USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 807 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 34 ASN : amide:sc= 1.11 K(o=2,f=-0.0015) USER MOD Set 1.2: A 35 ASN : amide:sc= 0.928 K(o=2,f=-0.57) USER MOD Set 2.1: A 8 SER OG : rot 180:sc= 1.07 USER MOD Set 2.2: A 18 SER OG : rot 52:sc= 1.18 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 171:sc= 0.414 (180deg=0.244) USER MOD Single : A 10 ASN : amide:sc= 0.374 K(o=0.37,f=-2.4!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 118:sc= 1.06 USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot -13:sc= 0.387 USER MOD Single : A 45 ASN : amide:sc= -0.392! C(o=-0.39!,f=-6.5!) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ -122:sc= -0.128 (180deg=-1.47!) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0137 USER MOD Single : A 101 ASN : amide:sc= -0.0908 X(o=-0.091,f=0) USER MOD Single : A 102 GLN : amide:sc= -1.11 K(o=-1.1,f=-0.089) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 86:sc= 1.26 USER MOD Single : A 107 GLN : amide:sc= -0.0124 X(o=-0.012,f=-0.012) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.893 -9.524 -4.117 1.00 0.00 N ATOM 2 CA MET A 1 -4.101 -8.312 -3.313 1.00 0.00 C ATOM 3 C MET A 1 -2.796 -7.912 -2.642 1.00 0.00 C ATOM 4 O MET A 1 -2.206 -8.695 -1.897 1.00 0.00 O ATOM 5 CB MET A 1 -5.223 -8.465 -2.294 1.00 0.00 C ATOM 6 CG MET A 1 -5.543 -7.105 -1.657 1.00 0.00 C ATOM 7 SD MET A 1 -6.402 -5.928 -2.734 1.00 0.00 S ATOM 8 CE MET A 1 -8.086 -6.610 -2.667 1.00 0.00 C ATOM 0 H1 MET A 1 -4.811 -9.882 -4.450 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.292 -9.299 -4.935 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.428 -10.251 -3.536 1.00 0.00 H new ATOM 0 HA MET A 1 -4.417 -7.517 -3.989 1.00 0.00 H new ATOM 0 HB2 MET A 1 -6.113 -8.867 -2.778 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.930 -9.177 -1.523 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.154 -7.273 -0.770 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.611 -6.651 -1.321 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.750 -6.001 -3.280 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.080 -7.633 -3.044 1.00 0.00 H new ATOM 0 HE3 MET A 1 -8.439 -6.606 -1.636 1.00 0.00 H new ATOM 18 N ILE A 2 -2.379 -6.664 -2.845 1.00 0.00 N ATOM 19 CA ILE A 2 -1.214 -6.043 -2.228 1.00 0.00 C ATOM 20 C ILE A 2 -1.661 -4.625 -1.876 1.00 0.00 C ATOM 21 O ILE A 2 -2.440 -4.032 -2.625 1.00 0.00 O ATOM 22 CB ILE A 2 0.017 -6.033 -3.167 1.00 0.00 C ATOM 23 CG1 ILE A 2 0.258 -7.380 -3.879 1.00 0.00 C ATOM 24 CG2 ILE A 2 1.290 -5.612 -2.409 1.00 0.00 C ATOM 25 CD1 ILE A 2 1.499 -7.366 -4.780 1.00 0.00 C ATOM 0 H ILE A 2 -2.870 -6.030 -3.475 1.00 0.00 H new ATOM 0 HA ILE A 2 -0.888 -6.601 -1.350 1.00 0.00 H new ATOM 0 HB ILE A 2 -0.210 -5.298 -3.939 1.00 0.00 H new ATOM 0 HG12 ILE A 2 0.367 -8.166 -3.131 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -0.617 -7.630 -4.479 1.00 0.00 H new ATOM 0 HG21 ILE A 2 2.138 -5.614 -3.093 1.00 0.00 H new ATOM 0 HG22 ILE A 2 1.156 -4.610 -2.000 1.00 0.00 H new ATOM 0 HG23 ILE A 2 1.478 -6.313 -1.596 1.00 0.00 H new ATOM 0 HD11 ILE A 2 1.616 -8.341 -5.253 1.00 0.00 H new ATOM 0 HD12 ILE A 2 1.382 -6.601 -5.548 1.00 0.00 H new ATOM 0 HD13 ILE A 2 2.382 -7.146 -4.180 1.00 0.00 H new ATOM 37 N ILE A 3 -1.215 -4.112 -0.734 1.00 0.00 N ATOM 38 CA ILE A 3 -1.766 -2.984 -0.003 1.00 0.00 C ATOM 39 C ILE A 3 -0.585 -2.103 0.353 1.00 0.00 C ATOM 40 O ILE A 3 0.206 -2.474 1.218 1.00 0.00 O ATOM 41 CB ILE A 3 -2.493 -3.501 1.258 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.723 -4.344 0.872 1.00 0.00 C ATOM 43 CG2 ILE A 3 -2.923 -2.339 2.161 1.00 0.00 C ATOM 44 CD1 ILE A 3 -4.026 -5.437 1.902 1.00 0.00 C ATOM 0 H ILE A 3 -0.400 -4.505 -0.264 1.00 0.00 H new ATOM 0 HA ILE A 3 -2.496 -2.421 -0.585 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.792 -4.129 1.808 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.591 -3.692 0.772 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -3.555 -4.803 -0.102 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -3.432 -2.731 3.041 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -2.044 -1.775 2.472 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.599 -1.683 1.613 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -4.902 -6.003 1.585 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -3.170 -6.107 1.984 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -4.222 -4.979 2.871 1.00 0.00 H new ATOM 56 N ALA A 4 -0.418 -0.986 -0.350 1.00 0.00 N ATOM 57 CA ALA A 4 0.674 -0.065 -0.036 1.00 0.00 C ATOM 58 C ALA A 4 0.294 0.796 1.150 1.00 0.00 C ATOM 59 O ALA A 4 -0.828 1.299 1.198 1.00 0.00 O ATOM 60 CB ALA A 4 1.016 0.858 -1.204 1.00 0.00 C ATOM 0 H ALA A 4 -1.012 -0.699 -1.128 1.00 0.00 H new ATOM 0 HA ALA A 4 1.547 -0.678 0.185 1.00 0.00 H new ATOM 0 HB1 ALA A 4 1.833 1.521 -0.917 1.00 0.00 H new ATOM 0 HB2 ALA A 4 1.319 0.260 -2.064 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.141 1.453 -1.466 1.00 0.00 H new ATOM 66 N ILE A 5 1.262 1.077 2.014 1.00 0.00 N ATOM 67 CA ILE A 5 1.144 2.032 3.099 1.00 0.00 C ATOM 68 C ILE A 5 2.444 2.845 3.058 1.00 0.00 C ATOM 69 O ILE A 5 3.519 2.263 3.216 1.00 0.00 O ATOM 70 CB ILE A 5 0.877 1.321 4.448 1.00 0.00 C ATOM 71 CG1 ILE A 5 -0.452 0.532 4.407 1.00 0.00 C ATOM 72 CG2 ILE A 5 0.828 2.361 5.583 1.00 0.00 C ATOM 73 CD1 ILE A 5 -0.669 -0.405 5.594 1.00 0.00 C ATOM 0 H ILE A 5 2.178 0.630 1.974 1.00 0.00 H new ATOM 0 HA ILE A 5 0.288 2.697 2.990 1.00 0.00 H new ATOM 0 HB ILE A 5 1.689 0.616 4.630 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -1.279 1.240 4.363 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -0.484 -0.053 3.488 1.00 0.00 H new ATOM 0 HG21 ILE A 5 0.640 1.857 6.531 1.00 0.00 H new ATOM 0 HG22 ILE A 5 1.781 2.888 5.635 1.00 0.00 H new ATOM 0 HG23 ILE A 5 0.029 3.076 5.387 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -1.625 -0.917 5.483 1.00 0.00 H new ATOM 0 HD12 ILE A 5 0.135 -1.140 5.629 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -0.672 0.173 6.518 1.00 0.00 H new ATOM 85 N PRO A 6 2.401 4.157 2.770 1.00 0.00 N ATOM 86 CA PRO A 6 3.564 5.016 2.886 1.00 0.00 C ATOM 87 C PRO A 6 3.872 5.145 4.372 1.00 0.00 C ATOM 88 O PRO A 6 3.038 5.674 5.112 1.00 0.00 O ATOM 89 CB PRO A 6 3.154 6.350 2.257 1.00 0.00 C ATOM 90 CG PRO A 6 1.637 6.403 2.421 1.00 0.00 C ATOM 91 CD PRO A 6 1.218 4.933 2.450 1.00 0.00 C ATOM 0 HA PRO A 6 4.457 4.641 2.387 1.00 0.00 H new ATOM 0 HB2 PRO A 6 3.636 7.189 2.758 1.00 0.00 H new ATOM 0 HB3 PRO A 6 3.441 6.398 1.207 1.00 0.00 H new ATOM 0 HG2 PRO A 6 1.352 6.918 3.339 1.00 0.00 H new ATOM 0 HG3 PRO A 6 1.165 6.937 1.596 1.00 0.00 H new ATOM 0 HD2 PRO A 6 0.438 4.770 3.194 1.00 0.00 H new ATOM 0 HD3 PRO A 6 0.808 4.630 1.486 1.00 0.00 H new ATOM 99 N VAL A 7 5.031 4.674 4.817 1.00 0.00 N ATOM 100 CA VAL A 7 5.423 4.757 6.217 1.00 0.00 C ATOM 101 C VAL A 7 6.622 5.672 6.362 1.00 0.00 C ATOM 102 O VAL A 7 7.396 5.850 5.421 1.00 0.00 O ATOM 103 CB VAL A 7 5.655 3.368 6.836 1.00 0.00 C ATOM 104 CG1 VAL A 7 4.333 2.635 7.048 1.00 0.00 C ATOM 105 CG2 VAL A 7 6.621 2.452 6.070 1.00 0.00 C ATOM 0 H VAL A 7 5.724 4.225 4.218 1.00 0.00 H new ATOM 0 HA VAL A 7 4.600 5.192 6.784 1.00 0.00 H new ATOM 0 HB VAL A 7 6.140 3.585 7.788 1.00 0.00 H new ATOM 0 HG11 VAL A 7 4.526 1.656 7.487 1.00 0.00 H new ATOM 0 HG12 VAL A 7 3.699 3.215 7.719 1.00 0.00 H new ATOM 0 HG13 VAL A 7 3.828 2.510 6.090 1.00 0.00 H new ATOM 0 HG21 VAL A 7 6.712 1.500 6.593 1.00 0.00 H new ATOM 0 HG22 VAL A 7 6.238 2.278 5.064 1.00 0.00 H new ATOM 0 HG23 VAL A 7 7.600 2.927 6.008 1.00 0.00 H new ATOM 115 N SER A 8 6.739 6.292 7.535 1.00 0.00 N ATOM 116 CA SER A 8 7.817 7.221 7.820 1.00 0.00 C ATOM 117 C SER A 8 9.129 6.496 8.121 1.00 0.00 C ATOM 118 O SER A 8 10.185 7.096 7.925 1.00 0.00 O ATOM 119 CB SER A 8 7.430 8.100 9.008 1.00 0.00 C ATOM 120 OG SER A 8 6.241 8.820 8.727 1.00 0.00 O ATOM 0 H SER A 8 6.088 6.161 8.309 1.00 0.00 H new ATOM 0 HA SER A 8 7.974 7.835 6.933 1.00 0.00 H new ATOM 0 HB2 SER A 8 7.287 7.482 9.894 1.00 0.00 H new ATOM 0 HB3 SER A 8 8.239 8.795 9.232 1.00 0.00 H new ATOM 0 HG SER A 8 6.006 9.377 9.498 1.00 0.00 H new ATOM 126 N GLU A 9 9.091 5.253 8.615 1.00 0.00 N ATOM 127 CA GLU A 9 10.283 4.550 9.083 1.00 0.00 C ATOM 128 C GLU A 9 10.156 3.065 8.765 1.00 0.00 C ATOM 129 O GLU A 9 9.045 2.533 8.696 1.00 0.00 O ATOM 130 CB GLU A 9 10.504 4.818 10.583 1.00 0.00 C ATOM 131 CG GLU A 9 10.877 6.294 10.777 1.00 0.00 C ATOM 132 CD GLU A 9 11.400 6.658 12.154 1.00 0.00 C ATOM 133 OE1 GLU A 9 12.545 6.251 12.467 1.00 0.00 O ATOM 134 OE2 GLU A 9 10.726 7.442 12.860 1.00 0.00 O ATOM 0 H GLU A 9 8.232 4.710 8.700 1.00 0.00 H new ATOM 0 HA GLU A 9 11.166 4.923 8.563 1.00 0.00 H new ATOM 0 HB2 GLU A 9 9.601 4.581 11.145 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.296 4.176 10.968 1.00 0.00 H new ATOM 0 HG2 GLU A 9 11.633 6.560 10.038 1.00 0.00 H new ATOM 0 HG3 GLU A 9 9.998 6.904 10.568 1.00 0.00 H new ATOM 141 N ASN A 10 11.302 2.415 8.562 1.00 0.00 N ATOM 142 CA ASN A 10 11.445 1.067 8.024 1.00 0.00 C ATOM 143 C ASN A 10 11.318 0.069 9.164 1.00 0.00 C ATOM 144 O ASN A 10 12.278 -0.622 9.524 1.00 0.00 O ATOM 145 CB ASN A 10 12.799 0.910 7.300 1.00 0.00 C ATOM 146 CG ASN A 10 12.858 -0.354 6.441 1.00 0.00 C ATOM 147 OD1 ASN A 10 12.058 -1.268 6.612 1.00 0.00 O ATOM 148 ND2 ASN A 10 13.786 -0.447 5.493 1.00 0.00 N ATOM 0 H ASN A 10 12.203 2.840 8.781 1.00 0.00 H new ATOM 0 HA ASN A 10 10.660 0.880 7.291 1.00 0.00 H new ATOM 0 HB2 ASN A 10 12.974 1.782 6.670 1.00 0.00 H new ATOM 0 HB3 ASN A 10 13.601 0.883 8.037 1.00 0.00 H new ATOM 0 HD21 ASN A 10 13.834 -1.280 4.906 1.00 0.00 H new ATOM 0 HD22 ASN A 10 14.450 0.314 5.353 1.00 0.00 H new ATOM 155 N ARG A 11 10.143 0.003 9.784 1.00 0.00 N ATOM 156 CA ARG A 11 9.937 -0.821 10.970 1.00 0.00 C ATOM 157 C ARG A 11 9.017 -1.984 10.622 1.00 0.00 C ATOM 158 O ARG A 11 8.163 -2.347 11.417 1.00 0.00 O ATOM 159 CB ARG A 11 9.435 0.041 12.141 1.00 0.00 C ATOM 160 CG ARG A 11 10.268 1.314 12.331 1.00 0.00 C ATOM 161 CD ARG A 11 10.074 1.926 13.718 1.00 0.00 C ATOM 162 NE ARG A 11 10.900 3.132 13.861 1.00 0.00 N ATOM 163 CZ ARG A 11 11.081 3.878 14.955 1.00 0.00 C ATOM 164 NH1 ARG A 11 10.567 3.505 16.125 1.00 0.00 N ATOM 165 NH2 ARG A 11 11.769 5.008 14.861 1.00 0.00 N ATOM 0 H ARG A 11 9.314 0.514 9.481 1.00 0.00 H new ATOM 0 HA ARG A 11 10.880 -1.253 11.305 1.00 0.00 H new ATOM 0 HB2 ARG A 11 8.394 0.314 11.967 1.00 0.00 H new ATOM 0 HB3 ARG A 11 9.461 -0.547 13.058 1.00 0.00 H new ATOM 0 HG2 ARG A 11 11.323 1.082 12.182 1.00 0.00 H new ATOM 0 HG3 ARG A 11 9.991 2.045 11.571 1.00 0.00 H new ATOM 0 HD2 ARG A 11 9.024 2.176 13.870 1.00 0.00 H new ATOM 0 HD3 ARG A 11 10.343 1.199 14.485 1.00 0.00 H new ATOM 0 HE ARG A 11 11.396 3.437 13.024 1.00 0.00 H new ATOM 0 HH11 ARG A 11 10.028 2.642 16.193 1.00 0.00 H new ATOM 0 HH12 ARG A 11 10.712 4.083 16.953 1.00 0.00 H new ATOM 0 HH21 ARG A 11 12.153 5.298 13.962 1.00 0.00 H new ATOM 0 HH22 ARG A 11 11.915 5.587 15.688 1.00 0.00 H new ATOM 179 N GLY A 12 9.183 -2.566 9.433 1.00 0.00 N ATOM 180 CA GLY A 12 8.386 -3.656 8.883 1.00 0.00 C ATOM 181 C GLY A 12 6.902 -3.539 9.223 1.00 0.00 C ATOM 182 O GLY A 12 6.197 -2.676 8.704 1.00 0.00 O ATOM 0 H GLY A 12 9.921 -2.270 8.794 1.00 0.00 H new ATOM 0 HA2 GLY A 12 8.505 -3.675 7.800 1.00 0.00 H new ATOM 0 HA3 GLY A 12 8.767 -4.604 9.262 1.00 0.00 H new ATOM 186 N LYS A 13 6.421 -4.402 10.113 1.00 0.00 N ATOM 187 CA LYS A 13 5.010 -4.454 10.503 1.00 0.00 C ATOM 188 C LYS A 13 4.623 -3.373 11.523 1.00 0.00 C ATOM 189 O LYS A 13 3.446 -3.041 11.646 1.00 0.00 O ATOM 190 CB LYS A 13 4.702 -5.867 11.015 1.00 0.00 C ATOM 191 CG LYS A 13 5.532 -6.311 12.240 1.00 0.00 C ATOM 192 CD LYS A 13 6.294 -7.635 12.046 1.00 0.00 C ATOM 193 CE LYS A 13 7.582 -7.434 11.236 1.00 0.00 C ATOM 194 NZ LYS A 13 8.365 -8.678 11.111 1.00 0.00 N ATOM 0 H LYS A 13 7.002 -5.092 10.589 1.00 0.00 H new ATOM 0 HA LYS A 13 4.399 -4.236 9.627 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.644 -5.922 11.272 1.00 0.00 H new ATOM 0 HB3 LYS A 13 4.870 -6.576 10.204 1.00 0.00 H new ATOM 0 HG2 LYS A 13 6.248 -5.526 12.482 1.00 0.00 H new ATOM 0 HG3 LYS A 13 4.867 -6.411 13.098 1.00 0.00 H new ATOM 0 HD2 LYS A 13 6.539 -8.060 13.019 1.00 0.00 H new ATOM 0 HD3 LYS A 13 5.652 -8.353 11.537 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.329 -7.065 10.242 1.00 0.00 H new ATOM 0 HE3 LYS A 13 8.194 -6.669 11.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 9.225 -8.493 10.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 8.630 -9.018 12.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 7.793 -9.402 10.631 1.00 0.00 H new ATOM 208 N ASP A 14 5.607 -2.827 12.231 1.00 0.00 N ATOM 209 CA ASP A 14 5.506 -1.802 13.269 1.00 0.00 C ATOM 210 C ASP A 14 5.560 -0.393 12.649 1.00 0.00 C ATOM 211 O ASP A 14 5.414 0.608 13.353 1.00 0.00 O ATOM 212 CB ASP A 14 6.684 -1.938 14.264 1.00 0.00 C ATOM 213 CG ASP A 14 7.094 -3.377 14.597 1.00 0.00 C ATOM 214 OD1 ASP A 14 6.486 -4.015 15.487 1.00 0.00 O ATOM 215 OD2 ASP A 14 8.056 -3.889 13.970 1.00 0.00 O ATOM 0 H ASP A 14 6.575 -3.112 12.083 1.00 0.00 H new ATOM 0 HA ASP A 14 4.556 -1.940 13.785 1.00 0.00 H new ATOM 0 HB2 ASP A 14 7.548 -1.417 13.852 1.00 0.00 H new ATOM 0 HB3 ASP A 14 6.417 -1.430 15.190 1.00 0.00 H new ATOM 220 N SER A 15 5.825 -0.297 11.340 1.00 0.00 N ATOM 221 CA SER A 15 6.008 0.933 10.577 1.00 0.00 C ATOM 222 C SER A 15 4.850 1.926 10.784 1.00 0.00 C ATOM 223 O SER A 15 3.706 1.579 10.481 1.00 0.00 O ATOM 224 CB SER A 15 6.213 0.590 9.112 1.00 0.00 C ATOM 225 OG SER A 15 7.272 -0.307 8.917 1.00 0.00 O ATOM 0 H SER A 15 5.922 -1.127 10.756 1.00 0.00 H new ATOM 0 HA SER A 15 6.899 1.441 10.946 1.00 0.00 H new ATOM 0 HB2 SER A 15 5.296 0.158 8.711 1.00 0.00 H new ATOM 0 HB3 SER A 15 6.407 1.504 8.551 1.00 0.00 H new ATOM 0 HG SER A 15 6.930 -1.136 8.522 1.00 0.00 H new ATOM 231 N PRO A 16 5.102 3.148 11.296 1.00 0.00 N ATOM 232 CA PRO A 16 4.072 4.177 11.438 1.00 0.00 C ATOM 233 C PRO A 16 3.720 4.790 10.077 1.00 0.00 C ATOM 234 O PRO A 16 4.623 5.124 9.301 1.00 0.00 O ATOM 235 CB PRO A 16 4.680 5.217 12.382 1.00 0.00 C ATOM 236 CG PRO A 16 6.183 5.104 12.126 1.00 0.00 C ATOM 237 CD PRO A 16 6.369 3.614 11.851 1.00 0.00 C ATOM 0 HA PRO A 16 3.139 3.775 11.832 1.00 0.00 H new ATOM 0 HB2 PRO A 16 4.311 6.219 12.165 1.00 0.00 H new ATOM 0 HB3 PRO A 16 4.434 5.006 13.423 1.00 0.00 H new ATOM 0 HG2 PRO A 16 6.496 5.714 11.278 1.00 0.00 H new ATOM 0 HG3 PRO A 16 6.766 5.432 12.987 1.00 0.00 H new ATOM 0 HD2 PRO A 16 7.187 3.445 11.151 1.00 0.00 H new ATOM 0 HD3 PRO A 16 6.616 3.076 12.766 1.00 0.00 H new ATOM 245 N ILE A 17 2.423 4.967 9.790 1.00 0.00 N ATOM 246 CA ILE A 17 1.961 5.587 8.551 1.00 0.00 C ATOM 247 C ILE A 17 2.471 7.031 8.472 1.00 0.00 C ATOM 248 O ILE A 17 2.486 7.745 9.477 1.00 0.00 O ATOM 249 CB ILE A 17 0.425 5.450 8.417 1.00 0.00 C ATOM 250 CG1 ILE A 17 -0.026 5.744 6.970 1.00 0.00 C ATOM 251 CG2 ILE A 17 -0.344 6.341 9.399 1.00 0.00 C ATOM 252 CD1 ILE A 17 -1.429 5.215 6.651 1.00 0.00 C ATOM 0 H ILE A 17 1.668 4.682 10.414 1.00 0.00 H new ATOM 0 HA ILE A 17 2.378 5.067 7.689 1.00 0.00 H new ATOM 0 HB ILE A 17 0.187 4.417 8.669 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.005 6.821 6.802 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.688 5.299 6.277 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -1.415 6.200 9.256 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -0.076 6.072 10.421 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -0.088 7.385 9.220 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -1.683 5.456 5.619 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -1.450 4.134 6.787 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -2.154 5.679 7.320 1.00 0.00 H new ATOM 264 N SER A 18 2.895 7.453 7.283 1.00 0.00 N ATOM 265 CA SER A 18 3.340 8.805 6.995 1.00 0.00 C ATOM 266 C SER A 18 2.161 9.653 6.509 1.00 0.00 C ATOM 267 O SER A 18 1.048 9.158 6.320 1.00 0.00 O ATOM 268 CB SER A 18 4.442 8.751 5.933 1.00 0.00 C ATOM 269 OG SER A 18 5.474 9.667 6.248 1.00 0.00 O ATOM 0 H SER A 18 2.938 6.839 6.470 1.00 0.00 H new ATOM 0 HA SER A 18 3.737 9.265 7.900 1.00 0.00 H new ATOM 0 HB2 SER A 18 4.849 7.742 5.872 1.00 0.00 H new ATOM 0 HB3 SER A 18 4.025 8.986 4.954 1.00 0.00 H new ATOM 0 HG SER A 18 5.769 9.522 7.171 1.00 0.00 H new ATOM 275 N GLU A 19 2.407 10.942 6.262 1.00 0.00 N ATOM 276 CA GLU A 19 1.322 11.881 5.976 1.00 0.00 C ATOM 277 C GLU A 19 1.120 12.067 4.475 1.00 0.00 C ATOM 278 O GLU A 19 -0.015 12.129 3.985 1.00 0.00 O ATOM 279 CB GLU A 19 1.532 13.244 6.648 1.00 0.00 C ATOM 280 CG GLU A 19 1.512 13.176 8.189 1.00 0.00 C ATOM 281 CD GLU A 19 0.687 14.301 8.823 1.00 0.00 C ATOM 282 OE1 GLU A 19 0.742 15.454 8.329 1.00 0.00 O ATOM 283 OE2 GLU A 19 -0.059 14.039 9.796 1.00 0.00 O ATOM 0 H GLU A 19 3.339 11.356 6.254 1.00 0.00 H new ATOM 0 HA GLU A 19 0.421 11.436 6.399 1.00 0.00 H new ATOM 0 HB2 GLU A 19 2.486 13.658 6.322 1.00 0.00 H new ATOM 0 HB3 GLU A 19 0.755 13.930 6.312 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.105 12.214 8.500 1.00 0.00 H new ATOM 0 HG3 GLU A 19 2.534 13.226 8.564 1.00 0.00 H new ATOM 290 N HIS A 20 2.221 12.177 3.735 1.00 0.00 N ATOM 291 CA HIS A 20 2.217 12.333 2.286 1.00 0.00 C ATOM 292 C HIS A 20 2.512 10.968 1.649 1.00 0.00 C ATOM 293 O HIS A 20 2.697 9.973 2.355 1.00 0.00 O ATOM 294 CB HIS A 20 3.198 13.457 1.898 1.00 0.00 C ATOM 295 CG HIS A 20 2.785 14.805 2.427 1.00 0.00 C ATOM 296 ND1 HIS A 20 3.347 15.500 3.486 1.00 0.00 N ATOM 297 CD2 HIS A 20 1.711 15.513 1.979 1.00 0.00 C ATOM 298 CE1 HIS A 20 2.600 16.606 3.673 1.00 0.00 C ATOM 299 NE2 HIS A 20 1.603 16.637 2.771 1.00 0.00 N ATOM 0 H HIS A 20 3.159 12.160 4.136 1.00 0.00 H new ATOM 0 HA HIS A 20 1.245 12.645 1.903 1.00 0.00 H new ATOM 0 HB2 HIS A 20 4.191 13.213 2.276 1.00 0.00 H new ATOM 0 HB3 HIS A 20 3.274 13.507 0.812 1.00 0.00 H new ATOM 0 HD2 HIS A 20 1.064 15.244 1.157 1.00 0.00 H new ATOM 0 HE1 HIS A 20 2.775 17.354 4.432 1.00 0.00 H new ATOM 0 HE2 HIS A 20 0.892 17.364 2.687 1.00 0.00 H new ATOM 308 N PHE A 21 2.521 10.897 0.320 1.00 0.00 N ATOM 309 CA PHE A 21 2.899 9.709 -0.445 1.00 0.00 C ATOM 310 C PHE A 21 4.087 10.035 -1.347 1.00 0.00 C ATOM 311 O PHE A 21 5.064 9.295 -1.383 1.00 0.00 O ATOM 312 CB PHE A 21 1.685 9.236 -1.247 1.00 0.00 C ATOM 313 CG PHE A 21 1.930 8.084 -2.202 1.00 0.00 C ATOM 314 CD1 PHE A 21 2.453 8.333 -3.486 1.00 0.00 C ATOM 315 CD2 PHE A 21 1.588 6.769 -1.837 1.00 0.00 C ATOM 316 CE1 PHE A 21 2.657 7.274 -4.386 1.00 0.00 C ATOM 317 CE2 PHE A 21 1.781 5.713 -2.744 1.00 0.00 C ATOM 318 CZ PHE A 21 2.335 5.962 -4.012 1.00 0.00 C ATOM 0 H PHE A 21 2.259 11.685 -0.272 1.00 0.00 H new ATOM 0 HA PHE A 21 3.207 8.903 0.221 1.00 0.00 H new ATOM 0 HB2 PHE A 21 0.903 8.942 -0.547 1.00 0.00 H new ATOM 0 HB3 PHE A 21 1.300 10.081 -1.818 1.00 0.00 H new ATOM 0 HD1 PHE A 21 2.698 9.343 -3.780 1.00 0.00 H new ATOM 0 HD2 PHE A 21 1.177 6.571 -0.858 1.00 0.00 H new ATOM 0 HE1 PHE A 21 3.062 7.471 -5.367 1.00 0.00 H new ATOM 0 HE2 PHE A 21 1.503 4.707 -2.466 1.00 0.00 H new ATOM 0 HZ PHE A 21 2.512 5.145 -4.696 1.00 0.00 H new ATOM 328 N GLY A 22 4.008 11.160 -2.066 1.00 0.00 N ATOM 329 CA GLY A 22 5.003 11.594 -3.041 1.00 0.00 C ATOM 330 C GLY A 22 6.388 11.855 -2.447 1.00 0.00 C ATOM 331 O GLY A 22 7.345 11.966 -3.212 1.00 0.00 O ATOM 0 H GLY A 22 3.226 11.809 -1.980 1.00 0.00 H new ATOM 0 HA2 GLY A 22 5.090 10.834 -3.818 1.00 0.00 H new ATOM 0 HA3 GLY A 22 4.649 12.505 -3.524 1.00 0.00 H new ATOM 335 N ARG A 23 6.525 11.913 -1.116 1.00 0.00 N ATOM 336 CA ARG A 23 7.825 11.922 -0.450 1.00 0.00 C ATOM 337 C ARG A 23 7.840 10.943 0.732 1.00 0.00 C ATOM 338 O ARG A 23 8.456 11.211 1.766 1.00 0.00 O ATOM 339 CB ARG A 23 8.185 13.373 -0.052 1.00 0.00 C ATOM 340 CG ARG A 23 7.146 14.179 0.754 1.00 0.00 C ATOM 341 CD ARG A 23 6.111 14.933 -0.115 1.00 0.00 C ATOM 342 NE ARG A 23 6.048 16.378 0.198 1.00 0.00 N ATOM 343 CZ ARG A 23 7.025 17.272 -0.017 1.00 0.00 C ATOM 344 NH1 ARG A 23 8.037 16.999 -0.829 1.00 0.00 N ATOM 345 NH2 ARG A 23 6.997 18.460 0.580 1.00 0.00 N ATOM 0 H ARG A 23 5.734 11.955 -0.474 1.00 0.00 H new ATOM 0 HA ARG A 23 8.599 11.571 -1.133 1.00 0.00 H new ATOM 0 HB2 ARG A 23 9.107 13.342 0.528 1.00 0.00 H new ATOM 0 HB3 ARG A 23 8.402 13.926 -0.966 1.00 0.00 H new ATOM 0 HG2 ARG A 23 6.616 13.500 1.422 1.00 0.00 H new ATOM 0 HG3 ARG A 23 7.670 14.900 1.382 1.00 0.00 H new ATOM 0 HD2 ARG A 23 6.363 14.804 -1.168 1.00 0.00 H new ATOM 0 HD3 ARG A 23 5.126 14.490 0.033 1.00 0.00 H new ATOM 0 HE ARG A 23 5.184 16.726 0.615 1.00 0.00 H new ATOM 0 HH11 ARG A 23 8.082 16.097 -1.303 1.00 0.00 H new ATOM 0 HH12 ARG A 23 8.771 17.691 -0.980 1.00 0.00 H new ATOM 0 HH21 ARG A 23 6.228 18.698 1.207 1.00 0.00 H new ATOM 0 HH22 ARG A 23 7.744 19.134 0.411 1.00 0.00 H new ATOM 359 N ALA A 24 7.205 9.779 0.568 1.00 0.00 N ATOM 360 CA ALA A 24 7.193 8.745 1.592 1.00 0.00 C ATOM 361 C ALA A 24 8.580 8.101 1.570 1.00 0.00 C ATOM 362 O ALA A 24 9.036 7.760 0.481 1.00 0.00 O ATOM 363 CB ALA A 24 6.124 7.700 1.272 1.00 0.00 C ATOM 0 H ALA A 24 6.689 9.533 -0.277 1.00 0.00 H new ATOM 0 HA ALA A 24 6.965 9.162 2.573 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.124 6.931 2.045 1.00 0.00 H new ATOM 0 HB2 ALA A 24 5.146 8.179 1.237 1.00 0.00 H new ATOM 0 HB3 ALA A 24 6.339 7.243 0.306 1.00 0.00 H new ATOM 369 N PRO A 25 9.270 7.943 2.702 1.00 0.00 N ATOM 370 CA PRO A 25 10.598 7.342 2.729 1.00 0.00 C ATOM 371 C PRO A 25 10.585 5.831 2.483 1.00 0.00 C ATOM 372 O PRO A 25 11.601 5.289 2.044 1.00 0.00 O ATOM 373 CB PRO A 25 11.168 7.683 4.099 1.00 0.00 C ATOM 374 CG PRO A 25 9.937 7.931 4.964 1.00 0.00 C ATOM 375 CD PRO A 25 8.869 8.421 4.007 1.00 0.00 C ATOM 0 HA PRO A 25 11.211 7.736 1.919 1.00 0.00 H new ATOM 0 HB2 PRO A 25 11.774 6.867 4.493 1.00 0.00 H new ATOM 0 HB3 PRO A 25 11.809 8.564 4.056 1.00 0.00 H new ATOM 0 HG2 PRO A 25 9.622 7.019 5.471 1.00 0.00 H new ATOM 0 HG3 PRO A 25 10.142 8.671 5.737 1.00 0.00 H new ATOM 0 HD2 PRO A 25 7.888 8.034 4.282 1.00 0.00 H new ATOM 0 HD3 PRO A 25 8.798 9.509 4.022 1.00 0.00 H new ATOM 383 N TYR A 26 9.464 5.157 2.747 1.00 0.00 N ATOM 384 CA TYR A 26 9.309 3.715 2.635 1.00 0.00 C ATOM 385 C TYR A 26 7.878 3.434 2.175 1.00 0.00 C ATOM 386 O TYR A 26 6.964 4.213 2.472 1.00 0.00 O ATOM 387 CB TYR A 26 9.568 3.072 4.009 1.00 0.00 C ATOM 388 CG TYR A 26 10.897 3.437 4.648 1.00 0.00 C ATOM 389 CD1 TYR A 26 12.067 2.762 4.274 1.00 0.00 C ATOM 390 CD2 TYR A 26 10.978 4.496 5.569 1.00 0.00 C ATOM 391 CE1 TYR A 26 13.322 3.224 4.708 1.00 0.00 C ATOM 392 CE2 TYR A 26 12.223 4.915 6.068 1.00 0.00 C ATOM 393 CZ TYR A 26 13.408 4.301 5.615 1.00 0.00 C ATOM 394 OH TYR A 26 14.604 4.708 6.122 1.00 0.00 O ATOM 0 H TYR A 26 8.611 5.623 3.056 1.00 0.00 H new ATOM 0 HA TYR A 26 10.017 3.298 1.919 1.00 0.00 H new ATOM 0 HB2 TYR A 26 8.765 3.362 4.686 1.00 0.00 H new ATOM 0 HB3 TYR A 26 9.519 1.988 3.901 1.00 0.00 H new ATOM 0 HD1 TYR A 26 12.004 1.883 3.650 1.00 0.00 H new ATOM 0 HD2 TYR A 26 10.076 4.992 5.896 1.00 0.00 H new ATOM 0 HE1 TYR A 26 14.224 2.753 4.346 1.00 0.00 H new ATOM 0 HE2 TYR A 26 12.272 5.708 6.799 1.00 0.00 H new ATOM 0 HH TYR A 26 14.462 5.464 6.729 1.00 0.00 H new ATOM 404 N PHE A 27 7.666 2.304 1.502 1.00 0.00 N ATOM 405 CA PHE A 27 6.348 1.806 1.129 1.00 0.00 C ATOM 406 C PHE A 27 6.252 0.386 1.644 1.00 0.00 C ATOM 407 O PHE A 27 6.936 -0.500 1.131 1.00 0.00 O ATOM 408 CB PHE A 27 6.119 1.813 -0.382 1.00 0.00 C ATOM 409 CG PHE A 27 5.996 3.182 -0.997 1.00 0.00 C ATOM 410 CD1 PHE A 27 4.915 4.003 -0.644 1.00 0.00 C ATOM 411 CD2 PHE A 27 6.938 3.619 -1.942 1.00 0.00 C ATOM 412 CE1 PHE A 27 4.778 5.259 -1.247 1.00 0.00 C ATOM 413 CE2 PHE A 27 6.775 4.859 -2.581 1.00 0.00 C ATOM 414 CZ PHE A 27 5.689 5.680 -2.232 1.00 0.00 C ATOM 0 H PHE A 27 8.426 1.697 1.195 1.00 0.00 H new ATOM 0 HA PHE A 27 5.588 2.457 1.561 1.00 0.00 H new ATOM 0 HB2 PHE A 27 6.944 1.287 -0.863 1.00 0.00 H new ATOM 0 HB3 PHE A 27 5.212 1.249 -0.600 1.00 0.00 H new ATOM 0 HD1 PHE A 27 4.194 3.669 0.087 1.00 0.00 H new ATOM 0 HD2 PHE A 27 7.791 3.000 -2.178 1.00 0.00 H new ATOM 0 HE1 PHE A 27 3.967 5.909 -0.954 1.00 0.00 H new ATOM 0 HE2 PHE A 27 7.479 5.179 -3.335 1.00 0.00 H new ATOM 0 HZ PHE A 27 5.554 6.634 -2.720 1.00 0.00 H new ATOM 424 N ALA A 28 5.414 0.193 2.655 1.00 0.00 N ATOM 425 CA ALA A 28 4.996 -1.100 3.148 1.00 0.00 C ATOM 426 C ALA A 28 3.906 -1.613 2.212 1.00 0.00 C ATOM 427 O ALA A 28 2.736 -1.298 2.399 1.00 0.00 O ATOM 428 CB ALA A 28 4.470 -0.912 4.576 1.00 0.00 C ATOM 0 H ALA A 28 4.994 0.967 3.169 1.00 0.00 H new ATOM 0 HA ALA A 28 5.812 -1.823 3.173 1.00 0.00 H new ATOM 0 HB1 ALA A 28 4.147 -1.874 4.974 1.00 0.00 H new ATOM 0 HB2 ALA A 28 5.262 -0.507 5.205 1.00 0.00 H new ATOM 0 HB3 ALA A 28 3.626 -0.222 4.565 1.00 0.00 H new ATOM 434 N PHE A 29 4.279 -2.337 1.161 1.00 0.00 N ATOM 435 CA PHE A 29 3.353 -3.116 0.353 1.00 0.00 C ATOM 436 C PHE A 29 3.118 -4.438 1.090 1.00 0.00 C ATOM 437 O PHE A 29 3.895 -5.378 0.949 1.00 0.00 O ATOM 438 CB PHE A 29 3.914 -3.301 -1.067 1.00 0.00 C ATOM 439 CG PHE A 29 3.377 -2.341 -2.130 1.00 0.00 C ATOM 440 CD1 PHE A 29 1.986 -2.176 -2.346 1.00 0.00 C ATOM 441 CD2 PHE A 29 4.276 -1.660 -2.978 1.00 0.00 C ATOM 442 CE1 PHE A 29 1.515 -1.279 -3.317 1.00 0.00 C ATOM 443 CE2 PHE A 29 3.790 -0.858 -4.024 1.00 0.00 C ATOM 444 CZ PHE A 29 2.417 -0.619 -4.160 1.00 0.00 C ATOM 0 H PHE A 29 5.247 -2.398 0.844 1.00 0.00 H new ATOM 0 HA PHE A 29 2.396 -2.610 0.225 1.00 0.00 H new ATOM 0 HB2 PHE A 29 4.998 -3.195 -1.025 1.00 0.00 H new ATOM 0 HB3 PHE A 29 3.706 -4.321 -1.389 1.00 0.00 H new ATOM 0 HD1 PHE A 29 1.282 -2.746 -1.758 1.00 0.00 H new ATOM 0 HD2 PHE A 29 5.340 -1.756 -2.822 1.00 0.00 H new ATOM 0 HE1 PHE A 29 0.455 -1.098 -3.414 1.00 0.00 H new ATOM 0 HE2 PHE A 29 4.482 -0.422 -4.730 1.00 0.00 H new ATOM 0 HZ PHE A 29 2.056 0.070 -4.910 1.00 0.00 H new ATOM 454 N VAL A 30 2.078 -4.508 1.917 1.00 0.00 N ATOM 455 CA VAL A 30 1.655 -5.744 2.578 1.00 0.00 C ATOM 456 C VAL A 30 0.856 -6.557 1.563 1.00 0.00 C ATOM 457 O VAL A 30 0.278 -5.987 0.639 1.00 0.00 O ATOM 458 CB VAL A 30 0.808 -5.409 3.826 1.00 0.00 C ATOM 459 CG1 VAL A 30 0.582 -6.639 4.719 1.00 0.00 C ATOM 460 CG2 VAL A 30 1.479 -4.322 4.681 1.00 0.00 C ATOM 0 H VAL A 30 1.498 -3.702 2.151 1.00 0.00 H new ATOM 0 HA VAL A 30 2.514 -6.324 2.917 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.151 -5.054 3.449 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.018 -6.356 5.584 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.060 -7.409 4.152 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.544 -7.026 5.056 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.858 -4.109 5.551 1.00 0.00 H new ATOM 0 HG22 VAL A 30 2.458 -4.671 5.010 1.00 0.00 H new ATOM 0 HG23 VAL A 30 1.597 -3.415 4.089 1.00 0.00 H new ATOM 470 N LYS A 31 0.815 -7.880 1.702 1.00 0.00 N ATOM 471 CA LYS A 31 0.102 -8.761 0.781 1.00 0.00 C ATOM 472 C LYS A 31 -1.213 -9.214 1.413 1.00 0.00 C ATOM 473 O LYS A 31 -1.656 -8.638 2.411 1.00 0.00 O ATOM 474 CB LYS A 31 1.061 -9.880 0.333 1.00 0.00 C ATOM 475 CG LYS A 31 2.218 -9.256 -0.463 1.00 0.00 C ATOM 476 CD LYS A 31 2.896 -10.222 -1.443 1.00 0.00 C ATOM 477 CE LYS A 31 3.066 -9.505 -2.790 1.00 0.00 C ATOM 478 NZ LYS A 31 3.987 -10.192 -3.711 1.00 0.00 N ATOM 0 H LYS A 31 1.280 -8.375 2.463 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.202 -8.252 -0.134 1.00 0.00 H new ATOM 0 HB2 LYS A 31 1.446 -10.416 1.201 1.00 0.00 H new ATOM 0 HB3 LYS A 31 0.530 -10.608 -0.281 1.00 0.00 H new ATOM 0 HG2 LYS A 31 1.841 -8.397 -1.018 1.00 0.00 H new ATOM 0 HG3 LYS A 31 2.965 -8.881 0.236 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.865 -10.537 -1.056 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.294 -11.122 -1.566 1.00 0.00 H new ATOM 0 HE2 LYS A 31 2.091 -9.411 -3.268 1.00 0.00 H new ATOM 0 HE3 LYS A 31 3.432 -8.494 -2.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 4.055 -9.655 -4.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.928 -10.259 -3.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 3.629 -11.148 -3.911 1.00 0.00 H new ATOM 492 N VAL A 32 -1.876 -10.205 0.818 1.00 0.00 N ATOM 493 CA VAL A 32 -2.927 -10.980 1.464 1.00 0.00 C ATOM 494 C VAL A 32 -2.729 -12.432 1.020 1.00 0.00 C ATOM 495 O VAL A 32 -2.463 -12.679 -0.157 1.00 0.00 O ATOM 496 CB VAL A 32 -4.340 -10.467 1.090 1.00 0.00 C ATOM 497 CG1 VAL A 32 -5.440 -11.152 1.919 1.00 0.00 C ATOM 498 CG2 VAL A 32 -4.536 -8.953 1.267 1.00 0.00 C ATOM 0 H VAL A 32 -1.692 -10.494 -0.143 1.00 0.00 H new ATOM 0 HA VAL A 32 -2.859 -10.885 2.548 1.00 0.00 H new ATOM 0 HB VAL A 32 -4.422 -10.714 0.031 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -6.414 -10.762 1.624 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -5.411 -12.227 1.744 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -5.275 -10.952 2.978 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -5.553 -8.682 0.982 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -4.367 -8.684 2.310 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -3.827 -8.418 0.635 1.00 0.00 H new ATOM 508 N LYS A 33 -2.881 -13.394 1.933 1.00 0.00 N ATOM 509 CA LYS A 33 -3.045 -14.820 1.670 1.00 0.00 C ATOM 510 C LYS A 33 -4.482 -15.110 2.047 1.00 0.00 C ATOM 511 O LYS A 33 -4.771 -15.302 3.230 1.00 0.00 O ATOM 512 CB LYS A 33 -2.031 -15.683 2.462 1.00 0.00 C ATOM 513 CG LYS A 33 -2.346 -17.194 2.489 1.00 0.00 C ATOM 514 CD LYS A 33 -2.846 -17.733 3.842 1.00 0.00 C ATOM 515 CE LYS A 33 -4.194 -18.452 3.702 1.00 0.00 C ATOM 516 NZ LYS A 33 -4.541 -19.196 4.933 1.00 0.00 N ATOM 0 H LYS A 33 -2.893 -13.184 2.931 1.00 0.00 H new ATOM 0 HA LYS A 33 -2.843 -15.073 0.629 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -1.040 -15.541 2.031 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -1.988 -15.317 3.488 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -3.099 -17.406 1.730 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -1.447 -17.742 2.207 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.108 -18.420 4.255 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -2.945 -16.909 4.548 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -4.975 -17.724 3.483 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -4.155 -19.141 2.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -5.458 -19.670 4.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -3.807 -19.907 5.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -4.602 -18.534 5.733 1.00 0.00 H new ATOM 530 N ASN A 34 -5.381 -15.112 1.064 1.00 0.00 N ATOM 531 CA ASN A 34 -6.792 -15.488 1.153 1.00 0.00 C ATOM 532 C ASN A 34 -7.664 -14.489 1.919 1.00 0.00 C ATOM 533 O ASN A 34 -8.723 -14.107 1.431 1.00 0.00 O ATOM 534 CB ASN A 34 -6.939 -16.920 1.690 1.00 0.00 C ATOM 535 CG ASN A 34 -8.211 -17.553 1.166 1.00 0.00 C ATOM 536 OD1 ASN A 34 -8.213 -18.087 0.061 1.00 0.00 O ATOM 537 ND2 ASN A 34 -9.283 -17.547 1.928 1.00 0.00 N ATOM 0 H ASN A 34 -5.125 -14.831 0.117 1.00 0.00 H new ATOM 0 HA ASN A 34 -7.179 -15.459 0.134 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -6.078 -17.518 1.391 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -6.954 -16.907 2.780 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -10.141 -17.993 1.604 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -9.256 -17.096 2.843 1.00 0.00 H new ATOM 544 N ASN A 35 -7.234 -14.100 3.119 1.00 0.00 N ATOM 545 CA ASN A 35 -7.848 -13.132 4.032 1.00 0.00 C ATOM 546 C ASN A 35 -6.915 -12.732 5.177 1.00 0.00 C ATOM 547 O ASN A 35 -7.287 -11.898 6.002 1.00 0.00 O ATOM 548 CB ASN A 35 -9.153 -13.674 4.635 1.00 0.00 C ATOM 549 CG ASN A 35 -9.095 -15.149 4.998 1.00 0.00 C ATOM 550 OD1 ASN A 35 -9.539 -15.994 4.227 1.00 0.00 O ATOM 551 ND2 ASN A 35 -8.498 -15.521 6.109 1.00 0.00 N ATOM 0 H ASN A 35 -6.375 -14.485 3.512 1.00 0.00 H new ATOM 0 HA ASN A 35 -8.058 -12.251 3.425 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -9.396 -13.099 5.528 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -9.964 -13.516 3.924 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -8.404 -16.512 6.330 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -8.129 -14.818 6.750 1.00 0.00 H new ATOM 558 N ALA A 36 -5.712 -13.298 5.250 1.00 0.00 N ATOM 559 CA ALA A 36 -4.692 -12.976 6.233 1.00 0.00 C ATOM 560 C ALA A 36 -3.540 -12.266 5.513 1.00 0.00 C ATOM 561 O ALA A 36 -3.586 -12.154 4.294 1.00 0.00 O ATOM 562 CB ALA A 36 -4.225 -14.256 6.923 1.00 0.00 C ATOM 0 H ALA A 36 -5.414 -14.023 4.597 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.086 -12.314 7.004 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.460 -14.013 7.660 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.071 -14.731 7.421 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.811 -14.939 6.181 1.00 0.00 H new ATOM 568 N ILE A 37 -2.484 -11.830 6.203 1.00 0.00 N ATOM 569 CA ILE A 37 -1.525 -10.850 5.697 1.00 0.00 C ATOM 570 C ILE A 37 -0.660 -11.380 4.555 1.00 0.00 C ATOM 571 O ILE A 37 -0.121 -10.576 3.805 1.00 0.00 O ATOM 572 CB ILE A 37 -0.729 -10.290 6.913 1.00 0.00 C ATOM 573 CG1 ILE A 37 -1.388 -9.005 7.457 1.00 0.00 C ATOM 574 CG2 ILE A 37 0.765 -9.998 6.682 1.00 0.00 C ATOM 575 CD1 ILE A 37 -2.860 -9.164 7.857 1.00 0.00 C ATOM 0 H ILE A 37 -2.269 -12.155 7.146 1.00 0.00 H new ATOM 0 HA ILE A 37 -2.054 -10.024 5.221 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.769 -11.111 7.629 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.824 -8.662 8.325 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.313 -8.225 6.699 1.00 0.00 H new ATOM 0 HG21 ILE A 37 1.207 -9.613 7.601 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.275 -10.917 6.391 1.00 0.00 H new ATOM 0 HG23 ILE A 37 0.873 -9.257 5.890 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.241 -8.212 8.228 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.441 -9.474 6.989 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.945 -9.918 8.639 1.00 0.00 H new ATOM 587 N ALA A 38 -0.548 -12.700 4.365 1.00 0.00 N ATOM 588 CA ALA A 38 0.536 -13.342 3.623 1.00 0.00 C ATOM 589 C ALA A 38 1.893 -12.895 4.169 1.00 0.00 C ATOM 590 O ALA A 38 2.519 -13.637 4.927 1.00 0.00 O ATOM 591 CB ALA A 38 0.446 -13.096 2.107 1.00 0.00 C ATOM 0 H ALA A 38 -1.228 -13.365 4.734 1.00 0.00 H new ATOM 0 HA ALA A 38 0.431 -14.417 3.769 1.00 0.00 H new ATOM 0 HB1 ALA A 38 1.276 -13.596 1.607 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -0.497 -13.492 1.729 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.495 -12.025 1.909 1.00 0.00 H new ATOM 597 N ASP A 39 2.345 -11.706 3.789 1.00 0.00 N ATOM 598 CA ASP A 39 3.690 -11.187 3.991 1.00 0.00 C ATOM 599 C ASP A 39 3.656 -9.662 4.022 1.00 0.00 C ATOM 600 O ASP A 39 2.677 -9.036 3.608 1.00 0.00 O ATOM 601 CB ASP A 39 4.583 -11.622 2.818 1.00 0.00 C ATOM 602 CG ASP A 39 6.072 -11.741 3.166 1.00 0.00 C ATOM 603 OD1 ASP A 39 6.523 -11.236 4.216 1.00 0.00 O ATOM 604 OD2 ASP A 39 6.792 -12.344 2.335 1.00 0.00 O ATOM 0 H ASP A 39 1.745 -11.039 3.303 1.00 0.00 H new ATOM 0 HA ASP A 39 4.080 -11.572 4.933 1.00 0.00 H new ATOM 0 HB2 ASP A 39 4.231 -12.584 2.447 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.468 -10.905 2.005 1.00 0.00 H new ATOM 609 N ILE A 40 4.763 -9.070 4.442 1.00 0.00 N ATOM 610 CA ILE A 40 5.067 -7.651 4.397 1.00 0.00 C ATOM 611 C ILE A 40 5.992 -7.433 3.175 1.00 0.00 C ATOM 612 O ILE A 40 6.585 -8.384 2.655 1.00 0.00 O ATOM 613 CB ILE A 40 5.725 -7.311 5.762 1.00 0.00 C ATOM 614 CG1 ILE A 40 4.799 -7.520 6.995 1.00 0.00 C ATOM 615 CG2 ILE A 40 6.306 -5.901 5.811 1.00 0.00 C ATOM 616 CD1 ILE A 40 3.832 -6.371 7.339 1.00 0.00 C ATOM 0 H ILE A 40 5.526 -9.608 4.852 1.00 0.00 H new ATOM 0 HA ILE A 40 4.205 -6.996 4.269 1.00 0.00 H new ATOM 0 HB ILE A 40 6.536 -8.036 5.831 1.00 0.00 H new ATOM 0 HG12 ILE A 40 4.210 -8.422 6.829 1.00 0.00 H new ATOM 0 HG13 ILE A 40 5.428 -7.707 7.865 1.00 0.00 H new ATOM 0 HG21 ILE A 40 6.751 -5.725 6.790 1.00 0.00 H new ATOM 0 HG22 ILE A 40 7.070 -5.795 5.041 1.00 0.00 H new ATOM 0 HG23 ILE A 40 5.512 -5.174 5.637 1.00 0.00 H new ATOM 0 HD11 ILE A 40 3.244 -6.641 8.216 1.00 0.00 H new ATOM 0 HD12 ILE A 40 4.402 -5.466 7.548 1.00 0.00 H new ATOM 0 HD13 ILE A 40 3.165 -6.192 6.496 1.00 0.00 H new ATOM 628 N SER A 41 6.136 -6.198 2.695 1.00 0.00 N ATOM 629 CA SER A 41 7.265 -5.719 1.894 1.00 0.00 C ATOM 630 C SER A 41 7.458 -4.239 2.215 1.00 0.00 C ATOM 631 O SER A 41 6.876 -3.384 1.549 1.00 0.00 O ATOM 632 CB SER A 41 7.035 -5.888 0.383 1.00 0.00 C ATOM 633 OG SER A 41 6.536 -7.162 0.043 1.00 0.00 O ATOM 0 H SER A 41 5.439 -5.472 2.860 1.00 0.00 H new ATOM 0 HA SER A 41 8.146 -6.310 2.144 1.00 0.00 H new ATOM 0 HB2 SER A 41 6.335 -5.126 0.040 1.00 0.00 H new ATOM 0 HB3 SER A 41 7.974 -5.719 -0.144 1.00 0.00 H new ATOM 0 HG SER A 41 6.624 -7.764 0.812 1.00 0.00 H new ATOM 639 N VAL A 42 8.186 -3.917 3.280 1.00 0.00 N ATOM 640 CA VAL A 42 8.506 -2.532 3.613 1.00 0.00 C ATOM 641 C VAL A 42 9.876 -2.275 3.013 1.00 0.00 C ATOM 642 O VAL A 42 10.907 -2.440 3.664 1.00 0.00 O ATOM 643 CB VAL A 42 8.380 -2.284 5.126 1.00 0.00 C ATOM 644 CG1 VAL A 42 8.736 -0.859 5.570 1.00 0.00 C ATOM 645 CG2 VAL A 42 6.992 -2.650 5.667 1.00 0.00 C ATOM 0 H VAL A 42 8.568 -4.602 3.932 1.00 0.00 H new ATOM 0 HA VAL A 42 7.804 -1.811 3.193 1.00 0.00 H new ATOM 0 HB VAL A 42 9.126 -2.952 5.557 1.00 0.00 H new ATOM 0 HG11 VAL A 42 8.619 -0.775 6.650 1.00 0.00 H new ATOM 0 HG12 VAL A 42 9.769 -0.641 5.299 1.00 0.00 H new ATOM 0 HG13 VAL A 42 8.073 -0.148 5.077 1.00 0.00 H new ATOM 0 HG21 VAL A 42 6.957 -2.456 6.739 1.00 0.00 H new ATOM 0 HG22 VAL A 42 6.235 -2.048 5.164 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.797 -3.706 5.483 1.00 0.00 H new ATOM 655 N GLU A 43 9.873 -1.932 1.730 1.00 0.00 N ATOM 656 CA GLU A 43 11.079 -1.579 1.009 1.00 0.00 C ATOM 657 C GLU A 43 11.232 -0.061 1.081 1.00 0.00 C ATOM 658 O GLU A 43 10.255 0.680 1.270 1.00 0.00 O ATOM 659 CB GLU A 43 10.999 -2.089 -0.441 1.00 0.00 C ATOM 660 CG GLU A 43 10.659 -3.585 -0.546 1.00 0.00 C ATOM 661 CD GLU A 43 11.572 -4.448 0.330 1.00 0.00 C ATOM 662 OE1 GLU A 43 12.810 -4.390 0.130 1.00 0.00 O ATOM 663 OE2 GLU A 43 11.065 -5.135 1.245 1.00 0.00 O ATOM 0 H GLU A 43 9.027 -1.892 1.162 1.00 0.00 H new ATOM 0 HA GLU A 43 11.957 -2.048 1.454 1.00 0.00 H new ATOM 0 HB2 GLU A 43 10.245 -1.514 -0.979 1.00 0.00 H new ATOM 0 HB3 GLU A 43 11.953 -1.905 -0.936 1.00 0.00 H new ATOM 0 HG2 GLU A 43 9.621 -3.742 -0.251 1.00 0.00 H new ATOM 0 HG3 GLU A 43 10.747 -3.904 -1.585 1.00 0.00 H new ATOM 670 N GLU A 44 12.451 0.423 0.886 1.00 0.00 N ATOM 671 CA GLU A 44 12.765 1.840 0.932 1.00 0.00 C ATOM 672 C GLU A 44 12.337 2.467 -0.393 1.00 0.00 C ATOM 673 O GLU A 44 12.357 1.802 -1.434 1.00 0.00 O ATOM 674 CB GLU A 44 14.246 2.053 1.310 1.00 0.00 C ATOM 675 CG GLU A 44 14.736 1.068 2.395 1.00 0.00 C ATOM 676 CD GLU A 44 15.968 1.486 3.206 1.00 0.00 C ATOM 677 OE1 GLU A 44 16.768 2.351 2.777 1.00 0.00 O ATOM 678 OE2 GLU A 44 16.079 0.985 4.351 1.00 0.00 O ATOM 0 H GLU A 44 13.259 -0.168 0.689 1.00 0.00 H new ATOM 0 HA GLU A 44 12.209 2.353 1.717 1.00 0.00 H new ATOM 0 HB2 GLU A 44 14.863 1.941 0.419 1.00 0.00 H new ATOM 0 HB3 GLU A 44 14.382 3.074 1.665 1.00 0.00 H new ATOM 0 HG2 GLU A 44 13.915 0.894 3.091 1.00 0.00 H new ATOM 0 HG3 GLU A 44 14.954 0.114 1.914 1.00 0.00 H new ATOM 685 N ASN A 45 11.869 3.714 -0.364 1.00 0.00 N ATOM 686 CA ASN A 45 11.449 4.427 -1.563 1.00 0.00 C ATOM 687 C ASN A 45 12.695 5.054 -2.190 1.00 0.00 C ATOM 688 O ASN A 45 13.212 6.024 -1.624 1.00 0.00 O ATOM 689 CB ASN A 45 10.417 5.507 -1.226 1.00 0.00 C ATOM 690 CG ASN A 45 9.986 6.312 -2.450 1.00 0.00 C ATOM 691 OD1 ASN A 45 10.342 6.036 -3.593 1.00 0.00 O ATOM 692 ND2 ASN A 45 9.191 7.341 -2.240 1.00 0.00 N ATOM 0 H ASN A 45 11.771 4.257 0.494 1.00 0.00 H new ATOM 0 HA ASN A 45 10.976 3.737 -2.261 1.00 0.00 H new ATOM 0 HB2 ASN A 45 9.541 5.039 -0.777 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.835 6.183 -0.480 1.00 0.00 H new ATOM 0 HD21 ASN A 45 8.872 7.908 -3.026 1.00 0.00 H new ATOM 0 HD22 ASN A 45 8.895 7.571 -1.292 1.00 0.00 H new ATOM 699 N PRO A 46 13.187 4.557 -3.340 1.00 0.00 N ATOM 700 CA PRO A 46 14.391 5.107 -3.946 1.00 0.00 C ATOM 701 C PRO A 46 14.203 6.573 -4.368 1.00 0.00 C ATOM 702 O PRO A 46 15.190 7.278 -4.586 1.00 0.00 O ATOM 703 CB PRO A 46 14.731 4.202 -5.138 1.00 0.00 C ATOM 704 CG PRO A 46 13.606 3.165 -5.240 1.00 0.00 C ATOM 705 CD PRO A 46 12.557 3.578 -4.215 1.00 0.00 C ATOM 0 HA PRO A 46 15.212 5.122 -3.230 1.00 0.00 H new ATOM 0 HB2 PRO A 46 14.805 4.784 -6.057 1.00 0.00 H new ATOM 0 HB3 PRO A 46 15.695 3.714 -4.991 1.00 0.00 H new ATOM 0 HG2 PRO A 46 13.183 3.146 -6.244 1.00 0.00 H new ATOM 0 HG3 PRO A 46 13.980 2.162 -5.033 1.00 0.00 H new ATOM 0 HD2 PRO A 46 11.683 4.005 -4.707 1.00 0.00 H new ATOM 0 HD3 PRO A 46 12.212 2.715 -3.645 1.00 0.00 H new ATOM 713 N LEU A 47 12.953 7.050 -4.477 1.00 0.00 N ATOM 714 CA LEU A 47 12.621 8.378 -4.962 1.00 0.00 C ATOM 715 C LEU A 47 11.863 9.163 -3.884 1.00 0.00 C ATOM 716 O LEU A 47 11.004 9.988 -4.212 1.00 0.00 O ATOM 717 CB LEU A 47 11.716 8.248 -6.206 1.00 0.00 C ATOM 718 CG LEU A 47 12.134 7.388 -7.403 1.00 0.00 C ATOM 719 CD1 LEU A 47 13.561 7.672 -7.863 1.00 0.00 C ATOM 720 CD2 LEU A 47 11.871 5.892 -7.222 1.00 0.00 C ATOM 0 H LEU A 47 12.132 6.501 -4.221 1.00 0.00 H new ATOM 0 HA LEU A 47 13.542 8.905 -5.212 1.00 0.00 H new ATOM 0 HB2 LEU A 47 10.754 7.869 -5.862 1.00 0.00 H new ATOM 0 HB3 LEU A 47 11.545 9.257 -6.582 1.00 0.00 H new ATOM 0 HG LEU A 47 11.472 7.699 -8.211 1.00 0.00 H new ATOM 0 HD11 LEU A 47 13.803 7.034 -8.713 1.00 0.00 H new ATOM 0 HD12 LEU A 47 13.647 8.718 -8.158 1.00 0.00 H new ATOM 0 HD13 LEU A 47 14.254 7.467 -7.047 1.00 0.00 H new ATOM 0 HD21 LEU A 47 12.195 5.355 -8.114 1.00 0.00 H new ATOM 0 HD22 LEU A 47 12.425 5.527 -6.357 1.00 0.00 H new ATOM 0 HD23 LEU A 47 10.805 5.726 -7.066 1.00 0.00 H new ATOM 732 N ALA A 48 12.235 9.031 -2.605 1.00 0.00 N ATOM 733 CA ALA A 48 11.532 9.735 -1.529 1.00 0.00 C ATOM 734 C ALA A 48 11.755 11.242 -1.627 1.00 0.00 C ATOM 735 O ALA A 48 10.971 12.035 -1.108 1.00 0.00 O ATOM 736 CB ALA A 48 11.992 9.228 -0.163 1.00 0.00 C ATOM 0 H ALA A 48 13.012 8.448 -2.293 1.00 0.00 H new ATOM 0 HA ALA A 48 10.466 9.534 -1.639 1.00 0.00 H new ATOM 0 HB1 ALA A 48 11.458 9.763 0.622 1.00 0.00 H new ATOM 0 HB2 ALA A 48 11.783 8.161 -0.082 1.00 0.00 H new ATOM 0 HB3 ALA A 48 13.063 9.397 -0.054 1.00 0.00 H new ATOM 830 N ALA A 55 8.898 9.400 -10.756 1.00 0.00 N ATOM 831 CA ALA A 55 9.330 8.021 -10.700 1.00 0.00 C ATOM 832 C ALA A 55 8.824 7.292 -9.458 1.00 0.00 C ATOM 833 O ALA A 55 8.756 6.069 -9.502 1.00 0.00 O ATOM 834 CB ALA A 55 10.844 7.998 -10.757 1.00 0.00 C ATOM 0 HA ALA A 55 8.904 7.489 -11.551 1.00 0.00 H new ATOM 0 HB1 ALA A 55 11.194 6.967 -10.716 1.00 0.00 H new ATOM 0 HB2 ALA A 55 11.180 8.459 -11.686 1.00 0.00 H new ATOM 0 HB3 ALA A 55 11.248 8.552 -9.910 1.00 0.00 H new ATOM 840 N VAL A 56 8.406 8.005 -8.400 1.00 0.00 N ATOM 841 CA VAL A 56 7.807 7.385 -7.214 1.00 0.00 C ATOM 842 C VAL A 56 6.715 6.385 -7.635 1.00 0.00 C ATOM 843 O VAL A 56 6.831 5.218 -7.275 1.00 0.00 O ATOM 844 CB VAL A 56 7.265 8.465 -6.237 1.00 0.00 C ATOM 845 CG1 VAL A 56 6.006 8.077 -5.444 1.00 0.00 C ATOM 846 CG2 VAL A 56 8.355 8.898 -5.271 1.00 0.00 C ATOM 0 H VAL A 56 8.474 9.021 -8.345 1.00 0.00 H new ATOM 0 HA VAL A 56 8.576 6.830 -6.677 1.00 0.00 H new ATOM 0 HB VAL A 56 6.958 9.286 -6.885 1.00 0.00 H new ATOM 0 HG11 VAL A 56 5.716 8.903 -4.795 1.00 0.00 H new ATOM 0 HG12 VAL A 56 5.193 7.857 -6.136 1.00 0.00 H new ATOM 0 HG13 VAL A 56 6.215 7.195 -4.838 1.00 0.00 H new ATOM 0 HG21 VAL A 56 7.961 9.655 -4.593 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.694 8.037 -4.696 1.00 0.00 H new ATOM 0 HG23 VAL A 56 9.193 9.314 -5.831 1.00 0.00 H new ATOM 856 N PRO A 57 5.687 6.779 -8.417 1.00 0.00 N ATOM 857 CA PRO A 57 4.614 5.872 -8.793 1.00 0.00 C ATOM 858 C PRO A 57 5.073 4.928 -9.909 1.00 0.00 C ATOM 859 O PRO A 57 4.461 3.882 -10.106 1.00 0.00 O ATOM 860 CB PRO A 57 3.486 6.782 -9.284 1.00 0.00 C ATOM 861 CG PRO A 57 4.189 8.021 -9.833 1.00 0.00 C ATOM 862 CD PRO A 57 5.541 8.047 -9.125 1.00 0.00 C ATOM 0 HA PRO A 57 4.299 5.240 -7.963 1.00 0.00 H new ATOM 0 HB2 PRO A 57 2.891 6.292 -10.054 1.00 0.00 H new ATOM 0 HB3 PRO A 57 2.806 7.041 -8.472 1.00 0.00 H new ATOM 0 HG2 PRO A 57 4.310 7.961 -10.915 1.00 0.00 H new ATOM 0 HG3 PRO A 57 3.616 8.925 -9.626 1.00 0.00 H new ATOM 0 HD2 PRO A 57 6.349 8.180 -9.845 1.00 0.00 H new ATOM 0 HD3 PRO A 57 5.594 8.884 -8.429 1.00 0.00 H new ATOM 870 N ASN A 58 6.121 5.288 -10.659 1.00 0.00 N ATOM 871 CA ASN A 58 6.639 4.476 -11.751 1.00 0.00 C ATOM 872 C ASN A 58 7.211 3.176 -11.204 1.00 0.00 C ATOM 873 O ASN A 58 6.901 2.104 -11.720 1.00 0.00 O ATOM 874 CB ASN A 58 7.657 5.246 -12.589 1.00 0.00 C ATOM 875 CG ASN A 58 7.714 4.627 -13.975 1.00 0.00 C ATOM 876 OD1 ASN A 58 8.336 3.588 -14.180 1.00 0.00 O ATOM 877 ND2 ASN A 58 7.063 5.248 -14.941 1.00 0.00 N ATOM 0 H ASN A 58 6.633 6.159 -10.519 1.00 0.00 H new ATOM 0 HA ASN A 58 5.817 4.227 -12.422 1.00 0.00 H new ATOM 0 HB2 ASN A 58 7.374 6.297 -12.656 1.00 0.00 H new ATOM 0 HB3 ASN A 58 8.639 5.209 -12.118 1.00 0.00 H new ATOM 0 HD21 ASN A 58 7.068 4.866 -15.887 1.00 0.00 H new ATOM 0 HD22 ASN A 58 6.555 6.110 -14.742 1.00 0.00 H new ATOM 884 N PHE A 59 7.978 3.288 -10.118 1.00 0.00 N ATOM 885 CA PHE A 59 8.445 2.181 -9.304 1.00 0.00 C ATOM 886 C PHE A 59 7.263 1.343 -8.814 1.00 0.00 C ATOM 887 O PHE A 59 7.130 0.200 -9.233 1.00 0.00 O ATOM 888 CB PHE A 59 9.320 2.730 -8.166 1.00 0.00 C ATOM 889 CG PHE A 59 9.421 1.834 -6.950 1.00 0.00 C ATOM 890 CD1 PHE A 59 9.862 0.501 -7.075 1.00 0.00 C ATOM 891 CD2 PHE A 59 9.016 2.323 -5.694 1.00 0.00 C ATOM 892 CE1 PHE A 59 9.918 -0.329 -5.942 1.00 0.00 C ATOM 893 CE2 PHE A 59 9.108 1.493 -4.564 1.00 0.00 C ATOM 894 CZ PHE A 59 9.554 0.169 -4.684 1.00 0.00 C ATOM 0 H PHE A 59 8.300 4.192 -9.774 1.00 0.00 H new ATOM 0 HA PHE A 59 9.065 1.506 -9.894 1.00 0.00 H new ATOM 0 HB2 PHE A 59 10.324 2.908 -8.552 1.00 0.00 H new ATOM 0 HB3 PHE A 59 8.922 3.696 -7.855 1.00 0.00 H new ATOM 0 HD1 PHE A 59 10.157 0.118 -8.041 1.00 0.00 H new ATOM 0 HD2 PHE A 59 8.637 3.330 -5.599 1.00 0.00 H new ATOM 0 HE1 PHE A 59 10.243 -1.354 -6.042 1.00 0.00 H new ATOM 0 HE2 PHE A 59 8.833 1.879 -3.594 1.00 0.00 H new ATOM 0 HZ PHE A 59 9.617 -0.464 -3.811 1.00 0.00 H new ATOM 904 N VAL A 60 6.394 1.871 -7.948 1.00 0.00 N ATOM 905 CA VAL A 60 5.395 1.030 -7.281 1.00 0.00 C ATOM 906 C VAL A 60 4.380 0.387 -8.240 1.00 0.00 C ATOM 907 O VAL A 60 3.843 -0.664 -7.912 1.00 0.00 O ATOM 908 CB VAL A 60 4.705 1.795 -6.140 1.00 0.00 C ATOM 909 CG1 VAL A 60 5.636 1.923 -4.916 1.00 0.00 C ATOM 910 CG2 VAL A 60 4.255 3.198 -6.509 1.00 0.00 C ATOM 0 H VAL A 60 6.360 2.859 -7.695 1.00 0.00 H new ATOM 0 HA VAL A 60 5.944 0.193 -6.850 1.00 0.00 H new ATOM 0 HB VAL A 60 3.820 1.199 -5.915 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.123 2.468 -4.124 1.00 0.00 H new ATOM 0 HG12 VAL A 60 5.904 0.929 -4.557 1.00 0.00 H new ATOM 0 HG13 VAL A 60 6.540 2.462 -5.201 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.779 3.666 -5.647 1.00 0.00 H new ATOM 0 HG22 VAL A 60 5.119 3.789 -6.812 1.00 0.00 H new ATOM 0 HG23 VAL A 60 3.544 3.147 -7.333 1.00 0.00 H new ATOM 920 N LYS A 61 4.165 0.941 -9.436 1.00 0.00 N ATOM 921 CA LYS A 61 3.360 0.323 -10.502 1.00 0.00 C ATOM 922 C LYS A 61 4.021 -0.906 -11.126 1.00 0.00 C ATOM 923 O LYS A 61 3.496 -1.474 -12.079 1.00 0.00 O ATOM 924 CB LYS A 61 3.059 1.356 -11.597 1.00 0.00 C ATOM 925 CG LYS A 61 1.778 1.057 -12.390 1.00 0.00 C ATOM 926 CD LYS A 61 1.809 1.340 -13.896 1.00 0.00 C ATOM 927 CE LYS A 61 2.346 0.158 -14.712 1.00 0.00 C ATOM 928 NZ LYS A 61 3.777 0.277 -15.049 1.00 0.00 N ATOM 0 H LYS A 61 4.551 1.848 -9.699 1.00 0.00 H new ATOM 0 HA LYS A 61 2.437 -0.017 -10.034 1.00 0.00 H new ATOM 0 HB2 LYS A 61 2.972 2.342 -11.140 1.00 0.00 H new ATOM 0 HB3 LYS A 61 3.902 1.398 -12.287 1.00 0.00 H new ATOM 0 HG2 LYS A 61 1.530 0.005 -12.248 1.00 0.00 H new ATOM 0 HG3 LYS A 61 0.966 1.638 -11.953 1.00 0.00 H new ATOM 0 HD2 LYS A 61 0.802 1.583 -14.236 1.00 0.00 H new ATOM 0 HD3 LYS A 61 2.429 2.217 -14.084 1.00 0.00 H new ATOM 0 HE2 LYS A 61 2.189 -0.763 -14.150 1.00 0.00 H new ATOM 0 HE3 LYS A 61 1.770 0.071 -15.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 4.074 -0.554 -15.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 3.931 1.138 -15.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 4.336 0.330 -14.174 1.00 0.00 H new ATOM 942 N GLU A 62 5.216 -1.279 -10.686 1.00 0.00 N ATOM 943 CA GLU A 62 5.845 -2.550 -11.012 1.00 0.00 C ATOM 944 C GLU A 62 5.617 -3.568 -9.893 1.00 0.00 C ATOM 945 O GLU A 62 5.722 -4.768 -10.138 1.00 0.00 O ATOM 946 CB GLU A 62 7.322 -2.315 -11.370 1.00 0.00 C ATOM 947 CG GLU A 62 8.327 -2.552 -10.233 1.00 0.00 C ATOM 948 CD GLU A 62 8.815 -4.003 -10.108 1.00 0.00 C ATOM 949 OE1 GLU A 62 8.913 -4.727 -11.128 1.00 0.00 O ATOM 950 OE2 GLU A 62 9.152 -4.412 -8.974 1.00 0.00 O ATOM 0 H GLU A 62 5.787 -0.692 -10.078 1.00 0.00 H new ATOM 0 HA GLU A 62 5.382 -2.991 -11.895 1.00 0.00 H new ATOM 0 HB2 GLU A 62 7.583 -2.967 -12.203 1.00 0.00 H new ATOM 0 HB3 GLU A 62 7.433 -1.289 -11.721 1.00 0.00 H new ATOM 0 HG2 GLU A 62 9.190 -1.904 -10.386 1.00 0.00 H new ATOM 0 HG3 GLU A 62 7.868 -2.254 -9.291 1.00 0.00 H new ATOM 957 N LYS A 63 5.269 -3.120 -8.679 1.00 0.00 N ATOM 958 CA LYS A 63 5.139 -3.995 -7.510 1.00 0.00 C ATOM 959 C LYS A 63 3.754 -4.649 -7.453 1.00 0.00 C ATOM 960 O LYS A 63 3.255 -4.922 -6.361 1.00 0.00 O ATOM 961 CB LYS A 63 5.388 -3.168 -6.227 1.00 0.00 C ATOM 962 CG LYS A 63 6.749 -2.457 -6.170 1.00 0.00 C ATOM 963 CD LYS A 63 7.928 -3.425 -6.036 1.00 0.00 C ATOM 964 CE LYS A 63 8.198 -3.791 -4.568 1.00 0.00 C ATOM 965 NZ LYS A 63 9.299 -4.767 -4.433 1.00 0.00 N ATOM 0 H LYS A 63 5.070 -2.139 -8.482 1.00 0.00 H new ATOM 0 HA LYS A 63 5.878 -4.792 -7.588 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.600 -2.421 -6.135 1.00 0.00 H new ATOM 0 HB3 LYS A 63 5.303 -3.829 -5.364 1.00 0.00 H new ATOM 0 HG2 LYS A 63 6.878 -1.860 -7.073 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.756 -1.766 -5.327 1.00 0.00 H new ATOM 0 HD2 LYS A 63 7.721 -4.331 -6.605 1.00 0.00 H new ATOM 0 HD3 LYS A 63 8.821 -2.974 -6.469 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.444 -2.888 -4.009 1.00 0.00 H new ATOM 0 HE3 LYS A 63 7.292 -4.204 -4.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 9.448 -4.986 -3.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 9.055 -5.639 -4.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 10.171 -4.364 -4.832 1.00 0.00 H new ATOM 979 N GLY A 64 3.206 -5.014 -8.613 1.00 0.00 N ATOM 980 CA GLY A 64 1.946 -5.725 -8.810 1.00 0.00 C ATOM 981 C GLY A 64 0.805 -5.255 -7.907 1.00 0.00 C ATOM 982 O GLY A 64 0.033 -6.100 -7.451 1.00 0.00 O ATOM 0 H GLY A 64 3.664 -4.805 -9.500 1.00 0.00 H new ATOM 0 HA2 GLY A 64 1.639 -5.613 -9.850 1.00 0.00 H new ATOM 0 HA3 GLY A 64 2.113 -6.789 -8.639 1.00 0.00 H new ATOM 986 N ALA A 65 0.723 -3.963 -7.562 1.00 0.00 N ATOM 987 CA ALA A 65 -0.182 -3.519 -6.512 1.00 0.00 C ATOM 988 C ALA A 65 -1.657 -3.654 -6.901 1.00 0.00 C ATOM 989 O ALA A 65 -1.982 -3.809 -8.075 1.00 0.00 O ATOM 990 CB ALA A 65 0.157 -2.086 -6.128 1.00 0.00 C ATOM 0 H ALA A 65 1.270 -3.219 -7.994 1.00 0.00 H new ATOM 0 HA ALA A 65 -0.041 -4.172 -5.651 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -0.519 -1.750 -5.342 1.00 0.00 H new ATOM 0 HB2 ALA A 65 1.185 -2.039 -5.767 1.00 0.00 H new ATOM 0 HB3 ALA A 65 0.049 -1.440 -7.000 1.00 0.00 H new ATOM 996 N GLU A 66 -2.548 -3.532 -5.913 1.00 0.00 N ATOM 997 CA GLU A 66 -4.002 -3.618 -6.079 1.00 0.00 C ATOM 998 C GLU A 66 -4.707 -2.571 -5.235 1.00 0.00 C ATOM 999 O GLU A 66 -5.662 -1.955 -5.701 1.00 0.00 O ATOM 1000 CB GLU A 66 -4.492 -5.006 -5.666 1.00 0.00 C ATOM 1001 CG GLU A 66 -4.460 -5.948 -6.866 1.00 0.00 C ATOM 1002 CD GLU A 66 -4.077 -7.368 -6.451 1.00 0.00 C ATOM 1003 OE1 GLU A 66 -2.986 -7.578 -5.870 1.00 0.00 O ATOM 1004 OE2 GLU A 66 -4.877 -8.316 -6.597 1.00 0.00 O ATOM 0 H GLU A 66 -2.269 -3.366 -4.946 1.00 0.00 H new ATOM 0 HA GLU A 66 -4.233 -3.439 -7.129 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.864 -5.400 -4.867 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.506 -4.940 -5.271 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -5.438 -5.959 -7.347 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -3.747 -5.578 -7.602 1.00 0.00 H new ATOM 1011 N LEU A 67 -4.231 -2.358 -4.007 1.00 0.00 N ATOM 1012 CA LEU A 67 -4.775 -1.391 -3.078 1.00 0.00 C ATOM 1013 C LEU A 67 -3.638 -0.504 -2.574 1.00 0.00 C ATOM 1014 O LEU A 67 -2.467 -0.902 -2.535 1.00 0.00 O ATOM 1015 CB LEU A 67 -5.486 -2.123 -1.923 1.00 0.00 C ATOM 1016 CG LEU A 67 -6.478 -1.240 -1.137 1.00 0.00 C ATOM 1017 CD1 LEU A 67 -7.834 -1.158 -1.846 1.00 0.00 C ATOM 1018 CD2 LEU A 67 -6.663 -1.830 0.258 1.00 0.00 C ATOM 0 H LEU A 67 -3.435 -2.872 -3.630 1.00 0.00 H new ATOM 0 HA LEU A 67 -5.515 -0.759 -3.569 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -6.021 -2.983 -2.326 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -4.735 -2.509 -1.234 1.00 0.00 H new ATOM 0 HG LEU A 67 -6.073 -0.230 -1.073 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -8.510 -0.529 -1.267 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -7.700 -0.729 -2.839 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -8.258 -2.158 -1.937 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -7.362 -1.214 0.824 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -7.056 -2.843 0.175 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -5.703 -1.854 0.773 1.00 0.00 H new ATOM 1030 N VAL A 68 -3.982 0.692 -2.127 1.00 0.00 N ATOM 1031 CA VAL A 68 -3.097 1.628 -1.461 1.00 0.00 C ATOM 1032 C VAL A 68 -3.927 2.212 -0.319 1.00 0.00 C ATOM 1033 O VAL A 68 -5.126 2.441 -0.483 1.00 0.00 O ATOM 1034 CB VAL A 68 -2.636 2.722 -2.448 1.00 0.00 C ATOM 1035 CG1 VAL A 68 -1.366 3.439 -1.974 1.00 0.00 C ATOM 1036 CG2 VAL A 68 -2.396 2.245 -3.886 1.00 0.00 C ATOM 0 H VAL A 68 -4.931 1.052 -2.224 1.00 0.00 H new ATOM 0 HA VAL A 68 -2.189 1.155 -1.088 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.485 3.405 -2.462 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -1.083 4.199 -2.703 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -1.554 3.913 -1.010 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.557 2.716 -1.871 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -2.076 3.087 -4.500 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -1.622 1.477 -3.890 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.320 1.831 -4.291 1.00 0.00 H new ATOM 1046 N ILE A 69 -3.313 2.461 0.829 1.00 0.00 N ATOM 1047 CA ILE A 69 -3.935 3.027 2.007 1.00 0.00 C ATOM 1048 C ILE A 69 -2.972 4.100 2.502 1.00 0.00 C ATOM 1049 O ILE A 69 -1.842 3.796 2.881 1.00 0.00 O ATOM 1050 CB ILE A 69 -4.192 1.936 3.063 1.00 0.00 C ATOM 1051 CG1 ILE A 69 -5.147 0.818 2.584 1.00 0.00 C ATOM 1052 CG2 ILE A 69 -4.760 2.629 4.302 1.00 0.00 C ATOM 1053 CD1 ILE A 69 -5.239 -0.347 3.583 1.00 0.00 C ATOM 0 H ILE A 69 -2.322 2.263 0.966 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.912 3.459 1.792 1.00 0.00 H new ATOM 0 HB ILE A 69 -3.249 1.433 3.275 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.141 1.237 2.427 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -4.804 0.440 1.621 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -4.956 1.887 5.076 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -4.040 3.359 4.673 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -5.689 3.136 4.042 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.922 -1.104 3.198 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -4.251 -0.787 3.721 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.609 0.022 4.540 1.00 0.00 H new ATOM 1065 N VAL A 70 -3.385 5.362 2.449 1.00 0.00 N ATOM 1066 CA VAL A 70 -2.514 6.501 2.724 1.00 0.00 C ATOM 1067 C VAL A 70 -3.195 7.458 3.707 1.00 0.00 C ATOM 1068 O VAL A 70 -4.389 7.339 3.983 1.00 0.00 O ATOM 1069 CB VAL A 70 -2.127 7.174 1.387 1.00 0.00 C ATOM 1070 CG1 VAL A 70 -1.636 6.176 0.326 1.00 0.00 C ATOM 1071 CG2 VAL A 70 -3.316 7.920 0.783 1.00 0.00 C ATOM 0 H VAL A 70 -4.341 5.626 2.212 1.00 0.00 H new ATOM 0 HA VAL A 70 -1.591 6.174 3.204 1.00 0.00 H new ATOM 0 HB VAL A 70 -1.316 7.857 1.640 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -1.381 6.713 -0.588 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -0.755 5.653 0.698 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.424 5.453 0.114 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -3.015 8.384 -0.157 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -4.129 7.219 0.598 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -3.652 8.691 1.477 1.00 0.00 H new ATOM 1081 N ARG A 71 -2.455 8.447 4.214 1.00 0.00 N ATOM 1082 CA ARG A 71 -3.035 9.518 5.017 1.00 0.00 C ATOM 1083 C ARG A 71 -3.595 10.619 4.111 1.00 0.00 C ATOM 1084 O ARG A 71 -4.792 10.881 4.184 1.00 0.00 O ATOM 1085 CB ARG A 71 -1.988 10.007 6.021 1.00 0.00 C ATOM 1086 CG ARG A 71 -2.504 11.077 7.000 1.00 0.00 C ATOM 1087 CD ARG A 71 -2.528 10.581 8.455 1.00 0.00 C ATOM 1088 NE ARG A 71 -3.465 11.376 9.267 1.00 0.00 N ATOM 1089 CZ ARG A 71 -4.804 11.303 9.223 1.00 0.00 C ATOM 1090 NH1 ARG A 71 -5.416 10.391 8.481 1.00 0.00 N ATOM 1091 NH2 ARG A 71 -5.542 12.169 9.899 1.00 0.00 N ATOM 0 H ARG A 71 -1.447 8.525 4.080 1.00 0.00 H new ATOM 0 HA ARG A 71 -3.886 9.157 5.595 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -1.623 9.154 6.592 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -1.137 10.412 5.473 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -1.872 11.962 6.932 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -3.509 11.379 6.706 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -2.819 9.531 8.480 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -1.527 10.645 8.881 1.00 0.00 H new ATOM 0 HE ARG A 71 -3.059 12.043 9.923 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -4.868 9.730 7.931 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -6.435 10.351 8.460 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -5.093 12.896 10.456 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -6.560 12.110 9.863 1.00 0.00 H new ATOM 1105 N GLY A 72 -2.777 11.281 3.276 1.00 0.00 N ATOM 1106 CA GLY A 72 -3.247 12.441 2.500 1.00 0.00 C ATOM 1107 C GLY A 72 -2.588 12.696 1.139 1.00 0.00 C ATOM 1108 O GLY A 72 -2.902 13.702 0.510 1.00 0.00 O ATOM 0 H GLY A 72 -1.799 11.037 3.122 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -4.319 12.326 2.338 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -3.111 13.333 3.112 1.00 0.00 H new ATOM 1112 N ILE A 73 -1.689 11.814 0.680 1.00 0.00 N ATOM 1113 CA ILE A 73 -1.212 11.673 -0.708 1.00 0.00 C ATOM 1114 C ILE A 73 -1.167 12.991 -1.522 1.00 0.00 C ATOM 1115 O ILE A 73 -0.442 13.909 -1.132 1.00 0.00 O ATOM 1116 CB ILE A 73 -1.951 10.468 -1.347 1.00 0.00 C ATOM 1117 CG1 ILE A 73 -1.470 10.084 -2.759 1.00 0.00 C ATOM 1118 CG2 ILE A 73 -3.485 10.595 -1.332 1.00 0.00 C ATOM 1119 CD1 ILE A 73 -1.547 8.576 -3.012 1.00 0.00 C ATOM 0 H ILE A 73 -1.247 11.138 1.303 1.00 0.00 H new ATOM 0 HA ILE A 73 -0.147 11.439 -0.714 1.00 0.00 H new ATOM 0 HB ILE A 73 -1.672 9.650 -0.683 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -2.075 10.605 -3.500 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -0.442 10.420 -2.894 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -3.928 9.714 -1.796 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -3.833 10.676 -0.302 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.782 11.485 -1.887 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -1.197 8.358 -4.021 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.920 8.053 -2.290 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -2.579 8.241 -2.906 1.00 0.00 H new ATOM 1131 N GLY A 74 -1.844 13.077 -2.665 1.00 0.00 N ATOM 1132 CA GLY A 74 -1.982 14.230 -3.540 1.00 0.00 C ATOM 1133 C GLY A 74 -2.323 13.747 -4.950 1.00 0.00 C ATOM 1134 O GLY A 74 -2.002 12.609 -5.315 1.00 0.00 O ATOM 0 H GLY A 74 -2.352 12.271 -3.030 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -2.764 14.892 -3.169 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.057 14.806 -3.553 1.00 0.00 H new ATOM 1138 N ARG A 75 -2.961 14.597 -5.762 1.00 0.00 N ATOM 1139 CA ARG A 75 -3.635 14.162 -6.990 1.00 0.00 C ATOM 1140 C ARG A 75 -2.705 13.487 -7.989 1.00 0.00 C ATOM 1141 O ARG A 75 -3.142 12.600 -8.720 1.00 0.00 O ATOM 1142 CB ARG A 75 -4.369 15.351 -7.635 1.00 0.00 C ATOM 1143 CG ARG A 75 -5.173 15.029 -8.909 1.00 0.00 C ATOM 1144 CD ARG A 75 -6.156 13.863 -8.723 1.00 0.00 C ATOM 1145 NE ARG A 75 -7.325 13.946 -9.607 1.00 0.00 N ATOM 1146 CZ ARG A 75 -8.408 14.710 -9.414 1.00 0.00 C ATOM 1147 NH1 ARG A 75 -8.425 15.726 -8.553 1.00 0.00 N ATOM 1148 NH2 ARG A 75 -9.503 14.476 -10.112 1.00 0.00 N ATOM 0 H ARG A 75 -3.025 15.600 -5.588 1.00 0.00 H new ATOM 0 HA ARG A 75 -4.358 13.399 -6.700 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -5.048 15.778 -6.897 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -3.635 16.120 -7.876 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -5.726 15.917 -9.217 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -4.482 14.788 -9.717 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -5.635 12.924 -8.908 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -6.493 13.842 -7.687 1.00 0.00 H new ATOM 0 HE ARG A 75 -7.311 13.368 -10.447 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -7.591 15.948 -8.009 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -9.272 16.282 -8.437 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -9.521 13.717 -10.793 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -10.331 15.054 -9.970 1.00 0.00 H new ATOM 1162 N ARG A 76 -1.427 13.870 -8.060 1.00 0.00 N ATOM 1163 CA ARG A 76 -0.553 13.236 -9.041 1.00 0.00 C ATOM 1164 C ARG A 76 -0.352 11.755 -8.735 1.00 0.00 C ATOM 1165 O ARG A 76 -0.158 10.980 -9.672 1.00 0.00 O ATOM 1166 CB ARG A 76 0.773 13.992 -9.178 1.00 0.00 C ATOM 1167 CG ARG A 76 1.634 13.295 -10.241 1.00 0.00 C ATOM 1168 CD ARG A 76 2.697 14.217 -10.849 1.00 0.00 C ATOM 1169 NE ARG A 76 2.460 14.447 -12.291 1.00 0.00 N ATOM 1170 CZ ARG A 76 2.817 13.622 -13.286 1.00 0.00 C ATOM 1171 NH1 ARG A 76 3.385 12.454 -13.019 1.00 0.00 N ATOM 1172 NH2 ARG A 76 2.648 13.979 -14.551 1.00 0.00 N ATOM 0 H ARG A 76 -0.992 14.584 -7.476 1.00 0.00 H new ATOM 0 HA ARG A 76 -1.046 13.289 -10.012 1.00 0.00 H new ATOM 0 HB2 ARG A 76 0.589 15.028 -9.462 1.00 0.00 H new ATOM 0 HB3 ARG A 76 1.296 14.012 -8.222 1.00 0.00 H new ATOM 0 HG2 ARG A 76 2.124 12.430 -9.794 1.00 0.00 H new ATOM 0 HG3 ARG A 76 0.988 12.920 -11.035 1.00 0.00 H new ATOM 0 HD2 ARG A 76 2.695 15.172 -10.323 1.00 0.00 H new ATOM 0 HD3 ARG A 76 3.684 13.777 -10.708 1.00 0.00 H new ATOM 0 HE ARG A 76 1.983 15.310 -12.552 1.00 0.00 H new ATOM 0 HH11 ARG A 76 3.553 12.178 -12.052 1.00 0.00 H new ATOM 0 HH12 ARG A 76 3.654 11.832 -13.781 1.00 0.00 H new ATOM 0 HH21 ARG A 76 2.243 14.888 -14.775 1.00 0.00 H new ATOM 0 HH22 ARG A 76 2.923 13.345 -15.301 1.00 0.00 H new ATOM 1186 N ALA A 77 -0.395 11.349 -7.469 1.00 0.00 N ATOM 1187 CA ALA A 77 -0.242 9.947 -7.140 1.00 0.00 C ATOM 1188 C ALA A 77 -1.585 9.213 -7.174 1.00 0.00 C ATOM 1189 O ALA A 77 -1.573 8.014 -7.437 1.00 0.00 O ATOM 1190 CB ALA A 77 0.476 9.812 -5.804 1.00 0.00 C ATOM 0 H ALA A 77 -0.533 11.966 -6.669 1.00 0.00 H new ATOM 0 HA ALA A 77 0.375 9.464 -7.898 1.00 0.00 H new ATOM 0 HB1 ALA A 77 0.591 8.756 -5.558 1.00 0.00 H new ATOM 0 HB2 ALA A 77 1.459 10.278 -5.871 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.107 10.305 -5.026 1.00 0.00 H new ATOM 1196 N ILE A 78 -2.741 9.879 -7.025 1.00 0.00 N ATOM 1197 CA ILE A 78 -4.018 9.309 -7.453 1.00 0.00 C ATOM 1198 C ILE A 78 -3.897 8.885 -8.926 1.00 0.00 C ATOM 1199 O ILE A 78 -4.276 7.773 -9.278 1.00 0.00 O ATOM 1200 CB ILE A 78 -5.136 10.340 -7.181 1.00 0.00 C ATOM 1201 CG1 ILE A 78 -5.702 10.281 -5.751 1.00 0.00 C ATOM 1202 CG2 ILE A 78 -6.337 10.254 -8.129 1.00 0.00 C ATOM 1203 CD1 ILE A 78 -4.700 10.201 -4.603 1.00 0.00 C ATOM 0 H ILE A 78 -2.813 10.809 -6.612 1.00 0.00 H new ATOM 0 HA ILE A 78 -4.280 8.412 -6.891 1.00 0.00 H new ATOM 0 HB ILE A 78 -4.608 11.279 -7.347 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -6.321 11.165 -5.597 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -6.360 9.415 -5.685 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -7.068 11.016 -7.860 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -6.004 10.417 -9.154 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -6.794 9.268 -8.048 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.236 10.165 -3.654 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -4.094 9.302 -4.711 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.054 11.079 -4.622 1.00 0.00 H new ATOM 1215 N ALA A 79 -3.276 9.694 -9.790 1.00 0.00 N ATOM 1216 CA ALA A 79 -3.109 9.314 -11.189 1.00 0.00 C ATOM 1217 C ALA A 79 -2.216 8.059 -11.377 1.00 0.00 C ATOM 1218 O ALA A 79 -2.142 7.532 -12.493 1.00 0.00 O ATOM 1219 CB ALA A 79 -2.574 10.498 -11.998 1.00 0.00 C ATOM 0 H ALA A 79 -2.886 10.604 -9.546 1.00 0.00 H new ATOM 0 HA ALA A 79 -4.095 9.040 -11.565 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -2.454 10.202 -13.040 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.277 11.329 -11.936 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.610 10.808 -11.595 1.00 0.00 H new ATOM 1225 N ALA A 80 -1.517 7.571 -10.334 1.00 0.00 N ATOM 1226 CA ALA A 80 -0.796 6.306 -10.359 1.00 0.00 C ATOM 1227 C ALA A 80 -1.754 5.121 -10.325 1.00 0.00 C ATOM 1228 O ALA A 80 -1.779 4.360 -11.289 1.00 0.00 O ATOM 1229 CB ALA A 80 0.208 6.218 -9.210 1.00 0.00 C ATOM 0 H ALA A 80 -1.443 8.060 -9.442 1.00 0.00 H new ATOM 0 HA ALA A 80 -0.243 6.266 -11.297 1.00 0.00 H new ATOM 0 HB1 ALA A 80 0.730 5.262 -9.256 1.00 0.00 H new ATOM 0 HB2 ALA A 80 0.930 7.030 -9.294 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -0.319 6.298 -8.259 1.00 0.00 H new ATOM 1235 N PHE A 81 -2.526 5.000 -9.239 1.00 0.00 N ATOM 1236 CA PHE A 81 -3.754 4.214 -9.087 1.00 0.00 C ATOM 1237 C PHE A 81 -4.475 4.148 -10.400 1.00 0.00 C ATOM 1238 O PHE A 81 -4.713 3.067 -10.918 1.00 0.00 O ATOM 1239 CB PHE A 81 -4.648 4.878 -8.030 1.00 0.00 C ATOM 1240 CG PHE A 81 -6.167 5.055 -8.234 1.00 0.00 C ATOM 1241 CD1 PHE A 81 -7.002 4.025 -8.711 1.00 0.00 C ATOM 1242 CD2 PHE A 81 -6.759 6.303 -7.945 1.00 0.00 C ATOM 1243 CE1 PHE A 81 -8.381 4.228 -8.892 1.00 0.00 C ATOM 1244 CE2 PHE A 81 -8.145 6.503 -8.082 1.00 0.00 C ATOM 1245 CZ PHE A 81 -8.958 5.468 -8.570 1.00 0.00 C ATOM 0 H PHE A 81 -2.289 5.488 -8.376 1.00 0.00 H new ATOM 0 HA PHE A 81 -3.507 3.201 -8.768 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -4.519 4.310 -7.109 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -4.238 5.872 -7.852 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -6.574 3.061 -8.942 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -6.136 7.120 -7.612 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -8.998 3.430 -9.279 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -8.583 7.452 -7.812 1.00 0.00 H new ATOM 0 HZ PHE A 81 -10.019 5.624 -8.697 1.00 0.00 H new ATOM 1255 N GLU A 82 -4.805 5.313 -10.935 1.00 0.00 N ATOM 1256 CA GLU A 82 -5.694 5.407 -12.067 1.00 0.00 C ATOM 1257 C GLU A 82 -5.070 4.859 -13.350 1.00 0.00 C ATOM 1258 O GLU A 82 -5.794 4.654 -14.328 1.00 0.00 O ATOM 1259 CB GLU A 82 -6.065 6.876 -12.283 1.00 0.00 C ATOM 1260 CG GLU A 82 -6.942 7.481 -11.176 1.00 0.00 C ATOM 1261 CD GLU A 82 -8.075 8.307 -11.763 1.00 0.00 C ATOM 1262 OE1 GLU A 82 -9.058 7.689 -12.239 1.00 0.00 O ATOM 1263 OE2 GLU A 82 -7.939 9.547 -11.838 1.00 0.00 O ATOM 0 H GLU A 82 -4.463 6.211 -10.594 1.00 0.00 H new ATOM 0 HA GLU A 82 -6.575 4.803 -11.847 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.149 7.461 -12.364 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -6.588 6.969 -13.235 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.353 6.683 -10.557 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.331 8.107 -10.526 1.00 0.00 H new ATOM 1270 N ALA A 83 -3.752 4.619 -13.376 1.00 0.00 N ATOM 1271 CA ALA A 83 -3.142 3.933 -14.508 1.00 0.00 C ATOM 1272 C ALA A 83 -3.333 2.420 -14.423 1.00 0.00 C ATOM 1273 O ALA A 83 -3.018 1.716 -15.386 1.00 0.00 O ATOM 1274 CB ALA A 83 -1.640 4.209 -14.557 1.00 0.00 C ATOM 0 H ALA A 83 -3.102 4.887 -12.637 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.634 4.313 -15.404 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.202 3.689 -15.409 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.470 5.281 -14.660 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -1.175 3.855 -13.637 1.00 0.00 H new ATOM 1280 N MET A 84 -3.750 1.905 -13.265 1.00 0.00 N ATOM 1281 CA MET A 84 -3.783 0.460 -13.014 1.00 0.00 C ATOM 1282 C MET A 84 -5.075 0.034 -12.299 1.00 0.00 C ATOM 1283 O MET A 84 -5.213 -1.121 -11.900 1.00 0.00 O ATOM 1284 CB MET A 84 -2.479 0.032 -12.296 1.00 0.00 C ATOM 1285 CG MET A 84 -1.910 1.082 -11.329 1.00 0.00 C ATOM 1286 SD MET A 84 -0.607 0.516 -10.204 1.00 0.00 S ATOM 1287 CE MET A 84 -0.234 2.058 -9.341 1.00 0.00 C ATOM 0 H MET A 84 -4.072 2.471 -12.480 1.00 0.00 H new ATOM 0 HA MET A 84 -3.813 -0.079 -13.961 1.00 0.00 H new ATOM 0 HB2 MET A 84 -2.669 -0.888 -11.743 1.00 0.00 H new ATOM 0 HB3 MET A 84 -1.724 -0.198 -13.048 1.00 0.00 H new ATOM 0 HG2 MET A 84 -1.517 1.911 -11.917 1.00 0.00 H new ATOM 0 HG3 MET A 84 -2.731 1.476 -10.730 1.00 0.00 H new ATOM 0 HE1 MET A 84 0.554 1.883 -8.608 1.00 0.00 H new ATOM 0 HE2 MET A 84 0.099 2.806 -10.060 1.00 0.00 H new ATOM 0 HE3 MET A 84 -1.129 2.417 -8.833 1.00 0.00 H new ATOM 1297 N GLY A 85 -6.036 0.948 -12.143 1.00 0.00 N ATOM 1298 CA GLY A 85 -7.237 0.786 -11.338 1.00 0.00 C ATOM 1299 C GLY A 85 -6.923 0.364 -9.901 1.00 0.00 C ATOM 1300 O GLY A 85 -7.712 -0.348 -9.284 1.00 0.00 O ATOM 0 H GLY A 85 -5.991 1.860 -12.597 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -7.792 1.724 -11.325 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -7.883 0.040 -11.800 1.00 0.00 H new ATOM 1304 N VAL A 86 -5.750 0.747 -9.396 1.00 0.00 N ATOM 1305 CA VAL A 86 -5.221 0.300 -8.109 1.00 0.00 C ATOM 1306 C VAL A 86 -5.884 1.110 -7.010 1.00 0.00 C ATOM 1307 O VAL A 86 -5.542 2.272 -6.814 1.00 0.00 O ATOM 1308 CB VAL A 86 -3.679 0.370 -8.144 1.00 0.00 C ATOM 1309 CG1 VAL A 86 -2.964 0.612 -6.814 1.00 0.00 C ATOM 1310 CG2 VAL A 86 -3.214 -0.959 -8.747 1.00 0.00 C ATOM 0 H VAL A 86 -5.127 1.392 -9.883 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.457 -0.743 -7.898 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.413 1.252 -8.727 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -1.887 0.639 -6.980 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.290 1.563 -6.393 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.204 -0.193 -6.120 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.125 -0.973 -8.800 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -3.558 -1.783 -8.121 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -3.627 -1.068 -9.750 1.00 0.00 H new ATOM 1320 N LYS A 87 -6.899 0.550 -6.355 1.00 0.00 N ATOM 1321 CA LYS A 87 -7.803 1.373 -5.565 1.00 0.00 C ATOM 1322 C LYS A 87 -7.051 2.021 -4.394 1.00 0.00 C ATOM 1323 O LYS A 87 -6.390 1.342 -3.613 1.00 0.00 O ATOM 1324 CB LYS A 87 -9.038 0.554 -5.168 1.00 0.00 C ATOM 1325 CG LYS A 87 -9.894 1.387 -4.211 1.00 0.00 C ATOM 1326 CD LYS A 87 -11.363 0.985 -4.128 1.00 0.00 C ATOM 1327 CE LYS A 87 -11.583 -0.464 -3.690 1.00 0.00 C ATOM 1328 NZ LYS A 87 -12.990 -0.693 -3.299 1.00 0.00 N ATOM 0 H LYS A 87 -7.111 -0.448 -6.356 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.180 2.208 -6.155 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -9.614 0.286 -6.054 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -8.736 -0.378 -4.690 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.460 1.322 -3.213 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -9.838 2.432 -4.516 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -11.872 1.648 -3.428 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -11.827 1.134 -5.103 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -11.314 -1.138 -4.503 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -10.927 -0.698 -2.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.112 -1.683 -3.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.237 -0.065 -2.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.612 -0.492 -4.108 1.00 0.00 H new ATOM 1342 N VAL A 88 -7.177 3.338 -4.249 1.00 0.00 N ATOM 1343 CA VAL A 88 -6.466 4.120 -3.245 1.00 0.00 C ATOM 1344 C VAL A 88 -7.481 4.605 -2.223 1.00 0.00 C ATOM 1345 O VAL A 88 -8.369 5.407 -2.522 1.00 0.00 O ATOM 1346 CB VAL A 88 -5.590 5.220 -3.880 1.00 0.00 C ATOM 1347 CG1 VAL A 88 -6.360 6.179 -4.797 1.00 0.00 C ATOM 1348 CG2 VAL A 88 -4.865 6.048 -2.808 1.00 0.00 C ATOM 0 H VAL A 88 -7.789 3.901 -4.839 1.00 0.00 H new ATOM 0 HA VAL A 88 -5.738 3.506 -2.715 1.00 0.00 H new ATOM 0 HB VAL A 88 -4.872 4.678 -4.495 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -5.674 6.922 -5.204 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.812 5.617 -5.614 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -7.141 6.680 -4.226 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.257 6.814 -3.289 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -5.599 6.523 -2.157 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.224 5.395 -2.216 1.00 0.00 H new ATOM 1358 N ILE A 89 -7.363 4.076 -1.016 1.00 0.00 N ATOM 1359 CA ILE A 89 -8.017 4.562 0.179 1.00 0.00 C ATOM 1360 C ILE A 89 -7.101 5.612 0.787 1.00 0.00 C ATOM 1361 O ILE A 89 -5.874 5.512 0.704 1.00 0.00 O ATOM 1362 CB ILE A 89 -8.251 3.353 1.095 1.00 0.00 C ATOM 1363 CG1 ILE A 89 -9.455 2.583 0.510 1.00 0.00 C ATOM 1364 CG2 ILE A 89 -8.456 3.716 2.573 1.00 0.00 C ATOM 1365 CD1 ILE A 89 -9.426 1.119 0.907 1.00 0.00 C ATOM 0 H ILE A 89 -6.780 3.258 -0.839 1.00 0.00 H new ATOM 0 HA ILE A 89 -8.986 5.027 -0.004 1.00 0.00 H new ATOM 0 HB ILE A 89 -7.354 2.734 1.111 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -10.383 3.037 0.859 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -9.448 2.666 -0.577 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -8.615 2.807 3.152 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -7.573 4.234 2.946 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -9.326 4.365 2.671 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -10.288 0.608 0.478 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -8.510 0.659 0.536 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -9.459 1.036 1.993 1.00 0.00 H new ATOM 1377 N LYS A 90 -7.698 6.614 1.426 1.00 0.00 N ATOM 1378 CA LYS A 90 -6.979 7.693 2.076 1.00 0.00 C ATOM 1379 C LYS A 90 -7.552 7.887 3.475 1.00 0.00 C ATOM 1380 O LYS A 90 -8.451 7.140 3.868 1.00 0.00 O ATOM 1381 CB LYS A 90 -6.981 8.962 1.208 1.00 0.00 C ATOM 1382 CG LYS A 90 -6.568 8.774 -0.271 1.00 0.00 C ATOM 1383 CD LYS A 90 -7.653 8.422 -1.300 1.00 0.00 C ATOM 1384 CE LYS A 90 -8.576 9.602 -1.577 1.00 0.00 C ATOM 1385 NZ LYS A 90 -9.733 9.632 -0.671 1.00 0.00 N ATOM 0 H LYS A 90 -8.712 6.696 1.505 1.00 0.00 H new ATOM 0 HA LYS A 90 -5.925 7.441 2.191 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -7.982 9.393 1.233 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -6.309 9.690 1.662 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -6.087 9.695 -0.600 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -5.812 7.990 -0.306 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -7.182 8.103 -2.230 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -8.240 7.579 -0.935 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -8.014 10.531 -1.476 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -8.926 9.552 -2.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -10.611 9.605 -1.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -9.700 8.808 -0.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -9.708 10.504 -0.105 1.00 0.00 H new ATOM 1399 N GLY A 91 -7.030 8.847 4.235 1.00 0.00 N ATOM 1400 CA GLY A 91 -7.535 9.124 5.569 1.00 0.00 C ATOM 1401 C GLY A 91 -7.198 8.053 6.598 1.00 0.00 C ATOM 1402 O GLY A 91 -7.758 8.077 7.691 1.00 0.00 O ATOM 0 H GLY A 91 -6.256 9.445 3.945 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -7.131 10.078 5.908 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -8.618 9.237 5.519 1.00 0.00 H new ATOM 1406 N ALA A 92 -6.274 7.137 6.302 1.00 0.00 N ATOM 1407 CA ALA A 92 -5.868 6.156 7.293 1.00 0.00 C ATOM 1408 C ALA A 92 -4.957 6.808 8.327 1.00 0.00 C ATOM 1409 O ALA A 92 -4.346 7.845 8.056 1.00 0.00 O ATOM 1410 CB ALA A 92 -5.145 5.016 6.594 1.00 0.00 C ATOM 0 H ALA A 92 -5.804 7.059 5.400 1.00 0.00 H new ATOM 0 HA ALA A 92 -6.746 5.765 7.806 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -4.836 4.275 7.331 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -5.814 4.551 5.869 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -4.266 5.404 6.080 1.00 0.00 H new ATOM 1416 N SER A 93 -4.798 6.154 9.470 1.00 0.00 N ATOM 1417 CA SER A 93 -3.889 6.490 10.551 1.00 0.00 C ATOM 1418 C SER A 93 -3.429 5.164 11.161 1.00 0.00 C ATOM 1419 O SER A 93 -4.103 4.152 10.959 1.00 0.00 O ATOM 1420 CB SER A 93 -4.608 7.399 11.558 1.00 0.00 C ATOM 1421 OG SER A 93 -5.880 6.924 11.962 1.00 0.00 O ATOM 0 H SER A 93 -5.341 5.316 9.678 1.00 0.00 H new ATOM 0 HA SER A 93 -3.016 7.046 10.210 1.00 0.00 H new ATOM 0 HB2 SER A 93 -3.979 7.515 12.440 1.00 0.00 H new ATOM 0 HB3 SER A 93 -4.725 8.389 11.118 1.00 0.00 H new ATOM 0 HG SER A 93 -6.275 7.552 12.602 1.00 0.00 H new ATOM 1427 N GLY A 94 -2.310 5.152 11.885 1.00 0.00 N ATOM 1428 CA GLY A 94 -1.902 3.996 12.679 1.00 0.00 C ATOM 1429 C GLY A 94 -0.516 3.469 12.330 1.00 0.00 C ATOM 1430 O GLY A 94 0.324 4.179 11.766 1.00 0.00 O ATOM 0 H GLY A 94 -1.664 5.940 11.937 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -1.922 4.267 13.735 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -2.630 3.197 12.541 1.00 0.00 H new ATOM 1434 N THR A 95 -0.242 2.226 12.714 1.00 0.00 N ATOM 1435 CA THR A 95 0.865 1.445 12.174 1.00 0.00 C ATOM 1436 C THR A 95 0.357 0.614 11.003 1.00 0.00 C ATOM 1437 O THR A 95 -0.848 0.545 10.772 1.00 0.00 O ATOM 1438 CB THR A 95 1.489 0.566 13.269 1.00 0.00 C ATOM 1439 OG1 THR A 95 0.500 -0.050 14.075 1.00 0.00 O ATOM 1440 CG2 THR A 95 2.365 1.446 14.149 1.00 0.00 C ATOM 0 H THR A 95 -0.788 1.728 13.416 1.00 0.00 H new ATOM 0 HA THR A 95 1.650 2.111 11.815 1.00 0.00 H new ATOM 0 HB THR A 95 2.071 -0.222 12.791 1.00 0.00 H new ATOM 0 HG1 THR A 95 0.933 -0.602 14.759 1.00 0.00 H new ATOM 0 HG21 THR A 95 2.818 0.840 14.934 1.00 0.00 H new ATOM 0 HG22 THR A 95 3.149 1.900 13.543 1.00 0.00 H new ATOM 0 HG23 THR A 95 1.756 2.229 14.601 1.00 0.00 H new ATOM 1448 N VAL A 96 1.266 -0.030 10.273 1.00 0.00 N ATOM 1449 CA VAL A 96 0.940 -0.888 9.144 1.00 0.00 C ATOM 1450 C VAL A 96 -0.081 -1.926 9.581 1.00 0.00 C ATOM 1451 O VAL A 96 -1.153 -2.009 8.986 1.00 0.00 O ATOM 1452 CB VAL A 96 2.239 -1.504 8.587 1.00 0.00 C ATOM 1453 CG1 VAL A 96 2.043 -2.786 7.778 1.00 0.00 C ATOM 1454 CG2 VAL A 96 2.896 -0.467 7.682 1.00 0.00 C ATOM 0 H VAL A 96 2.267 0.034 10.456 1.00 0.00 H new ATOM 0 HA VAL A 96 0.484 -0.319 8.334 1.00 0.00 H new ATOM 0 HB VAL A 96 2.850 -1.776 9.448 1.00 0.00 H new ATOM 0 HG11 VAL A 96 3.010 -3.146 7.427 1.00 0.00 H new ATOM 0 HG12 VAL A 96 1.579 -3.546 8.407 1.00 0.00 H new ATOM 0 HG13 VAL A 96 1.400 -2.581 6.922 1.00 0.00 H new ATOM 0 HG21 VAL A 96 3.820 -0.875 7.272 1.00 0.00 H new ATOM 0 HG22 VAL A 96 2.218 -0.214 6.867 1.00 0.00 H new ATOM 0 HG23 VAL A 96 3.120 0.430 8.259 1.00 0.00 H new ATOM 1464 N GLU A 97 0.227 -2.684 10.634 1.00 0.00 N ATOM 1465 CA GLU A 97 -0.659 -3.756 11.051 1.00 0.00 C ATOM 1466 C GLU A 97 -2.037 -3.231 11.480 1.00 0.00 C ATOM 1467 O GLU A 97 -3.037 -3.933 11.333 1.00 0.00 O ATOM 1468 CB GLU A 97 -0.021 -4.584 12.166 1.00 0.00 C ATOM 1469 CG GLU A 97 0.174 -3.832 13.491 1.00 0.00 C ATOM 1470 CD GLU A 97 0.577 -4.779 14.618 1.00 0.00 C ATOM 1471 OE1 GLU A 97 0.172 -5.966 14.611 1.00 0.00 O ATOM 1472 OE2 GLU A 97 1.399 -4.372 15.467 1.00 0.00 O ATOM 0 H GLU A 97 1.068 -2.575 11.200 1.00 0.00 H new ATOM 0 HA GLU A 97 -0.815 -4.401 10.186 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -0.642 -5.461 12.349 1.00 0.00 H new ATOM 0 HB3 GLU A 97 0.948 -4.945 11.823 1.00 0.00 H new ATOM 0 HG2 GLU A 97 0.940 -3.066 13.367 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -0.750 -3.319 13.759 1.00 0.00 H new ATOM 1479 N GLU A 98 -2.104 -2.013 12.028 1.00 0.00 N ATOM 1480 CA GLU A 98 -3.357 -1.415 12.460 1.00 0.00 C ATOM 1481 C GLU A 98 -4.150 -1.066 11.209 1.00 0.00 C ATOM 1482 O GLU A 98 -5.279 -1.514 11.058 1.00 0.00 O ATOM 1483 CB GLU A 98 -3.140 -0.190 13.368 1.00 0.00 C ATOM 1484 CG GLU A 98 -4.507 0.386 13.770 1.00 0.00 C ATOM 1485 CD GLU A 98 -4.431 1.556 14.749 1.00 0.00 C ATOM 1486 OE1 GLU A 98 -4.263 2.706 14.297 1.00 0.00 O ATOM 1487 OE2 GLU A 98 -4.662 1.327 15.961 1.00 0.00 O ATOM 0 H GLU A 98 -1.288 -1.420 12.181 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.914 -2.124 13.072 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.576 -0.475 14.256 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -2.552 0.565 12.846 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.029 0.713 12.871 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -5.106 -0.408 14.216 1.00 0.00 H new ATOM 1494 N VAL A 99 -3.568 -0.285 10.304 1.00 0.00 N ATOM 1495 CA VAL A 99 -4.203 0.162 9.078 1.00 0.00 C ATOM 1496 C VAL A 99 -4.735 -1.036 8.277 1.00 0.00 C ATOM 1497 O VAL A 99 -5.865 -0.993 7.782 1.00 0.00 O ATOM 1498 CB VAL A 99 -3.120 0.940 8.298 1.00 0.00 C ATOM 1499 CG1 VAL A 99 -3.534 1.268 6.878 1.00 0.00 C ATOM 1500 CG2 VAL A 99 -2.747 2.282 8.937 1.00 0.00 C ATOM 0 H VAL A 99 -2.615 0.062 10.410 1.00 0.00 H new ATOM 0 HA VAL A 99 -5.066 0.798 9.276 1.00 0.00 H new ATOM 0 HB VAL A 99 -2.271 0.256 8.316 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -2.732 1.815 6.382 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -3.734 0.344 6.335 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -4.435 1.881 6.894 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.982 2.771 8.335 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -3.630 2.919 8.988 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.363 2.112 9.943 1.00 0.00 H new ATOM 1510 N VAL A 100 -3.940 -2.103 8.143 1.00 0.00 N ATOM 1511 CA VAL A 100 -4.361 -3.322 7.468 1.00 0.00 C ATOM 1512 C VAL A 100 -5.569 -3.907 8.200 1.00 0.00 C ATOM 1513 O VAL A 100 -6.549 -4.257 7.545 1.00 0.00 O ATOM 1514 CB VAL A 100 -3.182 -4.311 7.363 1.00 0.00 C ATOM 1515 CG1 VAL A 100 -3.618 -5.687 6.841 1.00 0.00 C ATOM 1516 CG2 VAL A 100 -2.110 -3.782 6.400 1.00 0.00 C ATOM 0 H VAL A 100 -2.986 -2.139 8.502 1.00 0.00 H new ATOM 0 HA VAL A 100 -4.669 -3.104 6.445 1.00 0.00 H new ATOM 0 HB VAL A 100 -2.788 -4.411 8.374 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -2.752 -6.346 6.786 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -4.357 -6.115 7.518 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -4.055 -5.578 5.848 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -1.289 -4.496 6.342 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -2.545 -3.648 5.410 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -1.734 -2.826 6.764 1.00 0.00 H new ATOM 1526 N ASN A 101 -5.530 -4.008 9.531 1.00 0.00 N ATOM 1527 CA ASN A 101 -6.648 -4.536 10.309 1.00 0.00 C ATOM 1528 C ASN A 101 -7.918 -3.697 10.101 1.00 0.00 C ATOM 1529 O ASN A 101 -8.992 -4.276 9.942 1.00 0.00 O ATOM 1530 CB ASN A 101 -6.251 -4.601 11.793 1.00 0.00 C ATOM 1531 CG ASN A 101 -7.408 -5.011 12.688 1.00 0.00 C ATOM 1532 OD1 ASN A 101 -7.573 -6.189 12.973 1.00 0.00 O ATOM 1533 ND2 ASN A 101 -8.182 -4.059 13.191 1.00 0.00 N ATOM 0 H ASN A 101 -4.727 -3.728 10.094 1.00 0.00 H new ATOM 0 HA ASN A 101 -6.877 -5.544 9.963 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -5.432 -5.310 11.916 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -5.879 -3.626 12.109 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -8.937 -4.301 13.832 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -8.022 -3.084 12.936 1.00 0.00 H new ATOM 1540 N GLN A 102 -7.812 -2.360 10.076 1.00 0.00 N ATOM 1541 CA GLN A 102 -8.940 -1.456 9.838 1.00 0.00 C ATOM 1542 C GLN A 102 -9.574 -1.764 8.477 1.00 0.00 C ATOM 1543 O GLN A 102 -10.790 -1.942 8.368 1.00 0.00 O ATOM 1544 CB GLN A 102 -8.515 0.028 9.870 1.00 0.00 C ATOM 1545 CG GLN A 102 -7.926 0.530 11.193 1.00 0.00 C ATOM 1546 CD GLN A 102 -7.596 2.021 11.160 1.00 0.00 C ATOM 1547 OE1 GLN A 102 -8.461 2.866 10.951 1.00 0.00 O ATOM 1548 NE2 GLN A 102 -6.336 2.370 11.353 1.00 0.00 N ATOM 0 H GLN A 102 -6.928 -1.873 10.223 1.00 0.00 H new ATOM 0 HA GLN A 102 -9.659 -1.619 10.641 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -7.779 0.192 9.082 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -9.384 0.640 9.627 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -8.634 0.336 11.999 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -7.021 -0.034 11.421 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -5.629 1.655 11.526 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -6.070 3.354 11.329 1.00 0.00 H new ATOM 1557 N TYR A 103 -8.754 -1.794 7.422 1.00 0.00 N ATOM 1558 CA TYR A 103 -9.217 -2.045 6.067 1.00 0.00 C ATOM 1559 C TYR A 103 -9.806 -3.439 5.901 1.00 0.00 C ATOM 1560 O TYR A 103 -10.875 -3.574 5.300 1.00 0.00 O ATOM 1561 CB TYR A 103 -8.078 -1.845 5.073 1.00 0.00 C ATOM 1562 CG TYR A 103 -8.471 -2.297 3.680 1.00 0.00 C ATOM 1563 CD1 TYR A 103 -9.458 -1.579 2.983 1.00 0.00 C ATOM 1564 CD2 TYR A 103 -8.000 -3.521 3.167 1.00 0.00 C ATOM 1565 CE1 TYR A 103 -9.990 -2.089 1.790 1.00 0.00 C ATOM 1566 CE2 TYR A 103 -8.558 -4.055 1.990 1.00 0.00 C ATOM 1567 CZ TYR A 103 -9.579 -3.350 1.312 1.00 0.00 C ATOM 1568 OH TYR A 103 -10.212 -3.891 0.234 1.00 0.00 O ATOM 0 H TYR A 103 -7.748 -1.643 7.491 1.00 0.00 H new ATOM 0 HA TYR A 103 -10.013 -1.328 5.866 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -7.795 -0.793 5.049 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -7.202 -2.403 5.404 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -9.808 -0.632 3.367 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -7.209 -4.051 3.677 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -10.717 -1.514 1.236 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -8.207 -5.001 1.606 1.00 0.00 H new ATOM 0 HH TYR A 103 -9.815 -4.762 0.024 1.00 0.00 H new ATOM 1578 N LEU A 104 -9.124 -4.471 6.404 1.00 0.00 N ATOM 1579 CA LEU A 104 -9.607 -5.844 6.307 1.00 0.00 C ATOM 1580 C LEU A 104 -10.932 -5.986 7.048 1.00 0.00 C ATOM 1581 O LEU A 104 -11.735 -6.824 6.658 1.00 0.00 O ATOM 1582 CB LEU A 104 -8.582 -6.866 6.841 1.00 0.00 C ATOM 1583 CG LEU A 104 -7.345 -7.133 5.951 1.00 0.00 C ATOM 1584 CD1 LEU A 104 -6.627 -8.400 6.441 1.00 0.00 C ATOM 1585 CD2 LEU A 104 -7.708 -7.314 4.474 1.00 0.00 C ATOM 0 H LEU A 104 -8.230 -4.377 6.885 1.00 0.00 H new ATOM 0 HA LEU A 104 -9.756 -6.063 5.250 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.234 -6.523 7.815 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -9.097 -7.813 7.002 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.699 -6.259 6.031 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.755 -8.589 5.815 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.308 -8.261 7.474 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.307 -9.250 6.382 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -6.802 -7.498 3.897 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.385 -8.161 4.367 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.195 -6.411 4.106 1.00 0.00 H new ATOM 1597 N SER A 105 -11.194 -5.136 8.042 1.00 0.00 N ATOM 1598 CA SER A 105 -12.445 -5.089 8.779 1.00 0.00 C ATOM 1599 C SER A 105 -13.470 -4.127 8.159 1.00 0.00 C ATOM 1600 O SER A 105 -14.507 -3.868 8.773 1.00 0.00 O ATOM 1601 CB SER A 105 -12.128 -4.719 10.224 1.00 0.00 C ATOM 1602 OG SER A 105 -11.189 -5.628 10.772 1.00 0.00 O ATOM 0 H SER A 105 -10.517 -4.443 8.361 1.00 0.00 H new ATOM 0 HA SER A 105 -12.917 -6.071 8.736 1.00 0.00 H new ATOM 0 HB2 SER A 105 -11.730 -3.705 10.268 1.00 0.00 H new ATOM 0 HB3 SER A 105 -13.042 -4.729 10.818 1.00 0.00 H new ATOM 0 HG SER A 105 -10.281 -5.334 10.550 1.00 0.00 H new ATOM 1608 N GLY A 106 -13.204 -3.573 6.970 1.00 0.00 N ATOM 1609 CA GLY A 106 -14.163 -2.831 6.153 1.00 0.00 C ATOM 1610 C GLY A 106 -14.318 -1.352 6.513 1.00 0.00 C ATOM 1611 O GLY A 106 -15.082 -0.649 5.844 1.00 0.00 O ATOM 0 H GLY A 106 -12.282 -3.633 6.538 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -13.860 -2.904 5.109 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -15.137 -3.313 6.237 1.00 0.00 H new ATOM 1615 N GLN A 107 -13.605 -0.869 7.536 1.00 0.00 N ATOM 1616 CA GLN A 107 -13.799 0.471 8.090 1.00 0.00 C ATOM 1617 C GLN A 107 -13.298 1.558 7.138 1.00 0.00 C ATOM 1618 O GLN A 107 -13.929 2.599 6.967 1.00 0.00 O ATOM 1619 CB GLN A 107 -13.030 0.598 9.418 1.00 0.00 C ATOM 1620 CG GLN A 107 -13.561 -0.315 10.528 1.00 0.00 C ATOM 1621 CD GLN A 107 -14.933 0.145 11.014 1.00 0.00 C ATOM 1622 OE1 GLN A 107 -15.046 1.057 11.831 1.00 0.00 O ATOM 1623 NE2 GLN A 107 -16.007 -0.437 10.513 1.00 0.00 N ATOM 0 H GLN A 107 -12.873 -1.402 8.005 1.00 0.00 H new ATOM 0 HA GLN A 107 -14.869 0.608 8.245 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -11.979 0.368 9.242 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -13.077 1.633 9.757 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -13.628 -1.339 10.159 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -12.860 -0.322 11.363 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -15.908 -1.193 9.836 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -16.936 -0.130 10.803 1.00 0.00 H new ATOM 1632 N LEU A 108 -12.122 1.322 6.571 1.00 0.00 N ATOM 1633 CA LEU A 108 -11.324 2.321 5.872 1.00 0.00 C ATOM 1634 C LEU A 108 -11.909 2.519 4.483 1.00 0.00 C ATOM 1635 O LEU A 108 -12.315 1.543 3.840 1.00 0.00 O ATOM 1636 CB LEU A 108 -9.876 1.813 5.808 1.00 0.00 C ATOM 1637 CG LEU A 108 -8.783 2.763 6.324 1.00 0.00 C ATOM 1638 CD1 LEU A 108 -9.050 3.323 7.724 1.00 0.00 C ATOM 1639 CD2 LEU A 108 -7.487 1.956 6.354 1.00 0.00 C ATOM 0 H LEU A 108 -11.683 0.401 6.585 1.00 0.00 H new ATOM 0 HA LEU A 108 -11.335 3.281 6.388 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -9.816 0.886 6.378 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -9.649 1.565 4.771 1.00 0.00 H new ATOM 0 HG LEU A 108 -8.742 3.628 5.661 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -8.233 3.983 8.014 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -9.985 3.883 7.720 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -9.123 2.502 8.437 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -6.674 2.586 6.715 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -7.606 1.101 7.020 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -7.254 1.604 5.349 1.00 0.00 H new ATOM 1651 N LYS A 109 -11.927 3.756 3.991 1.00 0.00 N ATOM 1652 CA LYS A 109 -12.580 4.091 2.724 1.00 0.00 C ATOM 1653 C LYS A 109 -11.886 5.225 1.980 1.00 0.00 C ATOM 1654 O LYS A 109 -11.128 6.025 2.520 1.00 0.00 O ATOM 1655 CB LYS A 109 -14.075 4.405 2.974 1.00 0.00 C ATOM 1656 CG LYS A 109 -14.991 4.097 1.768 1.00 0.00 C ATOM 1657 CD LYS A 109 -15.167 2.585 1.536 1.00 0.00 C ATOM 1658 CE LYS A 109 -16.232 1.985 2.456 1.00 0.00 C ATOM 1659 NZ LYS A 109 -17.585 2.000 1.873 1.00 0.00 N ATOM 0 H LYS A 109 -11.492 4.553 4.456 1.00 0.00 H new ATOM 0 HA LYS A 109 -12.502 3.221 2.072 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -14.418 3.830 3.834 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -14.176 5.459 3.234 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -15.968 4.553 1.931 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -14.572 4.553 0.871 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -15.444 2.407 0.497 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -14.216 2.079 1.704 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -15.958 0.957 2.694 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -16.243 2.538 3.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -18.258 1.580 2.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -17.865 2.981 1.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -17.589 1.449 0.991 1.00 0.00 H new