USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 969 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 Single : A 9 SER OG : rot 47:sc= 0.734 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0868) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 168:sc= 1.53 (180deg=1.2!) USER MOD Single : A 24 LYS NZ :NH3+ -178:sc= -0.247 (180deg=-0.291) USER MOD Single : A 25 ASN : amide:sc= -0.309 X(o=-0.31,f=-0.28) USER MOD Single : A 28 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.134) USER MOD Single : A 31 THR OG1 : rot 31:sc= 0.283 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -0.466 K(o=-0.47,f=-1.2) USER MOD Single : A 39 LYS NZ :NH3+ -141:sc= 1.14 (180deg=-0.624) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 171:sc= 1.8 (180deg=1.38) USER MOD Single : A 66 LYS NZ :NH3+ -140:sc= 1.2 (180deg=-0.203) USER MOD Single : A 72 LYS NZ :NH3+ -166:sc= -0.0677 (180deg=-0.305) USER MOD Single : A 73 SER OG : rot 63:sc= 0.694 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= -0.493 K(o=-0.49,f=-4.1!) USER MOD Single : A 87 GLN : amide:sc= -1.02 K(o=-1,f=-5.4!) USER MOD Single : A 88 ASN : amide:sc= -0.201 K(o=-0.2,f=-1.1!) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 SER OG : rot 80:sc= 0.784 USER MOD ----------------------------------------------------------------- ATOM 34 N ILE A 3 2.276 4.076 6.701 1.00 2.43 N ATOM 35 CA ILE A 3 1.620 4.044 5.387 1.00 20.45 C ATOM 36 C ILE A 3 1.965 2.750 4.623 1.00 15.40 C ATOM 37 O ILE A 3 3.133 2.360 4.527 1.00 5.32 O ATOM 38 CB ILE A 3 2.005 5.285 4.530 1.00 44.51 C ATOM 39 CG1 ILE A 3 1.333 5.220 3.146 1.00 74.40 C ATOM 40 CG2 ILE A 3 3.524 5.409 4.394 1.00 23.11 C ATOM 41 CD1 ILE A 3 1.592 6.433 2.274 1.00 21.14 C ATOM 0 HA ILE A 3 0.545 4.068 5.565 1.00 20.45 H new ATOM 0 HB ILE A 3 1.642 6.176 5.043 1.00 44.51 H new ATOM 0 HG12 ILE A 3 1.685 4.330 2.625 1.00 74.40 H new ATOM 0 HG13 ILE A 3 0.257 5.106 3.281 1.00 74.40 H new ATOM 0 HG21 ILE A 3 3.765 6.284 3.791 1.00 23.11 H new ATOM 0 HG22 ILE A 3 3.970 5.516 5.383 1.00 23.11 H new ATOM 0 HG23 ILE A 3 3.920 4.515 3.912 1.00 23.11 H new ATOM 0 HD11 ILE A 3 1.084 6.309 1.317 1.00 21.14 H new ATOM 0 HD12 ILE A 3 1.214 7.326 2.772 1.00 21.14 H new ATOM 0 HD13 ILE A 3 2.664 6.537 2.105 1.00 21.14 H new ATOM 53 N VAL A 4 0.940 2.082 4.092 1.00 5.34 N ATOM 54 CA VAL A 4 1.119 0.824 3.352 1.00 11.21 C ATOM 55 C VAL A 4 0.519 0.924 1.940 1.00 74.51 C ATOM 56 O VAL A 4 -0.642 1.296 1.771 1.00 5.13 O ATOM 57 CB VAL A 4 0.459 -0.367 4.096 1.00 12.35 C ATOM 58 CG1 VAL A 4 0.667 -1.676 3.331 1.00 23.14 C ATOM 59 CG2 VAL A 4 0.998 -0.480 5.522 1.00 12.40 C ATOM 0 H VAL A 4 -0.030 2.391 4.159 1.00 5.34 H new ATOM 0 HA VAL A 4 2.192 0.649 3.278 1.00 11.21 H new ATOM 0 HB VAL A 4 -0.613 -0.177 4.151 1.00 12.35 H new ATOM 0 HG11 VAL A 4 0.194 -2.494 3.875 1.00 23.14 H new ATOM 0 HG12 VAL A 4 0.221 -1.593 2.340 1.00 23.14 H new ATOM 0 HG13 VAL A 4 1.734 -1.874 3.233 1.00 23.14 H new ATOM 0 HG21 VAL A 4 0.522 -1.321 6.025 1.00 12.40 H new ATOM 0 HG22 VAL A 4 2.076 -0.638 5.492 1.00 12.40 H new ATOM 0 HG23 VAL A 4 0.781 0.439 6.067 1.00 12.40 H new ATOM 69 N ILE A 5 1.309 0.588 0.927 1.00 43.42 N ATOM 70 CA ILE A 5 0.852 0.662 -0.467 1.00 34.52 C ATOM 71 C ILE A 5 0.558 -0.737 -1.036 1.00 62.45 C ATOM 72 O ILE A 5 1.460 -1.558 -1.181 1.00 61.11 O ATOM 73 CB ILE A 5 1.907 1.372 -1.351 1.00 5.51 C ATOM 74 CG1 ILE A 5 2.245 2.755 -0.760 1.00 22.32 C ATOM 75 CG2 ILE A 5 1.409 1.500 -2.793 1.00 31.42 C ATOM 76 CD1 ILE A 5 3.377 3.468 -1.465 1.00 45.42 C ATOM 0 H ILE A 5 2.269 0.261 1.038 1.00 43.42 H new ATOM 0 HA ILE A 5 -0.072 1.240 -0.477 1.00 34.52 H new ATOM 0 HB ILE A 5 2.815 0.769 -1.365 1.00 5.51 H new ATOM 0 HG12 ILE A 5 1.354 3.382 -0.799 1.00 22.32 H new ATOM 0 HG13 ILE A 5 2.505 2.635 0.292 1.00 22.32 H new ATOM 0 HG21 ILE A 5 2.166 2.002 -3.396 1.00 31.42 H new ATOM 0 HG22 ILE A 5 1.219 0.508 -3.202 1.00 31.42 H new ATOM 0 HG23 ILE A 5 0.488 2.082 -2.809 1.00 31.42 H new ATOM 0 HD11 ILE A 5 3.552 4.433 -0.989 1.00 45.42 H new ATOM 0 HD12 ILE A 5 4.282 2.864 -1.404 1.00 45.42 H new ATOM 0 HD13 ILE A 5 3.114 3.622 -2.511 1.00 45.42 H new ATOM 88 N VAL A 6 -0.709 -1.004 -1.347 1.00 24.00 N ATOM 89 CA VAL A 6 -1.121 -2.297 -1.911 1.00 53.11 C ATOM 90 C VAL A 6 -1.227 -2.229 -3.446 1.00 12.22 C ATOM 91 O VAL A 6 -2.076 -1.522 -3.996 1.00 23.34 O ATOM 92 CB VAL A 6 -2.481 -2.766 -1.328 1.00 12.14 C ATOM 93 CG1 VAL A 6 -2.870 -4.139 -1.883 1.00 34.53 C ATOM 94 CG2 VAL A 6 -2.437 -2.789 0.201 1.00 61.05 C ATOM 0 H VAL A 6 -1.474 -0.342 -1.219 1.00 24.00 H new ATOM 0 HA VAL A 6 -0.351 -3.018 -1.636 1.00 53.11 H new ATOM 0 HB VAL A 6 -3.244 -2.051 -1.635 1.00 12.14 H new ATOM 0 HG11 VAL A 6 -3.826 -4.445 -1.459 1.00 34.53 H new ATOM 0 HG12 VAL A 6 -2.956 -4.082 -2.968 1.00 34.53 H new ATOM 0 HG13 VAL A 6 -2.105 -4.869 -1.617 1.00 34.53 H new ATOM 0 HG21 VAL A 6 -3.401 -3.121 0.588 1.00 61.05 H new ATOM 0 HG22 VAL A 6 -1.657 -3.475 0.532 1.00 61.05 H new ATOM 0 HG23 VAL A 6 -2.222 -1.788 0.574 1.00 61.05 H new ATOM 104 N VAL A 7 -0.362 -2.973 -4.132 1.00 15.42 N ATOM 105 CA VAL A 7 -0.329 -2.981 -5.599 1.00 73.31 C ATOM 106 C VAL A 7 -0.789 -4.337 -6.163 1.00 42.03 C ATOM 107 O VAL A 7 -0.272 -5.388 -5.780 1.00 12.44 O ATOM 108 CB VAL A 7 1.098 -2.663 -6.118 1.00 41.11 C ATOM 109 CG1 VAL A 7 1.135 -2.642 -7.645 1.00 70.42 C ATOM 110 CG2 VAL A 7 1.595 -1.335 -5.546 1.00 63.11 C ATOM 0 H VAL A 7 0.330 -3.582 -3.696 1.00 15.42 H new ATOM 0 HA VAL A 7 -1.018 -2.209 -5.943 1.00 73.31 H new ATOM 0 HB VAL A 7 1.765 -3.455 -5.778 1.00 41.11 H new ATOM 0 HG11 VAL A 7 2.147 -2.417 -7.981 1.00 70.42 H new ATOM 0 HG12 VAL A 7 0.833 -3.616 -8.030 1.00 70.42 H new ATOM 0 HG13 VAL A 7 0.451 -1.878 -8.015 1.00 70.42 H new ATOM 0 HG21 VAL A 7 2.597 -1.129 -5.922 1.00 63.11 H new ATOM 0 HG22 VAL A 7 0.922 -0.533 -5.850 1.00 63.11 H new ATOM 0 HG23 VAL A 7 1.620 -1.394 -4.458 1.00 63.11 H new ATOM 120 N PHE A 8 -1.763 -4.310 -7.073 1.00 61.30 N ATOM 121 CA PHE A 8 -2.274 -5.541 -7.698 1.00 64.32 C ATOM 122 C PHE A 8 -1.595 -5.830 -9.045 1.00 52.31 C ATOM 123 O PHE A 8 -1.630 -6.957 -9.539 1.00 34.31 O ATOM 124 CB PHE A 8 -3.792 -5.453 -7.889 1.00 60.05 C ATOM 125 CG PHE A 8 -4.573 -5.482 -6.599 1.00 44.40 C ATOM 126 CD1 PHE A 8 -4.742 -4.332 -5.842 1.00 62.03 C ATOM 127 CD2 PHE A 8 -5.142 -6.663 -6.146 1.00 1.23 C ATOM 128 CE1 PHE A 8 -5.459 -4.364 -4.664 1.00 43.31 C ATOM 129 CE2 PHE A 8 -5.862 -6.698 -4.968 1.00 64.52 C ATOM 130 CZ PHE A 8 -6.020 -5.548 -4.227 1.00 71.13 C ATOM 0 H PHE A 8 -2.216 -3.455 -7.396 1.00 61.30 H new ATOM 0 HA PHE A 8 -2.039 -6.365 -7.024 1.00 64.32 H new ATOM 0 HB2 PHE A 8 -4.028 -4.534 -8.425 1.00 60.05 H new ATOM 0 HB3 PHE A 8 -4.118 -6.281 -8.518 1.00 60.05 H new ATOM 0 HD1 PHE A 8 -4.308 -3.402 -6.178 1.00 62.03 H new ATOM 0 HD2 PHE A 8 -5.020 -7.568 -6.723 1.00 1.23 H new ATOM 0 HE1 PHE A 8 -5.582 -3.462 -4.083 1.00 43.31 H new ATOM 0 HE2 PHE A 8 -6.300 -7.625 -4.629 1.00 64.52 H new ATOM 0 HZ PHE A 8 -6.582 -5.572 -3.305 1.00 71.13 H new ATOM 140 N SER A 9 -0.979 -4.811 -9.636 1.00 62.04 N ATOM 141 CA SER A 9 -0.292 -4.969 -10.925 1.00 51.55 C ATOM 142 C SER A 9 0.960 -5.848 -10.779 1.00 44.21 C ATOM 143 O SER A 9 2.014 -5.381 -10.340 1.00 33.24 O ATOM 144 CB SER A 9 0.093 -3.604 -11.522 1.00 71.22 C ATOM 145 OG SER A 9 0.984 -2.892 -10.677 1.00 0.12 O ATOM 0 H SER A 9 -0.938 -3.868 -9.249 1.00 62.04 H new ATOM 0 HA SER A 9 -0.987 -5.461 -11.605 1.00 51.55 H new ATOM 0 HB2 SER A 9 0.557 -3.752 -12.497 1.00 71.22 H new ATOM 0 HB3 SER A 9 -0.807 -3.011 -11.683 1.00 71.22 H new ATOM 0 HG SER A 9 1.704 -3.489 -10.385 1.00 0.12 H new ATOM 151 N THR A 10 0.833 -7.124 -11.144 1.00 25.15 N ATOM 152 CA THR A 10 1.940 -8.087 -11.025 1.00 15.34 C ATOM 153 C THR A 10 3.135 -7.729 -11.927 1.00 24.42 C ATOM 154 O THR A 10 4.224 -8.279 -11.768 1.00 73.15 O ATOM 155 CB THR A 10 1.477 -9.527 -11.363 1.00 52.12 C ATOM 156 OG1 THR A 10 0.971 -9.579 -12.707 1.00 42.14 O ATOM 157 CG2 THR A 10 0.395 -10.005 -10.390 1.00 73.04 C ATOM 0 H THR A 10 -0.026 -7.520 -11.526 1.00 25.15 H new ATOM 0 HA THR A 10 2.263 -8.037 -9.985 1.00 15.34 H new ATOM 0 HB THR A 10 2.340 -10.187 -11.270 1.00 52.12 H new ATOM 0 HG1 THR A 10 0.682 -10.493 -12.913 1.00 42.14 H new ATOM 0 HG21 THR A 10 0.091 -11.018 -10.653 1.00 73.04 H new ATOM 0 HG22 THR A 10 0.790 -9.997 -9.374 1.00 73.04 H new ATOM 0 HG23 THR A 10 -0.467 -9.341 -10.449 1.00 73.04 H new ATOM 165 N ASP A 11 2.923 -6.817 -12.879 1.00 73.01 N ATOM 166 CA ASP A 11 4.001 -6.344 -13.756 1.00 1.54 C ATOM 167 C ASP A 11 4.942 -5.390 -12.997 1.00 21.54 C ATOM 168 O ASP A 11 4.624 -4.214 -12.790 1.00 61.42 O ATOM 169 CB ASP A 11 3.408 -5.653 -14.989 1.00 74.11 C ATOM 170 CG ASP A 11 2.418 -6.548 -15.710 1.00 0.34 C ATOM 171 OD1 ASP A 11 2.855 -7.429 -16.481 1.00 23.14 O ATOM 172 OD2 ASP A 11 1.200 -6.393 -15.490 1.00 24.14 O ATOM 0 H ASP A 11 2.015 -6.390 -13.064 1.00 73.01 H new ATOM 0 HA ASP A 11 4.587 -7.203 -14.084 1.00 1.54 H new ATOM 0 HB2 ASP A 11 2.912 -4.731 -14.686 1.00 74.11 H new ATOM 0 HB3 ASP A 11 4.211 -5.374 -15.671 1.00 74.11 H new ATOM 177 N GLU A 12 6.105 -5.904 -12.593 1.00 25.51 N ATOM 178 CA GLU A 12 7.012 -5.181 -11.689 1.00 35.45 C ATOM 179 C GLU A 12 7.549 -3.860 -12.273 1.00 21.45 C ATOM 180 O GLU A 12 7.915 -2.955 -11.520 1.00 25.42 O ATOM 181 CB GLU A 12 8.175 -6.097 -11.247 1.00 11.23 C ATOM 182 CG GLU A 12 8.954 -6.764 -12.386 1.00 41.22 C ATOM 183 CD GLU A 12 9.826 -5.801 -13.181 1.00 34.52 C ATOM 184 OE1 GLU A 12 10.683 -5.121 -12.575 1.00 42.10 O ATOM 185 OE2 GLU A 12 9.661 -5.719 -14.417 1.00 50.43 O ATOM 0 H GLU A 12 6.445 -6.823 -12.877 1.00 25.51 H new ATOM 0 HA GLU A 12 6.417 -4.902 -10.820 1.00 35.45 H new ATOM 0 HB2 GLU A 12 8.871 -5.509 -10.649 1.00 11.23 H new ATOM 0 HB3 GLU A 12 7.775 -6.876 -10.598 1.00 11.23 H new ATOM 0 HG2 GLU A 12 9.583 -7.551 -11.971 1.00 41.22 H new ATOM 0 HG3 GLU A 12 8.248 -7.244 -13.064 1.00 41.22 H new ATOM 192 N GLU A 13 7.595 -3.737 -13.603 1.00 71.22 N ATOM 193 CA GLU A 13 8.108 -2.510 -14.231 1.00 21.44 C ATOM 194 C GLU A 13 7.314 -1.274 -13.785 1.00 1.42 C ATOM 195 O GLU A 13 7.871 -0.189 -13.656 1.00 73.51 O ATOM 196 CB GLU A 13 8.110 -2.606 -15.767 1.00 41.11 C ATOM 197 CG GLU A 13 6.726 -2.697 -16.408 1.00 5.22 C ATOM 198 CD GLU A 13 6.750 -2.323 -17.884 1.00 2.22 C ATOM 199 OE1 GLU A 13 6.964 -3.214 -18.731 1.00 5.43 O ATOM 200 OE2 GLU A 13 6.581 -1.123 -18.201 1.00 60.35 O ATOM 0 H GLU A 13 7.290 -4.457 -14.258 1.00 71.22 H new ATOM 0 HA GLU A 13 9.140 -2.401 -13.896 1.00 21.44 H new ATOM 0 HB2 GLU A 13 8.624 -1.734 -16.170 1.00 41.11 H new ATOM 0 HB3 GLU A 13 8.689 -3.482 -16.061 1.00 41.11 H new ATOM 0 HG2 GLU A 13 6.343 -3.711 -16.298 1.00 5.22 H new ATOM 0 HG3 GLU A 13 6.038 -2.037 -15.879 1.00 5.22 H new ATOM 207 N THR A 14 6.013 -1.441 -13.546 1.00 72.21 N ATOM 208 CA THR A 14 5.174 -0.342 -13.047 1.00 41.14 C ATOM 209 C THR A 14 5.501 -0.027 -11.580 1.00 31.40 C ATOM 210 O THR A 14 5.598 1.138 -11.185 1.00 40.35 O ATOM 211 CB THR A 14 3.666 -0.665 -13.193 1.00 34.24 C ATOM 212 OG1 THR A 14 3.354 -0.912 -14.574 1.00 62.22 O ATOM 213 CG2 THR A 14 2.795 0.478 -12.675 1.00 43.32 C ATOM 0 H THR A 14 5.516 -2.320 -13.688 1.00 72.21 H new ATOM 0 HA THR A 14 5.395 0.535 -13.656 1.00 41.14 H new ATOM 0 HB THR A 14 3.455 -1.553 -12.596 1.00 34.24 H new ATOM 0 HG1 THR A 14 2.400 -1.118 -14.662 1.00 62.22 H new ATOM 0 HG21 THR A 14 1.743 0.217 -12.793 1.00 43.32 H new ATOM 0 HG22 THR A 14 3.010 0.650 -11.620 1.00 43.32 H new ATOM 0 HG23 THR A 14 3.009 1.384 -13.241 1.00 43.32 H new ATOM 221 N LEU A 15 5.687 -1.078 -10.780 1.00 4.21 N ATOM 222 CA LEU A 15 6.126 -0.930 -9.386 1.00 45.22 C ATOM 223 C LEU A 15 7.480 -0.207 -9.314 1.00 62.45 C ATOM 224 O LEU A 15 7.752 0.550 -8.379 1.00 64.11 O ATOM 225 CB LEU A 15 6.241 -2.309 -8.722 1.00 63.34 C ATOM 226 CG LEU A 15 6.779 -2.308 -7.278 1.00 3.55 C ATOM 227 CD1 LEU A 15 5.799 -1.617 -6.334 1.00 71.40 C ATOM 228 CD2 LEU A 15 7.077 -3.732 -6.813 1.00 64.00 C ATOM 0 H LEU A 15 5.541 -2.044 -11.072 1.00 4.21 H new ATOM 0 HA LEU A 15 5.384 -0.333 -8.856 1.00 45.22 H new ATOM 0 HB2 LEU A 15 5.257 -2.777 -8.724 1.00 63.34 H new ATOM 0 HB3 LEU A 15 6.892 -2.934 -9.333 1.00 63.34 H new ATOM 0 HG LEU A 15 7.712 -1.745 -7.262 1.00 3.55 H new ATOM 0 HD11 LEU A 15 6.200 -1.629 -5.321 1.00 71.40 H new ATOM 0 HD12 LEU A 15 5.651 -0.586 -6.654 1.00 71.40 H new ATOM 0 HD13 LEU A 15 4.844 -2.143 -6.352 1.00 71.40 H new ATOM 0 HD21 LEU A 15 7.456 -3.709 -5.791 1.00 64.00 H new ATOM 0 HD22 LEU A 15 6.163 -4.325 -6.848 1.00 64.00 H new ATOM 0 HD23 LEU A 15 7.825 -4.179 -7.467 1.00 64.00 H new ATOM 240 N ARG A 16 8.315 -0.454 -10.317 1.00 11.44 N ATOM 241 CA ARG A 16 9.643 0.159 -10.415 1.00 4.44 C ATOM 242 C ARG A 16 9.555 1.698 -10.352 1.00 52.22 C ATOM 243 O ARG A 16 10.377 2.355 -9.710 1.00 4.30 O ATOM 244 CB ARG A 16 10.302 -0.298 -11.724 1.00 44.42 C ATOM 245 CG ARG A 16 11.819 -0.171 -11.751 1.00 62.32 C ATOM 246 CD ARG A 16 12.391 -0.656 -13.080 1.00 72.01 C ATOM 247 NE ARG A 16 11.937 -2.010 -13.424 1.00 34.21 N ATOM 248 CZ ARG A 16 12.045 -2.541 -14.614 1.00 20.14 C ATOM 249 NH1 ARG A 16 12.611 -1.892 -15.584 1.00 24.15 N ATOM 250 NH2 ARG A 16 11.595 -3.730 -14.832 1.00 34.43 N ATOM 0 H ARG A 16 8.094 -1.085 -11.088 1.00 11.44 H new ATOM 0 HA ARG A 16 10.250 -0.161 -9.568 1.00 4.44 H new ATOM 0 HB2 ARG A 16 10.035 -1.339 -11.905 1.00 44.42 H new ATOM 0 HB3 ARG A 16 9.888 0.285 -12.546 1.00 44.42 H new ATOM 0 HG2 ARG A 16 12.102 0.869 -11.588 1.00 62.32 H new ATOM 0 HG3 ARG A 16 12.249 -0.750 -10.934 1.00 62.32 H new ATOM 0 HD2 ARG A 16 12.099 0.034 -13.872 1.00 72.01 H new ATOM 0 HD3 ARG A 16 13.480 -0.642 -13.031 1.00 72.01 H new ATOM 0 HE ARG A 16 11.510 -2.572 -12.687 1.00 34.21 H new ATOM 0 HH11 ARG A 16 12.979 -0.954 -15.424 1.00 24.15 H new ATOM 0 HH12 ARG A 16 12.688 -2.319 -16.507 1.00 24.15 H new ATOM 0 HH21 ARG A 16 11.155 -4.255 -14.076 1.00 34.43 H new ATOM 0 HH22 ARG A 16 11.679 -4.145 -15.760 1.00 34.43 H new ATOM 264 N LYS A 17 8.536 2.262 -11.005 1.00 70.20 N ATOM 265 CA LYS A 17 8.291 3.714 -10.969 1.00 63.14 C ATOM 266 C LYS A 17 7.902 4.169 -9.553 1.00 72.22 C ATOM 267 O LYS A 17 8.393 5.186 -9.059 1.00 12.20 O ATOM 268 CB LYS A 17 7.174 4.108 -11.957 1.00 63.22 C ATOM 269 CG LYS A 17 7.575 4.094 -13.437 1.00 43.40 C ATOM 270 CD LYS A 17 8.026 2.713 -13.901 1.00 44.41 C ATOM 271 CE LYS A 17 8.253 2.657 -15.407 1.00 55.45 C ATOM 272 NZ LYS A 17 6.979 2.760 -16.169 1.00 54.32 N ATOM 0 H LYS A 17 7.864 1.739 -11.567 1.00 70.20 H new ATOM 0 HA LYS A 17 9.217 4.210 -11.261 1.00 63.14 H new ATOM 0 HB2 LYS A 17 6.333 3.429 -11.819 1.00 63.22 H new ATOM 0 HB3 LYS A 17 6.822 5.108 -11.702 1.00 63.22 H new ATOM 0 HG2 LYS A 17 6.730 4.421 -14.043 1.00 43.40 H new ATOM 0 HG3 LYS A 17 8.380 4.811 -13.600 1.00 43.40 H new ATOM 0 HD2 LYS A 17 8.948 2.442 -13.386 1.00 44.41 H new ATOM 0 HD3 LYS A 17 7.275 1.974 -13.621 1.00 44.41 H new ATOM 0 HE2 LYS A 17 8.919 3.468 -15.703 1.00 55.45 H new ATOM 0 HE3 LYS A 17 8.754 1.723 -15.663 1.00 55.45 H new ATOM 0 HZ1 LYS A 17 7.159 2.566 -17.175 1.00 54.32 H new ATOM 0 HZ2 LYS A 17 6.297 2.068 -15.800 1.00 54.32 H new ATOM 0 HZ3 LYS A 17 6.589 3.719 -16.066 1.00 54.32 H new ATOM 286 N PHE A 18 7.026 3.402 -8.903 1.00 72.22 N ATOM 287 CA PHE A 18 6.559 3.732 -7.549 1.00 73.13 C ATOM 288 C PHE A 18 7.734 3.879 -6.576 1.00 32.25 C ATOM 289 O PHE A 18 7.801 4.837 -5.802 1.00 44.33 O ATOM 290 CB PHE A 18 5.597 2.654 -7.030 1.00 42.24 C ATOM 291 CG PHE A 18 4.364 2.453 -7.879 1.00 72.21 C ATOM 292 CD1 PHE A 18 3.854 3.486 -8.653 1.00 32.11 C ATOM 293 CD2 PHE A 18 3.713 1.228 -7.898 1.00 52.35 C ATOM 294 CE1 PHE A 18 2.725 3.300 -9.423 1.00 10.31 C ATOM 295 CE2 PHE A 18 2.583 1.039 -8.668 1.00 52.10 C ATOM 296 CZ PHE A 18 2.089 2.076 -9.432 1.00 71.12 C ATOM 0 H PHE A 18 6.624 2.548 -9.289 1.00 72.22 H new ATOM 0 HA PHE A 18 6.034 4.685 -7.608 1.00 73.13 H new ATOM 0 HB2 PHE A 18 6.134 1.708 -6.962 1.00 42.24 H new ATOM 0 HB3 PHE A 18 5.287 2.918 -6.019 1.00 42.24 H new ATOM 0 HD1 PHE A 18 4.347 4.447 -8.652 1.00 32.11 H new ATOM 0 HD2 PHE A 18 4.095 0.412 -7.303 1.00 52.35 H new ATOM 0 HE1 PHE A 18 2.339 4.113 -10.019 1.00 10.31 H new ATOM 0 HE2 PHE A 18 2.086 0.080 -8.672 1.00 52.10 H new ATOM 0 HZ PHE A 18 1.206 1.930 -10.036 1.00 71.12 H new ATOM 306 N LYS A 19 8.666 2.929 -6.633 1.00 63.20 N ATOM 307 CA LYS A 19 9.844 2.950 -5.762 1.00 32.03 C ATOM 308 C LYS A 19 10.687 4.215 -5.981 1.00 62.52 C ATOM 309 O LYS A 19 11.338 4.712 -5.061 1.00 15.21 O ATOM 310 CB LYS A 19 10.707 1.700 -5.994 1.00 61.33 C ATOM 311 CG LYS A 19 9.950 0.388 -5.799 1.00 3.45 C ATOM 312 CD LYS A 19 10.879 -0.827 -5.834 1.00 72.11 C ATOM 313 CE LYS A 19 11.599 -0.981 -7.171 1.00 62.22 C ATOM 314 NZ LYS A 19 12.489 -2.173 -7.181 1.00 53.12 N ATOM 0 H LYS A 19 8.630 2.135 -7.272 1.00 63.20 H new ATOM 0 HA LYS A 19 9.488 2.955 -4.732 1.00 32.03 H new ATOM 0 HB2 LYS A 19 11.110 1.730 -7.006 1.00 61.33 H new ATOM 0 HB3 LYS A 19 11.557 1.724 -5.312 1.00 61.33 H new ATOM 0 HG2 LYS A 19 9.423 0.413 -4.845 1.00 3.45 H new ATOM 0 HG3 LYS A 19 9.194 0.288 -6.578 1.00 3.45 H new ATOM 0 HD2 LYS A 19 11.617 -0.738 -5.037 1.00 72.11 H new ATOM 0 HD3 LYS A 19 10.300 -1.728 -5.632 1.00 72.11 H new ATOM 0 HE2 LYS A 19 10.865 -1.068 -7.972 1.00 62.22 H new ATOM 0 HE3 LYS A 19 12.187 -0.086 -7.373 1.00 62.22 H new ATOM 0 HZ1 LYS A 19 12.961 -2.246 -8.105 1.00 53.12 H new ATOM 0 HZ2 LYS A 19 13.205 -2.078 -6.433 1.00 53.12 H new ATOM 0 HZ3 LYS A 19 11.924 -3.030 -7.013 1.00 53.12 H new ATOM 328 N ASP A 20 10.677 4.728 -7.208 1.00 12.03 N ATOM 329 CA ASP A 20 11.428 5.938 -7.550 1.00 74.12 C ATOM 330 C ASP A 20 10.705 7.207 -7.072 1.00 74.42 C ATOM 331 O ASP A 20 11.340 8.158 -6.609 1.00 50.30 O ATOM 332 CB ASP A 20 11.668 5.986 -9.061 1.00 70.02 C ATOM 333 CG ASP A 20 12.591 4.878 -9.539 1.00 42.54 C ATOM 334 OD1 ASP A 20 13.099 4.104 -8.696 1.00 1.14 O ATOM 335 OD2 ASP A 20 12.823 4.779 -10.760 1.00 1.02 O ATOM 0 H ASP A 20 10.156 4.325 -7.987 1.00 12.03 H new ATOM 0 HA ASP A 20 12.388 5.902 -7.036 1.00 74.12 H new ATOM 0 HB2 ASP A 20 10.713 5.908 -9.580 1.00 70.02 H new ATOM 0 HB3 ASP A 20 12.097 6.952 -9.327 1.00 70.02 H new ATOM 340 N ILE A 21 9.378 7.212 -7.185 1.00 61.15 N ATOM 341 CA ILE A 21 8.556 8.317 -6.676 1.00 32.25 C ATOM 342 C ILE A 21 8.732 8.473 -5.155 1.00 22.35 C ATOM 343 O ILE A 21 8.898 9.581 -4.641 1.00 70.25 O ATOM 344 CB ILE A 21 7.056 8.086 -7.000 1.00 62.41 C ATOM 345 CG1 ILE A 21 6.848 7.968 -8.524 1.00 44.01 C ATOM 346 CG2 ILE A 21 6.196 9.207 -6.418 1.00 32.51 C ATOM 347 CD1 ILE A 21 5.416 7.673 -8.935 1.00 41.12 C ATOM 0 H ILE A 21 8.844 6.462 -7.625 1.00 61.15 H new ATOM 0 HA ILE A 21 8.890 9.230 -7.170 1.00 32.25 H new ATOM 0 HB ILE A 21 6.744 7.150 -6.537 1.00 62.41 H new ATOM 0 HG12 ILE A 21 7.166 8.898 -8.996 1.00 44.01 H new ATOM 0 HG13 ILE A 21 7.494 7.179 -8.908 1.00 44.01 H new ATOM 0 HG21 ILE A 21 5.149 9.024 -6.658 1.00 32.51 H new ATOM 0 HG22 ILE A 21 6.321 9.237 -5.336 1.00 32.51 H new ATOM 0 HG23 ILE A 21 6.504 10.161 -6.845 1.00 32.51 H new ATOM 0 HD11 ILE A 21 5.356 7.606 -10.021 1.00 41.12 H new ATOM 0 HD12 ILE A 21 5.098 6.728 -8.495 1.00 41.12 H new ATOM 0 HD13 ILE A 21 4.765 8.474 -8.584 1.00 41.12 H new ATOM 359 N ILE A 22 8.703 7.348 -4.446 1.00 42.03 N ATOM 360 CA ILE A 22 8.908 7.334 -2.992 1.00 22.01 C ATOM 361 C ILE A 22 10.303 7.867 -2.610 1.00 53.22 C ATOM 362 O ILE A 22 10.427 8.761 -1.767 1.00 2.31 O ATOM 363 CB ILE A 22 8.724 5.904 -2.418 1.00 70.13 C ATOM 364 CG1 ILE A 22 7.311 5.382 -2.727 1.00 24.40 C ATOM 365 CG2 ILE A 22 8.991 5.886 -0.912 1.00 43.01 C ATOM 366 CD1 ILE A 22 7.049 3.970 -2.243 1.00 23.54 C ATOM 0 H ILE A 22 8.539 6.427 -4.853 1.00 42.03 H new ATOM 0 HA ILE A 22 8.155 7.993 -2.559 1.00 22.01 H new ATOM 0 HB ILE A 22 9.448 5.244 -2.897 1.00 70.13 H new ATOM 0 HG12 ILE A 22 6.581 6.051 -2.271 1.00 24.40 H new ATOM 0 HG13 ILE A 22 7.150 5.420 -3.804 1.00 24.40 H new ATOM 0 HG21 ILE A 22 8.856 4.874 -0.531 1.00 43.01 H new ATOM 0 HG22 ILE A 22 10.013 6.213 -0.720 1.00 43.01 H new ATOM 0 HG23 ILE A 22 8.294 6.558 -0.411 1.00 43.01 H new ATOM 0 HD11 ILE A 22 6.031 3.680 -2.501 1.00 23.54 H new ATOM 0 HD12 ILE A 22 7.752 3.286 -2.718 1.00 23.54 H new ATOM 0 HD13 ILE A 22 7.175 3.927 -1.161 1.00 23.54 H new ATOM 378 N LYS A 23 11.349 7.328 -3.252 1.00 55.20 N ATOM 379 CA LYS A 23 12.736 7.721 -2.946 1.00 55.31 C ATOM 380 C LYS A 23 12.976 9.234 -3.108 1.00 23.34 C ATOM 381 O LYS A 23 13.810 9.805 -2.405 1.00 31.31 O ATOM 382 CB LYS A 23 13.740 6.945 -3.817 1.00 30.43 C ATOM 383 CG LYS A 23 13.906 5.478 -3.422 1.00 71.42 C ATOM 384 CD LYS A 23 15.093 4.826 -4.135 1.00 14.03 C ATOM 385 CE LYS A 23 14.891 4.743 -5.646 1.00 53.41 C ATOM 386 NZ LYS A 23 13.824 3.777 -6.011 1.00 60.33 N ATOM 0 H LYS A 23 11.264 6.622 -3.983 1.00 55.20 H new ATOM 0 HA LYS A 23 12.895 7.469 -1.898 1.00 55.31 H new ATOM 0 HB2 LYS A 23 13.417 6.996 -4.857 1.00 30.43 H new ATOM 0 HB3 LYS A 23 14.711 7.438 -3.760 1.00 30.43 H new ATOM 0 HG2 LYS A 23 14.046 5.406 -2.343 1.00 71.42 H new ATOM 0 HG3 LYS A 23 12.994 4.932 -3.662 1.00 71.42 H new ATOM 0 HD2 LYS A 23 15.998 5.395 -3.923 1.00 14.03 H new ATOM 0 HD3 LYS A 23 15.247 3.823 -3.736 1.00 14.03 H new ATOM 0 HE2 LYS A 23 14.635 5.729 -6.033 1.00 53.41 H new ATOM 0 HE3 LYS A 23 15.826 4.447 -6.121 1.00 53.41 H new ATOM 0 HZ1 LYS A 23 13.577 3.895 -7.014 1.00 60.33 H new ATOM 0 HZ2 LYS A 23 14.164 2.807 -5.850 1.00 60.33 H new ATOM 0 HZ3 LYS A 23 12.983 3.951 -5.424 1.00 60.33 H new ATOM 400 N LYS A 24 12.248 9.879 -4.028 1.00 24.51 N ATOM 401 CA LYS A 24 12.390 11.330 -4.250 1.00 23.34 C ATOM 402 C LYS A 24 12.152 12.120 -2.953 1.00 41.31 C ATOM 403 O LYS A 24 12.793 13.142 -2.701 1.00 52.03 O ATOM 404 CB LYS A 24 11.393 11.825 -5.311 1.00 61.32 C ATOM 405 CG LYS A 24 11.649 13.269 -5.760 1.00 51.31 C ATOM 406 CD LYS A 24 10.375 13.989 -6.210 1.00 2.34 C ATOM 407 CE LYS A 24 9.455 14.298 -5.030 1.00 12.22 C ATOM 408 NZ LYS A 24 8.280 15.116 -5.433 1.00 14.15 N ATOM 0 H LYS A 24 11.559 9.426 -4.628 1.00 24.51 H new ATOM 0 HA LYS A 24 13.410 11.498 -4.595 1.00 23.34 H new ATOM 0 HB2 LYS A 24 11.442 11.168 -6.179 1.00 61.32 H new ATOM 0 HB3 LYS A 24 10.382 11.750 -4.911 1.00 61.32 H new ATOM 0 HG2 LYS A 24 12.103 13.824 -4.939 1.00 51.31 H new ATOM 0 HG3 LYS A 24 12.368 13.267 -6.579 1.00 51.31 H new ATOM 0 HD2 LYS A 24 10.641 14.917 -6.717 1.00 2.34 H new ATOM 0 HD3 LYS A 24 9.844 13.371 -6.934 1.00 2.34 H new ATOM 0 HE2 LYS A 24 9.110 13.364 -4.586 1.00 12.22 H new ATOM 0 HE3 LYS A 24 10.018 14.828 -4.262 1.00 12.22 H new ATOM 0 HZ1 LYS A 24 7.702 15.330 -4.595 1.00 14.15 H new ATOM 0 HZ2 LYS A 24 8.607 16.004 -5.864 1.00 14.15 H new ATOM 0 HZ3 LYS A 24 7.708 14.587 -6.122 1.00 14.15 H new ATOM 422 N ASN A 25 11.221 11.632 -2.137 1.00 11.32 N ATOM 423 CA ASN A 25 10.811 12.327 -0.912 1.00 61.24 C ATOM 424 C ASN A 25 11.717 11.974 0.283 1.00 52.51 C ATOM 425 O ASN A 25 11.522 12.476 1.392 1.00 31.13 O ATOM 426 CB ASN A 25 9.351 11.983 -0.594 1.00 22.40 C ATOM 427 CG ASN A 25 8.410 12.354 -1.727 1.00 75.13 C ATOM 428 OD1 ASN A 25 7.920 13.474 -1.798 1.00 14.25 O ATOM 429 ND2 ASN A 25 8.154 11.423 -2.627 1.00 0.31 N ATOM 0 H ASN A 25 10.731 10.752 -2.301 1.00 11.32 H new ATOM 0 HA ASN A 25 10.909 13.399 -1.083 1.00 61.24 H new ATOM 0 HB2 ASN A 25 9.268 10.915 -0.391 1.00 22.40 H new ATOM 0 HB3 ASN A 25 9.047 12.505 0.313 1.00 22.40 H new ATOM 0 HD21 ASN A 25 7.532 11.627 -3.409 1.00 0.31 H new ATOM 0 HD22 ASN A 25 8.578 10.499 -2.540 1.00 0.31 H new ATOM 436 N GLY A 26 12.709 11.115 0.051 1.00 32.33 N ATOM 437 CA GLY A 26 13.645 10.734 1.108 1.00 54.22 C ATOM 438 C GLY A 26 13.222 9.488 1.887 1.00 61.31 C ATOM 439 O GLY A 26 13.743 9.220 2.972 1.00 1.44 O ATOM 0 H GLY A 26 12.885 10.673 -0.851 1.00 32.33 H new ATOM 0 HA2 GLY A 26 14.626 10.559 0.666 1.00 54.22 H new ATOM 0 HA3 GLY A 26 13.752 11.567 1.803 1.00 54.22 H new ATOM 443 N PHE A 27 12.278 8.725 1.335 1.00 72.15 N ATOM 444 CA PHE A 27 11.786 7.500 1.982 1.00 24.32 C ATOM 445 C PHE A 27 12.262 6.239 1.238 1.00 34.14 C ATOM 446 O PHE A 27 12.370 6.230 0.010 1.00 54.11 O ATOM 447 CB PHE A 27 10.252 7.521 2.056 1.00 12.22 C ATOM 448 CG PHE A 27 9.696 8.654 2.888 1.00 44.42 C ATOM 449 CD1 PHE A 27 9.418 9.885 2.311 1.00 30.34 C ATOM 450 CD2 PHE A 27 9.453 8.489 4.245 1.00 22.42 C ATOM 451 CE1 PHE A 27 8.910 10.924 3.067 1.00 62.22 C ATOM 452 CE2 PHE A 27 8.945 9.527 5.006 1.00 60.43 C ATOM 453 CZ PHE A 27 8.674 10.745 4.415 1.00 13.31 C ATOM 0 H PHE A 27 11.836 8.931 0.439 1.00 72.15 H new ATOM 0 HA PHE A 27 12.195 7.468 2.992 1.00 24.32 H new ATOM 0 HB2 PHE A 27 9.850 7.594 1.045 1.00 12.22 H new ATOM 0 HB3 PHE A 27 9.905 6.574 2.470 1.00 12.22 H new ATOM 0 HD1 PHE A 27 9.601 10.033 1.257 1.00 30.34 H new ATOM 0 HD2 PHE A 27 9.663 7.538 4.713 1.00 22.42 H new ATOM 0 HE1 PHE A 27 8.698 11.876 2.603 1.00 62.22 H new ATOM 0 HE2 PHE A 27 8.761 9.385 6.061 1.00 60.43 H new ATOM 0 HZ PHE A 27 8.278 11.557 5.007 1.00 13.31 H new ATOM 463 N LYS A 28 12.540 5.177 1.992 1.00 4.44 N ATOM 464 CA LYS A 28 13.040 3.916 1.422 1.00 4.44 C ATOM 465 C LYS A 28 11.925 2.857 1.344 1.00 64.35 C ATOM 466 O LYS A 28 11.092 2.745 2.245 1.00 4.32 O ATOM 467 CB LYS A 28 14.220 3.406 2.262 1.00 65.52 C ATOM 468 CG LYS A 28 15.336 4.441 2.416 1.00 54.24 C ATOM 469 CD LYS A 28 15.986 4.791 1.074 1.00 63.52 C ATOM 470 CE LYS A 28 16.758 6.107 1.138 1.00 24.04 C ATOM 471 NZ LYS A 28 17.696 6.152 2.288 1.00 60.42 N ATOM 0 H LYS A 28 12.428 5.160 3.006 1.00 4.44 H new ATOM 0 HA LYS A 28 13.381 4.104 0.404 1.00 4.44 H new ATOM 0 HB2 LYS A 28 13.859 3.120 3.250 1.00 65.52 H new ATOM 0 HB3 LYS A 28 14.627 2.507 1.799 1.00 65.52 H new ATOM 0 HG2 LYS A 28 14.931 5.346 2.869 1.00 54.24 H new ATOM 0 HG3 LYS A 28 16.095 4.056 3.097 1.00 54.24 H new ATOM 0 HD2 LYS A 28 16.662 3.988 0.778 1.00 63.52 H new ATOM 0 HD3 LYS A 28 15.216 4.859 0.305 1.00 63.52 H new ATOM 0 HE2 LYS A 28 17.315 6.245 0.211 1.00 24.04 H new ATOM 0 HE3 LYS A 28 16.054 6.936 1.213 1.00 24.04 H new ATOM 0 HZ1 LYS A 28 18.316 6.982 2.198 1.00 60.42 H new ATOM 0 HZ2 LYS A 28 17.156 6.218 3.174 1.00 60.42 H new ATOM 0 HZ3 LYS A 28 18.274 5.288 2.298 1.00 60.42 H new ATOM 485 N VAL A 29 11.930 2.075 0.265 1.00 43.43 N ATOM 486 CA VAL A 29 10.828 1.153 -0.044 1.00 52.42 C ATOM 487 C VAL A 29 11.130 -0.302 0.358 1.00 71.44 C ATOM 488 O VAL A 29 12.220 -0.816 0.112 1.00 21.11 O ATOM 489 CB VAL A 29 10.506 1.181 -1.560 1.00 2.53 C ATOM 490 CG1 VAL A 29 9.260 0.354 -1.877 1.00 73.24 C ATOM 491 CG2 VAL A 29 10.350 2.617 -2.048 1.00 22.21 C ATOM 0 H VAL A 29 12.689 2.059 -0.416 1.00 43.43 H new ATOM 0 HA VAL A 29 9.976 1.499 0.541 1.00 52.42 H new ATOM 0 HB VAL A 29 11.343 0.729 -2.092 1.00 2.53 H new ATOM 0 HG11 VAL A 29 9.060 0.393 -2.948 1.00 73.24 H new ATOM 0 HG12 VAL A 29 9.424 -0.681 -1.576 1.00 73.24 H new ATOM 0 HG13 VAL A 29 8.406 0.759 -1.333 1.00 73.24 H new ATOM 0 HG21 VAL A 29 10.124 2.616 -3.114 1.00 22.21 H new ATOM 0 HG22 VAL A 29 9.537 3.099 -1.505 1.00 22.21 H new ATOM 0 HG23 VAL A 29 11.277 3.163 -1.874 1.00 22.21 H new ATOM 501 N ARG A 30 10.146 -0.961 0.975 1.00 25.50 N ATOM 502 CA ARG A 30 10.225 -2.402 1.256 1.00 23.44 C ATOM 503 C ARG A 30 9.152 -3.167 0.464 1.00 21.33 C ATOM 504 O ARG A 30 7.966 -3.116 0.797 1.00 42.34 O ATOM 505 CB ARG A 30 10.059 -2.683 2.759 1.00 61.11 C ATOM 506 CG ARG A 30 11.082 -1.969 3.638 1.00 32.31 C ATOM 507 CD ARG A 30 11.110 -2.530 5.059 1.00 70.32 C ATOM 508 NE ARG A 30 11.667 -3.883 5.101 1.00 3.14 N ATOM 509 CZ ARG A 30 11.843 -4.573 6.195 1.00 14.31 C ATOM 510 NH1 ARG A 30 11.484 -4.104 7.347 1.00 75.13 N ATOM 511 NH2 ARG A 30 12.373 -5.746 6.134 1.00 63.22 N ATOM 0 H ARG A 30 9.282 -0.521 1.291 1.00 25.50 H new ATOM 0 HA ARG A 30 11.211 -2.746 0.945 1.00 23.44 H new ATOM 0 HB2 ARG A 30 9.057 -2.382 3.066 1.00 61.11 H new ATOM 0 HB3 ARG A 30 10.135 -3.757 2.929 1.00 61.11 H new ATOM 0 HG2 ARG A 30 12.072 -2.064 3.192 1.00 32.31 H new ATOM 0 HG3 ARG A 30 10.849 -0.905 3.673 1.00 32.31 H new ATOM 0 HD2 ARG A 30 11.702 -1.874 5.697 1.00 70.32 H new ATOM 0 HD3 ARG A 30 10.098 -2.541 5.465 1.00 70.32 H new ATOM 0 HE ARG A 30 11.935 -4.315 4.217 1.00 3.14 H new ATOM 0 HH11 ARG A 30 11.056 -3.181 7.411 1.00 75.13 H new ATOM 0 HH12 ARG A 30 11.630 -4.658 8.191 1.00 75.13 H new ATOM 0 HH21 ARG A 30 12.654 -6.133 5.233 1.00 63.22 H new ATOM 0 HH22 ARG A 30 12.512 -6.288 6.987 1.00 63.22 H new ATOM 525 N THR A 31 9.566 -3.862 -0.594 1.00 35.10 N ATOM 526 CA THR A 31 8.627 -4.609 -1.446 1.00 51.13 C ATOM 527 C THR A 31 8.233 -5.957 -0.828 1.00 3.05 C ATOM 528 O THR A 31 9.088 -6.804 -0.552 1.00 4.43 O ATOM 529 CB THR A 31 9.206 -4.867 -2.858 1.00 5.11 C ATOM 530 OG1 THR A 31 10.420 -5.638 -2.776 1.00 3.43 O ATOM 531 CG2 THR A 31 9.479 -3.554 -3.586 1.00 53.32 C ATOM 0 H THR A 31 10.541 -3.927 -0.886 1.00 35.10 H new ATOM 0 HA THR A 31 7.741 -3.979 -1.527 1.00 51.13 H new ATOM 0 HB THR A 31 8.463 -5.431 -3.422 1.00 5.11 H new ATOM 0 HG1 THR A 31 10.376 -6.237 -2.001 1.00 3.43 H new ATOM 0 HG21 THR A 31 9.885 -3.764 -4.575 1.00 53.32 H new ATOM 0 HG22 THR A 31 8.549 -2.994 -3.687 1.00 53.32 H new ATOM 0 HG23 THR A 31 10.198 -2.965 -3.016 1.00 53.32 H new ATOM 539 N VAL A 32 6.933 -6.147 -0.626 1.00 4.43 N ATOM 540 CA VAL A 32 6.395 -7.396 -0.075 1.00 30.44 C ATOM 541 C VAL A 32 5.654 -8.208 -1.148 1.00 30.13 C ATOM 542 O VAL A 32 4.846 -7.671 -1.906 1.00 33.53 O ATOM 543 CB VAL A 32 5.422 -7.108 1.101 1.00 22.12 C ATOM 544 CG1 VAL A 32 4.731 -8.387 1.576 1.00 42.21 C ATOM 545 CG2 VAL A 32 6.158 -6.429 2.256 1.00 25.14 C ATOM 0 H VAL A 32 6.222 -5.446 -0.837 1.00 4.43 H new ATOM 0 HA VAL A 32 7.243 -7.977 0.287 1.00 30.44 H new ATOM 0 HB VAL A 32 4.651 -6.429 0.738 1.00 22.12 H new ATOM 0 HG11 VAL A 32 4.057 -8.152 2.400 1.00 42.21 H new ATOM 0 HG12 VAL A 32 4.162 -8.820 0.753 1.00 42.21 H new ATOM 0 HG13 VAL A 32 5.481 -9.102 1.914 1.00 42.21 H new ATOM 0 HG21 VAL A 32 5.459 -6.236 3.070 1.00 25.14 H new ATOM 0 HG22 VAL A 32 6.957 -7.080 2.611 1.00 25.14 H new ATOM 0 HG23 VAL A 32 6.584 -5.486 1.912 1.00 25.14 H new ATOM 555 N ARG A 33 5.940 -9.506 -1.200 1.00 52.53 N ATOM 556 CA ARG A 33 5.237 -10.431 -2.097 1.00 60.31 C ATOM 557 C ARG A 33 4.730 -11.645 -1.297 1.00 32.12 C ATOM 558 O ARG A 33 3.635 -12.161 -1.539 1.00 31.41 O ATOM 559 CB ARG A 33 6.180 -10.881 -3.228 1.00 13.45 C ATOM 560 CG ARG A 33 5.480 -11.589 -4.382 1.00 74.22 C ATOM 561 CD ARG A 33 4.521 -10.655 -5.110 1.00 3.54 C ATOM 562 NE ARG A 33 3.926 -11.280 -6.287 1.00 71.31 N ATOM 563 CZ ARG A 33 2.921 -10.785 -6.951 1.00 54.01 C ATOM 564 NH1 ARG A 33 2.342 -9.697 -6.559 1.00 32.41 N ATOM 565 NH2 ARG A 33 2.479 -11.399 -7.995 1.00 21.41 N ATOM 0 H ARG A 33 6.659 -9.948 -0.628 1.00 52.53 H new ATOM 0 HA ARG A 33 4.381 -9.925 -2.542 1.00 60.31 H new ATOM 0 HB2 ARG A 33 6.705 -10.008 -3.617 1.00 13.45 H new ATOM 0 HB3 ARG A 33 6.935 -11.548 -2.812 1.00 13.45 H new ATOM 0 HG2 ARG A 33 6.224 -11.967 -5.083 1.00 74.22 H new ATOM 0 HG3 ARG A 33 4.932 -12.451 -4.003 1.00 74.22 H new ATOM 0 HD2 ARG A 33 3.730 -10.345 -4.427 1.00 3.54 H new ATOM 0 HD3 ARG A 33 5.054 -9.753 -5.411 1.00 3.54 H new ATOM 0 HE ARG A 33 4.323 -12.162 -6.611 1.00 71.31 H new ATOM 0 HH11 ARG A 33 2.672 -9.217 -5.722 1.00 32.41 H new ATOM 0 HH12 ARG A 33 1.556 -9.319 -7.087 1.00 32.41 H new ATOM 0 HH21 ARG A 33 2.916 -12.269 -8.298 1.00 21.41 H new ATOM 0 HH22 ARG A 33 1.692 -11.015 -8.518 1.00 21.41 H new ATOM 579 N SER A 34 5.542 -12.081 -0.335 1.00 1.20 N ATOM 580 CA SER A 34 5.185 -13.182 0.572 1.00 1.13 C ATOM 581 C SER A 34 4.806 -12.639 1.961 1.00 12.10 C ATOM 582 O SER A 34 5.403 -11.667 2.434 1.00 14.12 O ATOM 583 CB SER A 34 6.369 -14.155 0.710 1.00 13.54 C ATOM 584 OG SER A 34 6.827 -14.596 -0.560 1.00 4.44 O ATOM 0 H SER A 34 6.465 -11.685 -0.159 1.00 1.20 H new ATOM 0 HA SER A 34 4.327 -13.707 0.152 1.00 1.13 H new ATOM 0 HB2 SER A 34 7.184 -13.665 1.243 1.00 13.54 H new ATOM 0 HB3 SER A 34 6.068 -15.015 1.309 1.00 13.54 H new ATOM 0 HG SER A 34 7.580 -15.211 -0.440 1.00 4.44 H new ATOM 590 N PRO A 35 3.818 -13.256 2.643 1.00 4.21 N ATOM 591 CA PRO A 35 3.386 -12.827 3.990 1.00 61.50 C ATOM 592 C PRO A 35 4.548 -12.683 4.989 1.00 13.55 C ATOM 593 O PRO A 35 4.522 -11.816 5.866 1.00 42.44 O ATOM 594 CB PRO A 35 2.413 -13.940 4.439 1.00 20.31 C ATOM 595 CG PRO A 35 2.575 -15.049 3.446 1.00 63.41 C ATOM 596 CD PRO A 35 3.033 -14.406 2.166 1.00 25.44 C ATOM 0 HA PRO A 35 2.935 -11.835 3.959 1.00 61.50 H new ATOM 0 HB2 PRO A 35 2.647 -14.281 5.447 1.00 20.31 H new ATOM 0 HB3 PRO A 35 1.385 -13.577 4.456 1.00 20.31 H new ATOM 0 HG2 PRO A 35 3.303 -15.781 3.796 1.00 63.41 H new ATOM 0 HG3 PRO A 35 1.635 -15.580 3.299 1.00 63.41 H new ATOM 0 HD2 PRO A 35 3.636 -15.086 1.565 1.00 25.44 H new ATOM 0 HD3 PRO A 35 2.192 -14.093 1.547 1.00 25.44 H new ATOM 604 N GLN A 36 5.564 -13.533 4.840 1.00 42.14 N ATOM 605 CA GLN A 36 6.758 -13.501 5.697 1.00 62.55 C ATOM 606 C GLN A 36 7.430 -12.113 5.690 1.00 71.13 C ATOM 607 O GLN A 36 7.952 -11.653 6.707 1.00 31.31 O ATOM 608 CB GLN A 36 7.753 -14.566 5.216 1.00 3.15 C ATOM 609 CG GLN A 36 8.962 -14.763 6.122 1.00 14.41 C ATOM 610 CD GLN A 36 8.594 -15.335 7.483 1.00 45.40 C ATOM 611 OE1 GLN A 36 8.358 -14.607 8.441 1.00 4.21 O ATOM 612 NE2 GLN A 36 8.523 -16.646 7.578 1.00 14.41 N ATOM 0 H GLN A 36 5.587 -14.261 4.126 1.00 42.14 H new ATOM 0 HA GLN A 36 6.449 -13.711 6.721 1.00 62.55 H new ATOM 0 HB2 GLN A 36 7.229 -15.517 5.121 1.00 3.15 H new ATOM 0 HB3 GLN A 36 8.103 -14.294 4.220 1.00 3.15 H new ATOM 0 HG2 GLN A 36 9.672 -15.430 5.633 1.00 14.41 H new ATOM 0 HG3 GLN A 36 9.466 -13.807 6.260 1.00 14.41 H new ATOM 0 HE21 GLN A 36 8.725 -17.228 6.765 1.00 14.41 H new ATOM 0 HE22 GLN A 36 8.266 -17.080 8.465 1.00 14.41 H new ATOM 621 N GLU A 37 7.416 -11.455 4.535 1.00 34.54 N ATOM 622 CA GLU A 37 8.014 -10.121 4.385 1.00 41.43 C ATOM 623 C GLU A 37 7.224 -9.060 5.165 1.00 12.30 C ATOM 624 O GLU A 37 7.794 -8.286 5.936 1.00 53.11 O ATOM 625 CB GLU A 37 8.065 -9.735 2.902 1.00 42.22 C ATOM 626 CG GLU A 37 8.753 -10.762 2.014 1.00 33.22 C ATOM 627 CD GLU A 37 10.224 -10.941 2.344 1.00 3.43 C ATOM 628 OE1 GLU A 37 11.049 -10.156 1.832 1.00 21.21 O ATOM 629 OE2 GLU A 37 10.559 -11.867 3.110 1.00 33.11 O ATOM 0 H GLU A 37 6.996 -11.822 3.681 1.00 34.54 H new ATOM 0 HA GLU A 37 9.025 -10.161 4.791 1.00 41.43 H new ATOM 0 HB2 GLU A 37 7.047 -9.584 2.542 1.00 42.22 H new ATOM 0 HB3 GLU A 37 8.583 -8.781 2.804 1.00 42.22 H new ATOM 0 HG2 GLU A 37 8.244 -11.721 2.115 1.00 33.22 H new ATOM 0 HG3 GLU A 37 8.654 -10.457 0.972 1.00 33.22 H new ATOM 636 N LEU A 38 5.906 -9.026 4.949 1.00 61.52 N ATOM 637 CA LEU A 38 5.024 -8.079 5.648 1.00 63.15 C ATOM 638 C LEU A 38 5.130 -8.254 7.169 1.00 61.32 C ATOM 639 O LEU A 38 5.248 -7.281 7.917 1.00 2.14 O ATOM 640 CB LEU A 38 3.570 -8.284 5.193 1.00 70.24 C ATOM 641 CG LEU A 38 2.534 -7.343 5.831 1.00 43.15 C ATOM 642 CD1 LEU A 38 2.842 -5.887 5.489 1.00 52.01 C ATOM 643 CD2 LEU A 38 1.120 -7.718 5.386 1.00 40.55 C ATOM 0 H LEU A 38 5.423 -9.643 4.296 1.00 61.52 H new ATOM 0 HA LEU A 38 5.339 -7.066 5.398 1.00 63.15 H new ATOM 0 HB2 LEU A 38 3.527 -8.162 4.111 1.00 70.24 H new ATOM 0 HB3 LEU A 38 3.282 -9.313 5.410 1.00 70.24 H new ATOM 0 HG LEU A 38 2.592 -7.455 6.914 1.00 43.15 H new ATOM 0 HD11 LEU A 38 2.097 -5.239 5.951 1.00 52.01 H new ATOM 0 HD12 LEU A 38 3.832 -5.627 5.865 1.00 52.01 H new ATOM 0 HD13 LEU A 38 2.818 -5.754 4.407 1.00 52.01 H new ATOM 0 HD21 LEU A 38 0.402 -7.041 5.848 1.00 40.55 H new ATOM 0 HD22 LEU A 38 1.047 -7.639 4.301 1.00 40.55 H new ATOM 0 HD23 LEU A 38 0.902 -8.741 5.691 1.00 40.55 H new ATOM 655 N LYS A 39 5.093 -9.511 7.607 1.00 24.45 N ATOM 656 CA LYS A 39 5.252 -9.867 9.020 1.00 62.52 C ATOM 657 C LYS A 39 6.516 -9.232 9.628 1.00 14.20 C ATOM 658 O LYS A 39 6.433 -8.405 10.545 1.00 41.22 O ATOM 659 CB LYS A 39 5.315 -11.397 9.147 1.00 33.22 C ATOM 660 CG LYS A 39 5.796 -11.893 10.507 1.00 2.44 C ATOM 661 CD LYS A 39 6.025 -13.400 10.504 1.00 33.02 C ATOM 662 CE LYS A 39 6.868 -13.844 11.693 1.00 0.14 C ATOM 663 NZ LYS A 39 8.195 -13.167 11.712 1.00 24.13 N ATOM 0 H LYS A 39 4.952 -10.314 6.994 1.00 24.45 H new ATOM 0 HA LYS A 39 4.396 -9.480 9.573 1.00 62.52 H new ATOM 0 HB2 LYS A 39 4.324 -11.807 8.953 1.00 33.22 H new ATOM 0 HB3 LYS A 39 5.978 -11.787 8.375 1.00 33.22 H new ATOM 0 HG2 LYS A 39 6.722 -11.384 10.774 1.00 2.44 H new ATOM 0 HG3 LYS A 39 5.060 -11.637 11.270 1.00 2.44 H new ATOM 0 HD2 LYS A 39 5.064 -13.914 10.527 1.00 33.02 H new ATOM 0 HD3 LYS A 39 6.520 -13.691 9.578 1.00 33.02 H new ATOM 0 HE2 LYS A 39 6.335 -13.626 12.618 1.00 0.14 H new ATOM 0 HE3 LYS A 39 7.011 -14.924 11.654 1.00 0.14 H new ATOM 0 HZ1 LYS A 39 8.925 -13.843 12.013 1.00 24.13 H new ATOM 0 HZ2 LYS A 39 8.420 -12.816 10.759 1.00 24.13 H new ATOM 0 HZ3 LYS A 39 8.168 -12.368 12.377 1.00 24.13 H new ATOM 677 N ASP A 40 7.678 -9.615 9.105 1.00 0.04 N ATOM 678 CA ASP A 40 8.960 -9.117 9.607 1.00 14.22 C ATOM 679 C ASP A 40 9.085 -7.592 9.491 1.00 74.30 C ATOM 680 O ASP A 40 9.577 -6.934 10.408 1.00 43.34 O ATOM 681 CB ASP A 40 10.110 -9.813 8.877 1.00 1.24 C ATOM 682 CG ASP A 40 10.400 -11.185 9.456 1.00 52.43 C ATOM 683 OD1 ASP A 40 9.456 -11.980 9.620 1.00 71.41 O ATOM 684 OD2 ASP A 40 11.576 -11.467 9.774 1.00 3.22 O ATOM 0 H ASP A 40 7.760 -10.272 8.329 1.00 0.04 H new ATOM 0 HA ASP A 40 9.010 -9.353 10.670 1.00 14.22 H new ATOM 0 HB2 ASP A 40 9.863 -9.910 7.820 1.00 1.24 H new ATOM 0 HB3 ASP A 40 11.006 -9.196 8.940 1.00 1.24 H new ATOM 689 N SER A 41 8.626 -7.031 8.379 1.00 15.00 N ATOM 690 CA SER A 41 8.697 -5.578 8.168 1.00 71.44 C ATOM 691 C SER A 41 8.051 -4.807 9.326 1.00 72.33 C ATOM 692 O SER A 41 8.620 -3.845 9.840 1.00 61.33 O ATOM 693 CB SER A 41 8.026 -5.181 6.847 1.00 41.32 C ATOM 694 OG SER A 41 8.117 -3.781 6.623 1.00 34.11 O ATOM 0 H SER A 41 8.202 -7.550 7.610 1.00 15.00 H new ATOM 0 HA SER A 41 9.754 -5.314 8.125 1.00 71.44 H new ATOM 0 HB2 SER A 41 8.498 -5.715 6.022 1.00 41.32 H new ATOM 0 HB3 SER A 41 6.978 -5.482 6.864 1.00 41.32 H new ATOM 0 HG SER A 41 7.683 -3.557 5.774 1.00 34.11 H new ATOM 863 N ALA A 51 11.872 6.962 8.100 1.00 33.04 N ATOM 864 CA ALA A 51 11.776 7.187 6.644 1.00 51.23 C ATOM 865 C ALA A 51 11.605 5.886 5.831 1.00 64.44 C ATOM 866 O ALA A 51 12.155 5.752 4.737 1.00 13.25 O ATOM 867 CB ALA A 51 13.008 7.954 6.166 1.00 73.22 C ATOM 0 HA ALA A 51 10.873 7.772 6.470 1.00 51.23 H new ATOM 0 HB1 ALA A 51 12.938 8.121 5.091 1.00 73.22 H new ATOM 0 HB2 ALA A 51 13.061 8.914 6.679 1.00 73.22 H new ATOM 0 HB3 ALA A 51 13.905 7.375 6.386 1.00 73.22 H new ATOM 873 N THR A 52 10.823 4.944 6.348 1.00 62.42 N ATOM 874 CA THR A 52 10.628 3.646 5.679 1.00 71.10 C ATOM 875 C THR A 52 9.158 3.418 5.293 1.00 4.12 C ATOM 876 O THR A 52 8.265 3.511 6.134 1.00 25.15 O ATOM 877 CB THR A 52 11.096 2.475 6.580 1.00 22.34 C ATOM 878 OG1 THR A 52 12.469 2.659 6.960 1.00 15.20 O ATOM 879 CG2 THR A 52 10.948 1.132 5.864 1.00 54.03 C ATOM 0 H THR A 52 10.312 5.047 7.225 1.00 62.42 H new ATOM 0 HA THR A 52 11.232 3.672 4.772 1.00 71.10 H new ATOM 0 HB THR A 52 10.465 2.469 7.469 1.00 22.34 H new ATOM 0 HG1 THR A 52 12.753 1.914 7.530 1.00 15.20 H new ATOM 0 HG21 THR A 52 11.284 0.330 6.521 1.00 54.03 H new ATOM 0 HG22 THR A 52 9.902 0.972 5.603 1.00 54.03 H new ATOM 0 HG23 THR A 52 11.552 1.135 4.957 1.00 54.03 H new ATOM 887 N ILE A 53 8.915 3.124 4.016 1.00 61.32 N ATOM 888 CA ILE A 53 7.564 2.826 3.514 1.00 65.04 C ATOM 889 C ILE A 53 7.496 1.398 2.943 1.00 34.22 C ATOM 890 O ILE A 53 8.409 0.952 2.244 1.00 62.23 O ATOM 891 CB ILE A 53 7.128 3.840 2.422 1.00 14.03 C ATOM 892 CG1 ILE A 53 7.111 5.271 2.993 1.00 31.15 C ATOM 893 CG2 ILE A 53 5.756 3.469 1.849 1.00 51.32 C ATOM 894 CD1 ILE A 53 6.658 6.327 2.004 1.00 53.35 C ATOM 0 H ILE A 53 9.641 3.084 3.300 1.00 61.32 H new ATOM 0 HA ILE A 53 6.881 2.909 4.359 1.00 65.04 H new ATOM 0 HB ILE A 53 7.854 3.801 1.610 1.00 14.03 H new ATOM 0 HG12 ILE A 53 6.453 5.296 3.862 1.00 31.15 H new ATOM 0 HG13 ILE A 53 8.112 5.523 3.344 1.00 31.15 H new ATOM 0 HG21 ILE A 53 5.472 4.194 1.086 1.00 51.32 H new ATOM 0 HG22 ILE A 53 5.804 2.475 1.405 1.00 51.32 H new ATOM 0 HG23 ILE A 53 5.015 3.474 2.648 1.00 51.32 H new ATOM 0 HD11 ILE A 53 6.674 7.306 2.484 1.00 53.35 H new ATOM 0 HD12 ILE A 53 7.329 6.333 1.145 1.00 53.35 H new ATOM 0 HD13 ILE A 53 5.645 6.103 1.671 1.00 53.35 H new ATOM 906 N VAL A 54 6.411 0.682 3.237 1.00 54.43 N ATOM 907 CA VAL A 54 6.261 -0.706 2.783 1.00 60.02 C ATOM 908 C VAL A 54 5.183 -0.841 1.690 1.00 1.24 C ATOM 909 O VAL A 54 4.091 -0.275 1.791 1.00 22.25 O ATOM 910 CB VAL A 54 5.937 -1.649 3.973 1.00 65.45 C ATOM 911 CG1 VAL A 54 4.598 -1.293 4.619 1.00 11.22 C ATOM 912 CG2 VAL A 54 5.971 -3.111 3.530 1.00 43.43 C ATOM 0 H VAL A 54 5.626 1.035 3.784 1.00 54.43 H new ATOM 0 HA VAL A 54 7.216 -1.003 2.349 1.00 60.02 H new ATOM 0 HB VAL A 54 6.708 -1.510 4.731 1.00 65.45 H new ATOM 0 HG11 VAL A 54 4.402 -1.973 5.448 1.00 11.22 H new ATOM 0 HG12 VAL A 54 4.634 -0.269 4.990 1.00 11.22 H new ATOM 0 HG13 VAL A 54 3.802 -1.384 3.880 1.00 11.22 H new ATOM 0 HG21 VAL A 54 5.741 -3.754 4.380 1.00 43.43 H new ATOM 0 HG22 VAL A 54 5.233 -3.270 2.744 1.00 43.43 H new ATOM 0 HG23 VAL A 54 6.963 -3.353 3.150 1.00 43.43 H new ATOM 922 N VAL A 55 5.504 -1.594 0.638 1.00 22.25 N ATOM 923 CA VAL A 55 4.592 -1.790 -0.496 1.00 23.22 C ATOM 924 C VAL A 55 4.245 -3.277 -0.680 1.00 63.31 C ATOM 925 O VAL A 55 5.102 -4.084 -1.039 1.00 21.32 O ATOM 926 CB VAL A 55 5.209 -1.246 -1.813 1.00 60.40 C ATOM 927 CG1 VAL A 55 4.246 -1.430 -2.987 1.00 31.13 C ATOM 928 CG2 VAL A 55 5.601 0.223 -1.662 1.00 24.41 C ATOM 0 H VAL A 55 6.394 -2.083 0.545 1.00 22.25 H new ATOM 0 HA VAL A 55 3.681 -1.235 -0.271 1.00 23.22 H new ATOM 0 HB VAL A 55 6.111 -1.821 -2.023 1.00 60.40 H new ATOM 0 HG11 VAL A 55 4.703 -1.041 -3.897 1.00 31.13 H new ATOM 0 HG12 VAL A 55 4.028 -2.490 -3.116 1.00 31.13 H new ATOM 0 HG13 VAL A 55 3.320 -0.891 -2.786 1.00 31.13 H new ATOM 0 HG21 VAL A 55 6.031 0.583 -2.597 1.00 24.41 H new ATOM 0 HG22 VAL A 55 4.717 0.812 -1.419 1.00 24.41 H new ATOM 0 HG23 VAL A 55 6.335 0.323 -0.863 1.00 24.41 H new ATOM 938 N VAL A 56 2.987 -3.631 -0.434 1.00 1.53 N ATOM 939 CA VAL A 56 2.530 -5.020 -0.562 1.00 51.14 C ATOM 940 C VAL A 56 1.956 -5.289 -1.964 1.00 51.13 C ATOM 941 O VAL A 56 0.843 -4.868 -2.289 1.00 32.50 O ATOM 942 CB VAL A 56 1.458 -5.363 0.508 1.00 3.22 C ATOM 943 CG1 VAL A 56 1.035 -6.832 0.415 1.00 60.22 C ATOM 944 CG2 VAL A 56 1.974 -5.032 1.908 1.00 50.34 C ATOM 0 H VAL A 56 2.261 -2.976 -0.144 1.00 1.53 H new ATOM 0 HA VAL A 56 3.400 -5.657 -0.406 1.00 51.14 H new ATOM 0 HB VAL A 56 0.577 -4.752 0.313 1.00 3.22 H new ATOM 0 HG11 VAL A 56 0.284 -7.043 1.176 1.00 60.22 H new ATOM 0 HG12 VAL A 56 0.617 -7.028 -0.572 1.00 60.22 H new ATOM 0 HG13 VAL A 56 1.903 -7.471 0.575 1.00 60.22 H new ATOM 0 HG21 VAL A 56 1.210 -5.279 2.645 1.00 50.34 H new ATOM 0 HG22 VAL A 56 2.874 -5.612 2.111 1.00 50.34 H new ATOM 0 HG23 VAL A 56 2.206 -3.969 1.968 1.00 50.34 H new ATOM 954 N VAL A 57 2.727 -5.983 -2.795 1.00 25.11 N ATOM 955 CA VAL A 57 2.294 -6.330 -4.152 1.00 31.14 C ATOM 956 C VAL A 57 1.692 -7.743 -4.181 1.00 10.44 C ATOM 957 O VAL A 57 2.402 -8.734 -4.003 1.00 13.32 O ATOM 958 CB VAL A 57 3.472 -6.244 -5.155 1.00 70.32 C ATOM 959 CG1 VAL A 57 2.986 -6.464 -6.588 1.00 42.00 C ATOM 960 CG2 VAL A 57 4.193 -4.903 -5.019 1.00 51.14 C ATOM 0 H VAL A 57 3.660 -6.319 -2.555 1.00 25.11 H new ATOM 0 HA VAL A 57 1.532 -5.610 -4.450 1.00 31.14 H new ATOM 0 HB VAL A 57 4.182 -7.037 -4.920 1.00 70.32 H new ATOM 0 HG11 VAL A 57 3.831 -6.399 -7.273 1.00 42.00 H new ATOM 0 HG12 VAL A 57 2.528 -7.450 -6.670 1.00 42.00 H new ATOM 0 HG13 VAL A 57 2.252 -5.700 -6.844 1.00 42.00 H new ATOM 0 HG21 VAL A 57 5.017 -4.859 -5.731 1.00 51.14 H new ATOM 0 HG22 VAL A 57 3.494 -4.092 -5.223 1.00 51.14 H new ATOM 0 HG23 VAL A 57 4.582 -4.800 -4.006 1.00 51.14 H new ATOM 970 N VAL A 58 0.387 -7.834 -4.419 1.00 24.15 N ATOM 971 CA VAL A 58 -0.333 -9.114 -4.330 1.00 22.32 C ATOM 972 C VAL A 58 -0.643 -9.721 -5.713 1.00 42.44 C ATOM 973 O VAL A 58 -0.338 -9.130 -6.753 1.00 32.42 O ATOM 974 CB VAL A 58 -1.659 -8.936 -3.548 1.00 23.44 C ATOM 975 CG1 VAL A 58 -1.396 -8.357 -2.160 1.00 74.04 C ATOM 976 CG2 VAL A 58 -2.630 -8.053 -4.327 1.00 11.42 C ATOM 0 H VAL A 58 -0.200 -7.040 -4.676 1.00 24.15 H new ATOM 0 HA VAL A 58 0.328 -9.802 -3.803 1.00 22.32 H new ATOM 0 HB VAL A 58 -2.115 -9.918 -3.425 1.00 23.44 H new ATOM 0 HG11 VAL A 58 -2.341 -8.241 -1.629 1.00 74.04 H new ATOM 0 HG12 VAL A 58 -0.747 -9.031 -1.602 1.00 74.04 H new ATOM 0 HG13 VAL A 58 -0.912 -7.385 -2.257 1.00 74.04 H new ATOM 0 HG21 VAL A 58 -3.554 -7.941 -3.760 1.00 11.42 H new ATOM 0 HG22 VAL A 58 -2.182 -7.073 -4.488 1.00 11.42 H new ATOM 0 HG23 VAL A 58 -2.848 -8.514 -5.290 1.00 11.42 H new ATOM 986 N ASP A 59 -1.221 -10.927 -5.711 1.00 25.53 N ATOM 987 CA ASP A 59 -1.711 -11.572 -6.940 1.00 52.43 C ATOM 988 C ASP A 59 -3.247 -11.486 -7.039 1.00 0.12 C ATOM 989 O ASP A 59 -3.803 -11.317 -8.126 1.00 20.12 O ATOM 990 CB ASP A 59 -1.287 -13.044 -6.976 1.00 13.11 C ATOM 991 CG ASP A 59 0.216 -13.233 -7.065 1.00 24.30 C ATOM 992 OD1 ASP A 59 0.886 -13.249 -6.012 1.00 15.10 O ATOM 993 OD2 ASP A 59 0.736 -13.380 -8.191 1.00 22.54 O ATOM 0 H ASP A 59 -1.363 -11.482 -4.867 1.00 25.53 H new ATOM 0 HA ASP A 59 -1.273 -11.043 -7.787 1.00 52.43 H new ATOM 0 HB2 ASP A 59 -1.657 -13.544 -6.081 1.00 13.11 H new ATOM 0 HB3 ASP A 59 -1.759 -13.530 -7.830 1.00 13.11 H new ATOM 998 N ASP A 60 -3.921 -11.610 -5.896 1.00 23.53 N ATOM 999 CA ASP A 60 -5.390 -11.619 -5.842 1.00 21.34 C ATOM 1000 C ASP A 60 -5.924 -10.788 -4.658 1.00 62.22 C ATOM 1001 O ASP A 60 -5.159 -10.351 -3.793 1.00 43.00 O ATOM 1002 CB ASP A 60 -5.894 -13.067 -5.754 1.00 34.15 C ATOM 1003 CG ASP A 60 -5.146 -13.881 -4.710 1.00 10.20 C ATOM 1004 OD1 ASP A 60 -5.393 -13.691 -3.500 1.00 35.13 O ATOM 1005 OD2 ASP A 60 -4.302 -14.721 -5.094 1.00 25.43 O ATOM 0 H ASP A 60 -3.472 -11.707 -4.985 1.00 23.53 H new ATOM 0 HA ASP A 60 -5.766 -11.158 -6.755 1.00 21.34 H new ATOM 0 HB2 ASP A 60 -6.957 -13.064 -5.515 1.00 34.15 H new ATOM 0 HB3 ASP A 60 -5.788 -13.545 -6.728 1.00 34.15 H new ATOM 1010 N LYS A 61 -7.243 -10.573 -4.626 1.00 65.43 N ATOM 1011 CA LYS A 61 -7.875 -9.791 -3.553 1.00 11.43 C ATOM 1012 C LYS A 61 -7.858 -10.543 -2.213 1.00 2.24 C ATOM 1013 O LYS A 61 -7.874 -9.925 -1.150 1.00 31.30 O ATOM 1014 CB LYS A 61 -9.328 -9.433 -3.917 1.00 63.45 C ATOM 1015 CG LYS A 61 -9.988 -8.470 -2.924 1.00 41.41 C ATOM 1016 CD LYS A 61 -11.452 -8.183 -3.267 1.00 2.52 C ATOM 1017 CE LYS A 61 -12.366 -9.368 -2.962 1.00 44.22 C ATOM 1018 NZ LYS A 61 -12.452 -9.657 -1.502 1.00 25.44 N ATOM 0 H LYS A 61 -7.894 -10.927 -5.327 1.00 65.43 H new ATOM 0 HA LYS A 61 -7.292 -8.876 -3.444 1.00 11.43 H new ATOM 0 HB2 LYS A 61 -9.345 -8.986 -4.911 1.00 63.45 H new ATOM 0 HB3 LYS A 61 -9.917 -10.349 -3.969 1.00 63.45 H new ATOM 0 HG2 LYS A 61 -9.930 -8.892 -1.921 1.00 41.41 H new ATOM 0 HG3 LYS A 61 -9.432 -7.533 -2.908 1.00 41.41 H new ATOM 0 HD2 LYS A 61 -11.790 -7.313 -2.704 1.00 2.52 H new ATOM 0 HD3 LYS A 61 -11.531 -7.929 -4.324 1.00 2.52 H new ATOM 0 HE2 LYS A 61 -13.364 -9.163 -3.349 1.00 44.22 H new ATOM 0 HE3 LYS A 61 -11.998 -10.251 -3.484 1.00 44.22 H new ATOM 0 HZ1 LYS A 61 -13.195 -10.364 -1.331 1.00 25.44 H new ATOM 0 HZ2 LYS A 61 -11.539 -10.026 -1.167 1.00 25.44 H new ATOM 0 HZ3 LYS A 61 -12.682 -8.783 -0.988 1.00 25.44 H new ATOM 1032 N GLU A 62 -7.822 -11.874 -2.269 1.00 14.54 N ATOM 1033 CA GLU A 62 -7.857 -12.698 -1.054 1.00 24.10 C ATOM 1034 C GLU A 62 -6.646 -12.423 -0.149 1.00 54.00 C ATOM 1035 O GLU A 62 -6.800 -12.078 1.023 1.00 21.02 O ATOM 1036 CB GLU A 62 -7.916 -14.187 -1.419 1.00 61.44 C ATOM 1037 CG GLU A 62 -7.902 -15.115 -0.206 1.00 11.24 C ATOM 1038 CD GLU A 62 -7.838 -16.590 -0.571 1.00 33.41 C ATOM 1039 OE1 GLU A 62 -7.441 -16.918 -1.710 1.00 61.22 O ATOM 1040 OE2 GLU A 62 -8.159 -17.433 0.292 1.00 60.13 O ATOM 0 H GLU A 62 -7.769 -12.406 -3.138 1.00 14.54 H new ATOM 0 HA GLU A 62 -8.757 -12.430 -0.500 1.00 24.10 H new ATOM 0 HB2 GLU A 62 -8.819 -14.375 -1.999 1.00 61.44 H new ATOM 0 HB3 GLU A 62 -7.069 -14.429 -2.061 1.00 61.44 H new ATOM 0 HG2 GLU A 62 -7.046 -14.867 0.422 1.00 11.24 H new ATOM 0 HG3 GLU A 62 -8.797 -14.935 0.390 1.00 11.24 H new ATOM 1047 N TRP A 63 -5.443 -12.576 -0.694 1.00 41.55 N ATOM 1048 CA TRP A 63 -4.220 -12.247 0.049 1.00 30.21 C ATOM 1049 C TRP A 63 -4.219 -10.764 0.464 1.00 43.31 C ATOM 1050 O TRP A 63 -3.819 -10.417 1.576 1.00 63.13 O ATOM 1051 CB TRP A 63 -2.980 -12.598 -0.796 1.00 30.40 C ATOM 1052 CG TRP A 63 -1.670 -12.043 -0.283 1.00 4.32 C ATOM 1053 CD1 TRP A 63 -0.666 -11.515 -1.046 1.00 70.42 C ATOM 1054 CD2 TRP A 63 -1.219 -11.954 1.082 1.00 43.44 C ATOM 1055 NE1 TRP A 63 0.370 -11.097 -0.247 1.00 43.41 N ATOM 1056 CE2 TRP A 63 0.055 -11.352 1.060 1.00 51.23 C ATOM 1057 CE3 TRP A 63 -1.767 -12.313 2.317 1.00 14.43 C ATOM 1058 CZ2 TRP A 63 0.785 -11.108 2.218 1.00 74.54 C ATOM 1059 CZ3 TRP A 63 -1.042 -12.069 3.467 1.00 61.24 C ATOM 1060 CH2 TRP A 63 0.220 -11.468 3.411 1.00 34.12 C ATOM 0 H TRP A 63 -5.284 -12.923 -1.640 1.00 41.55 H new ATOM 0 HA TRP A 63 -4.188 -12.842 0.962 1.00 30.21 H new ATOM 0 HB2 TRP A 63 -2.897 -13.683 -0.856 1.00 30.40 H new ATOM 0 HB3 TRP A 63 -3.137 -12.233 -1.811 1.00 30.40 H new ATOM 0 HD1 TRP A 63 -0.685 -11.438 -2.123 1.00 70.42 H new ATOM 0 HE1 TRP A 63 1.234 -10.666 -0.575 1.00 43.41 H new ATOM 0 HE3 TRP A 63 -2.742 -12.774 2.371 1.00 14.43 H new ATOM 0 HZ2 TRP A 63 1.763 -10.651 2.177 1.00 74.54 H new ATOM 0 HZ3 TRP A 63 -1.456 -12.347 4.425 1.00 61.24 H new ATOM 0 HH2 TRP A 63 0.759 -11.284 4.328 1.00 34.12 H new ATOM 1071 N ALA A 64 -4.703 -9.898 -0.421 1.00 24.13 N ATOM 1072 CA ALA A 64 -4.790 -8.466 -0.126 1.00 1.23 C ATOM 1073 C ALA A 64 -5.666 -8.185 1.113 1.00 63.23 C ATOM 1074 O ALA A 64 -5.272 -7.437 2.011 1.00 42.21 O ATOM 1075 CB ALA A 64 -5.323 -7.714 -1.340 1.00 70.54 C ATOM 0 H ALA A 64 -5.041 -10.159 -1.347 1.00 24.13 H new ATOM 0 HA ALA A 64 -3.785 -8.112 0.102 1.00 1.23 H new ATOM 0 HB1 ALA A 64 -5.384 -6.650 -1.111 1.00 70.54 H new ATOM 0 HB2 ALA A 64 -4.652 -7.865 -2.185 1.00 70.54 H new ATOM 0 HB3 ALA A 64 -6.315 -8.088 -1.593 1.00 70.54 H new ATOM 1081 N GLU A 65 -6.850 -8.798 1.165 1.00 74.32 N ATOM 1082 CA GLU A 65 -7.775 -8.593 2.287 1.00 10.45 C ATOM 1083 C GLU A 65 -7.270 -9.281 3.567 1.00 20.52 C ATOM 1084 O GLU A 65 -7.463 -8.768 4.674 1.00 73.35 O ATOM 1085 CB GLU A 65 -9.190 -9.082 1.927 1.00 70.31 C ATOM 1086 CG GLU A 65 -9.314 -10.589 1.731 1.00 31.21 C ATOM 1087 CD GLU A 65 -10.724 -11.017 1.353 1.00 31.04 C ATOM 1088 OE1 GLU A 65 -11.541 -11.268 2.267 1.00 33.13 O ATOM 1089 OE2 GLU A 65 -11.028 -11.096 0.145 1.00 22.24 O ATOM 0 H GLU A 65 -7.192 -9.438 0.448 1.00 74.32 H new ATOM 0 HA GLU A 65 -7.821 -7.522 2.483 1.00 10.45 H new ATOM 0 HB2 GLU A 65 -9.877 -8.774 2.715 1.00 70.31 H new ATOM 0 HB3 GLU A 65 -9.510 -8.583 1.012 1.00 70.31 H new ATOM 0 HG2 GLU A 65 -8.621 -10.908 0.953 1.00 31.21 H new ATOM 0 HG3 GLU A 65 -9.018 -11.096 2.649 1.00 31.21 H new ATOM 1096 N LYS A 66 -6.612 -10.432 3.414 1.00 72.25 N ATOM 1097 CA LYS A 66 -5.973 -11.117 4.546 1.00 73.13 C ATOM 1098 C LYS A 66 -4.866 -10.246 5.159 1.00 42.12 C ATOM 1099 O LYS A 66 -4.704 -10.196 6.380 1.00 13.31 O ATOM 1100 CB LYS A 66 -5.402 -12.473 4.107 1.00 34.24 C ATOM 1101 CG LYS A 66 -6.472 -13.521 3.797 1.00 43.02 C ATOM 1102 CD LYS A 66 -5.860 -14.821 3.282 1.00 52.32 C ATOM 1103 CE LYS A 66 -6.918 -15.897 3.055 1.00 1.24 C ATOM 1104 NZ LYS A 66 -6.351 -17.097 2.382 1.00 23.41 N ATOM 0 H LYS A 66 -6.506 -10.911 2.520 1.00 72.25 H new ATOM 0 HA LYS A 66 -6.734 -11.291 5.307 1.00 73.13 H new ATOM 0 HB2 LYS A 66 -4.783 -12.327 3.222 1.00 34.24 H new ATOM 0 HB3 LYS A 66 -4.750 -12.854 4.893 1.00 34.24 H new ATOM 0 HG2 LYS A 66 -7.053 -13.724 4.697 1.00 43.02 H new ATOM 0 HG3 LYS A 66 -7.164 -13.125 3.053 1.00 43.02 H new ATOM 0 HD2 LYS A 66 -5.332 -14.629 2.348 1.00 52.32 H new ATOM 0 HD3 LYS A 66 -5.122 -15.183 3.997 1.00 52.32 H new ATOM 0 HE2 LYS A 66 -7.352 -16.188 4.012 1.00 1.24 H new ATOM 0 HE3 LYS A 66 -7.727 -15.489 2.449 1.00 1.24 H new ATOM 0 HZ1 LYS A 66 -7.029 -17.453 1.679 1.00 23.41 H new ATOM 0 HZ2 LYS A 66 -5.462 -16.841 1.907 1.00 23.41 H new ATOM 0 HZ3 LYS A 66 -6.165 -17.836 3.089 1.00 23.41 H new ATOM 1118 N ALA A 67 -4.112 -9.552 4.304 1.00 11.02 N ATOM 1119 CA ALA A 67 -3.106 -8.593 4.767 1.00 4.31 C ATOM 1120 C ALA A 67 -3.751 -7.501 5.637 1.00 20.32 C ATOM 1121 O ALA A 67 -3.229 -7.136 6.691 1.00 41.20 O ATOM 1122 CB ALA A 67 -2.384 -7.972 3.575 1.00 65.05 C ATOM 0 H ALA A 67 -4.178 -9.636 3.290 1.00 11.02 H new ATOM 0 HA ALA A 67 -2.378 -9.125 5.379 1.00 4.31 H new ATOM 0 HB1 ALA A 67 -1.639 -7.261 3.931 1.00 65.05 H new ATOM 0 HB2 ALA A 67 -1.892 -8.756 2.999 1.00 65.05 H new ATOM 0 HB3 ALA A 67 -3.105 -7.455 2.942 1.00 65.05 H new ATOM 1128 N ILE A 68 -4.905 -6.998 5.190 1.00 35.14 N ATOM 1129 CA ILE A 68 -5.667 -6.000 5.950 1.00 32.05 C ATOM 1130 C ILE A 68 -6.128 -6.564 7.310 1.00 70.55 C ATOM 1131 O ILE A 68 -6.168 -5.847 8.311 1.00 21.25 O ATOM 1132 CB ILE A 68 -6.900 -5.501 5.148 1.00 34.43 C ATOM 1133 CG1 ILE A 68 -6.459 -4.928 3.786 1.00 2.43 C ATOM 1134 CG2 ILE A 68 -7.688 -4.455 5.943 1.00 3.23 C ATOM 1135 CD1 ILE A 68 -5.462 -3.791 3.887 1.00 73.02 C ATOM 0 H ILE A 68 -5.334 -7.265 4.304 1.00 35.14 H new ATOM 0 HA ILE A 68 -4.999 -5.157 6.128 1.00 32.05 H new ATOM 0 HB ILE A 68 -7.557 -6.353 4.971 1.00 34.43 H new ATOM 0 HG12 ILE A 68 -6.021 -5.730 3.191 1.00 2.43 H new ATOM 0 HG13 ILE A 68 -7.340 -4.578 3.249 1.00 2.43 H new ATOM 0 HG21 ILE A 68 -8.546 -4.123 5.358 1.00 3.23 H new ATOM 0 HG22 ILE A 68 -8.035 -4.894 6.878 1.00 3.23 H new ATOM 0 HG23 ILE A 68 -7.045 -3.602 6.160 1.00 3.23 H new ATOM 0 HD11 ILE A 68 -5.203 -3.444 2.887 1.00 73.02 H new ATOM 0 HD12 ILE A 68 -5.902 -2.970 4.453 1.00 73.02 H new ATOM 0 HD13 ILE A 68 -4.563 -4.140 4.394 1.00 73.02 H new ATOM 1147 N ARG A 69 -6.463 -7.857 7.344 1.00 1.20 N ATOM 1148 CA ARG A 69 -6.849 -8.519 8.599 1.00 70.22 C ATOM 1149 C ARG A 69 -5.665 -8.557 9.580 1.00 74.53 C ATOM 1150 O ARG A 69 -5.831 -8.360 10.789 1.00 52.43 O ATOM 1151 CB ARG A 69 -7.356 -9.948 8.337 1.00 34.52 C ATOM 1152 CG ARG A 69 -8.450 -10.032 7.279 1.00 50.21 C ATOM 1153 CD ARG A 69 -9.167 -11.377 7.292 1.00 43.33 C ATOM 1154 NE ARG A 69 -9.902 -11.579 8.539 1.00 62.33 N ATOM 1155 CZ ARG A 69 -11.205 -11.642 8.621 1.00 41.22 C ATOM 1156 NH1 ARG A 69 -11.939 -11.556 7.557 1.00 74.14 N ATOM 1157 NH2 ARG A 69 -11.768 -11.807 9.770 1.00 40.31 N ATOM 0 H ARG A 69 -6.476 -8.465 6.525 1.00 1.20 H new ATOM 0 HA ARG A 69 -7.658 -7.940 9.043 1.00 70.22 H new ATOM 0 HB2 ARG A 69 -6.516 -10.570 8.027 1.00 34.52 H new ATOM 0 HB3 ARG A 69 -7.734 -10.365 9.270 1.00 34.52 H new ATOM 0 HG2 ARG A 69 -9.175 -9.235 7.445 1.00 50.21 H new ATOM 0 HG3 ARG A 69 -8.013 -9.865 6.294 1.00 50.21 H new ATOM 0 HD2 ARG A 69 -9.856 -11.432 6.449 1.00 43.33 H new ATOM 0 HD3 ARG A 69 -8.441 -12.179 7.162 1.00 43.33 H new ATOM 0 HE ARG A 69 -9.364 -11.677 9.400 1.00 62.33 H new ATOM 0 HH11 ARG A 69 -11.501 -11.438 6.643 1.00 74.14 H new ATOM 0 HH12 ARG A 69 -12.955 -11.606 7.633 1.00 74.14 H new ATOM 0 HH21 ARG A 69 -11.197 -11.888 10.611 1.00 40.31 H new ATOM 0 HH22 ARG A 69 -12.785 -11.857 9.837 1.00 40.31 H new ATOM 1171 N PHE A 70 -4.470 -8.807 9.046 1.00 31.11 N ATOM 1172 CA PHE A 70 -3.240 -8.791 9.844 1.00 43.11 C ATOM 1173 C PHE A 70 -2.998 -7.392 10.438 1.00 54.31 C ATOM 1174 O PHE A 70 -2.662 -7.252 11.614 1.00 53.51 O ATOM 1175 CB PHE A 70 -2.044 -9.219 8.979 1.00 61.20 C ATOM 1176 CG PHE A 70 -0.765 -9.439 9.756 1.00 41.54 C ATOM 1177 CD1 PHE A 70 -0.465 -10.687 10.287 1.00 45.54 C ATOM 1178 CD2 PHE A 70 0.137 -8.400 9.952 1.00 42.41 C ATOM 1179 CE1 PHE A 70 0.705 -10.894 10.993 1.00 42.14 C ATOM 1180 CE2 PHE A 70 1.308 -8.604 10.660 1.00 52.44 C ATOM 1181 CZ PHE A 70 1.591 -9.851 11.179 1.00 24.45 C ATOM 0 H PHE A 70 -4.325 -9.024 8.060 1.00 31.11 H new ATOM 0 HA PHE A 70 -3.350 -9.498 10.667 1.00 43.11 H new ATOM 0 HB2 PHE A 70 -2.300 -10.139 8.454 1.00 61.20 H new ATOM 0 HB3 PHE A 70 -1.868 -8.457 8.219 1.00 61.20 H new ATOM 0 HD1 PHE A 70 -1.155 -11.506 10.146 1.00 45.54 H new ATOM 0 HD2 PHE A 70 -0.079 -7.422 9.547 1.00 42.41 H new ATOM 0 HE1 PHE A 70 0.926 -11.870 11.399 1.00 42.14 H new ATOM 0 HE2 PHE A 70 2.000 -7.788 10.806 1.00 52.44 H new ATOM 0 HZ PHE A 70 2.505 -10.011 11.731 1.00 24.45 H new ATOM 1191 N VAL A 71 -3.184 -6.359 9.614 1.00 41.13 N ATOM 1192 CA VAL A 71 -3.070 -4.967 10.072 1.00 0.52 C ATOM 1193 C VAL A 71 -4.105 -4.653 11.167 1.00 22.42 C ATOM 1194 O VAL A 71 -3.793 -4.010 12.170 1.00 32.13 O ATOM 1195 CB VAL A 71 -3.249 -3.967 8.898 1.00 42.43 C ATOM 1196 CG1 VAL A 71 -3.144 -2.524 9.389 1.00 60.52 C ATOM 1197 CG2 VAL A 71 -2.228 -4.241 7.795 1.00 24.51 C ATOM 0 H VAL A 71 -3.414 -6.457 8.625 1.00 41.13 H new ATOM 0 HA VAL A 71 -2.068 -4.852 10.485 1.00 0.52 H new ATOM 0 HB VAL A 71 -4.246 -4.109 8.482 1.00 42.43 H new ATOM 0 HG11 VAL A 71 -3.273 -1.843 8.548 1.00 60.52 H new ATOM 0 HG12 VAL A 71 -3.920 -2.335 10.131 1.00 60.52 H new ATOM 0 HG13 VAL A 71 -2.164 -2.363 9.839 1.00 60.52 H new ATOM 0 HG21 VAL A 71 -2.371 -3.529 6.982 1.00 24.51 H new ATOM 0 HG22 VAL A 71 -1.221 -4.135 8.197 1.00 24.51 H new ATOM 0 HG23 VAL A 71 -2.363 -5.255 7.418 1.00 24.51 H new ATOM 1207 N LYS A 72 -5.337 -5.120 10.967 1.00 3.50 N ATOM 1208 CA LYS A 72 -6.404 -4.943 11.960 1.00 63.32 C ATOM 1209 C LYS A 72 -6.009 -5.602 13.295 1.00 71.42 C ATOM 1210 O LYS A 72 -6.301 -5.081 14.373 1.00 64.32 O ATOM 1211 CB LYS A 72 -7.726 -5.529 11.417 1.00 2.24 C ATOM 1212 CG LYS A 72 -8.989 -5.101 12.176 1.00 64.34 C ATOM 1213 CD LYS A 72 -9.166 -5.843 13.502 1.00 42.44 C ATOM 1214 CE LYS A 72 -10.391 -5.356 14.271 1.00 35.11 C ATOM 1215 NZ LYS A 72 -10.323 -3.900 14.560 1.00 43.14 N ATOM 0 H LYS A 72 -5.624 -5.624 10.128 1.00 3.50 H new ATOM 0 HA LYS A 72 -6.550 -3.879 12.145 1.00 63.32 H new ATOM 0 HB2 LYS A 72 -7.833 -5.237 10.372 1.00 2.24 H new ATOM 0 HB3 LYS A 72 -7.659 -6.617 11.439 1.00 2.24 H new ATOM 0 HG2 LYS A 72 -8.946 -4.029 12.368 1.00 64.34 H new ATOM 0 HG3 LYS A 72 -9.862 -5.277 11.547 1.00 64.34 H new ATOM 0 HD2 LYS A 72 -9.260 -6.912 13.310 1.00 42.44 H new ATOM 0 HD3 LYS A 72 -8.275 -5.707 14.115 1.00 42.44 H new ATOM 0 HE2 LYS A 72 -11.290 -5.570 13.693 1.00 35.11 H new ATOM 0 HE3 LYS A 72 -10.475 -5.908 15.207 1.00 35.11 H new ATOM 0 HZ1 LYS A 72 -11.037 -3.654 15.275 1.00 43.14 H new ATOM 0 HZ2 LYS A 72 -9.377 -3.661 14.920 1.00 43.14 H new ATOM 0 HZ3 LYS A 72 -10.507 -3.364 13.688 1.00 43.14 H new ATOM 1229 N SER A 73 -5.320 -6.740 13.212 1.00 40.31 N ATOM 1230 CA SER A 73 -4.852 -7.463 14.408 1.00 54.54 C ATOM 1231 C SER A 73 -3.874 -6.614 15.239 1.00 33.13 C ATOM 1232 O SER A 73 -3.701 -6.841 16.439 1.00 31.04 O ATOM 1233 CB SER A 73 -4.179 -8.785 14.004 1.00 51.41 C ATOM 1234 OG SER A 73 -5.083 -9.637 13.307 1.00 65.32 O ATOM 0 H SER A 73 -5.070 -7.187 12.330 1.00 40.31 H new ATOM 0 HA SER A 73 -5.725 -7.674 15.025 1.00 54.54 H new ATOM 0 HB2 SER A 73 -3.314 -8.577 13.374 1.00 51.41 H new ATOM 0 HB3 SER A 73 -3.810 -9.294 14.894 1.00 51.41 H new ATOM 0 HG SER A 73 -5.354 -9.210 12.468 1.00 65.32 H new ATOM 1240 N LEU A 74 -3.239 -5.637 14.596 1.00 21.33 N ATOM 1241 CA LEU A 74 -2.303 -4.733 15.278 1.00 24.51 C ATOM 1242 C LEU A 74 -3.044 -3.738 16.189 1.00 60.21 C ATOM 1243 O LEU A 74 -2.585 -3.419 17.287 1.00 33.41 O ATOM 1244 CB LEU A 74 -1.466 -3.965 14.246 1.00 22.01 C ATOM 1245 CG LEU A 74 -0.664 -4.838 13.264 1.00 10.23 C ATOM 1246 CD1 LEU A 74 0.030 -3.968 12.216 1.00 43.12 C ATOM 1247 CD2 LEU A 74 0.349 -5.704 14.013 1.00 64.11 C ATOM 0 H LEU A 74 -3.353 -5.447 13.600 1.00 21.33 H new ATOM 0 HA LEU A 74 -1.647 -5.341 15.901 1.00 24.51 H new ATOM 0 HB2 LEU A 74 -2.131 -3.320 13.672 1.00 22.01 H new ATOM 0 HB3 LEU A 74 -0.772 -3.315 14.778 1.00 22.01 H new ATOM 0 HG LEU A 74 -1.358 -5.502 12.749 1.00 10.23 H new ATOM 0 HD11 LEU A 74 0.592 -4.603 11.531 1.00 43.12 H new ATOM 0 HD12 LEU A 74 -0.718 -3.404 11.658 1.00 43.12 H new ATOM 0 HD13 LEU A 74 0.711 -3.276 12.711 1.00 43.12 H new ATOM 0 HD21 LEU A 74 0.905 -6.313 13.300 1.00 64.11 H new ATOM 0 HD22 LEU A 74 1.041 -5.064 14.560 1.00 64.11 H new ATOM 0 HD23 LEU A 74 -0.175 -6.354 14.714 1.00 64.11 H new ATOM 1259 N GLY A 75 -4.191 -3.248 15.721 1.00 51.33 N ATOM 1260 CA GLY A 75 -4.962 -2.266 16.480 1.00 72.05 C ATOM 1261 C GLY A 75 -4.537 -0.822 16.212 1.00 65.11 C ATOM 1262 O GLY A 75 -5.108 0.119 16.775 1.00 64.15 O ATOM 0 H GLY A 75 -4.604 -3.513 14.827 1.00 51.33 H new ATOM 0 HA2 GLY A 75 -6.018 -2.377 16.236 1.00 72.05 H new ATOM 0 HA3 GLY A 75 -4.857 -2.476 17.544 1.00 72.05 H new ATOM 1266 N ALA A 76 -3.540 -0.646 15.346 1.00 24.21 N ATOM 1267 CA ALA A 76 -3.024 0.684 14.999 1.00 42.14 C ATOM 1268 C ALA A 76 -3.547 1.150 13.633 1.00 54.44 C ATOM 1269 O ALA A 76 -3.598 0.374 12.679 1.00 33.42 O ATOM 1270 CB ALA A 76 -1.500 0.664 14.995 1.00 74.20 C ATOM 0 H ALA A 76 -3.068 -1.413 14.867 1.00 24.21 H new ATOM 0 HA ALA A 76 -3.377 1.390 15.751 1.00 42.14 H new ATOM 0 HB1 ALA A 76 -1.124 1.654 14.737 1.00 74.20 H new ATOM 0 HB2 ALA A 76 -1.137 0.385 15.984 1.00 74.20 H new ATOM 0 HB3 ALA A 76 -1.148 -0.061 14.261 1.00 74.20 H new ATOM 1276 N GLN A 77 -3.928 2.423 13.541 1.00 55.24 N ATOM 1277 CA GLN A 77 -4.423 2.986 12.280 1.00 62.13 C ATOM 1278 C GLN A 77 -3.265 3.332 11.329 1.00 11.31 C ATOM 1279 O GLN A 77 -2.267 3.942 11.729 1.00 23.33 O ATOM 1280 CB GLN A 77 -5.283 4.234 12.534 1.00 41.21 C ATOM 1281 CG GLN A 77 -4.559 5.351 13.277 1.00 71.13 C ATOM 1282 CD GLN A 77 -5.340 6.652 13.296 1.00 33.23 C ATOM 1283 OE1 GLN A 77 -5.188 7.492 12.416 1.00 65.11 O ATOM 1284 NE2 GLN A 77 -6.192 6.826 14.286 1.00 31.35 N ATOM 0 H GLN A 77 -3.905 3.083 14.318 1.00 55.24 H new ATOM 0 HA GLN A 77 -5.042 2.224 11.806 1.00 62.13 H new ATOM 0 HB2 GLN A 77 -5.636 4.619 11.577 1.00 41.21 H new ATOM 0 HB3 GLN A 77 -6.164 3.944 13.106 1.00 41.21 H new ATOM 0 HG2 GLN A 77 -4.367 5.034 14.302 1.00 71.13 H new ATOM 0 HG3 GLN A 77 -3.589 5.522 12.809 1.00 71.13 H new ATOM 0 HE21 GLN A 77 -6.295 6.107 15.003 1.00 31.35 H new ATOM 0 HE22 GLN A 77 -6.749 7.679 14.336 1.00 31.35 H new ATOM 1293 N VAL A 78 -3.401 2.936 10.069 1.00 13.32 N ATOM 1294 CA VAL A 78 -2.399 3.233 9.042 1.00 24.54 C ATOM 1295 C VAL A 78 -3.061 3.726 7.747 1.00 1.05 C ATOM 1296 O VAL A 78 -4.216 3.405 7.465 1.00 73.42 O ATOM 1297 CB VAL A 78 -1.515 1.996 8.727 1.00 44.50 C ATOM 1298 CG1 VAL A 78 -0.639 1.630 9.925 1.00 44.13 C ATOM 1299 CG2 VAL A 78 -2.377 0.806 8.306 1.00 41.40 C ATOM 0 H VAL A 78 -4.201 2.404 9.728 1.00 13.32 H new ATOM 0 HA VAL A 78 -1.764 4.023 9.444 1.00 24.54 H new ATOM 0 HB VAL A 78 -0.860 2.255 7.895 1.00 44.50 H new ATOM 0 HG11 VAL A 78 -0.030 0.761 9.678 1.00 44.13 H new ATOM 0 HG12 VAL A 78 0.010 2.470 10.171 1.00 44.13 H new ATOM 0 HG13 VAL A 78 -1.272 1.398 10.781 1.00 44.13 H new ATOM 0 HG21 VAL A 78 -1.736 -0.049 8.090 1.00 41.40 H new ATOM 0 HG22 VAL A 78 -3.064 0.551 9.113 1.00 41.40 H new ATOM 0 HG23 VAL A 78 -2.947 1.067 7.414 1.00 41.40 H new ATOM 1309 N LEU A 79 -2.324 4.516 6.972 1.00 24.22 N ATOM 1310 CA LEU A 79 -2.820 5.038 5.696 1.00 63.54 C ATOM 1311 C LEU A 79 -2.421 4.108 4.542 1.00 50.24 C ATOM 1312 O LEU A 79 -1.248 3.791 4.365 1.00 51.43 O ATOM 1313 CB LEU A 79 -2.274 6.453 5.463 1.00 20.51 C ATOM 1314 CG LEU A 79 -2.699 7.128 4.144 1.00 64.33 C ATOM 1315 CD1 LEU A 79 -4.221 7.150 4.004 1.00 71.42 C ATOM 1316 CD2 LEU A 79 -2.131 8.543 4.071 1.00 32.12 C ATOM 0 H LEU A 79 -1.376 4.812 7.204 1.00 24.22 H new ATOM 0 HA LEU A 79 -3.908 5.084 5.733 1.00 63.54 H new ATOM 0 HB2 LEU A 79 -2.592 7.086 6.292 1.00 20.51 H new ATOM 0 HB3 LEU A 79 -1.185 6.411 5.493 1.00 20.51 H new ATOM 0 HG LEU A 79 -2.297 6.546 3.315 1.00 64.33 H new ATOM 0 HD11 LEU A 79 -4.493 7.632 3.065 1.00 71.42 H new ATOM 0 HD12 LEU A 79 -4.602 6.129 4.012 1.00 71.42 H new ATOM 0 HD13 LEU A 79 -4.655 7.705 4.836 1.00 71.42 H new ATOM 0 HD21 LEU A 79 -2.438 9.010 3.135 1.00 32.12 H new ATOM 0 HD22 LEU A 79 -2.507 9.130 4.909 1.00 32.12 H new ATOM 0 HD23 LEU A 79 -1.043 8.501 4.116 1.00 32.12 H new ATOM 1328 N ILE A 80 -3.403 3.673 3.759 1.00 45.21 N ATOM 1329 CA ILE A 80 -3.170 2.696 2.691 1.00 2.21 C ATOM 1330 C ILE A 80 -3.478 3.284 1.305 1.00 35.35 C ATOM 1331 O ILE A 80 -4.401 4.080 1.148 1.00 73.13 O ATOM 1332 CB ILE A 80 -4.035 1.425 2.918 1.00 31.44 C ATOM 1333 CG1 ILE A 80 -3.743 0.831 4.308 1.00 55.54 C ATOM 1334 CG2 ILE A 80 -3.782 0.384 1.822 1.00 63.32 C ATOM 1335 CD1 ILE A 80 -4.619 -0.351 4.674 1.00 4.24 C ATOM 0 H ILE A 80 -4.372 3.980 3.841 1.00 45.21 H new ATOM 0 HA ILE A 80 -2.114 2.429 2.723 1.00 2.21 H new ATOM 0 HB ILE A 80 -5.086 1.710 2.870 1.00 31.44 H new ATOM 0 HG12 ILE A 80 -2.699 0.521 4.346 1.00 55.54 H new ATOM 0 HG13 ILE A 80 -3.872 1.611 5.059 1.00 55.54 H new ATOM 0 HG21 ILE A 80 -4.400 -0.495 2.005 1.00 63.32 H new ATOM 0 HG22 ILE A 80 -4.035 0.809 0.851 1.00 63.32 H new ATOM 0 HG23 ILE A 80 -2.731 0.096 1.829 1.00 63.32 H new ATOM 0 HD11 ILE A 80 -4.349 -0.710 5.667 1.00 4.24 H new ATOM 0 HD12 ILE A 80 -5.665 -0.044 4.671 1.00 4.24 H new ATOM 0 HD13 ILE A 80 -4.474 -1.150 3.948 1.00 4.24 H new ATOM 1347 N ILE A 81 -2.687 2.904 0.304 1.00 43.12 N ATOM 1348 CA ILE A 81 -2.944 3.304 -1.088 1.00 2.14 C ATOM 1349 C ILE A 81 -3.062 2.071 -1.997 1.00 22.43 C ATOM 1350 O ILE A 81 -2.211 1.185 -1.965 1.00 42.15 O ATOM 1351 CB ILE A 81 -1.836 4.245 -1.634 1.00 34.54 C ATOM 1352 CG1 ILE A 81 -1.746 5.520 -0.776 1.00 51.44 C ATOM 1353 CG2 ILE A 81 -2.097 4.598 -3.101 1.00 34.22 C ATOM 1354 CD1 ILE A 81 -0.737 6.530 -1.277 1.00 34.04 C ATOM 0 H ILE A 81 -1.860 2.319 0.426 1.00 43.12 H new ATOM 0 HA ILE A 81 -3.888 3.849 -1.092 1.00 2.14 H new ATOM 0 HB ILE A 81 -0.882 3.722 -1.577 1.00 34.54 H new ATOM 0 HG12 ILE A 81 -2.728 5.991 -0.739 1.00 51.44 H new ATOM 0 HG13 ILE A 81 -1.488 5.241 0.246 1.00 51.44 H new ATOM 0 HG21 ILE A 81 -1.308 5.258 -3.462 1.00 34.22 H new ATOM 0 HG22 ILE A 81 -2.109 3.686 -3.698 1.00 34.22 H new ATOM 0 HG23 ILE A 81 -3.060 5.102 -3.188 1.00 34.22 H new ATOM 0 HD11 ILE A 81 -0.734 7.399 -0.619 1.00 34.04 H new ATOM 0 HD12 ILE A 81 0.255 6.079 -1.287 1.00 34.04 H new ATOM 0 HD13 ILE A 81 -1.004 6.841 -2.287 1.00 34.04 H new ATOM 1366 N ILE A 82 -4.122 2.018 -2.801 1.00 14.14 N ATOM 1367 CA ILE A 82 -4.390 0.859 -3.664 1.00 43.01 C ATOM 1368 C ILE A 82 -4.228 1.209 -5.153 1.00 20.55 C ATOM 1369 O ILE A 82 -4.761 2.217 -5.628 1.00 53.24 O ATOM 1370 CB ILE A 82 -5.824 0.317 -3.431 1.00 1.31 C ATOM 1371 CG1 ILE A 82 -6.026 -0.064 -1.956 1.00 42.31 C ATOM 1372 CG2 ILE A 82 -6.103 -0.884 -4.333 1.00 61.33 C ATOM 1373 CD1 ILE A 82 -7.447 -0.473 -1.620 1.00 53.33 C ATOM 0 H ILE A 82 -4.814 2.764 -2.876 1.00 14.14 H new ATOM 0 HA ILE A 82 -3.659 0.095 -3.400 1.00 43.01 H new ATOM 0 HB ILE A 82 -6.530 1.108 -3.684 1.00 1.31 H new ATOM 0 HG12 ILE A 82 -5.353 -0.884 -1.707 1.00 42.31 H new ATOM 0 HG13 ILE A 82 -5.743 0.782 -1.330 1.00 42.31 H new ATOM 0 HG21 ILE A 82 -7.115 -1.248 -4.152 1.00 61.33 H new ATOM 0 HG22 ILE A 82 -6.006 -0.585 -5.377 1.00 61.33 H new ATOM 0 HG23 ILE A 82 -5.388 -1.677 -4.114 1.00 61.33 H new ATOM 0 HD11 ILE A 82 -7.512 -0.728 -0.562 1.00 53.33 H new ATOM 0 HD12 ILE A 82 -8.124 0.353 -1.837 1.00 53.33 H new ATOM 0 HD13 ILE A 82 -7.728 -1.339 -2.219 1.00 53.33 H new ATOM 1385 N TYR A 83 -3.497 0.369 -5.884 1.00 44.25 N ATOM 1386 CA TYR A 83 -3.299 0.559 -7.328 1.00 63.55 C ATOM 1387 C TYR A 83 -3.825 -0.643 -8.135 1.00 31.43 C ATOM 1388 O TYR A 83 -3.327 -1.765 -7.997 1.00 61.20 O ATOM 1389 CB TYR A 83 -1.808 0.785 -7.633 1.00 54.40 C ATOM 1390 CG TYR A 83 -1.505 0.968 -9.112 1.00 73.41 C ATOM 1391 CD1 TYR A 83 -1.725 2.189 -9.744 1.00 25.34 C ATOM 1392 CD2 TYR A 83 -1.009 -0.083 -9.878 1.00 52.33 C ATOM 1393 CE1 TYR A 83 -1.458 2.355 -11.089 1.00 3.22 C ATOM 1394 CE2 TYR A 83 -0.740 0.077 -11.224 1.00 32.43 C ATOM 1395 CZ TYR A 83 -0.966 1.297 -11.824 1.00 45.23 C ATOM 1396 OH TYR A 83 -0.700 1.459 -13.165 1.00 74.12 O ATOM 0 H TYR A 83 -3.029 -0.453 -5.503 1.00 44.25 H new ATOM 0 HA TYR A 83 -3.868 1.439 -7.628 1.00 63.55 H new ATOM 0 HB2 TYR A 83 -1.465 1.666 -7.090 1.00 54.40 H new ATOM 0 HB3 TYR A 83 -1.237 -0.064 -7.257 1.00 54.40 H new ATOM 0 HD1 TYR A 83 -2.111 3.020 -9.173 1.00 25.34 H new ATOM 0 HD2 TYR A 83 -0.831 -1.041 -9.412 1.00 52.33 H new ATOM 0 HE1 TYR A 83 -1.634 3.309 -11.563 1.00 3.22 H new ATOM 0 HE2 TYR A 83 -0.355 -0.750 -11.803 1.00 32.43 H new ATOM 0 HH TYR A 83 -0.358 0.618 -13.535 1.00 74.12 H new ATOM 1406 N ASP A 84 -4.828 -0.391 -8.979 1.00 24.33 N ATOM 1407 CA ASP A 84 -5.394 -1.419 -9.863 1.00 62.01 C ATOM 1408 C ASP A 84 -5.923 -0.772 -11.165 1.00 74.33 C ATOM 1409 O ASP A 84 -6.142 0.440 -11.222 1.00 61.03 O ATOM 1410 CB ASP A 84 -6.516 -2.184 -9.137 1.00 42.14 C ATOM 1411 CG ASP A 84 -6.831 -3.524 -9.786 1.00 40.21 C ATOM 1412 OD1 ASP A 84 -7.411 -3.538 -10.889 1.00 12.35 O ATOM 1413 OD2 ASP A 84 -6.486 -4.573 -9.201 1.00 72.04 O ATOM 0 H ASP A 84 -5.270 0.524 -9.071 1.00 24.33 H new ATOM 0 HA ASP A 84 -4.611 -2.129 -10.128 1.00 62.01 H new ATOM 0 HB2 ASP A 84 -6.226 -2.347 -8.099 1.00 42.14 H new ATOM 0 HB3 ASP A 84 -7.417 -1.571 -9.123 1.00 42.14 H new ATOM 1418 N GLN A 85 -6.132 -1.586 -12.202 1.00 22.31 N ATOM 1419 CA GLN A 85 -6.530 -1.078 -13.526 1.00 32.32 C ATOM 1420 C GLN A 85 -8.043 -1.213 -13.793 1.00 0.44 C ATOM 1421 O GLN A 85 -8.561 -0.635 -14.755 1.00 50.50 O ATOM 1422 CB GLN A 85 -5.738 -1.805 -14.623 1.00 61.43 C ATOM 1423 CG GLN A 85 -4.258 -1.427 -14.677 1.00 52.41 C ATOM 1424 CD GLN A 85 -4.014 -0.038 -15.255 1.00 4.11 C ATOM 1425 OE1 GLN A 85 -4.841 0.863 -15.140 1.00 62.44 O ATOM 1426 NE2 GLN A 85 -2.875 0.150 -15.889 1.00 53.12 N ATOM 0 H GLN A 85 -6.033 -2.600 -12.155 1.00 22.31 H new ATOM 0 HA GLN A 85 -6.300 -0.013 -13.540 1.00 32.32 H new ATOM 0 HB2 GLN A 85 -5.822 -2.880 -14.465 1.00 61.43 H new ATOM 0 HB3 GLN A 85 -6.193 -1.588 -15.589 1.00 61.43 H new ATOM 0 HG2 GLN A 85 -3.841 -1.473 -13.671 1.00 52.41 H new ATOM 0 HG3 GLN A 85 -3.723 -2.163 -15.278 1.00 52.41 H new ATOM 0 HE21 GLN A 85 -2.205 -0.614 -15.971 1.00 53.12 H new ATOM 0 HE22 GLN A 85 -2.663 1.060 -16.298 1.00 53.12 H new ATOM 1435 N ASP A 86 -8.749 -1.977 -12.963 1.00 22.21 N ATOM 1436 CA ASP A 86 -10.203 -2.135 -13.106 1.00 22.31 C ATOM 1437 C ASP A 86 -10.941 -1.304 -12.044 1.00 21.52 C ATOM 1438 O ASP A 86 -10.630 -1.386 -10.863 1.00 23.15 O ATOM 1439 CB ASP A 86 -10.592 -3.613 -12.991 1.00 11.02 C ATOM 1440 CG ASP A 86 -12.062 -3.846 -13.302 1.00 53.23 C ATOM 1441 OD1 ASP A 86 -12.903 -3.733 -12.384 1.00 71.44 O ATOM 1442 OD2 ASP A 86 -12.390 -4.112 -14.471 1.00 10.34 O ATOM 0 H ASP A 86 -8.344 -2.497 -12.185 1.00 22.21 H new ATOM 0 HA ASP A 86 -10.495 -1.774 -14.092 1.00 22.31 H new ATOM 0 HB2 ASP A 86 -9.980 -4.202 -13.674 1.00 11.02 H new ATOM 0 HB3 ASP A 86 -10.375 -3.967 -11.983 1.00 11.02 H new ATOM 1447 N GLN A 87 -11.928 -0.521 -12.472 1.00 62.22 N ATOM 1448 CA GLN A 87 -12.614 0.426 -11.579 1.00 61.14 C ATOM 1449 C GLN A 87 -13.415 -0.268 -10.459 1.00 71.52 C ATOM 1450 O GLN A 87 -13.153 -0.043 -9.278 1.00 2.12 O ATOM 1451 CB GLN A 87 -13.521 1.353 -12.400 1.00 31.53 C ATOM 1452 CG GLN A 87 -12.750 2.290 -13.329 1.00 62.31 C ATOM 1453 CD GLN A 87 -11.975 3.370 -12.585 1.00 1.34 C ATOM 1454 OE1 GLN A 87 -11.568 3.195 -11.441 1.00 52.45 O ATOM 1455 NE2 GLN A 87 -11.752 4.492 -13.232 1.00 3.21 N ATOM 0 H GLN A 87 -12.275 -0.519 -13.431 1.00 62.22 H new ATOM 0 HA GLN A 87 -11.842 1.013 -11.081 1.00 61.14 H new ATOM 0 HB2 GLN A 87 -14.205 0.747 -12.994 1.00 31.53 H new ATOM 0 HB3 GLN A 87 -14.130 1.948 -11.720 1.00 31.53 H new ATOM 0 HG2 GLN A 87 -12.056 1.704 -13.931 1.00 62.31 H new ATOM 0 HG3 GLN A 87 -13.449 2.763 -14.019 1.00 62.31 H new ATOM 0 HE21 GLN A 87 -12.102 4.611 -14.183 1.00 3.21 H new ATOM 0 HE22 GLN A 87 -11.229 5.244 -12.783 1.00 3.21 H new ATOM 1464 N ASN A 88 -14.389 -1.103 -10.825 1.00 21.12 N ATOM 1465 CA ASN A 88 -15.217 -1.812 -9.832 1.00 51.02 C ATOM 1466 C ASN A 88 -14.340 -2.665 -8.894 1.00 43.14 C ATOM 1467 O ASN A 88 -14.526 -2.666 -7.677 1.00 41.14 O ATOM 1468 CB ASN A 88 -16.253 -2.696 -10.548 1.00 11.41 C ATOM 1469 CG ASN A 88 -17.356 -3.205 -9.627 1.00 3.32 C ATOM 1470 OD1 ASN A 88 -17.162 -3.390 -8.430 1.00 15.33 O ATOM 1471 ND2 ASN A 88 -18.527 -3.437 -10.183 1.00 45.20 N ATOM 0 H ASN A 88 -14.628 -1.308 -11.795 1.00 21.12 H new ATOM 0 HA ASN A 88 -15.740 -1.072 -9.226 1.00 51.02 H new ATOM 0 HB2 ASN A 88 -16.703 -2.128 -11.362 1.00 11.41 H new ATOM 0 HB3 ASN A 88 -15.743 -3.548 -10.998 1.00 11.41 H new ATOM 0 HD21 ASN A 88 -19.302 -3.780 -9.615 1.00 45.20 H new ATOM 0 HD22 ASN A 88 -18.659 -3.274 -11.181 1.00 45.20 H new ATOM 1478 N ARG A 89 -13.382 -3.375 -9.482 1.00 71.34 N ATOM 1479 CA ARG A 89 -12.404 -4.181 -8.733 1.00 51.34 C ATOM 1480 C ARG A 89 -11.547 -3.309 -7.787 1.00 4.25 C ATOM 1481 O ARG A 89 -11.299 -3.680 -6.636 1.00 14.04 O ATOM 1482 CB ARG A 89 -11.536 -4.950 -9.753 1.00 5.33 C ATOM 1483 CG ARG A 89 -10.054 -5.090 -9.415 1.00 60.44 C ATOM 1484 CD ARG A 89 -9.762 -6.201 -8.413 1.00 10.01 C ATOM 1485 NE ARG A 89 -8.324 -6.427 -8.319 1.00 14.35 N ATOM 1486 CZ ARG A 89 -7.729 -7.544 -8.633 1.00 60.51 C ATOM 1487 NH1 ARG A 89 -8.414 -8.597 -8.946 1.00 72.45 N ATOM 1488 NH2 ARG A 89 -6.443 -7.593 -8.640 1.00 4.42 N ATOM 0 H ARG A 89 -13.256 -3.412 -10.493 1.00 71.34 H new ATOM 0 HA ARG A 89 -12.926 -4.889 -8.090 1.00 51.34 H new ATOM 0 HB2 ARG A 89 -11.955 -5.949 -9.873 1.00 5.33 H new ATOM 0 HB3 ARG A 89 -11.620 -4.451 -10.718 1.00 5.33 H new ATOM 0 HG2 ARG A 89 -9.497 -5.283 -10.332 1.00 60.44 H new ATOM 0 HG3 ARG A 89 -9.690 -4.144 -9.013 1.00 60.44 H new ATOM 0 HD2 ARG A 89 -10.160 -5.933 -7.435 1.00 10.01 H new ATOM 0 HD3 ARG A 89 -10.263 -7.119 -8.720 1.00 10.01 H new ATOM 0 HE ARG A 89 -7.744 -5.658 -7.984 1.00 14.35 H new ATOM 0 HH11 ARG A 89 -9.433 -8.560 -8.949 1.00 72.45 H new ATOM 0 HH12 ARG A 89 -7.934 -9.464 -9.189 1.00 72.45 H new ATOM 0 HH21 ARG A 89 -5.900 -6.763 -8.401 1.00 4.42 H new ATOM 0 HH22 ARG A 89 -5.967 -8.462 -8.884 1.00 4.42 H new ATOM 1502 N LEU A 90 -11.101 -2.155 -8.278 1.00 53.12 N ATOM 1503 CA LEU A 90 -10.336 -1.200 -7.463 1.00 71.20 C ATOM 1504 C LEU A 90 -11.171 -0.702 -6.272 1.00 20.51 C ATOM 1505 O LEU A 90 -10.708 -0.680 -5.126 1.00 22.42 O ATOM 1506 CB LEU A 90 -9.901 -0.008 -8.333 1.00 2.24 C ATOM 1507 CG LEU A 90 -9.095 1.093 -7.620 1.00 72.53 C ATOM 1508 CD1 LEU A 90 -7.769 0.550 -7.092 1.00 24.32 C ATOM 1509 CD2 LEU A 90 -8.858 2.277 -8.557 1.00 34.01 C ATOM 0 H LEU A 90 -11.255 -1.853 -9.240 1.00 53.12 H new ATOM 0 HA LEU A 90 -9.454 -1.708 -7.073 1.00 71.20 H new ATOM 0 HB2 LEU A 90 -9.304 -0.388 -9.162 1.00 2.24 H new ATOM 0 HB3 LEU A 90 -10.793 0.445 -8.765 1.00 2.24 H new ATOM 0 HG LEU A 90 -9.679 1.439 -6.767 1.00 72.53 H new ATOM 0 HD11 LEU A 90 -7.221 1.350 -6.593 1.00 24.32 H new ATOM 0 HD12 LEU A 90 -7.962 -0.255 -6.383 1.00 24.32 H new ATOM 0 HD13 LEU A 90 -7.176 0.167 -7.923 1.00 24.32 H new ATOM 0 HD21 LEU A 90 -8.287 3.045 -8.035 1.00 34.01 H new ATOM 0 HD22 LEU A 90 -8.301 1.942 -9.432 1.00 34.01 H new ATOM 0 HD23 LEU A 90 -9.817 2.689 -8.872 1.00 34.01 H new ATOM 1521 N GLU A 91 -12.408 -0.303 -6.558 1.00 71.01 N ATOM 1522 CA GLU A 91 -13.342 0.145 -5.525 1.00 75.12 C ATOM 1523 C GLU A 91 -13.657 -0.979 -4.533 1.00 72.23 C ATOM 1524 O GLU A 91 -13.709 -0.748 -3.329 1.00 3.30 O ATOM 1525 CB GLU A 91 -14.643 0.652 -6.161 1.00 4.31 C ATOM 1526 CG GLU A 91 -14.473 1.921 -6.987 1.00 11.11 C ATOM 1527 CD GLU A 91 -15.771 2.364 -7.641 1.00 53.31 C ATOM 1528 OE1 GLU A 91 -16.687 2.808 -6.914 1.00 53.43 O ATOM 1529 OE2 GLU A 91 -15.885 2.268 -8.882 1.00 21.24 O ATOM 0 H GLU A 91 -12.790 -0.280 -7.503 1.00 71.01 H new ATOM 0 HA GLU A 91 -12.865 0.960 -4.981 1.00 75.12 H new ATOM 0 HB2 GLU A 91 -15.054 -0.132 -6.797 1.00 4.31 H new ATOM 0 HB3 GLU A 91 -15.373 0.838 -5.373 1.00 4.31 H new ATOM 0 HG2 GLU A 91 -14.100 2.721 -6.347 1.00 11.11 H new ATOM 0 HG3 GLU A 91 -13.720 1.752 -7.757 1.00 11.11 H new ATOM 1536 N GLU A 92 -13.853 -2.193 -5.049 1.00 43.52 N ATOM 1537 CA GLU A 92 -14.212 -3.357 -4.221 1.00 15.51 C ATOM 1538 C GLU A 92 -13.264 -3.521 -3.020 1.00 2.03 C ATOM 1539 O GLU A 92 -13.702 -3.530 -1.868 1.00 50.02 O ATOM 1540 CB GLU A 92 -14.197 -4.637 -5.069 1.00 4.00 C ATOM 1541 CG GLU A 92 -14.626 -5.894 -4.311 1.00 64.54 C ATOM 1542 CD GLU A 92 -16.088 -5.857 -3.883 1.00 10.12 C ATOM 1543 OE1 GLU A 92 -16.953 -6.308 -4.667 1.00 31.20 O ATOM 1544 OE2 GLU A 92 -16.377 -5.379 -2.767 1.00 40.05 O ATOM 0 H GLU A 92 -13.770 -2.402 -6.044 1.00 43.52 H new ATOM 0 HA GLU A 92 -15.217 -3.184 -3.835 1.00 15.51 H new ATOM 0 HB2 GLU A 92 -14.856 -4.500 -5.926 1.00 4.00 H new ATOM 0 HB3 GLU A 92 -13.191 -4.788 -5.462 1.00 4.00 H new ATOM 0 HG2 GLU A 92 -14.459 -6.767 -4.941 1.00 64.54 H new ATOM 0 HG3 GLU A 92 -13.997 -6.013 -3.429 1.00 64.54 H new ATOM 1551 N PHE A 93 -11.966 -3.640 -3.287 1.00 62.41 N ATOM 1552 CA PHE A 93 -10.984 -3.783 -2.211 1.00 32.51 C ATOM 1553 C PHE A 93 -10.947 -2.522 -1.328 1.00 24.24 C ATOM 1554 O PHE A 93 -10.714 -2.603 -0.121 1.00 75.22 O ATOM 1555 CB PHE A 93 -9.591 -4.093 -2.774 1.00 21.23 C ATOM 1556 CG PHE A 93 -8.566 -4.375 -1.702 1.00 61.32 C ATOM 1557 CD1 PHE A 93 -8.834 -5.295 -0.698 1.00 71.24 C ATOM 1558 CD2 PHE A 93 -7.342 -3.725 -1.695 1.00 62.54 C ATOM 1559 CE1 PHE A 93 -7.905 -5.554 0.286 1.00 64.21 C ATOM 1560 CE2 PHE A 93 -6.409 -3.982 -0.712 1.00 45.31 C ATOM 1561 CZ PHE A 93 -6.691 -4.897 0.280 1.00 42.11 C ATOM 0 H PHE A 93 -11.571 -3.641 -4.227 1.00 62.41 H new ATOM 0 HA PHE A 93 -11.291 -4.624 -1.589 1.00 32.51 H new ATOM 0 HB2 PHE A 93 -9.658 -4.954 -3.439 1.00 21.23 H new ATOM 0 HB3 PHE A 93 -9.254 -3.250 -3.377 1.00 21.23 H new ATOM 0 HD1 PHE A 93 -9.781 -5.814 -0.688 1.00 71.24 H new ATOM 0 HD2 PHE A 93 -7.116 -3.007 -2.470 1.00 62.54 H new ATOM 0 HE1 PHE A 93 -8.127 -6.271 1.062 1.00 64.21 H new ATOM 0 HE2 PHE A 93 -5.459 -3.467 -0.719 1.00 45.31 H new ATOM 0 HZ PHE A 93 -5.963 -5.100 1.052 1.00 42.11 H new ATOM 1571 N SER A 94 -11.194 -1.359 -1.931 1.00 43.25 N ATOM 1572 CA SER A 94 -11.319 -0.107 -1.168 1.00 35.43 C ATOM 1573 C SER A 94 -12.492 -0.189 -0.181 1.00 4.34 C ATOM 1574 O SER A 94 -12.418 0.319 0.940 1.00 63.31 O ATOM 1575 CB SER A 94 -11.514 1.091 -2.110 1.00 32.23 C ATOM 1576 OG SER A 94 -11.639 2.306 -1.384 1.00 44.24 O ATOM 0 H SER A 94 -11.312 -1.253 -2.939 1.00 43.25 H new ATOM 0 HA SER A 94 -10.395 0.036 -0.608 1.00 35.43 H new ATOM 0 HB2 SER A 94 -10.668 1.159 -2.794 1.00 32.23 H new ATOM 0 HB3 SER A 94 -12.405 0.936 -2.719 1.00 32.23 H new ATOM 0 HG SER A 94 -11.760 3.050 -2.010 1.00 44.24 H new ATOM 1582 N ARG A 95 -13.573 -0.851 -0.600 1.00 4.41 N ATOM 1583 CA ARG A 95 -14.726 -1.082 0.273 1.00 15.03 C ATOM 1584 C ARG A 95 -14.335 -2.015 1.425 1.00 31.04 C ATOM 1585 O ARG A 95 -14.680 -1.774 2.580 1.00 52.34 O ATOM 1586 CB ARG A 95 -15.895 -1.692 -0.520 1.00 54.35 C ATOM 1587 CG ARG A 95 -16.267 -0.922 -1.786 1.00 43.22 C ATOM 1588 CD ARG A 95 -16.596 0.540 -1.499 1.00 22.02 C ATOM 1589 NE ARG A 95 -17.818 0.680 -0.712 1.00 34.11 N ATOM 1590 CZ ARG A 95 -17.867 1.133 0.510 1.00 33.15 C ATOM 1591 NH1 ARG A 95 -16.782 1.459 1.142 1.00 75.33 N ATOM 1592 NH2 ARG A 95 -19.006 1.249 1.104 1.00 72.42 N ATOM 0 H ARG A 95 -13.674 -1.237 -1.539 1.00 4.41 H new ATOM 0 HA ARG A 95 -15.046 -0.123 0.681 1.00 15.03 H new ATOM 0 HB2 ARG A 95 -15.638 -2.715 -0.794 1.00 54.35 H new ATOM 0 HB3 ARG A 95 -16.769 -1.746 0.128 1.00 54.35 H new ATOM 0 HG2 ARG A 95 -15.441 -0.974 -2.496 1.00 43.22 H new ATOM 0 HG3 ARG A 95 -17.125 -1.399 -2.260 1.00 43.22 H new ATOM 0 HD2 ARG A 95 -15.765 1.001 -0.964 1.00 22.02 H new ATOM 0 HD3 ARG A 95 -16.707 1.078 -2.440 1.00 22.02 H new ATOM 0 HE ARG A 95 -18.697 0.403 -1.150 1.00 34.11 H new ATOM 0 HH11 ARG A 95 -15.876 1.362 0.683 1.00 75.33 H new ATOM 0 HH12 ARG A 95 -16.835 1.812 2.097 1.00 75.33 H new ATOM 0 HH21 ARG A 95 -19.864 0.987 0.618 1.00 72.42 H new ATOM 0 HH22 ARG A 95 -19.049 1.603 2.060 1.00 72.42 H new ATOM 1606 N GLU A 96 -13.593 -3.072 1.090 1.00 42.14 N ATOM 1607 CA GLU A 96 -13.080 -4.024 2.084 1.00 32.14 C ATOM 1608 C GLU A 96 -12.298 -3.304 3.196 1.00 30.13 C ATOM 1609 O GLU A 96 -12.552 -3.508 4.384 1.00 54.15 O ATOM 1610 CB GLU A 96 -12.175 -5.064 1.398 1.00 64.22 C ATOM 1611 CG GLU A 96 -12.854 -5.849 0.273 1.00 53.24 C ATOM 1612 CD GLU A 96 -13.815 -6.918 0.776 1.00 20.03 C ATOM 1613 OE1 GLU A 96 -14.824 -6.568 1.423 1.00 20.02 O ATOM 1614 OE2 GLU A 96 -13.572 -8.113 0.508 1.00 65.22 O ATOM 0 H GLU A 96 -13.331 -3.294 0.130 1.00 42.14 H new ATOM 0 HA GLU A 96 -13.933 -4.527 2.540 1.00 32.14 H new ATOM 0 HB2 GLU A 96 -11.300 -4.555 0.993 1.00 64.22 H new ATOM 0 HB3 GLU A 96 -11.816 -5.767 2.149 1.00 64.22 H new ATOM 0 HG2 GLU A 96 -13.398 -5.155 -0.368 1.00 53.24 H new ATOM 0 HG3 GLU A 96 -12.089 -6.320 -0.344 1.00 53.24 H new ATOM 1621 N VAL A 97 -11.358 -2.448 2.797 1.00 53.45 N ATOM 1622 CA VAL A 97 -10.521 -1.705 3.749 1.00 54.42 C ATOM 1623 C VAL A 97 -11.331 -0.662 4.548 1.00 25.31 C ATOM 1624 O VAL A 97 -11.298 -0.647 5.781 1.00 65.11 O ATOM 1625 CB VAL A 97 -9.350 -0.992 3.025 1.00 61.05 C ATOM 1626 CG1 VAL A 97 -8.440 -0.278 4.024 1.00 61.00 C ATOM 1627 CG2 VAL A 97 -8.553 -1.981 2.175 1.00 63.43 C ATOM 0 H VAL A 97 -11.154 -2.249 1.818 1.00 53.45 H new ATOM 0 HA VAL A 97 -10.124 -2.442 4.448 1.00 54.42 H new ATOM 0 HB VAL A 97 -9.775 -0.239 2.361 1.00 61.05 H new ATOM 0 HG11 VAL A 97 -7.627 0.213 3.489 1.00 61.00 H new ATOM 0 HG12 VAL A 97 -9.016 0.467 4.573 1.00 61.00 H new ATOM 0 HG13 VAL A 97 -8.027 -1.005 4.724 1.00 61.00 H new ATOM 0 HG21 VAL A 97 -7.737 -1.458 1.677 1.00 63.43 H new ATOM 0 HG22 VAL A 97 -8.145 -2.764 2.814 1.00 63.43 H new ATOM 0 HG23 VAL A 97 -9.208 -2.428 1.427 1.00 63.43 H new ATOM 1637 N ARG A 98 -12.063 0.204 3.841 1.00 14.40 N ATOM 1638 CA ARG A 98 -12.847 1.269 4.491 1.00 5.31 C ATOM 1639 C ARG A 98 -13.918 0.706 5.434 1.00 44.30 C ATOM 1640 O ARG A 98 -14.195 1.285 6.486 1.00 54.31 O ATOM 1641 CB ARG A 98 -13.507 2.183 3.448 1.00 14.11 C ATOM 1642 CG ARG A 98 -12.512 3.011 2.641 1.00 70.21 C ATOM 1643 CD ARG A 98 -13.204 4.072 1.792 1.00 51.15 C ATOM 1644 NE ARG A 98 -13.997 4.989 2.611 1.00 62.32 N ATOM 1645 CZ ARG A 98 -13.503 5.987 3.296 1.00 4.20 C ATOM 1646 NH1 ARG A 98 -12.237 6.251 3.258 1.00 54.54 N ATOM 1647 NH2 ARG A 98 -14.288 6.720 4.015 1.00 13.54 N ATOM 0 H ARG A 98 -12.132 0.193 2.823 1.00 14.40 H new ATOM 0 HA ARG A 98 -12.145 1.852 5.087 1.00 5.31 H new ATOM 0 HB2 ARG A 98 -14.097 1.573 2.764 1.00 14.11 H new ATOM 0 HB3 ARG A 98 -14.200 2.855 3.954 1.00 14.11 H new ATOM 0 HG2 ARG A 98 -11.808 3.493 3.319 1.00 70.21 H new ATOM 0 HG3 ARG A 98 -11.932 2.352 1.995 1.00 70.21 H new ATOM 0 HD2 ARG A 98 -12.456 4.636 1.234 1.00 51.15 H new ATOM 0 HD3 ARG A 98 -13.850 3.588 1.059 1.00 51.15 H new ATOM 0 HE ARG A 98 -15.005 4.839 2.650 1.00 62.32 H new ATOM 0 HH11 ARG A 98 -11.613 5.678 2.690 1.00 54.54 H new ATOM 0 HH12 ARG A 98 -11.863 7.032 3.796 1.00 54.54 H new ATOM 0 HH21 ARG A 98 -15.287 6.519 4.046 1.00 13.54 H new ATOM 0 HH22 ARG A 98 -13.908 7.500 4.551 1.00 13.54 H new ATOM 1661 N ARG A 99 -14.509 -0.425 5.061 1.00 2.34 N ATOM 1662 CA ARG A 99 -15.555 -1.056 5.875 1.00 3.23 C ATOM 1663 C ARG A 99 -15.017 -1.466 7.255 1.00 71.03 C ATOM 1664 O ARG A 99 -15.762 -1.520 8.231 1.00 62.11 O ATOM 1665 CB ARG A 99 -16.136 -2.281 5.148 1.00 13.32 C ATOM 1666 CG ARG A 99 -17.410 -2.839 5.780 1.00 63.44 C ATOM 1667 CD ARG A 99 -18.529 -1.804 5.792 1.00 62.31 C ATOM 1668 NE ARG A 99 -19.785 -2.352 6.298 1.00 60.52 N ATOM 1669 CZ ARG A 99 -20.761 -1.628 6.775 1.00 5.31 C ATOM 1670 NH1 ARG A 99 -20.635 -0.343 6.889 1.00 70.11 N ATOM 1671 NH2 ARG A 99 -21.858 -2.197 7.156 1.00 1.22 N ATOM 0 H ARG A 99 -14.285 -0.927 4.202 1.00 2.34 H new ATOM 0 HA ARG A 99 -16.348 -0.323 6.024 1.00 3.23 H new ATOM 0 HB2 ARG A 99 -16.346 -2.010 4.113 1.00 13.32 H new ATOM 0 HB3 ARG A 99 -15.381 -3.067 5.124 1.00 13.32 H new ATOM 0 HG2 ARG A 99 -17.735 -3.721 5.228 1.00 63.44 H new ATOM 0 HG3 ARG A 99 -17.200 -3.161 6.800 1.00 63.44 H new ATOM 0 HD2 ARG A 99 -18.230 -0.956 6.409 1.00 62.31 H new ATOM 0 HD3 ARG A 99 -18.681 -1.425 4.781 1.00 62.31 H new ATOM 0 HE ARG A 99 -19.907 -3.364 6.277 1.00 60.52 H new ATOM 0 HH11 ARG A 99 -19.767 0.112 6.605 1.00 70.11 H new ATOM 0 HH12 ARG A 99 -21.404 0.214 7.263 1.00 70.11 H new ATOM 0 HH21 ARG A 99 -21.959 -3.209 7.084 1.00 1.22 H new ATOM 0 HH22 ARG A 99 -22.622 -1.633 7.529 1.00 1.22 H new ATOM 1685 N ARG A 100 -13.714 -1.742 7.332 1.00 73.25 N ATOM 1686 CA ARG A 100 -13.080 -2.138 8.594 1.00 70.52 C ATOM 1687 C ARG A 100 -12.599 -0.918 9.399 1.00 3.44 C ATOM 1688 O ARG A 100 -12.107 -1.058 10.518 1.00 53.33 O ATOM 1689 CB ARG A 100 -11.905 -3.089 8.329 1.00 64.30 C ATOM 1690 CG ARG A 100 -12.283 -4.312 7.498 1.00 42.14 C ATOM 1691 CD ARG A 100 -11.270 -5.440 7.653 1.00 32.25 C ATOM 1692 NE ARG A 100 -11.202 -5.905 9.039 1.00 35.31 N ATOM 1693 CZ ARG A 100 -10.902 -7.121 9.402 1.00 25.20 C ATOM 1694 NH1 ARG A 100 -10.610 -8.025 8.524 1.00 21.52 N ATOM 1695 NH2 ARG A 100 -10.908 -7.433 10.657 1.00 51.44 N ATOM 0 H ARG A 100 -13.076 -1.699 6.537 1.00 73.25 H new ATOM 0 HA ARG A 100 -13.833 -2.655 9.189 1.00 70.52 H new ATOM 0 HB2 ARG A 100 -11.114 -2.542 7.816 1.00 64.30 H new ATOM 0 HB3 ARG A 100 -11.495 -3.421 9.283 1.00 64.30 H new ATOM 0 HG2 ARG A 100 -13.269 -4.665 7.800 1.00 42.14 H new ATOM 0 HG3 ARG A 100 -12.354 -4.029 6.448 1.00 42.14 H new ATOM 0 HD2 ARG A 100 -11.544 -6.270 7.001 1.00 32.25 H new ATOM 0 HD3 ARG A 100 -10.286 -5.095 7.334 1.00 32.25 H new ATOM 0 HE ARG A 100 -11.404 -5.228 9.775 1.00 35.31 H new ATOM 0 HH11 ARG A 100 -10.612 -7.791 7.531 1.00 21.52 H new ATOM 0 HH12 ARG A 100 -10.378 -8.972 8.825 1.00 21.52 H new ATOM 0 HH21 ARG A 100 -11.146 -6.730 11.356 1.00 51.44 H new ATOM 0 HH22 ARG A 100 -10.674 -8.382 10.948 1.00 51.44 H new ATOM 1709 N GLY A 101 -12.739 0.274 8.824 1.00 70.10 N ATOM 1710 CA GLY A 101 -12.382 1.501 9.536 1.00 21.01 C ATOM 1711 C GLY A 101 -10.941 1.962 9.311 1.00 63.53 C ATOM 1712 O GLY A 101 -10.348 2.607 10.179 1.00 3.32 O ATOM 0 H GLY A 101 -13.093 0.417 7.878 1.00 70.10 H new ATOM 0 HA2 GLY A 101 -13.059 2.297 9.226 1.00 21.01 H new ATOM 0 HA3 GLY A 101 -12.539 1.347 10.603 1.00 21.01 H new ATOM 1716 N PHE A 102 -10.367 1.630 8.155 1.00 60.04 N ATOM 1717 CA PHE A 102 -9.026 2.116 7.791 1.00 13.20 C ATOM 1718 C PHE A 102 -9.080 3.173 6.675 1.00 22.15 C ATOM 1719 O PHE A 102 -9.975 3.161 5.823 1.00 31.15 O ATOM 1720 CB PHE A 102 -8.118 0.953 7.362 1.00 35.00 C ATOM 1721 CG PHE A 102 -7.560 0.160 8.519 1.00 22.45 C ATOM 1722 CD1 PHE A 102 -6.568 0.703 9.326 1.00 25.33 C ATOM 1723 CD2 PHE A 102 -8.013 -1.123 8.792 1.00 64.13 C ATOM 1724 CE1 PHE A 102 -6.042 -0.017 10.382 1.00 41.44 C ATOM 1725 CE2 PHE A 102 -7.491 -1.846 9.849 1.00 50.04 C ATOM 1726 CZ PHE A 102 -6.504 -1.293 10.644 1.00 3.54 C ATOM 0 H PHE A 102 -10.802 1.030 7.454 1.00 60.04 H new ATOM 0 HA PHE A 102 -8.609 2.586 8.681 1.00 13.20 H new ATOM 0 HB2 PHE A 102 -8.682 0.284 6.713 1.00 35.00 H new ATOM 0 HB3 PHE A 102 -7.291 1.348 6.771 1.00 35.00 H new ATOM 0 HD1 PHE A 102 -6.203 1.700 9.126 1.00 25.33 H new ATOM 0 HD2 PHE A 102 -8.781 -1.561 8.172 1.00 64.13 H new ATOM 0 HE1 PHE A 102 -5.271 0.417 11.002 1.00 41.44 H new ATOM 0 HE2 PHE A 102 -7.854 -2.842 10.053 1.00 50.04 H new ATOM 0 HZ PHE A 102 -6.095 -1.857 11.469 1.00 3.54 H new ATOM 1736 N GLU A 103 -8.113 4.090 6.703 1.00 70.42 N ATOM 1737 CA GLU A 103 -7.983 5.132 5.680 1.00 55.03 C ATOM 1738 C GLU A 103 -7.249 4.601 4.443 1.00 74.14 C ATOM 1739 O GLU A 103 -6.082 4.214 4.518 1.00 1.30 O ATOM 1740 CB GLU A 103 -7.230 6.348 6.256 1.00 10.44 C ATOM 1741 CG GLU A 103 -8.072 7.243 7.167 1.00 33.14 C ATOM 1742 CD GLU A 103 -8.749 6.498 8.307 1.00 1.23 C ATOM 1743 OE1 GLU A 103 -8.090 6.254 9.341 1.00 13.14 O ATOM 1744 OE2 GLU A 103 -9.950 6.162 8.177 1.00 60.44 O ATOM 0 H GLU A 103 -7.400 4.133 7.431 1.00 70.42 H new ATOM 0 HA GLU A 103 -8.985 5.438 5.378 1.00 55.03 H new ATOM 0 HB2 GLU A 103 -6.365 5.992 6.816 1.00 10.44 H new ATOM 0 HB3 GLU A 103 -6.849 6.948 5.430 1.00 10.44 H new ATOM 0 HG2 GLU A 103 -7.435 8.023 7.583 1.00 33.14 H new ATOM 0 HG3 GLU A 103 -8.834 7.740 6.568 1.00 33.14 H new ATOM 1751 N VAL A 104 -7.934 4.583 3.304 1.00 65.22 N ATOM 1752 CA VAL A 104 -7.338 4.087 2.063 1.00 54.02 C ATOM 1753 C VAL A 104 -7.625 5.016 0.873 1.00 23.32 C ATOM 1754 O VAL A 104 -8.711 5.589 0.760 1.00 53.31 O ATOM 1755 CB VAL A 104 -7.829 2.656 1.736 1.00 32.45 C ATOM 1756 CG1 VAL A 104 -9.333 2.633 1.474 1.00 43.35 C ATOM 1757 CG2 VAL A 104 -7.056 2.082 0.557 1.00 61.14 C ATOM 0 H VAL A 104 -8.898 4.904 3.212 1.00 65.22 H new ATOM 0 HA VAL A 104 -6.260 4.065 2.226 1.00 54.02 H new ATOM 0 HB VAL A 104 -7.640 2.026 2.605 1.00 32.45 H new ATOM 0 HG11 VAL A 104 -9.647 1.614 1.247 1.00 43.35 H new ATOM 0 HG12 VAL A 104 -9.862 2.987 2.359 1.00 43.35 H new ATOM 0 HG13 VAL A 104 -9.565 3.281 0.629 1.00 43.35 H new ATOM 0 HG21 VAL A 104 -7.415 1.076 0.342 1.00 61.14 H new ATOM 0 HG22 VAL A 104 -7.204 2.715 -0.318 1.00 61.14 H new ATOM 0 HG23 VAL A 104 -5.995 2.044 0.802 1.00 61.14 H new ATOM 1767 N ARG A 105 -6.636 5.162 -0.007 1.00 63.24 N ATOM 1768 CA ARG A 105 -6.734 6.039 -1.177 1.00 23.32 C ATOM 1769 C ARG A 105 -6.409 5.257 -2.464 1.00 23.12 C ATOM 1770 O ARG A 105 -5.372 4.603 -2.558 1.00 10.41 O ATOM 1771 CB ARG A 105 -5.767 7.226 -1.005 1.00 32.11 C ATOM 1772 CG ARG A 105 -5.918 7.954 0.336 1.00 63.13 C ATOM 1773 CD ARG A 105 -7.330 8.500 0.553 1.00 54.23 C ATOM 1774 NE ARG A 105 -7.584 8.809 1.963 1.00 72.02 N ATOM 1775 CZ ARG A 105 -8.777 8.943 2.485 1.00 44.11 C ATOM 1776 NH1 ARG A 105 -9.832 8.919 1.737 1.00 43.11 N ATOM 1777 NH2 ARG A 105 -8.910 9.133 3.756 1.00 40.32 N ATOM 0 H ARG A 105 -5.742 4.676 0.069 1.00 63.24 H new ATOM 0 HA ARG A 105 -7.753 6.417 -1.261 1.00 23.32 H new ATOM 0 HB2 ARG A 105 -4.743 6.865 -1.099 1.00 32.11 H new ATOM 0 HB3 ARG A 105 -5.931 7.937 -1.815 1.00 32.11 H new ATOM 0 HG2 ARG A 105 -5.668 7.270 1.147 1.00 63.13 H new ATOM 0 HG3 ARG A 105 -5.204 8.776 0.381 1.00 63.13 H new ATOM 0 HD2 ARG A 105 -7.468 9.400 -0.047 1.00 54.23 H new ATOM 0 HD3 ARG A 105 -8.060 7.769 0.204 1.00 54.23 H new ATOM 0 HE ARG A 105 -6.779 8.927 2.578 1.00 72.02 H new ATOM 0 HH11 ARG A 105 -9.740 8.795 0.729 1.00 43.11 H new ATOM 0 HH12 ARG A 105 -10.756 9.024 2.155 1.00 43.11 H new ATOM 0 HH21 ARG A 105 -8.085 9.179 4.354 1.00 40.32 H new ATOM 0 HH22 ARG A 105 -9.840 9.237 4.161 1.00 40.32 H new ATOM 1791 N THR A 106 -7.302 5.317 -3.448 1.00 43.44 N ATOM 1792 CA THR A 106 -7.155 4.526 -4.682 1.00 2.14 C ATOM 1793 C THR A 106 -6.724 5.389 -5.879 1.00 13.13 C ATOM 1794 O THR A 106 -7.151 6.534 -6.021 1.00 22.24 O ATOM 1795 CB THR A 106 -8.474 3.801 -5.041 1.00 52.24 C ATOM 1796 OG1 THR A 106 -9.544 4.751 -5.157 1.00 71.32 O ATOM 1797 CG2 THR A 106 -8.830 2.758 -3.986 1.00 4.13 C ATOM 0 H THR A 106 -8.137 5.902 -3.422 1.00 43.44 H new ATOM 0 HA THR A 106 -6.373 3.793 -4.481 1.00 2.14 H new ATOM 0 HB THR A 106 -8.331 3.295 -5.996 1.00 52.24 H new ATOM 0 HG1 THR A 106 -10.374 4.283 -5.386 1.00 71.32 H new ATOM 0 HG21 THR A 106 -9.761 2.264 -4.263 1.00 4.13 H new ATOM 0 HG22 THR A 106 -8.032 2.019 -3.921 1.00 4.13 H new ATOM 0 HG23 THR A 106 -8.952 3.246 -3.019 1.00 4.13 H new ATOM 1805 N VAL A 107 -5.866 4.826 -6.736 1.00 60.12 N ATOM 1806 CA VAL A 107 -5.383 5.521 -7.940 1.00 51.43 C ATOM 1807 C VAL A 107 -5.370 4.587 -9.167 1.00 43.12 C ATOM 1808 O VAL A 107 -5.101 3.391 -9.045 1.00 43.04 O ATOM 1809 CB VAL A 107 -3.954 6.095 -7.729 1.00 15.42 C ATOM 1810 CG1 VAL A 107 -3.954 7.202 -6.673 1.00 55.51 C ATOM 1811 CG2 VAL A 107 -2.975 4.984 -7.347 1.00 60.25 C ATOM 0 H VAL A 107 -5.488 3.886 -6.619 1.00 60.12 H new ATOM 0 HA VAL A 107 -6.077 6.341 -8.123 1.00 51.43 H new ATOM 0 HB VAL A 107 -3.626 6.532 -8.673 1.00 15.42 H new ATOM 0 HG11 VAL A 107 -2.941 7.584 -6.547 1.00 55.51 H new ATOM 0 HG12 VAL A 107 -4.610 8.011 -6.994 1.00 55.51 H new ATOM 0 HG13 VAL A 107 -4.311 6.800 -5.725 1.00 55.51 H new ATOM 0 HG21 VAL A 107 -1.981 5.408 -7.204 1.00 60.25 H new ATOM 0 HG22 VAL A 107 -3.304 4.511 -6.422 1.00 60.25 H new ATOM 0 HG23 VAL A 107 -2.941 4.240 -8.143 1.00 60.25 H new ATOM 1821 N THR A 108 -5.659 5.140 -10.350 1.00 72.14 N ATOM 1822 CA THR A 108 -5.687 4.350 -11.599 1.00 3.34 C ATOM 1823 C THR A 108 -4.463 4.624 -12.489 1.00 33.54 C ATOM 1824 O THR A 108 -4.388 4.143 -13.623 1.00 64.10 O ATOM 1825 CB THR A 108 -6.960 4.647 -12.432 1.00 72.11 C ATOM 1826 OG1 THR A 108 -6.939 6.005 -12.906 1.00 22.43 O ATOM 1827 CG2 THR A 108 -8.224 4.414 -11.609 1.00 32.11 C ATOM 0 H THR A 108 -5.877 6.129 -10.475 1.00 72.14 H new ATOM 0 HA THR A 108 -5.680 3.306 -11.286 1.00 3.34 H new ATOM 0 HB THR A 108 -6.969 3.965 -13.282 1.00 72.11 H new ATOM 0 HG1 THR A 108 -7.747 6.180 -13.432 1.00 22.43 H new ATOM 0 HG21 THR A 108 -9.101 4.630 -12.219 1.00 32.11 H new ATOM 0 HG22 THR A 108 -8.258 3.375 -11.280 1.00 32.11 H new ATOM 0 HG23 THR A 108 -8.217 5.070 -10.738 1.00 32.11 H new ATOM 1835 N SER A 109 -3.503 5.393 -11.978 1.00 24.44 N ATOM 1836 CA SER A 109 -2.319 5.780 -12.764 1.00 14.21 C ATOM 1837 C SER A 109 -1.127 6.121 -11.856 1.00 52.03 C ATOM 1838 O SER A 109 -1.305 6.716 -10.793 1.00 31.14 O ATOM 1839 CB SER A 109 -2.656 6.988 -13.654 1.00 51.22 C ATOM 1840 OG SER A 109 -1.535 7.406 -14.420 1.00 75.41 O ATOM 0 H SER A 109 -3.516 5.762 -11.027 1.00 24.44 H new ATOM 0 HA SER A 109 -2.037 4.931 -13.386 1.00 14.21 H new ATOM 0 HB2 SER A 109 -3.477 6.730 -14.322 1.00 51.22 H new ATOM 0 HB3 SER A 109 -3.000 7.814 -13.031 1.00 51.22 H new ATOM 0 HG SER A 109 -1.786 8.174 -14.975 1.00 75.41 H new ATOM 1846 N PRO A 110 0.107 5.736 -12.255 1.00 71.40 N ATOM 1847 CA PRO A 110 1.332 6.055 -11.489 1.00 34.31 C ATOM 1848 C PRO A 110 1.494 7.557 -11.188 1.00 72.10 C ATOM 1849 O PRO A 110 1.968 7.935 -10.117 1.00 63.11 O ATOM 1850 CB PRO A 110 2.459 5.561 -12.408 1.00 24.41 C ATOM 1851 CG PRO A 110 1.826 4.488 -13.226 1.00 63.21 C ATOM 1852 CD PRO A 110 0.412 4.942 -13.462 1.00 4.24 C ATOM 0 HA PRO A 110 1.320 5.587 -10.505 1.00 34.31 H new ATOM 0 HB2 PRO A 110 2.842 6.366 -13.036 1.00 24.41 H new ATOM 0 HB3 PRO A 110 3.302 5.177 -11.833 1.00 24.41 H new ATOM 0 HG2 PRO A 110 2.356 4.349 -14.168 1.00 63.21 H new ATOM 0 HG3 PRO A 110 1.849 3.532 -12.704 1.00 63.21 H new ATOM 0 HD2 PRO A 110 0.327 5.540 -14.369 1.00 4.24 H new ATOM 0 HD3 PRO A 110 -0.269 4.098 -13.572 1.00 4.24 H new ATOM 1860 N ASP A 111 1.097 8.409 -12.132 1.00 31.24 N ATOM 1861 CA ASP A 111 1.179 9.862 -11.939 1.00 50.30 C ATOM 1862 C ASP A 111 0.188 10.327 -10.853 1.00 21.53 C ATOM 1863 O ASP A 111 0.537 11.119 -9.972 1.00 44.23 O ATOM 1864 CB ASP A 111 0.914 10.580 -13.267 1.00 41.31 C ATOM 1865 CG ASP A 111 1.120 12.083 -13.166 1.00 43.21 C ATOM 1866 OD1 ASP A 111 2.278 12.541 -13.294 1.00 0.13 O ATOM 1867 OD2 ASP A 111 0.128 12.810 -12.963 1.00 34.24 O ATOM 0 H ASP A 111 0.717 8.124 -13.035 1.00 31.24 H new ATOM 0 HA ASP A 111 2.184 10.115 -11.601 1.00 50.30 H new ATOM 0 HB2 ASP A 111 1.576 10.176 -14.033 1.00 41.31 H new ATOM 0 HB3 ASP A 111 -0.107 10.377 -13.589 1.00 41.31 H new ATOM 1872 N ASP A 112 -1.046 9.826 -10.920 1.00 62.40 N ATOM 1873 CA ASP A 112 -2.040 10.052 -9.864 1.00 3.31 C ATOM 1874 C ASP A 112 -1.522 9.539 -8.511 1.00 61.20 C ATOM 1875 O ASP A 112 -1.705 10.182 -7.475 1.00 21.15 O ATOM 1876 CB ASP A 112 -3.353 9.350 -10.226 1.00 53.13 C ATOM 1877 CG ASP A 112 -4.014 9.948 -11.456 1.00 72.14 C ATOM 1878 OD1 ASP A 112 -3.385 9.955 -12.534 1.00 24.20 O ATOM 1879 OD2 ASP A 112 -5.166 10.419 -11.346 1.00 41.24 O ATOM 0 H ASP A 112 -1.384 9.258 -11.697 1.00 62.40 H new ATOM 0 HA ASP A 112 -2.218 11.124 -9.779 1.00 3.31 H new ATOM 0 HB2 ASP A 112 -3.159 8.292 -10.400 1.00 53.13 H new ATOM 0 HB3 ASP A 112 -4.040 9.413 -9.382 1.00 53.13 H new ATOM 1884 N PHE A 113 -0.876 8.374 -8.535 1.00 21.32 N ATOM 1885 CA PHE A 113 -0.226 7.816 -7.344 1.00 73.51 C ATOM 1886 C PHE A 113 0.806 8.796 -6.769 1.00 53.51 C ATOM 1887 O PHE A 113 0.842 9.040 -5.564 1.00 61.00 O ATOM 1888 CB PHE A 113 0.449 6.481 -7.695 1.00 75.51 C ATOM 1889 CG PHE A 113 1.370 5.956 -6.618 1.00 20.44 C ATOM 1890 CD1 PHE A 113 0.868 5.260 -5.528 1.00 14.31 C ATOM 1891 CD2 PHE A 113 2.740 6.170 -6.698 1.00 73.23 C ATOM 1892 CE1 PHE A 113 1.715 4.790 -4.541 1.00 1.11 C ATOM 1893 CE2 PHE A 113 3.588 5.701 -5.716 1.00 45.42 C ATOM 1894 CZ PHE A 113 3.076 5.012 -4.637 1.00 12.35 C ATOM 0 H PHE A 113 -0.787 7.794 -9.369 1.00 21.32 H new ATOM 0 HA PHE A 113 -0.989 7.645 -6.584 1.00 73.51 H new ATOM 0 HB2 PHE A 113 -0.322 5.737 -7.894 1.00 75.51 H new ATOM 0 HB3 PHE A 113 1.018 6.604 -8.617 1.00 75.51 H new ATOM 0 HD1 PHE A 113 -0.195 5.083 -5.449 1.00 14.31 H new ATOM 0 HD2 PHE A 113 3.147 6.711 -7.540 1.00 73.23 H new ATOM 0 HE1 PHE A 113 1.314 4.250 -3.696 1.00 1.11 H new ATOM 0 HE2 PHE A 113 4.651 5.873 -5.792 1.00 45.42 H new ATOM 0 HZ PHE A 113 3.738 4.646 -3.867 1.00 12.35 H new ATOM 1904 N LYS A 114 1.639 9.349 -7.646 1.00 33.22 N ATOM 1905 CA LYS A 114 2.654 10.333 -7.261 1.00 42.11 C ATOM 1906 C LYS A 114 2.035 11.514 -6.494 1.00 73.20 C ATOM 1907 O LYS A 114 2.413 11.796 -5.356 1.00 64.23 O ATOM 1908 CB LYS A 114 3.373 10.844 -8.517 1.00 10.01 C ATOM 1909 CG LYS A 114 4.339 12.000 -8.265 1.00 72.43 C ATOM 1910 CD LYS A 114 4.958 12.505 -9.564 1.00 32.24 C ATOM 1911 CE LYS A 114 5.826 13.736 -9.337 1.00 40.13 C ATOM 1912 NZ LYS A 114 6.397 14.245 -10.612 1.00 65.21 N ATOM 0 H LYS A 114 1.632 9.130 -8.642 1.00 33.22 H new ATOM 0 HA LYS A 114 3.368 9.844 -6.598 1.00 42.11 H new ATOM 0 HB2 LYS A 114 3.924 10.018 -8.967 1.00 10.01 H new ATOM 0 HB3 LYS A 114 2.626 11.163 -9.244 1.00 10.01 H new ATOM 0 HG2 LYS A 114 3.811 12.816 -7.771 1.00 72.43 H new ATOM 0 HG3 LYS A 114 5.128 11.675 -7.587 1.00 72.43 H new ATOM 0 HD2 LYS A 114 5.560 11.714 -10.011 1.00 32.24 H new ATOM 0 HD3 LYS A 114 4.167 12.744 -10.274 1.00 32.24 H new ATOM 0 HE2 LYS A 114 5.232 14.519 -8.865 1.00 40.13 H new ATOM 0 HE3 LYS A 114 6.634 13.490 -8.648 1.00 40.13 H new ATOM 0 HZ1 LYS A 114 6.982 15.083 -10.420 1.00 65.21 H new ATOM 0 HZ2 LYS A 114 6.984 13.506 -11.049 1.00 65.21 H new ATOM 0 HZ3 LYS A 114 5.625 14.503 -11.260 1.00 65.21 H new ATOM 1926 N LYS A 115 1.073 12.188 -7.124 1.00 44.44 N ATOM 1927 CA LYS A 115 0.414 13.355 -6.519 1.00 73.12 C ATOM 1928 C LYS A 115 -0.275 12.999 -5.189 1.00 3.21 C ATOM 1929 O LYS A 115 -0.249 13.781 -4.236 1.00 31.45 O ATOM 1930 CB LYS A 115 -0.603 13.953 -7.501 1.00 44.41 C ATOM 1931 CG LYS A 115 0.024 14.436 -8.807 1.00 1.32 C ATOM 1932 CD LYS A 115 1.048 15.542 -8.569 1.00 4.54 C ATOM 1933 CE LYS A 115 1.715 15.987 -9.866 1.00 10.21 C ATOM 1934 NZ LYS A 115 2.657 17.117 -9.646 1.00 35.11 N ATOM 0 H LYS A 115 0.729 11.949 -8.054 1.00 44.44 H new ATOM 0 HA LYS A 115 1.184 14.095 -6.301 1.00 73.12 H new ATOM 0 HB2 LYS A 115 -1.362 13.204 -7.727 1.00 44.41 H new ATOM 0 HB3 LYS A 115 -1.112 14.788 -7.021 1.00 44.41 H new ATOM 0 HG2 LYS A 115 0.505 13.598 -9.311 1.00 1.32 H new ATOM 0 HG3 LYS A 115 -0.758 14.802 -9.472 1.00 1.32 H new ATOM 0 HD2 LYS A 115 0.558 16.396 -8.101 1.00 4.54 H new ATOM 0 HD3 LYS A 115 1.808 15.189 -7.872 1.00 4.54 H new ATOM 0 HE2 LYS A 115 2.253 15.146 -10.305 1.00 10.21 H new ATOM 0 HE3 LYS A 115 0.951 16.286 -10.583 1.00 10.21 H new ATOM 0 HZ1 LYS A 115 3.089 17.390 -10.552 1.00 35.11 H new ATOM 0 HZ2 LYS A 115 2.140 17.928 -9.251 1.00 35.11 H new ATOM 0 HZ3 LYS A 115 3.401 16.824 -8.981 1.00 35.11 H new ATOM 1948 N SER A 116 -0.887 11.819 -5.130 1.00 0.43 N ATOM 1949 CA SER A 116 -1.527 11.337 -3.897 1.00 0.11 C ATOM 1950 C SER A 116 -0.489 11.108 -2.790 1.00 10.24 C ATOM 1951 O SER A 116 -0.618 11.628 -1.685 1.00 23.32 O ATOM 1952 CB SER A 116 -2.295 10.034 -4.159 1.00 72.31 C ATOM 1953 OG SER A 116 -3.325 10.223 -5.117 1.00 0.11 O ATOM 0 H SER A 116 -0.956 11.175 -5.918 1.00 0.43 H new ATOM 0 HA SER A 116 -2.227 12.105 -3.567 1.00 0.11 H new ATOM 0 HB2 SER A 116 -1.605 9.268 -4.511 1.00 72.31 H new ATOM 0 HB3 SER A 116 -2.726 9.670 -3.226 1.00 72.31 H new ATOM 0 HG SER A 116 -2.938 10.221 -6.018 1.00 0.11 H new ATOM 1959 N LEU A 117 0.551 10.343 -3.109 1.00 23.45 N ATOM 1960 CA LEU A 117 1.607 9.999 -2.147 1.00 1.55 C ATOM 1961 C LEU A 117 2.289 11.250 -1.572 1.00 51.04 C ATOM 1962 O LEU A 117 2.306 11.458 -0.353 1.00 55.23 O ATOM 1963 CB LEU A 117 2.656 9.108 -2.829 1.00 20.11 C ATOM 1964 CG LEU A 117 3.842 8.687 -1.943 1.00 12.24 C ATOM 1965 CD1 LEU A 117 3.384 7.761 -0.818 1.00 52.43 C ATOM 1966 CD2 LEU A 117 4.933 8.026 -2.783 1.00 70.21 C ATOM 0 H LEU A 117 0.690 9.943 -4.037 1.00 23.45 H new ATOM 0 HA LEU A 117 1.141 9.464 -1.319 1.00 1.55 H new ATOM 0 HB2 LEU A 117 2.161 8.209 -3.195 1.00 20.11 H new ATOM 0 HB3 LEU A 117 3.045 9.635 -3.700 1.00 20.11 H new ATOM 0 HG LEU A 117 4.260 9.585 -1.487 1.00 12.24 H new ATOM 0 HD11 LEU A 117 4.242 7.479 -0.207 1.00 52.43 H new ATOM 0 HD12 LEU A 117 2.651 8.277 -0.198 1.00 52.43 H new ATOM 0 HD13 LEU A 117 2.932 6.866 -1.245 1.00 52.43 H new ATOM 0 HD21 LEU A 117 5.763 7.736 -2.138 1.00 70.21 H new ATOM 0 HD22 LEU A 117 4.528 7.141 -3.274 1.00 70.21 H new ATOM 0 HD23 LEU A 117 5.288 8.729 -3.537 1.00 70.21 H new ATOM 1978 N GLU A 118 2.839 12.081 -2.459 1.00 41.15 N ATOM 1979 CA GLU A 118 3.581 13.282 -2.053 1.00 64.45 C ATOM 1980 C GLU A 118 2.717 14.228 -1.201 1.00 72.25 C ATOM 1981 O GLU A 118 3.218 14.896 -0.291 1.00 21.15 O ATOM 1982 CB GLU A 118 4.123 14.006 -3.295 1.00 34.24 C ATOM 1983 CG GLU A 118 5.036 13.125 -4.154 1.00 71.53 C ATOM 1984 CD GLU A 118 5.619 13.834 -5.371 1.00 71.42 C ATOM 1985 OE1 GLU A 118 5.215 14.977 -5.668 1.00 51.52 O ATOM 1986 OE2 GLU A 118 6.510 13.253 -6.027 1.00 53.31 O ATOM 0 H GLU A 118 2.786 11.946 -3.469 1.00 41.15 H new ATOM 0 HA GLU A 118 4.418 12.967 -1.430 1.00 64.45 H new ATOM 0 HB2 GLU A 118 3.286 14.351 -3.901 1.00 34.24 H new ATOM 0 HB3 GLU A 118 4.674 14.892 -2.980 1.00 34.24 H new ATOM 0 HG2 GLU A 118 5.854 12.756 -3.535 1.00 71.53 H new ATOM 0 HG3 GLU A 118 4.472 12.254 -4.489 1.00 71.53 H new ATOM 1993 N ARG A 119 1.414 14.282 -1.485 1.00 51.02 N ATOM 1994 CA ARG A 119 0.490 15.052 -0.647 1.00 41.04 C ATOM 1995 C ARG A 119 0.257 14.377 0.712 1.00 15.00 C ATOM 1996 O ARG A 119 0.510 14.979 1.755 1.00 61.51 O ATOM 1997 CB ARG A 119 -0.866 15.278 -1.338 1.00 44.10 C ATOM 1998 CG ARG A 119 -0.892 16.465 -2.301 1.00 72.21 C ATOM 1999 CD ARG A 119 -2.313 17.000 -2.482 1.00 23.40 C ATOM 2000 NE ARG A 119 -2.904 17.404 -1.201 1.00 4.15 N ATOM 2001 CZ ARG A 119 -4.125 17.846 -1.053 1.00 1.20 C ATOM 2002 NH1 ARG A 119 -4.912 17.996 -2.071 1.00 32.20 N ATOM 2003 NH2 ARG A 119 -4.557 18.151 0.127 1.00 13.11 N ATOM 0 H ARG A 119 0.979 13.809 -2.277 1.00 51.02 H new ATOM 0 HA ARG A 119 0.966 16.019 -0.487 1.00 41.04 H new ATOM 0 HB2 ARG A 119 -1.136 14.375 -1.886 1.00 44.10 H new ATOM 0 HB3 ARG A 119 -1.629 15.428 -0.574 1.00 44.10 H new ATOM 0 HG2 ARG A 119 -0.248 17.258 -1.922 1.00 72.21 H new ATOM 0 HG3 ARG A 119 -0.489 16.161 -3.267 1.00 72.21 H new ATOM 0 HD2 ARG A 119 -2.298 17.852 -3.162 1.00 23.40 H new ATOM 0 HD3 ARG A 119 -2.935 16.234 -2.945 1.00 23.40 H new ATOM 0 HE ARG A 119 -2.321 17.335 -0.367 1.00 4.15 H new ATOM 0 HH11 ARG A 119 -4.582 17.768 -3.009 1.00 32.20 H new ATOM 0 HH12 ARG A 119 -5.862 18.342 -1.935 1.00 32.20 H new ATOM 0 HH21 ARG A 119 -3.946 18.046 0.937 1.00 13.11 H new ATOM 0 HH22 ARG A 119 -5.509 18.496 0.248 1.00 13.11 H new ATOM 2017 N LEU A 120 -0.218 13.128 0.690 1.00 12.21 N ATOM 2018 CA LEU A 120 -0.621 12.407 1.911 1.00 21.54 C ATOM 2019 C LEU A 120 0.449 12.460 3.012 1.00 41.21 C ATOM 2020 O LEU A 120 0.133 12.680 4.183 1.00 75.31 O ATOM 2021 CB LEU A 120 -0.967 10.950 1.576 1.00 40.42 C ATOM 2022 CG LEU A 120 -2.237 10.760 0.729 1.00 43.25 C ATOM 2023 CD1 LEU A 120 -2.437 9.292 0.366 1.00 54.04 C ATOM 2024 CD2 LEU A 120 -3.466 11.308 1.458 1.00 64.54 C ATOM 0 H LEU A 120 -0.335 12.587 -0.167 1.00 12.21 H new ATOM 0 HA LEU A 120 -1.504 12.912 2.302 1.00 21.54 H new ATOM 0 HB2 LEU A 120 -0.125 10.506 1.045 1.00 40.42 H new ATOM 0 HB3 LEU A 120 -1.084 10.397 2.508 1.00 40.42 H new ATOM 0 HG LEU A 120 -2.110 11.323 -0.195 1.00 43.25 H new ATOM 0 HD11 LEU A 120 -3.342 9.185 -0.233 1.00 54.04 H new ATOM 0 HD12 LEU A 120 -1.579 8.939 -0.206 1.00 54.04 H new ATOM 0 HD13 LEU A 120 -2.533 8.702 1.277 1.00 54.04 H new ATOM 0 HD21 LEU A 120 -4.351 11.162 0.839 1.00 64.54 H new ATOM 0 HD22 LEU A 120 -3.593 10.781 2.403 1.00 64.54 H new ATOM 0 HD23 LEU A 120 -3.330 12.372 1.651 1.00 64.54 H new ATOM 2036 N ILE A 121 1.713 12.281 2.633 1.00 63.00 N ATOM 2037 CA ILE A 121 2.824 12.353 3.591 1.00 42.41 C ATOM 2038 C ILE A 121 2.830 13.695 4.348 1.00 63.45 C ATOM 2039 O ILE A 121 3.124 13.747 5.544 1.00 62.43 O ATOM 2040 CB ILE A 121 4.188 12.148 2.882 1.00 40.43 C ATOM 2041 CG1 ILE A 121 4.223 10.774 2.191 1.00 14.11 C ATOM 2042 CG2 ILE A 121 5.347 12.283 3.872 1.00 54.31 C ATOM 2043 CD1 ILE A 121 5.506 10.496 1.434 1.00 22.34 C ATOM 0 H ILE A 121 1.997 12.085 1.673 1.00 63.00 H new ATOM 0 HA ILE A 121 2.676 11.549 4.312 1.00 42.41 H new ATOM 0 HB ILE A 121 4.303 12.925 2.126 1.00 40.43 H new ATOM 0 HG12 ILE A 121 4.081 9.997 2.943 1.00 14.11 H new ATOM 0 HG13 ILE A 121 3.383 10.705 1.499 1.00 14.11 H new ATOM 0 HG21 ILE A 121 6.292 12.135 3.349 1.00 54.31 H new ATOM 0 HG22 ILE A 121 5.331 13.278 4.317 1.00 54.31 H new ATOM 0 HG23 ILE A 121 5.245 11.533 4.656 1.00 54.31 H new ATOM 0 HD11 ILE A 121 5.451 9.508 0.976 1.00 22.34 H new ATOM 0 HD12 ILE A 121 5.641 11.249 0.658 1.00 22.34 H new ATOM 0 HD13 ILE A 121 6.350 10.530 2.123 1.00 22.34 H new ATOM 2055 N ARG A 122 2.499 14.775 3.643 1.00 61.14 N ATOM 2056 CA ARG A 122 2.403 16.107 4.256 1.00 32.14 C ATOM 2057 C ARG A 122 1.026 16.338 4.908 1.00 75.42 C ATOM 2058 O ARG A 122 0.902 17.117 5.856 1.00 53.43 O ATOM 2059 CB ARG A 122 2.677 17.194 3.208 1.00 23.43 C ATOM 2060 CG ARG A 122 4.122 17.234 2.718 1.00 20.33 C ATOM 2061 CD ARG A 122 4.337 18.339 1.685 1.00 44.34 C ATOM 2062 NE ARG A 122 3.860 19.641 2.164 1.00 32.23 N ATOM 2063 CZ ARG A 122 4.526 20.760 2.069 1.00 61.34 C ATOM 2064 NH1 ARG A 122 5.725 20.780 1.583 1.00 33.01 N ATOM 2065 NH2 ARG A 122 3.991 21.859 2.485 1.00 13.44 N ATOM 0 H ARG A 122 2.292 14.758 2.644 1.00 61.14 H new ATOM 0 HA ARG A 122 3.157 16.163 5.041 1.00 32.14 H new ATOM 0 HB2 ARG A 122 2.019 17.035 2.354 1.00 23.43 H new ATOM 0 HB3 ARG A 122 2.421 18.165 3.631 1.00 23.43 H new ATOM 0 HG2 ARG A 122 4.789 17.393 3.565 1.00 20.33 H new ATOM 0 HG3 ARG A 122 4.385 16.271 2.281 1.00 20.33 H new ATOM 0 HD2 ARG A 122 5.398 18.408 1.444 1.00 44.34 H new ATOM 0 HD3 ARG A 122 3.817 18.079 0.763 1.00 44.34 H new ATOM 0 HE ARG A 122 2.940 19.675 2.604 1.00 32.23 H new ATOM 0 HH11 ARG A 122 6.162 19.914 1.268 1.00 33.01 H new ATOM 0 HH12 ARG A 122 6.233 21.662 1.515 1.00 33.01 H new ATOM 0 HH21 ARG A 122 3.053 21.850 2.885 1.00 13.44 H new ATOM 0 HH22 ARG A 122 4.507 22.736 2.413 1.00 13.44 H new ATOM 2079 N GLU A 123 -0.006 15.663 4.396 1.00 0.42 N ATOM 2080 CA GLU A 123 -1.356 15.769 4.965 1.00 71.24 C ATOM 2081 C GLU A 123 -1.383 15.225 6.402 1.00 11.30 C ATOM 2082 O GLU A 123 -2.044 15.783 7.279 1.00 11.33 O ATOM 2083 CB GLU A 123 -2.379 15.003 4.107 1.00 72.24 C ATOM 2084 CG GLU A 123 -2.459 15.448 2.646 1.00 73.42 C ATOM 2085 CD GLU A 123 -2.895 16.896 2.465 1.00 1.54 C ATOM 2086 OE1 GLU A 123 -3.991 17.254 2.940 1.00 52.43 O ATOM 2087 OE2 GLU A 123 -2.164 17.671 1.812 1.00 53.52 O ATOM 0 H GLU A 123 0.064 15.039 3.592 1.00 0.42 H new ATOM 0 HA GLU A 123 -1.627 16.825 4.976 1.00 71.24 H new ATOM 0 HB2 GLU A 123 -2.132 13.942 4.135 1.00 72.24 H new ATOM 0 HB3 GLU A 123 -3.365 15.113 4.559 1.00 72.24 H new ATOM 0 HG2 GLU A 123 -1.483 15.312 2.181 1.00 73.42 H new ATOM 0 HG3 GLU A 123 -3.157 14.800 2.117 1.00 73.42 H new