5.407 1.00 10.00 H new ATOM 0 HE ARG A 63 -11.062 2.849 6.371 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -12.055 5.995 5.083 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -13.761 5.737 5.465 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -13.252 2.544 6.863 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -14.434 3.796 6.465 1.00 10.00 H new ATOM 732 N PHE A 64 -5.522 3.539 3.193 1.00 10.00 N ATOM 733 CA PHE A 64 -4.579 2.568 3.726 1.00 10.00 C ATOM 734 C PHE A 64 -4.479 2.723 5.235 1.00 10.00 C ATOM 735 O PHE A 64 -3.994 3.741 5.731 1.00 10.00 O ATOM 736 CB PHE A 64 -3.204 2.752 3.084 1.00 10.00 C ATOM 737 CG PHE A 64 -3.103 2.183 1.699 1.00 10.00 C ATOM 738 CD1 PHE A 64 -3.284 2.989 0.586 1.00 10.00 C ATOM 739 CD2 PHE A 64 -2.828 0.838 1.510 1.00 10.00 C ATOM 740 CE1 PHE A 64 -3.185 2.465 -0.690 1.00 10.00 C ATOM 741 CE2 PHE A 64 -2.729 0.308 0.237 1.00 10.00 C ATOM 742 CZ PHE A 64 -2.910 1.121 -0.864 1.00 10.00 C ATOM 0 H PHE A 64 -5.109 4.442 2.958 1.00 10.00 H new ATOM 0 HA PHE A 64 -4.936 1.565 3.494 1.00 10.00 H new ATOM 0 HB2 PHE A 64 -2.969 3.816 3.048 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -2.452 2.281 3.716 1.00 10.00 H new ATOM 0 HD1 PHE A 64 -3.505 4.038 0.717 1.00 10.00 H new ATOM 0 HD2 PHE A 64 -2.689 0.196 2.367 1.00 10.00 H new ATOM 0 HE1 PHE A 64 -3.322 3.105 -1.549 1.00 10.00 H new ATOM 0 HE2 PHE A 64 -2.510 -0.741 0.104 1.00 10.00 H new ATOM 0 HZ PHE A 64 -2.837 0.708 -1.859 1.00 10.00 H new ATOM 752 N LEU A 65 -4.948 1.723 5.957 1.00 10.00 N ATOM 753 CA LEU A 65 -4.926 1.756 7.410 1.00 10.00 C ATOM 754 C LEU A 65 -3.783 0.913 7.958 1.00 10.00 C ATOM 755 O LEU A 65 -3.757 -0.308 7.798 1.00 10.00 O ATOM 756 CB LEU A 65 -6.258 1.265 7.981 1.00 10.00 C ATOM 757 CG LEU A 65 -7.440 2.216 7.787 1.00 10.00 C ATOM 758 CD1 LEU A 65 -8.724 1.567 8.278 1.00 10.00 C ATOM 759 CD2 LEU A 65 -7.194 3.532 8.510 1.00 10.00 C ATOM 0 H LEU A 65 -5.351 0.874 5.561 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.771 2.790 7.717 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -6.502 0.308 7.519 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -6.132 1.081 9.048 1.00 10.00 H new ATOM 0 HG LEU A 65 -7.543 2.427 6.723 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -9.557 2.255 8.134 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -8.907 0.652 7.715 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -8.629 1.329 9.337 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -8.046 4.195 8.360 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -7.065 3.343 9.576 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -6.294 4.002 8.113 1.00 10.00 H new ATOM 771 N PHE A 66 -2.836 1.579 8.589 1.00 10.00 N ATOM 772 CA PHE A 66 -1.692 0.915 9.179 1.00 10.00 C ATOM 773 C PHE A 66 -1.731 1.097 10.687 1.00 10.00 C ATOM 774 O PHE A 66 -1.384 2.163 11.195 1.00 10.00 O ATOM 775 CB PHE A 66 -0.396 1.484 8.600 1.00 10.00 C ATOM 776 CG PHE A 66 0.837 0.715 8.981 1.00 10.00 C ATOM 777 CD1 PHE A 66 1.084 -0.534 8.437 1.00 10.00 C ATOM 778 CD2 PHE A 66 1.751 1.245 9.878 1.00 10.00 C ATOM 779 CE1 PHE A 66 2.220 -1.240 8.781 1.00 10.00 C ATOM 780 CE2 PHE A 66 2.887 0.543 10.225 1.00 10.00 C ATOM 781 CZ PHE A 66 3.122 -0.700 9.675 1.00 10.00 C ATOM 0 H PHE A 66 -2.838 2.592 8.707 1.00 10.00 H new ATOM 0 HA PHE A 66 -1.728 -0.150 8.948 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -0.476 1.506 7.513 1.00 10.00 H new ATOM 0 HB3 PHE A 66 -0.285 2.516 8.933 1.00 10.00 H new ATOM 0 HD1 PHE A 66 0.381 -0.960 7.737 1.00 10.00 H new ATOM 0 HD2 PHE A 66 1.572 2.218 10.310 1.00 10.00 H new ATOM 0 HE1 PHE A 66 2.402 -2.214 8.351 1.00 10.00 H new ATOM 0 HE2 PHE A 66 3.591 0.966 10.926 1.00 10.00 H new ATOM 0 HZ PHE A 66 4.011 -1.250 9.944 1.00 10.00 H new ATOM 791 N GLU A 67 -2.203 0.068 11.388 1.00 10.00 N ATOM 792 CA GLU A 67 -2.303 0.100 12.845 1.00 10.00 C ATOM 793 C GLU A 67 -3.319 1.147 13.298 1.00 10.00 C ATOM 794 O GLU A 67 -3.206 1.713 14.385 1.00 10.00 O ATOM 795 CB GLU A 67 -0.933 0.384 13.471 1.00 10.00 C ATOM 796 CG GLU A 67 -0.231 -0.857 13.990 1.00 10.00 C ATOM 797 CD GLU A 67 -0.505 -1.095 15.459 1.00 10.00 C ATOM 798 OE1 GLU A 67 0.442 -0.983 16.264 1.00 10.00 O ATOM 799 OE2 GLU A 67 -1.668 -1.377 15.816 1.00 10.00 O ATOM 0 H GLU A 67 -2.524 -0.804 10.967 1.00 10.00 H new ATOM 0 HA GLU A 67 -2.646 -0.878 13.182 1.00 10.00 H new ATOM 0 HB2 GLU A 67 -0.297 0.867 12.729 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -1.058 1.090 14.292 1.00 10.00 H new ATOM 0 HG2 GLU A 67 -0.557 -1.724 13.416 1.00 10.00 H new ATOM 0 HG3 GLU A 67 0.843 -0.757 13.834 1.00 10.00 H new ATOM 806 N GLY A 68 -4.316 1.388 12.454 1.00 10.00 N ATOM 807 CA GLY A 68 -5.344 2.361 12.765 1.00 10.00 C ATOM 808 C GLY A 68 -5.074 3.706 12.124 1.00 10.00 C ATOM 809 O GLY A 68 -6.000 4.460 11.827 1.00 10.00 O ATOM 0 H GLY A 68 -4.430 0.922 11.554 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -6.310 1.987 12.426 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -5.411 2.483 13.846 1.00 10.00 H new ATOM 813 N GLN A 69 -3.804 4.002 11.894 1.00 10.00 N ATOM 814 CA GLN A 69 -3.407 5.265 11.293 1.00 10.00 C ATOM 815 C GLN A 69 -3.459 5.181 9.774 1.00 10.00 C ATOM 816 O GLN A 69 -2.910 4.255 9.178 1.00 10.00 O ATOM 817 CB GLN A 69 -1.996 5.638 11.748 1.00 10.00 C ATOM 818 CG GLN A 69 -1.879 5.835 13.249 1.00 10.00 C ATOM 819 CD GLN A 69 -0.442 5.867 13.731 1.00 10.00 C ATOM 820 OE1 GLN A 69 0.438 5.223 13.161 1.00 10.00 O ATOM 821 NE2 GLN A 69 -0.196 6.618 14.790 1.00 10.00 N ATOM 0 H GLN A 69 -3.027 3.380 12.116 1.00 10.00 H new ATOM 0 HA GLN A 69 -4.105 6.036 11.618 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -1.303 4.856 11.436 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -1.690 6.555 11.244 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -2.371 6.767 13.527 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -2.410 5.030 13.758 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -0.953 7.137 15.234 1.00 10.00 H new ATOM 0 HE22 GLN A 69 0.751 6.679 15.163 1.00 10.00 H new ATOM 830 N ARG A 70 -4.140 6.132 9.153 1.00 10.00 N ATOM 831 CA ARG A 70 -4.235 6.163 7.702 1.00 10.00 C ATOM 832 C ARG A 70 -2.976 6.788 7.111 1.00 10.00 C ATOM 833 O ARG A 70 -2.621 7.925 7.425 1.00 10.00 O ATOM 834 CB ARG A 70 -5.492 6.912 7.243 1.00 10.00 C ATOM 835 CG ARG A 70 -5.722 8.239 7.947 1.00 10.00 C ATOM 836 CD ARG A 70 -7.134 8.754 7.706 1.00 10.00 C ATOM 837 NE ARG A 70 -7.302 9.292 6.357 1.00 10.00 N ATOM 838 CZ ARG A 70 -8.336 9.005 5.562 1.00 10.00 C ATOM 839 NH1 ARG A 70 -9.292 8.173 5.965 1.00 10.00 N ATOM 840 NH2 ARG A 70 -8.417 9.553 4.360 1.00 10.00 N ATOM 0 H ARG A 70 -4.632 6.888 9.628 1.00 10.00 H new ATOM 0 HA ARG A 70 -4.318 5.139 7.339 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -5.423 7.091 6.170 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -6.360 6.273 7.404 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -5.554 8.120 9.017 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -4.999 8.973 7.591 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -7.846 7.944 7.864 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -7.366 9.529 8.436 1.00 10.00 H new ATOM 0 HE ARG A 70 -6.586 9.925 6.001 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -9.240 7.747 6.890 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -10.077 7.961 5.349 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -7.690 10.194 4.042 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -9.206 9.334 3.752 1.00 10.00 H new ATOM 854 N ILE A 71 -2.304 6.024 6.267 1.00 10.00 N ATOM 855 CA ILE A 71 -1.067 6.462 5.636 1.00 10.00 C ATOM 856 C ILE A 71 -1.302 7.644 4.701 1.00 10.00 C ATOM 857 O ILE A 71 -2.161 7.594 3.817 1.00 10.00 O ATOM 858 CB ILE A 71 -0.411 5.309 4.850 1.00 10.00 C ATOM 859 CG1 ILE A 71 -0.132 4.122 5.779 1.00 10.00 C ATOM 860 CG2 ILE A 71 0.873 5.774 4.184 1.00 10.00 C ATOM 861 CD1 ILE A 71 0.683 4.484 7.006 1.00 10.00 C ATOM 0 H ILE A 71 -2.598 5.085 5.999 1.00 10.00 H new ATOM 0 HA ILE A 71 -0.397 6.779 6.435 1.00 10.00 H new ATOM 0 HB ILE A 71 -1.103 4.988 4.071 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.081 3.692 6.099 1.00 10.00 H new ATOM 0 HG13 ILE A 71 0.395 3.350 5.219 1.00 10.00 H new ATOM 0 HG21 ILE A 71 1.319 4.945 3.635 1.00 10.00 H new ATOM 0 HG22 ILE A 71 0.651 6.588 3.494 1.00 10.00 H new ATOM 0 HG23 ILE A 71 1.571 6.123 4.944 1.00 10.00 H new ATOM 0 HD11 ILE A 71 0.840 3.593 7.615 1.00 10.00 H new ATOM 0 HD12 ILE A 71 1.648 4.886 6.696 1.00 10.00 H new ATOM 0 HD13 ILE A 71 0.148 5.233 7.590 1.00 10.00 H new ATOM 873 N ALA A 72 -0.522 8.698 4.896 1.00 10.00 N ATOM 874 CA ALA A 72 -0.629 9.895 4.081 1.00 10.00 C ATOM 875 C ALA A 72 0.185 9.741 2.802 1.00 10.00 C ATOM 876 O ALA A 72 0.932 8.775 2.639 1.00 10.00 O ATOM 877 CB ALA A 72 -0.163 11.115 4.861 1.00 10.00 C ATOM 0 H ALA A 72 0.197 8.746 5.618 1.00 10.00 H new ATOM 0 HA ALA A 72 -1.676 10.036 3.812 1.00 10.00 H new ATOM 0 HB1 ALA A 72 -0.250 12.003 4.234 1.00 10.00 H new ATOM 0 HB2 ALA A 72 -0.782 11.236 5.750 1.00 10.00 H new ATOM 0 HB3 ALA A 72 0.877 10.981 5.158 1.00 10.00 H new ATOM 883 N ASP A 73 0.022 10.685 1.891 1.00 10.00 N ATOM 884 CA ASP A 73 0.737 10.657 0.620 1.00 10.00 C ATOM 885 C ASP A 73 2.211 10.980 0.812 1.00 10.00 C ATOM 886 O ASP A 73 3.076 10.415 0.143 1.00 10.00 O ATOM 887 CB ASP A 73 0.118 11.655 -0.360 1.00 10.00 C ATOM 888 CG ASP A 73 -1.116 11.113 -1.056 1.00 10.00 C ATOM 889 OD1 ASP A 73 -1.611 10.040 -0.652 1.00 10.00 O ATOM 890 OD2 ASP A 73 -1.592 11.764 -2.016 1.00 10.00 O ATOM 0 H ASP A 73 -0.601 11.485 2.006 1.00 10.00 H new ATOM 0 HA ASP A 73 0.653 9.649 0.213 1.00 10.00 H new ATOM 0 HB2 ASP A 73 -0.145 12.567 0.176 1.00 10.00 H new ATOM 0 HB3 ASP A 73 0.861 11.928 -1.109 1.00 10.00 H new ATOM 895 N ASN A 74 2.491 11.874 1.748 1.00 10.00 N ATOM 896 CA ASN A 74 3.859 12.296 2.033 1.00 10.00 C ATOM 897 C ASN A 74 4.516 11.395 3.078 1.00 10.00 C ATOM 898 O ASN A 74 5.393 11.833 3.825 1.00 10.00 O ATOM 899 CB ASN A 74 3.869 13.752 2.514 1.00 10.00 C ATOM 900 CG ASN A 74 2.939 13.985 3.688 1.00 10.00 C ATOM 901 OD1 ASN A 74 1.744 14.236 3.511 1.00 10.00 O ATOM 902 ND2 ASN A 74 3.477 13.904 4.893 1.00 10.00 N ATOM 0 H ASN A 74 1.785 12.326 2.329 1.00 10.00 H new ATOM 0 HA ASN A 74 4.435 12.215 1.111 1.00 10.00 H new ATOM 0 HB2 ASN A 74 4.884 14.030 2.799 1.00 10.00 H new ATOM 0 HB3 ASN A 74 3.579 14.405 1.691 1.00 10.00 H new ATOM 0 HD21 ASN A 74 2.899 14.051 5.720 1.00 10.00 H new ATOM 0 HD22 ASN A 74 4.470 13.694 4.995 1.00 10.00 H new ATOM 909 N HIS A 75 4.102 10.139 3.122 1.00 10.00 N ATOM 910 CA HIS A 75 4.661 9.186 4.069 1.00 10.00 C ATOM 911 C HIS A 75 5.643 8.252 3.374 1.00 10.00 C ATOM 912 O HIS A 75 5.514 7.974 2.178 1.00 10.00 O ATOM 913 CB HIS A 75 3.550 8.372 4.738 1.00 10.00 C ATOM 914 CG HIS A 75 3.142 8.895 6.079 1.00 10.00 C ATOM 915 ND1 HIS A 75 1.855 8.761 6.542 1.00 10.00 N ATOM 916 CD2 HIS A 75 3.884 9.530 7.016 1.00 10.00 C ATOM 917 CE1 HIS A 75 1.846 9.313 7.743 1.00 10.00 C ATOM 918 NE2 HIS A 75 3.053 9.793 8.072 1.00 10.00 N ATOM 0 H HIS A 75 3.380 9.755 2.513 1.00 10.00 H new ATOM 0 HA HIS A 75 5.194 9.747 4.837 1.00 10.00 H new ATOM 0 HB2 HIS A 75 2.678 8.358 4.083 1.00 10.00 H new ATOM 0 HB3 HIS A 75 3.884 7.340 4.847 1.00 10.00 H new ATOM 0 HD2 HIS A 75 4.932 9.781 6.944 1.00 10.00 H new ATOM 0 HE1 HIS A 75 0.975 9.370 8.379 1.00 10.00 H new ATOM 0 HE2 HIS A 75 3.304 10.264 8.941 1.00 10.00 H new ATOM 926 N THR A 76 6.628 7.783 4.123 1.00 10.00 N ATOM 927 CA THR A 76 7.626 6.873 3.594 1.00 10.00 C ATOM 928 C THR A 76 7.706 5.617 4.462 1.00 10.00 C ATOM 929 O THR A 76 7.458 5.680 5.663 1.00 10.00 O ATOM 930 CB THR A 76 9.013 7.544 3.520 1.00 10.00 C ATOM 931 OG1 THR A 76 9.034 8.739 4.317 1.00 10.00 O ATOM 932 CG2 THR A 76 9.374 7.887 2.082 1.00 10.00 C ATOM 0 H THR A 76 6.756 8.021 5.107 1.00 10.00 H new ATOM 0 HA THR A 76 7.325 6.598 2.583 1.00 10.00 H new ATOM 0 HB THR A 76 9.747 6.838 3.908 1.00 10.00 H new ATOM 0 HG1 THR A 76 8.636 8.555 5.193 1.00 10.00 H new ATOM 0 HG21 THR A 76 10.356 8.359 2.056 1.00 10.00 H new ATOM 0 HG22 THR A 76 9.394 6.976 1.484 1.00 10.00 H new ATOM 0 HG23 THR A 76 8.631 8.572 1.674 1.00 10.00 H new ATOM 940 N PRO A 77 8.063 4.461 3.874 1.00 10.00 N ATOM 941 CA PRO A 77 8.164 3.191 4.614 1.00 10.00 C ATOM 942 C PRO A 77 9.298 3.192 5.641 1.00 10.00 C ATOM 943 O PRO A 77 9.470 2.233 6.392 1.00 10.00 O ATOM 944 CB PRO A 77 8.440 2.147 3.521 1.00 10.00 C ATOM 945 CG PRO A 77 8.138 2.822 2.227 1.00 10.00 C ATOM 946 CD PRO A 77 8.386 4.284 2.450 1.00 10.00 C ATOM 0 HA PRO A 77 7.259 2.997 5.190 1.00 10.00 H new ATOM 0 HB2 PRO A 77 9.477 1.811 3.554 1.00 10.00 H new ATOM 0 HB3 PRO A 77 7.815 1.265 3.657 1.00 10.00 H new ATOM 0 HG2 PRO A 77 8.773 2.437 1.429 1.00 10.00 H new ATOM 0 HG3 PRO A 77 7.106 2.644 1.927 1.00 10.00 H new ATOM 0 HD2 PRO A 77 9.419 4.556 2.234 1.00 10.00 H new ATOM 0 HD3 PRO A 77 7.754 4.902 1.813 1.00 10.00 H new ATOM 954 N LYS A 78 10.071 4.270 5.662 1.00 10.00 N ATOM 955 CA LYS A 78 11.184 4.398 6.592 1.00 10.00 C ATOM 956 C LYS A 78 10.688 4.833 7.971 1.00 10.00 C ATOM 957 O LYS A 78 11.345 4.594 8.983 1.00 10.00 O ATOM 958 CB LYS A 78 12.208 5.405 6.050 1.00 10.00 C ATOM 959 CG LYS A 78 13.493 5.486 6.863 1.00 10.00 C ATOM 960 CD LYS A 78 14.336 4.225 6.724 1.00 10.00 C ATOM 961 CE LYS A 78 14.958 4.114 5.341 1.00 10.00 C ATOM 962 NZ LYS A 78 15.936 3.000 5.260 1.00 10.00 N ATOM 0 H LYS A 78 9.946 5.071 5.043 1.00 10.00 H new ATOM 0 HA LYS A 78 11.665 3.425 6.694 1.00 10.00 H new ATOM 0 HB2 LYS A 78 12.457 5.136 5.023 1.00 10.00 H new ATOM 0 HB3 LYS A 78 11.748 6.393 6.018 1.00 10.00 H new ATOM 0 HG2 LYS A 78 14.074 6.349 6.537 1.00 10.00 H new ATOM 0 HG3 LYS A 78 13.248 5.645 7.913 1.00 10.00 H new ATOM 0 HD2 LYS A 78 15.123 4.229 7.478 1.00 10.00 H new ATOM 0 HD3 LYS A 78 13.716 3.350 6.915 1.00 10.00 H new ATOM 0 HE2 LYS A 78 14.172 3.961 4.601 1.00 10.00 H new ATOM 0 HE3 LYS A 78 15.454 5.051 5.090 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 16.337 2.959 4.301 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 16.700 3.158 5.948 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 15.458 2.102 5.474 1.00 10.00 H new ATOM 976 N GLU A 79 9.519 5.457 8.007 1.00 10.00 N ATOM 977 CA GLU A 79 8.953 5.927 9.262 1.00 10.00 C ATOM 978 C GLU A 79 7.773 5.050 9.671 1.00 10.00 C ATOM 979 O GLU A 79 7.472 4.064 8.990 1.00 10.00 O ATOM 980 CB GLU A 79 8.524 7.394 9.133 1.00 10.00 C ATOM 981 CG GLU A 79 7.363 7.617 8.177 1.00 10.00 C ATOM 982 CD GLU A 79 7.364 9.001 7.569 1.00 10.00 C ATOM 983 OE1 GLU A 79 7.353 9.995 8.326 1.00 10.00 O ATOM 984 OE2 GLU A 79 7.378 9.104 6.327 1.00 10.00 O ATOM 0 H GLU A 79 8.947 5.649 7.185 1.00 10.00 H new ATOM 0 HA GLU A 79 9.714 5.860 10.040 1.00 10.00 H new ATOM 0 HB2 GLU A 79 8.247 7.769 10.118 1.00 10.00 H new ATOM 0 HB3 GLU A 79 9.377 7.983 8.796 1.00 10.00 H new ATOM 0 HG2 GLU A 79 7.407 6.875 7.380 1.00 10.00 H new ATOM 0 HG3 GLU A 79 6.425 7.459 8.709 1.00 10.00 H new ATOM 991 N LEU A 80 7.140 5.395 10.799 1.00 10.00 N ATOM 992 CA LEU A 80 5.981 4.664 11.336 1.00 10.00 C ATOM 993 C LEU A 80 6.395 3.319 11.940 1.00 10.00 C ATOM 994 O LEU A 80 5.921 2.933 13.012 1.00 10.00 O ATOM 995 CB LEU A 80 4.903 4.462 10.257 1.00 10.00 C ATOM 996 CG LEU A 80 4.251 5.748 9.748 1.00 10.00 C ATOM 997 CD1 LEU A 80 3.951 5.635 8.261 1.00 10.00 C ATOM 998 CD2 LEU A 80 2.982 6.049 10.532 1.00 10.00 C ATOM 0 H LEU A 80 7.418 6.194 11.370 1.00 10.00 H new ATOM 0 HA LEU A 80 5.557 5.273 12.134 1.00 10.00 H new ATOM 0 HB2 LEU A 80 5.350 3.939 9.411 1.00 10.00 H new ATOM 0 HB3 LEU A 80 4.125 3.812 10.658 1.00 10.00 H new ATOM 0 HG LEU A 80 4.947 6.574 9.897 1.00 10.00 H new ATOM 0 HD11 LEU A 80 3.487 6.558 7.912 1.00 10.00 H new ATOM 0 HD12 LEU A 80 4.879 5.466 7.714 1.00 10.00 H new ATOM 0 HD13 LEU A 80 3.272 4.800 8.089 1.00 10.00 H new ATOM 0 HD21 LEU A 80 2.531 6.968 10.156 1.00 10.00 H new ATOM 0 HD22 LEU A 80 2.278 5.225 10.415 1.00 10.00 H new ATOM 0 HD23 LEU A 80 3.226 6.170 11.587 1.00 10.00 H new ATOM 1010 N GLY A 81 7.284 2.619 11.255 1.00 10.00 N ATOM 1011 CA GLY A 81 7.753 1.337 11.727 1.00 10.00 C ATOM 1012 C GLY A 81 7.386 0.215 10.780 1.00 10.00 C ATOM 1013 O GLY A 81 7.096 -0.897 11.212 1.00 10.00 O ATOM 0 H GLY A 81 7.693 2.921 10.371 1.00 10.00 H new ATOM 0 HA2 GLY A 81 8.836 1.369 11.848 1.00 10.00 H new ATOM 0 HA3 GLY A 81 7.328 1.135 12.710 1.00 10.00 H new ATOM 1017 N MET A 82 7.393 0.511 9.486 1.00 10.00 N ATOM 1018 CA MET A 82 7.053 -0.481 8.474 1.00 10.00 C ATOM 1019 C MET A 82 8.201 -1.458 8.278 1.00 10.00 C ATOM 1020 O MET A 82 9.344 -1.051 8.060 1.00 10.00 O ATOM 1021 CB MET A 82 6.723 0.205 7.148 1.00 10.00 C ATOM 1022 CG MET A 82 5.409 0.963 7.169 1.00 10.00 C ATOM 1023 SD MET A 82 5.026 1.731 5.583 1.00 10.00 S ATOM 1024 CE MET A 82 3.394 2.380 5.919 1.00 10.00 C ATOM 0 H MET A 82 7.630 1.430 9.113 1.00 10.00 H new ATOM 0 HA MET A 82 6.177 -1.033 8.816 1.00 10.00 H new ATOM 0 HB2 MET A 82 7.528 0.896 6.895 1.00 10.00 H new ATOM 0 HB3 MET A 82 6.688 -0.546 6.359 1.00 10.00 H new ATOM 0 HG2 MET A 82 4.604 0.280 7.442 1.00 10.00 H new ATOM 0 HG3 MET A 82 5.450 1.732 7.940 1.00 10.00 H new ATOM 0 HE1 MET A 82 2.773 2.282 5.029 1.00 10.00 H new ATOM 0 HE2 MET A 82 2.942 1.822 6.739 1.00 10.00 H new ATOM 0 HE3 MET A 82 3.470 3.432 6.194 1.00 10.00 H new ATOM 1034 N GLU A 83 7.902 -2.741 8.362 1.00 10.00 N ATOM 1035 CA GLU A 83 8.918 -3.761 8.191 1.00 10.00 C ATOM 1036 C GLU A 83 8.538 -4.741 7.091 1.00 10.00 C ATOM 1037 O GLU A 83 7.478 -4.627 6.477 1.00 10.00 O ATOM 1038 CB GLU A 83 9.138 -4.505 9.504 1.00 10.00 C ATOM 1039 CG GLU A 83 10.511 -4.260 10.105 1.00 10.00 C ATOM 1040 CD GLU A 83 11.622 -4.469 9.097 1.00 10.00 C ATOM 1041 OE1 GLU A 83 11.687 -5.564 8.500 1.00 10.00 O ATOM 1042 OE2 GLU A 83 12.433 -3.539 8.899 1.00 10.00 O ATOM 0 H GLU A 83 6.966 -3.100 8.547 1.00 10.00 H new ATOM 0 HA GLU A 83 9.845 -3.269 7.897 1.00 10.00 H new ATOM 0 HB2 GLU A 83 8.375 -4.200 10.220 1.00 10.00 H new ATOM 0 HB3 GLU A 83 9.007 -5.574 9.335 1.00 10.00 H new ATOM 0 HG2 GLU A 83 10.560 -3.242 10.492 1.00 10.00 H new ATOM 0 HG3 GLU A 83 10.660 -4.930 10.952 1.00 10.00 H new ATOM 1049 N GLU A 84 9.422 -5.697 6.843 1.00 10.00 N ATOM 1050 CA GLU A 84 9.195 -6.710 5.825 1.00 10.00 C ATOM 1051 C GLU A 84 8.084 -7.661 6.264 1.00 10.00 C ATOM 1052 O GLU A 84 8.036 -8.071 7.428 1.00 10.00 O ATOM 1053 CB GLU A 84 10.500 -7.476 5.559 1.00 10.00 C ATOM 1054 CG GLU A 84 10.316 -8.830 4.880 1.00 10.00 C ATOM 1055 CD GLU A 84 10.029 -8.734 3.392 1.00 10.00 C ATOM 1056 OE1 GLU A 84 9.343 -7.786 2.965 1.00 10.00 O ATOM 1057 OE2 GLU A 84 10.475 -9.632 2.643 1.00 10.00 O ATOM 0 H GLU A 84 10.309 -5.791 7.338 1.00 10.00 H new ATOM 0 HA GLU A 84 8.879 -6.228 4.900 1.00 10.00 H new ATOM 0 HB2 GLU A 84 11.148 -6.858 4.938 1.00 10.00 H new ATOM 0 HB3 GLU A 84 11.017 -7.627 6.507 1.00 10.00 H new ATOM 0 HG2 GLU A 84 11.216 -9.426 5.029 1.00 10.00 H new ATOM 0 HG3 GLU A 84 9.497 -9.361 5.365 1.00 10.00 H new ATOM 1064 N GLU A 85 7.182 -7.987 5.335 1.00 10.00 N ATOM 1065 CA GLU A 85 6.060 -8.890 5.607 1.00 10.00 C ATOM 1066 C GLU A 85 5.088 -8.277 6.612 1.00 10.00 C ATOM 1067 O GLU A 85 4.448 -8.987 7.392 1.00 10.00 O ATOM 1068 CB GLU A 85 6.563 -10.244 6.117 1.00 10.00 C ATOM 1069 CG GLU A 85 7.295 -11.057 5.064 1.00 10.00 C ATOM 1070 CD GLU A 85 6.346 -11.729 4.098 1.00 10.00 C ATOM 1071 OE1 GLU A 85 5.566 -12.601 4.535 1.00 10.00 O ATOM 1072 OE2 GLU A 85 6.376 -11.382 2.900 1.00 10.00 O ATOM 0 H GLU A 85 7.208 -7.635 4.378 1.00 10.00 H new ATOM 0 HA GLU A 85 5.528 -9.046 4.669 1.00 10.00 H new ATOM 0 HB2 GLU A 85 7.229 -10.079 6.964 1.00 10.00 H new ATOM 0 HB3 GLU A 85 5.715 -10.822 6.485 1.00 10.00 H new ATOM 0 HG2 GLU A 85 7.972 -10.406 4.511 1.00 10.00 H new ATOM 0 HG3 GLU A 85 7.908 -11.814 5.553 1.00 10.00 H new ATOM 1079 N ASP A 86 4.977 -6.955 6.580 1.00 10.00 N ATOM 1080 CA ASP A 86 4.080 -6.241 7.479 1.00 10.00 C ATOM 1081 C ASP A 86 2.641 -6.381 7.006 1.00 10.00 C ATOM 1082 O ASP A 86 2.391 -6.829 5.887 1.00 10.00 O ATOM 1083 CB ASP A 86 4.456 -4.765 7.566 1.00 10.00 C ATOM 1084 CG ASP A 86 4.287 -4.219 8.972 1.00 10.00 C ATOM 1085 OD1 ASP A 86 3.263 -4.535 9.626 1.00 10.00 O ATOM 1086 OD2 ASP A 86 5.185 -3.486 9.436 1.00 10.00 O ATOM 0 H ASP A 86 5.498 -6.355 5.940 1.00 10.00 H new ATOM 0 HA ASP A 86 4.176 -6.680 8.472 1.00 10.00 H new ATOM 0 HB2 ASP A 86 5.490 -4.635 7.248 1.00 10.00 H new ATOM 0 HB3 ASP A 86 3.836 -4.191 6.877 1.00 10.00 H new ATOM 1091 N VAL A 87 1.706 -5.977 7.846 1.00 10.00 N ATOM 1092 CA VAL A 87 0.289 -6.080 7.523 1.00 10.00 C ATOM 1093 C VAL A 87 -0.366 -4.704 7.463 1.00 10.00 C ATOM 1094 O VAL A 87 -0.280 -3.920 8.409 1.00 10.00 O ATOM 1095 CB VAL A 87 -0.459 -6.952 8.557 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -1.937 -7.060 8.213 1.00 10.00 C ATOM 1097 CG2 VAL A 87 0.171 -8.336 8.648 1.00 10.00 C ATOM 0 H VAL A 87 1.900 -5.572 8.762 1.00 10.00 H new ATOM 0 HA VAL A 87 0.221 -6.551 6.542 1.00 10.00 H new ATOM 0 HB VAL A 87 -0.373 -6.468 9.530 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -2.439 -7.679 8.956 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -2.383 -6.065 8.208 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -2.049 -7.513 7.228 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -0.370 -8.934 9.381 1.00 10.00 H new ATOM 0 HG22 VAL A 87 0.121 -8.823 7.674 1.00 10.00 H new ATOM 0 HG23 VAL A 87 1.213 -8.242 8.954 1.00 10.00 H new ATOM 1107 N ILE A 88 -1.018 -4.415 6.346 1.00 10.00 N ATOM 1108 CA ILE A 88 -1.704 -3.147 6.167 1.00 10.00 C ATOM 1109 C ILE A 88 -3.104 -3.396 5.601 1.00 10.00 C ATOM 1110 O ILE A 88 -3.297 -4.293 4.777 1.00 10.00 O ATOM 1111 CB ILE A 88 -0.898 -2.187 5.256 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -1.513 -0.786 5.263 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -0.809 -2.723 3.833 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -0.598 0.282 4.704 1.00 10.00 C ATOM 0 H ILE A 88 -1.085 -5.046 5.547 1.00 10.00 H new ATOM 0 HA ILE A 88 -1.794 -2.662 7.139 1.00 10.00 H new ATOM 0 HB ILE A 88 0.114 -2.122 5.656 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.436 -0.801 4.684 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -1.783 -0.522 6.286 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -0.238 -2.028 3.217 1.00 10.00 H new ATOM 0 HG22 ILE A 88 -0.313 -3.694 3.840 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.813 -2.832 3.422 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.101 1.248 4.741 1.00 10.00 H new ATOM 0 HD12 ILE A 88 0.315 0.326 5.297 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.348 0.043 3.670 1.00 10.00 H new ATOM 1126 N GLU A 89 -4.077 -2.625 6.067 1.00 10.00 N ATOM 1127 CA GLU A 89 -5.456 -2.784 5.624 1.00 10.00 C ATOM 1128 C GLU A 89 -5.839 -1.723 4.602 1.00 10.00 C ATOM 1129 O GLU A 89 -5.253 -0.639 4.564 1.00 10.00 O ATOM 1130 CB GLU A 89 -6.405 -2.698 6.820 1.00 10.00 C ATOM 1131 CG GLU A 89 -6.066 -3.663 7.942 1.00 10.00 C ATOM 1132 CD GLU A 89 -6.328 -3.071 9.311 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -7.482 -2.679 9.589 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -5.384 -3.008 10.126 1.00 10.00 O ATOM 0 H GLU A 89 -3.937 -1.883 6.752 1.00 10.00 H new ATOM 0 HA GLU A 89 -5.540 -3.763 5.153 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -6.390 -1.681 7.211 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -7.422 -2.894 6.480 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -6.653 -4.574 7.824 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -5.017 -3.949 7.867 1.00 10.00 H new ATOM 1141 N VAL A 90 -6.825 -2.040 3.781 1.00 10.00 N ATOM 1142 CA VAL A 90 -7.305 -1.115 2.769 1.00 10.00 C ATOM 1143 C VAL A 90 -8.835 -1.140 2.708 1.00 10.00 C ATOM 1144 O VAL A 90 -9.450 -2.199 2.576 1.00 10.00 O ATOM 1145 CB VAL A 90 -6.696 -1.428 1.377 1.00 10.00 C ATOM 1146 CG1 VAL A 90 -7.033 -2.842 0.922 1.00 10.00 C ATOM 1147 CG2 VAL A 90 -7.148 -0.408 0.345 1.00 10.00 C ATOM 0 H VAL A 90 -7.311 -2.936 3.796 1.00 10.00 H new ATOM 0 HA VAL A 90 -6.981 -0.113 3.051 1.00 10.00 H new ATOM 0 HB VAL A 90 -5.612 -1.362 1.473 1.00 10.00 H new ATOM 0 HG11 VAL A 90 -6.590 -3.025 -0.057 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -6.636 -3.560 1.640 1.00 10.00 H new ATOM 0 HG13 VAL A 90 -8.115 -2.955 0.857 1.00 10.00 H new ATOM 0 HG21 VAL A 90 -6.708 -0.649 -0.622 1.00 10.00 H new ATOM 0 HG22 VAL A 90 -8.235 -0.429 0.264 1.00 10.00 H new ATOM 0 HG23 VAL A 90 -6.826 0.587 0.652 1.00 10.00 H new ATOM 1157 N TYR A 91 -9.445 0.030 2.850 1.00 10.00 N ATOM 1158 CA TYR A 91 -10.902 0.146 2.823 1.00 10.00 C ATOM 1159 C TYR A 91 -11.325 1.314 1.947 1.00 10.00 C ATOM 1160 O TYR A 91 -10.515 2.180 1.639 1.00 10.00 O ATOM 1161 CB TYR A 91 -11.445 0.337 4.240 1.00 10.00 C ATOM 1162 CG TYR A 91 -11.589 -0.953 5.013 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -12.787 -1.654 5.002 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -10.528 -1.475 5.743 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -12.926 -2.836 5.699 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -10.662 -2.657 6.443 1.00 10.00 C ATOM 1167 CZ TYR A 91 -11.862 -3.334 6.416 1.00 10.00 C ATOM 1168 OH TYR A 91 -11.998 -4.515 7.106 1.00 10.00 O ATOM 0 H TYR A 91 -8.955 0.914 2.985 1.00 10.00 H new ATOM 0 HA TYR A 91 -11.313 -0.774 2.406 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -10.781 1.006 4.787 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -12.417 0.828 4.184 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -13.624 -1.268 4.439 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -9.585 -0.948 5.763 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -13.866 -3.368 5.682 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -9.830 -3.049 7.009 1.00 10.00 H new ATOM 0 HH TYR A 91 -12.573 -5.126 6.599 1.00 10.00 H new ATOM 1178 N GLN A 92 -12.587 1.343 1.549 1.00 10.00 N ATOM 1179 CA GLN A 92 -13.076 2.425 0.709 1.00 10.00 C ATOM 1180 C GLN A 92 -13.507 3.608 1.566 1.00 10.00 C ATOM 1181 O GLN A 92 -14.124 3.431 2.616 1.00 10.00 O ATOM 1182 CB GLN A 92 -14.242 1.956 -0.159 1.00 10.00 C ATOM 1183 CG GLN A 92 -14.564 2.911 -1.300 1.00 10.00 C ATOM 1184 CD GLN A 92 -16.024 2.882 -1.693 1.00 10.00 C ATOM 1185 OE1 GLN A 92 -16.429 2.118 -2.571 1.00 10.00 O ATOM 1186 NE2 GLN A 92 -16.824 3.721 -1.051 1.00 10.00 N ATOM 0 H GLN A 92 -13.284 0.639 1.790 1.00 10.00 H new ATOM 0 HA GLN A 92 -12.263 2.739 0.054 1.00 10.00 H new ATOM 0 HB2 GLN A 92 -14.008 0.974 -0.571 1.00 10.00 H new ATOM 0 HB3 GLN A 92 -15.127 1.836 0.466 1.00 10.00 H new ATOM 0 HG2 GLN A 92 -14.291 3.925 -1.007 1.00 10.00 H new ATOM 0 HG3 GLN A 92 -13.954 2.654 -2.166 1.00 10.00 H new ATOM 0 HE21 GLN A 92 -16.446 4.336 -0.331 1.00 10.00 H new ATOM 0 HE22 GLN A 92 -17.818 3.752 -1.277 1.00 10.00 H new ATOM 1195 N GLU A 93 -13.172 4.807 1.115 1.00 10.00 N ATOM 1196 CA GLU A 93 -13.525 6.025 1.828 1.00 10.00 C ATOM 1197 C GLU A 93 -14.996 6.369 1.607 1.00 10.00 C ATOM 1198 O GLU A 93 -15.609 5.912 0.639 1.00 10.00 O ATOM 1199 CB GLU A 93 -12.646 7.183 1.357 1.00 10.00 C ATOM 1200 CG GLU A 93 -11.215 7.100 1.853 1.00 10.00 C ATOM 1201 CD GLU A 93 -11.026 7.794 3.186 1.00 10.00 C ATOM 1202 OE1 GLU A 93 -11.207 7.144 4.236 1.00 10.00 O ATOM 1203 OE2 GLU A 93 -10.689 8.994 3.191 1.00 10.00 O ATOM 0 H GLU A 93 -12.652 4.963 0.251 1.00 10.00 H new ATOM 0 HA GLU A 93 -13.361 5.860 2.893 1.00 10.00 H new ATOM 0 HB2 GLU A 93 -12.643 7.206 0.267 1.00 10.00 H new ATOM 0 HB3 GLU A 93 -13.085 8.122 1.695 1.00 10.00 H new ATOM 0 HG2 GLU A 93 -10.926 6.053 1.947 1.00 10.00 H new ATOM 0 HG3 GLU A 93 -10.551 7.549 1.115 1.00 10.00 H new ATOM 1210 N GLN A 94 -15.550 7.183 2.503 1.00 10.00 N ATOM 1211 CA GLN A 94 -16.947 7.599 2.413 1.00 10.00 C ATOM 1212 C GLN A 94 -17.166 8.488 1.191 1.00 10.00 C ATOM 1213 O GLN A 94 -18.276 8.582 0.660 1.00 10.00 O ATOM 1214 CB GLN A 94 -17.354 8.340 3.689 1.00 10.00 C ATOM 1215 CG GLN A 94 -18.837 8.657 3.768 1.00 10.00 C ATOM 1216 CD GLN A 94 -19.243 9.178 5.130 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -19.239 10.384 5.375 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -19.597 8.273 6.027 1.00 10.00 N ATOM 0 H GLN A 94 -15.049 7.569 3.303 1.00 10.00 H new ATOM 0 HA GLN A 94 -17.569 6.711 2.305 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -17.075 7.737 4.553 1.00 10.00 H new ATOM 0 HB3 GLN A 94 -16.789 9.270 3.753 1.00 10.00 H new ATOM 0 HG2 GLN A 94 -19.089 9.398 3.009 1.00 10.00 H new ATOM 0 HG3 GLN A 94 -19.411 7.759 3.540 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -19.587 7.283 5.784 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -19.880 8.566 6.962 1.00 10.00 H new ATOM 1227 N THR A 95 -16.095 9.125 0.740 1.00 10.00 N ATOM 1228 CA THR A 95 -16.153 9.996 -0.419 1.00 10.00 C ATOM 1229 C THR A 95 -16.358 9.187 -1.698 1.00 10.00 C ATOM 1230 O THR A 95 -16.804 9.716 -2.716 1.00 10.00 O ATOM 1231 CB THR A 95 -14.863 10.820 -0.532 1.00 10.00 C ATOM 1232 OG1 THR A 95 -13.783 10.083 0.054 1.00 10.00 O ATOM 1233 CG2 THR A 95 -15.011 12.161 0.168 1.00 10.00 C ATOM 0 H THR A 95 -15.170 9.052 1.164 1.00 10.00 H new ATOM 0 HA THR A 95 -17.000 10.670 -0.291 1.00 10.00 H new ATOM 0 HB THR A 95 -14.657 11.009 -1.586 1.00 10.00 H new ATOM 0 HG1 THR A 95 -12.956 10.603 -0.017 1.00 10.00 H new ATOM 0 HG21 THR A 95 -14.083 12.725 0.073 1.00 10.00 H new ATOM 0 HG22 THR A 95 -15.826 12.722 -0.290 1.00 10.00 H new ATOM 0 HG23 THR A 95 -15.230 11.998 1.223 1.00 10.00 H new ATOM 1241 N GLY A 96 -16.031 7.899 -1.638 1.00 10.00 N ATOM 1242 CA GLY A 96 -16.188 7.028 -2.789 1.00 10.00 C ATOM 1243 C GLY A 96 -14.974 7.032 -3.691 1.00 10.00 C ATOM 1244 O GLY A 96 -14.463 5.975 -4.065 1.00 10.00 O ATOM 0 H GLY A 96 -15.658 7.441 -0.807 1.00 10.00 H new ATOM 0 HA2 GLY A 96 -16.379 6.011 -2.447 1.00 10.00 H new ATOM 0 HA3 GLY A 96 -17.062 7.341 -3.360 1.00 10.00 H new ATOM 1286 N ARG B 359 -1.525 -14.550 -2.632 1.00 10.00 N ATOM 1287 CA ARG B 359 -0.517 -13.494 -2.674 1.00 10.00 C ATOM 1288 C ARG B 359 -0.242 -13.066 -4.109 1.00 10.00 C ATOM 1289 O ARG B 359 -0.317 -13.878 -5.032 1.00 10.00 O ATOM 1290 CB ARG B 359 0.788 -13.960 -2.021 1.00 10.00 C ATOM 1291 CG ARG B 359 0.710 -14.057 -0.509 1.00 10.00 C ATOM 1292 CD ARG B 359 0.894 -15.486 -0.028 1.00 10.00 C ATOM 1293 NE ARG B 359 0.470 -15.649 1.358 1.00 10.00 N ATOM 1294 CZ ARG B 359 0.575 -16.783 2.044 1.00 10.00 C ATOM 1295 NH1 ARG B 359 1.103 -17.863 1.486 1.00 10.00 N ATOM 1296 NH2 ARG B 359 0.135 -16.831 3.292 1.00 10.00 N ATOM 0 HA ARG B 359 -0.908 -12.642 -2.117 1.00 10.00 H new ATOM 0 HB2 ARG B 359 1.059 -14.935 -2.426 1.00 10.00 H new ATOM 0 HB3 ARG B 359 1.587 -13.269 -2.292 1.00 10.00 H new ATOM 0 HG2 ARG B 359 1.475 -13.422 -0.064 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -0.255 -13.680 -0.169 1.00 10.00 H new ATOM 0 HD2 ARG B 359 0.322 -16.161 -0.665 1.00 10.00 H new ATOM 0 HD3 ARG B 359 1.942 -15.770 -0.123 1.00 10.00 H new ATOM 0 HE ARG B 359 0.067 -14.841 1.832 1.00 10.00 H new ATOM 0 HH11 ARG B 359 1.433 -17.829 0.522 1.00 10.00 H new ATOM 0 HH12 ARG B 359 1.179 -18.728 2.021 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -0.280 -16.003 3.719 1.00 10.00 H new ATOM 0 HH22 ARG B 359 0.211 -17.696 3.827 1.00 10.00 H new ATOM 1310 N ASP B 360 0.077 -11.794 -4.284 1.00 10.00 N ATOM 1311 CA ASP B 360 0.371 -11.243 -5.603 1.00 10.00 C ATOM 1312 C ASP B 360 1.415 -10.138 -5.488 1.00 10.00 C ATOM 1313 O ASP B 360 1.108 -9.044 -5.013 1.00 10.00 O ATOM 1314 CB ASP B 360 -0.901 -10.687 -6.251 1.00 10.00 C ATOM 1315 CG ASP B 360 -0.795 -10.610 -7.762 1.00 10.00 C ATOM 1316 OD1 ASP B 360 -0.475 -9.525 -8.294 1.00 10.00 O ATOM 1317 OD2 ASP B 360 -1.042 -11.633 -8.428 1.00 10.00 O ATOM 0 H ASP B 360 0.140 -11.116 -3.524 1.00 10.00 H new ATOM 0 HA ASP B 360 0.762 -12.044 -6.230 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -1.748 -11.317 -5.981 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -1.103 -9.693 -5.853 1.00 10.00 H new ATOM 1322 N PRO B 361 2.664 -10.419 -5.896 1.00 10.00 N ATOM 1323 CA PRO B 361 3.756 -9.445 -5.830 1.00 10.00 C ATOM 1324 C PRO B 361 3.632 -8.344 -6.882 1.00 10.00 C ATOM 1325 O PRO B 361 3.553 -8.619 -8.082 1.00 10.00 O ATOM 1326 CB PRO B 361 5.006 -10.291 -6.074 1.00 10.00 C ATOM 1327 CG PRO B 361 4.532 -11.454 -6.868 1.00 10.00 C ATOM 1328 CD PRO B 361 3.113 -11.715 -6.441 1.00 10.00 C ATOM 0 HA PRO B 361 3.766 -8.915 -4.878 1.00 10.00 H new ATOM 0 HB2 PRO B 361 5.766 -9.727 -6.615 1.00 10.00 H new ATOM 0 HB3 PRO B 361 5.456 -10.611 -5.134 1.00 10.00 H new ATOM 0 HG2 PRO B 361 4.583 -11.241 -7.936 1.00 10.00 H new ATOM 0 HG3 PRO B 361 5.158 -12.328 -6.687 1.00 10.00 H new ATOM 0 HD2 PRO B 361 2.495 -12.031 -7.281 1.00 10.00 H new ATOM 0 HD3 PRO B 361 3.060 -12.504 -5.691 1.00 10.00 H new ATOM 1336 N ILE B 362 3.616 -7.099 -6.426 1.00 10.00 N ATOM 1337 CA ILE B 362 3.505 -5.958 -7.323 1.00 10.00 C ATOM 1338 C ILE B 362 4.769 -5.112 -7.280 1.00 10.00 C ATOM 1339 O ILE B 362 5.216 -4.708 -6.209 1.00 10.00 O ATOM 1340 CB ILE B 362 2.297 -5.062 -6.973 1.00 10.00 C ATOM 1341 CG1 ILE B 362 1.041 -5.909 -6.750 1.00 10.00 C ATOM 1342 CG2 ILE B 362 2.061 -4.039 -8.080 1.00 10.00 C ATOM 1343 CD1 ILE B 362 -0.156 -5.101 -6.298 1.00 10.00 C ATOM 0 H ILE B 362 3.679 -6.854 -5.438 1.00 10.00 H new ATOM 0 HA ILE B 362 3.362 -6.363 -8.325 1.00 10.00 H new ATOM 0 HB ILE B 362 2.518 -4.531 -6.047 1.00 10.00 H new ATOM 0 HG12 ILE B 362 0.792 -6.427 -7.676 1.00 10.00 H new ATOM 0 HG13 ILE B 362 1.256 -6.675 -6.005 1.00 10.00 H new ATOM 0 HG21 ILE B 362 1.207 -3.413 -7.821 1.00 10.00 H new ATOM 0 HG22 ILE B 362 2.947 -3.414 -8.193 1.00 10.00 H new ATOM 0 HG23 ILE B 362 1.860 -4.557 -9.018 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -1.011 -5.763 -6.159 1.00 10.00 H new ATOM 0 HD12 ILE B 362 0.075 -4.604 -5.356 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -0.396 -4.353 -7.053 1.00 10.00 H new ATOM 1355 N VAL B 363 5.346 -4.860 -8.445 1.00 10.00 N ATOM 1356 CA VAL B 363 6.550 -4.048 -8.554 1.00 10.00 C ATOM 1357 C VAL B 363 6.315 -2.901 -9.530 1.00 10.00 C ATOM 1358 O VAL B 363 5.789 -3.112 -10.622 1.00 10.00 O ATOM 1359 CB VAL B 363 7.762 -4.875 -9.042 1.00 10.00 C ATOM 1360 CG1 VAL B 363 9.047 -4.067 -8.926 1.00 10.00 C ATOM 1361 CG2 VAL B 363 7.875 -6.179 -8.267 1.00 10.00 C ATOM 0 H VAL B 363 4.996 -5.210 -9.337 1.00 10.00 H new ATOM 0 HA VAL B 363 6.773 -3.664 -7.559 1.00 10.00 H new ATOM 0 HB VAL B 363 7.605 -5.118 -10.093 1.00 10.00 H new ATOM 0 HG11 VAL B 363 9.887 -4.668 -9.275 1.00 10.00 H new ATOM 0 HG12 VAL B 363 8.967 -3.167 -9.535 1.00 10.00 H new ATOM 0 HG13 VAL B 363 9.208 -3.787 -7.885 1.00 10.00 H new ATOM 0 HG21 VAL B 363 8.735 -6.743 -8.628 1.00 10.00 H new ATOM 0 HG22 VAL B 363 8.003 -5.962 -7.206 1.00 10.00 H new ATOM 0 HG23 VAL B 363 6.969 -6.767 -8.410 1.00 10.00 H new ATOM 1371 N ILE B 364 6.690 -1.691 -9.133 1.00 10.00 N ATOM 1372 CA ILE B 364 6.516 -0.519 -9.985 1.00 10.00 C ATOM 1373 C ILE B 364 7.870 0.071 -10.361 1.00 10.00 C ATOM 1374 O ILE B 364 8.903 -0.343 -9.829 1.00 10.00 O ATOM 1375 CB ILE B 364 5.661 0.577 -9.305 1.00 10.00 C ATOM 1376 CG1 ILE B 364 6.407 1.188 -8.111 1.00 10.00 C ATOM 1377 CG2 ILE B 364 4.320 0.008 -8.862 1.00 10.00 C ATOM 1378 CD1 ILE B 364 5.940 2.583 -7.748 1.00 10.00 C ATOM 0 H ILE B 364 7.116 -1.495 -8.227 1.00 10.00 H new ATOM 0 HA ILE B 364 5.992 -0.856 -10.879 1.00 10.00 H new ATOM 0 HB ILE B 364 5.478 1.368 -10.033 1.00 10.00 H new ATOM 0 HG12 ILE B 364 6.284 0.537 -7.246 1.00 10.00 H new ATOM 0 HG13 ILE B 364 7.473 1.219 -8.337 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.731 0.792 -8.386 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.782 -0.373 -9.730 1.00 10.00 H new ATOM 0 HG23 ILE B 364 4.485 -0.803 -8.153 1.00 10.00 H new ATOM 0 HD11 ILE B 364 6.513 2.948 -6.896 1.00 10.00 H new ATOM 0 HD12 ILE B 364 6.089 3.249 -8.598 1.00 10.00 H new ATOM 0 HD13 ILE B 364 4.882 2.556 -7.489 1.00 10.00 H new