USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 876 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 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 163:sc= 0.435 (180deg=-0.031!) USER MOD Single : A 11 LYS NZ :NH3+ 170:sc= -0.0014 (180deg=-0.129) USER MOD Single : A 13 THR OG1 : rot -159:sc= -2.74! USER MOD Single : A 14 LYS NZ :NH3+ 167:sc=-0.00928 (180deg=-0.173) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= -0.0503 USER MOD Single : A 37 SER OG : rot 180:sc= 0.0336 USER MOD Single : A 38 MET CE :methyl 136:sc= -0.197 (180deg=-1.01) USER MOD Single : A 39 SER OG : rot -89:sc= 0.588 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -0.126 K(o=-0.13,f=-0.85) USER MOD Single : A 49 HIS : no HD1:sc= -1.51 X(o=-1.5,f=-1.7) USER MOD Single : B 201 MET CE :methyl -135:sc= 0 (180deg=-0.637) USER MOD Single : B 211 LYS NZ :NH3+ 177:sc= 0.127 (180deg=0.117) USER MOD Single : B 213 THR OG1 : rot -67:sc= 0.226 USER MOD Single : B 214 LYS NZ :NH3+ -170:sc= -0.011 (180deg=-0.157) USER MOD Single : B 221 TYR OH : rot 180:sc= 0 USER MOD Single : B 229 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 230 SER OG : rot -26:sc= 0.578 USER MOD Single : B 235 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 236 THR OG1 : rot 180:sc= 0 USER MOD Single : B 237 SER OG : rot 180:sc=-0.00717 USER MOD Single : B 238 MET CE :methyl 156:sc= -0.207 (180deg=-0.986) USER MOD Single : B 239 SER OG : rot 180:sc= -0.0938 USER MOD Single : B 241 TYR OH : rot 130:sc= 0 USER MOD Single : B 248 ASN : amide:sc= -0.224 K(o=-0.22,f=-3.3!) USER MOD Single : B 249 HIS : no HD1:sc= -1.58 K(o=-1.6,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.446 11.048 0.095 1.00 34.24 N ATOM 2 CA MET A 1 18.277 10.818 0.985 1.00 32.41 C ATOM 3 C MET A 1 18.631 11.050 2.463 1.00 74.33 C ATOM 4 O MET A 1 19.034 10.127 3.171 1.00 5.13 O ATOM 5 CB MET A 1 17.736 9.396 0.784 1.00 42.31 C ATOM 6 CG MET A 1 17.141 9.160 -0.598 1.00 73.12 C ATOM 7 SD MET A 1 18.311 9.503 -1.930 1.00 52.33 S ATOM 8 CE MET A 1 17.252 9.302 -3.363 1.00 72.42 C ATOM 0 H1 MET A 1 19.266 10.616 -0.834 1.00 34.24 H new ATOM 0 H2 MET A 1 19.597 12.070 -0.023 1.00 34.24 H new ATOM 0 H3 MET A 1 20.294 10.619 0.518 1.00 34.24 H new ATOM 0 HA MET A 1 17.506 11.540 0.716 1.00 32.41 H new ATOM 0 HB2 MET A 1 18.543 8.682 0.950 1.00 42.31 H new ATOM 0 HB3 MET A 1 16.974 9.196 1.537 1.00 42.31 H new ATOM 0 HG2 MET A 1 16.805 8.126 -0.672 1.00 73.12 H new ATOM 0 HG3 MET A 1 16.261 9.791 -0.722 1.00 73.12 H new ATOM 0 HE1 MET A 1 17.829 9.482 -4.270 1.00 72.42 H new ATOM 0 HE2 MET A 1 16.853 8.288 -3.381 1.00 72.42 H new ATOM 0 HE3 MET A 1 16.429 10.014 -3.310 1.00 72.42 H new ATOM 20 N VAL A 2 18.510 12.297 2.913 1.00 72.51 N ATOM 21 CA VAL A 2 18.723 12.645 4.325 1.00 23.33 C ATOM 22 C VAL A 2 17.409 12.540 5.119 1.00 35.51 C ATOM 23 O VAL A 2 17.411 12.442 6.348 1.00 53.12 O ATOM 24 CB VAL A 2 19.305 14.080 4.464 1.00 1.55 C ATOM 25 CG1 VAL A 2 18.316 15.133 3.963 1.00 0.42 C ATOM 26 CG2 VAL A 2 19.726 14.366 5.906 1.00 63.42 C ATOM 0 H VAL A 2 18.264 13.090 2.321 1.00 72.51 H new ATOM 0 HA VAL A 2 19.441 11.934 4.734 1.00 23.33 H new ATOM 0 HB VAL A 2 20.195 14.136 3.837 1.00 1.55 H new ATOM 0 HG11 VAL A 2 18.754 16.125 4.074 1.00 0.42 H new ATOM 0 HG12 VAL A 2 18.092 14.951 2.912 1.00 0.42 H new ATOM 0 HG13 VAL A 2 17.396 15.075 4.545 1.00 0.42 H new ATOM 0 HG21 VAL A 2 20.129 15.376 5.974 1.00 63.42 H new ATOM 0 HG22 VAL A 2 18.860 14.276 6.562 1.00 63.42 H new ATOM 0 HG23 VAL A 2 20.489 13.650 6.211 1.00 63.42 H new ATOM 36 N GLY A 3 16.287 12.560 4.399 1.00 4.13 N ATOM 37 CA GLY A 3 14.971 12.489 5.031 1.00 61.51 C ATOM 38 C GLY A 3 13.924 13.309 4.290 1.00 23.14 C ATOM 39 O GLY A 3 12.727 13.010 4.340 1.00 25.21 O ATOM 0 H GLY A 3 16.264 12.625 3.381 1.00 4.13 H new ATOM 0 HA2 GLY A 3 14.648 11.449 5.076 1.00 61.51 H new ATOM 0 HA3 GLY A 3 15.045 12.844 6.059 1.00 61.51 H new ATOM 43 N ARG A 4 14.377 14.351 3.601 1.00 63.52 N ATOM 44 CA ARG A 4 13.485 15.212 2.824 1.00 31.42 C ATOM 45 C ARG A 4 12.958 14.486 1.575 1.00 24.44 C ATOM 46 O ARG A 4 13.718 14.154 0.662 1.00 51.45 O ATOM 47 CB ARG A 4 14.213 16.504 2.427 1.00 60.31 C ATOM 48 CG ARG A 4 14.690 17.322 3.624 1.00 22.00 C ATOM 49 CD ARG A 4 15.400 18.604 3.201 1.00 22.33 C ATOM 50 NE ARG A 4 15.874 19.371 4.353 1.00 51.43 N ATOM 51 CZ ARG A 4 16.293 20.607 4.298 1.00 13.12 C ATOM 52 NH1 ARG A 4 16.324 21.249 3.177 1.00 64.23 N ATOM 53 NH2 ARG A 4 16.692 21.198 5.373 1.00 14.52 N ATOM 0 H ARG A 4 15.359 14.622 3.563 1.00 63.52 H new ATOM 0 HA ARG A 4 12.628 15.465 3.448 1.00 31.42 H new ATOM 0 HB2 ARG A 4 15.071 16.252 1.803 1.00 60.31 H new ATOM 0 HB3 ARG A 4 13.546 17.116 1.820 1.00 60.31 H new ATOM 0 HG2 ARG A 4 13.836 17.573 4.254 1.00 22.00 H new ATOM 0 HG3 ARG A 4 15.366 16.717 4.229 1.00 22.00 H new ATOM 0 HD2 ARG A 4 16.244 18.356 2.558 1.00 22.33 H new ATOM 0 HD3 ARG A 4 14.720 19.218 2.611 1.00 22.33 H new ATOM 0 HE ARG A 4 15.878 18.909 5.262 1.00 51.43 H new ATOM 0 HH11 ARG A 4 16.019 20.791 2.318 1.00 64.23 H new ATOM 0 HH12 ARG A 4 16.654 22.214 3.151 1.00 64.23 H new ATOM 0 HH21 ARG A 4 16.680 20.700 6.263 1.00 14.52 H new ATOM 0 HH22 ARG A 4 17.020 22.163 5.333 1.00 14.52 H new ATOM 67 N ARG A 5 11.654 14.229 1.550 1.00 54.44 N ATOM 68 CA ARG A 5 11.015 13.541 0.425 1.00 2.33 C ATOM 69 C ARG A 5 10.875 14.469 -0.800 1.00 72.14 C ATOM 70 O ARG A 5 10.765 15.691 -0.658 1.00 54.30 O ATOM 71 CB ARG A 5 9.645 12.990 0.864 1.00 44.41 C ATOM 72 CG ARG A 5 9.745 11.749 1.763 1.00 63.44 C ATOM 73 CD ARG A 5 8.942 11.887 3.054 1.00 33.43 C ATOM 74 NE ARG A 5 7.524 12.135 2.810 1.00 70.03 N ATOM 75 CZ ARG A 5 6.560 11.631 3.532 1.00 54.20 C ATOM 76 NH1 ARG A 5 6.815 10.786 4.482 1.00 35.15 N ATOM 77 NH2 ARG A 5 5.338 11.965 3.294 1.00 34.31 N ATOM 0 H ARG A 5 11.012 14.487 2.300 1.00 54.44 H new ATOM 0 HA ARG A 5 11.650 12.708 0.123 1.00 2.33 H new ATOM 0 HB2 ARG A 5 9.101 13.771 1.395 1.00 44.41 H new ATOM 0 HB3 ARG A 5 9.061 12.741 -0.022 1.00 44.41 H new ATOM 0 HG2 ARG A 5 9.391 10.878 1.212 1.00 63.44 H new ATOM 0 HG3 ARG A 5 10.791 11.568 2.009 1.00 63.44 H new ATOM 0 HD2 ARG A 5 9.052 10.977 3.644 1.00 33.43 H new ATOM 0 HD3 ARG A 5 9.353 12.704 3.647 1.00 33.43 H new ATOM 0 HE ARG A 5 7.271 12.739 2.028 1.00 70.03 H new ATOM 0 HH11 ARG A 5 7.778 10.508 4.672 1.00 35.15 H new ATOM 0 HH12 ARG A 5 6.053 10.399 5.039 1.00 35.15 H new ATOM 0 HH21 ARG A 5 5.126 12.622 2.543 1.00 34.31 H new ATOM 0 HH22 ARG A 5 4.583 11.573 3.857 1.00 34.31 H new ATOM 91 N PRO A 6 10.906 13.901 -2.024 1.00 15.35 N ATOM 92 CA PRO A 6 10.804 14.686 -3.271 1.00 70.23 C ATOM 93 C PRO A 6 9.488 15.479 -3.385 1.00 72.30 C ATOM 94 O PRO A 6 8.433 15.030 -2.928 1.00 53.45 O ATOM 95 CB PRO A 6 10.900 13.623 -4.382 1.00 64.41 C ATOM 96 CG PRO A 6 10.556 12.331 -3.714 1.00 61.53 C ATOM 97 CD PRO A 6 11.050 12.459 -2.299 1.00 64.41 C ATOM 0 HA PRO A 6 11.582 15.447 -3.324 1.00 70.23 H new ATOM 0 HB2 PRO A 6 10.210 13.841 -5.197 1.00 64.41 H new ATOM 0 HB3 PRO A 6 11.901 13.591 -4.811 1.00 64.41 H new ATOM 0 HG2 PRO A 6 9.481 12.152 -3.739 1.00 61.53 H new ATOM 0 HG3 PRO A 6 11.031 11.490 -4.220 1.00 61.53 H new ATOM 0 HD2 PRO A 6 10.459 11.856 -1.610 1.00 64.41 H new ATOM 0 HD3 PRO A 6 12.085 12.131 -2.202 1.00 64.41 H new ATOM 105 N GLY A 7 9.565 16.666 -3.991 1.00 25.52 N ATOM 106 CA GLY A 7 8.384 17.509 -4.166 1.00 65.00 C ATOM 107 C GLY A 7 7.886 17.537 -5.606 1.00 33.50 C ATOM 108 O GLY A 7 8.612 17.950 -6.514 1.00 54.24 O ATOM 0 H GLY A 7 10.427 17.062 -4.366 1.00 25.52 H new ATOM 0 HA2 GLY A 7 7.586 17.148 -3.517 1.00 65.00 H new ATOM 0 HA3 GLY A 7 8.618 18.525 -3.848 1.00 65.00 H new ATOM 112 N GLY A 8 6.646 17.105 -5.819 1.00 30.03 N ATOM 113 CA GLY A 8 6.089 17.061 -7.167 1.00 22.32 C ATOM 114 C GLY A 8 4.565 17.003 -7.200 1.00 22.11 C ATOM 115 O GLY A 8 3.929 17.708 -7.984 1.00 20.13 O ATOM 0 H GLY A 8 6.015 16.784 -5.085 1.00 30.03 H new ATOM 0 HA2 GLY A 8 6.422 17.941 -7.717 1.00 22.32 H new ATOM 0 HA3 GLY A 8 6.488 16.190 -7.687 1.00 22.32 H new ATOM 119 N GLY A 9 3.972 16.155 -6.361 1.00 33.05 N ATOM 120 CA GLY A 9 2.518 15.993 -6.348 1.00 74.50 C ATOM 121 C GLY A 9 1.992 15.131 -7.498 1.00 73.22 C ATOM 122 O GLY A 9 1.134 14.272 -7.298 1.00 13.43 O ATOM 0 H GLY A 9 4.470 15.574 -5.687 1.00 33.05 H new ATOM 0 HA2 GLY A 9 2.218 15.544 -5.401 1.00 74.50 H new ATOM 0 HA3 GLY A 9 2.050 16.976 -6.397 1.00 74.50 H new ATOM 126 N LEU A 10 2.490 15.379 -8.710 1.00 15.25 N ATOM 127 CA LEU A 10 2.108 14.590 -9.889 1.00 74.53 C ATOM 128 C LEU A 10 2.849 13.245 -9.917 1.00 12.44 C ATOM 129 O LEU A 10 2.234 12.184 -10.035 1.00 54.13 O ATOM 130 CB LEU A 10 2.409 15.377 -11.172 1.00 21.52 C ATOM 131 CG LEU A 10 1.767 16.773 -11.258 1.00 34.34 C ATOM 132 CD1 LEU A 10 2.159 17.463 -12.561 1.00 15.54 C ATOM 133 CD2 LEU A 10 0.248 16.684 -11.126 1.00 31.02 C ATOM 0 H LEU A 10 3.161 16.122 -8.904 1.00 15.25 H new ATOM 0 HA LEU A 10 1.038 14.392 -9.830 1.00 74.53 H new ATOM 0 HB2 LEU A 10 3.489 15.487 -11.265 1.00 21.52 H new ATOM 0 HB3 LEU A 10 2.073 14.788 -12.026 1.00 21.52 H new ATOM 0 HG LEU A 10 2.141 17.372 -10.427 1.00 34.34 H new ATOM 0 HD11 LEU A 10 1.696 18.449 -12.604 1.00 15.54 H new ATOM 0 HD12 LEU A 10 3.243 17.569 -12.605 1.00 15.54 H new ATOM 0 HD13 LEU A 10 1.819 16.865 -13.406 1.00 15.54 H new ATOM 0 HD21 LEU A 10 -0.182 17.684 -11.190 1.00 31.02 H new ATOM 0 HD22 LEU A 10 -0.151 16.065 -11.929 1.00 31.02 H new ATOM 0 HD23 LEU A 10 -0.008 16.240 -10.164 1.00 31.02 H new ATOM 145 N LYS A 11 4.180 13.304 -9.832 1.00 4.11 N ATOM 146 CA LYS A 11 5.012 12.097 -9.753 1.00 25.15 C ATOM 147 C LYS A 11 6.085 12.239 -8.658 1.00 43.12 C ATOM 148 O LYS A 11 7.262 11.923 -8.858 1.00 4.55 O ATOM 149 CB LYS A 11 5.649 11.784 -11.119 1.00 1.54 C ATOM 150 CG LYS A 11 6.542 12.888 -11.683 1.00 33.23 C ATOM 151 CD LYS A 11 7.154 12.471 -13.021 1.00 31.21 C ATOM 152 CE LYS A 11 8.069 13.543 -13.600 1.00 42.33 C ATOM 153 NZ LYS A 11 9.238 13.811 -12.722 1.00 31.02 N ATOM 0 H LYS A 11 4.708 14.177 -9.816 1.00 4.11 H new ATOM 0 HA LYS A 11 4.371 11.259 -9.482 1.00 25.15 H new ATOM 0 HB2 LYS A 11 6.238 10.872 -11.028 1.00 1.54 H new ATOM 0 HB3 LYS A 11 4.854 11.579 -11.836 1.00 1.54 H new ATOM 0 HG2 LYS A 11 5.959 13.800 -11.814 1.00 33.23 H new ATOM 0 HG3 LYS A 11 7.336 13.117 -10.972 1.00 33.23 H new ATOM 0 HD2 LYS A 11 7.719 11.548 -12.887 1.00 31.21 H new ATOM 0 HD3 LYS A 11 6.356 12.256 -13.731 1.00 31.21 H new ATOM 0 HE2 LYS A 11 8.419 13.229 -14.583 1.00 42.33 H new ATOM 0 HE3 LYS A 11 7.504 14.464 -13.742 1.00 42.33 H new ATOM 0 HZ1 LYS A 11 9.918 14.416 -13.225 1.00 31.02 H new ATOM 0 HZ2 LYS A 11 8.919 14.293 -11.857 1.00 31.02 H new ATOM 0 HZ3 LYS A 11 9.695 12.912 -12.469 1.00 31.02 H new ATOM 167 N ASP A 12 5.650 12.688 -7.483 1.00 34.41 N ATOM 168 CA ASP A 12 6.522 12.819 -6.304 1.00 35.15 C ATOM 169 C ASP A 12 6.932 11.438 -5.771 1.00 55.43 C ATOM 170 O ASP A 12 7.827 11.308 -4.934 1.00 61.42 O ATOM 171 CB ASP A 12 5.776 13.590 -5.205 1.00 52.31 C ATOM 172 CG ASP A 12 4.517 12.864 -4.727 1.00 60.11 C ATOM 173 OD1 ASP A 12 3.749 12.362 -5.576 1.00 44.32 O ATOM 174 OD2 ASP A 12 4.282 12.807 -3.502 1.00 64.32 O ATOM 0 H ASP A 12 4.685 12.973 -7.315 1.00 34.41 H new ATOM 0 HA ASP A 12 7.423 13.359 -6.595 1.00 35.15 H new ATOM 0 HB2 ASP A 12 6.444 13.746 -4.358 1.00 52.31 H new ATOM 0 HB3 ASP A 12 5.502 14.576 -5.580 1.00 52.31 H new ATOM 179 N THR A 13 6.259 10.416 -6.273 1.00 43.02 N ATOM 180 CA THR A 13 6.390 9.055 -5.767 1.00 70.24 C ATOM 181 C THR A 13 6.614 8.039 -6.900 1.00 61.21 C ATOM 182 O THR A 13 6.423 8.350 -8.077 1.00 43.55 O ATOM 183 CB THR A 13 5.117 8.669 -4.978 1.00 45.20 C ATOM 184 OG1 THR A 13 3.950 9.014 -5.743 1.00 62.24 O ATOM 185 CG2 THR A 13 5.053 9.378 -3.630 1.00 75.11 C ATOM 0 H THR A 13 5.602 10.505 -7.048 1.00 43.02 H new ATOM 0 HA THR A 13 7.263 9.028 -5.115 1.00 70.24 H new ATOM 0 HB THR A 13 5.152 7.594 -4.800 1.00 45.20 H new ATOM 0 HG1 THR A 13 3.177 9.088 -5.145 1.00 62.24 H new ATOM 0 HG21 THR A 13 4.145 9.081 -3.106 1.00 75.11 H new ATOM 0 HG22 THR A 13 5.923 9.104 -3.033 1.00 75.11 H new ATOM 0 HG23 THR A 13 5.046 10.457 -3.786 1.00 75.11 H new ATOM 193 N LYS A 14 7.043 6.829 -6.538 1.00 53.33 N ATOM 194 CA LYS A 14 7.202 5.738 -7.507 1.00 63.42 C ATOM 195 C LYS A 14 5.984 4.797 -7.464 1.00 11.12 C ATOM 196 O LYS A 14 5.470 4.487 -6.386 1.00 54.11 O ATOM 197 CB LYS A 14 8.493 4.946 -7.227 1.00 43.15 C ATOM 198 CG LYS A 14 9.783 5.726 -7.486 1.00 70.51 C ATOM 199 CD LYS A 14 9.891 6.184 -8.942 1.00 21.30 C ATOM 200 CE LYS A 14 11.245 6.826 -9.244 1.00 60.32 C ATOM 201 NZ LYS A 14 12.367 5.853 -9.131 1.00 55.05 N ATOM 0 H LYS A 14 7.287 6.577 -5.580 1.00 53.33 H new ATOM 0 HA LYS A 14 7.272 6.175 -8.503 1.00 63.42 H new ATOM 0 HB2 LYS A 14 8.484 4.617 -6.188 1.00 43.15 H new ATOM 0 HB3 LYS A 14 8.495 4.049 -7.846 1.00 43.15 H new ATOM 0 HG2 LYS A 14 9.820 6.595 -6.829 1.00 70.51 H new ATOM 0 HG3 LYS A 14 10.641 5.101 -7.237 1.00 70.51 H new ATOM 0 HD2 LYS A 14 9.740 5.330 -9.602 1.00 21.30 H new ATOM 0 HD3 LYS A 14 9.096 6.898 -9.157 1.00 21.30 H new ATOM 0 HE2 LYS A 14 11.230 7.245 -10.250 1.00 60.32 H new ATOM 0 HE3 LYS A 14 11.414 7.654 -8.556 1.00 60.32 H new ATOM 0 HZ1 LYS A 14 13.226 6.263 -9.551 1.00 55.05 H new ATOM 0 HZ2 LYS A 14 12.541 5.638 -8.128 1.00 55.05 H new ATOM 0 HZ3 LYS A 14 12.119 4.977 -9.634 1.00 55.05 H new ATOM 215 N PRO A 15 5.498 4.344 -8.637 1.00 24.11 N ATOM 216 CA PRO A 15 4.344 3.434 -8.712 1.00 23.25 C ATOM 217 C PRO A 15 4.683 1.985 -8.301 1.00 33.34 C ATOM 218 O PRO A 15 5.723 1.436 -8.681 1.00 34.50 O ATOM 219 CB PRO A 15 3.943 3.505 -10.190 1.00 42.43 C ATOM 220 CG PRO A 15 5.207 3.831 -10.912 1.00 31.14 C ATOM 221 CD PRO A 15 6.017 4.693 -9.977 1.00 14.11 C ATOM 0 HA PRO A 15 3.552 3.726 -8.022 1.00 23.25 H new ATOM 0 HB2 PRO A 15 3.525 2.559 -10.532 1.00 42.43 H new ATOM 0 HB3 PRO A 15 3.183 4.269 -10.358 1.00 42.43 H new ATOM 0 HG2 PRO A 15 5.751 2.923 -11.174 1.00 31.14 H new ATOM 0 HG3 PRO A 15 4.998 4.357 -11.844 1.00 31.14 H new ATOM 0 HD2 PRO A 15 7.083 4.482 -10.061 1.00 14.11 H new ATOM 0 HD3 PRO A 15 5.884 5.753 -10.194 1.00 14.11 H new ATOM 229 N VAL A 16 3.790 1.382 -7.521 1.00 10.30 N ATOM 230 CA VAL A 16 3.930 -0.009 -7.077 1.00 63.42 C ATOM 231 C VAL A 16 2.547 -0.669 -6.940 1.00 63.51 C ATOM 232 O VAL A 16 1.581 -0.033 -6.506 1.00 13.34 O ATOM 233 CB VAL A 16 4.692 -0.089 -5.726 1.00 33.32 C ATOM 234 CG1 VAL A 16 3.980 0.722 -4.642 1.00 20.12 C ATOM 235 CG2 VAL A 16 4.882 -1.541 -5.287 1.00 1.15 C ATOM 0 H VAL A 16 2.947 1.841 -7.177 1.00 10.30 H new ATOM 0 HA VAL A 16 4.508 -0.546 -7.830 1.00 63.42 H new ATOM 0 HB VAL A 16 5.679 0.348 -5.876 1.00 33.32 H new ATOM 0 HG11 VAL A 16 4.536 0.647 -3.708 1.00 20.12 H new ATOM 0 HG12 VAL A 16 3.923 1.767 -4.948 1.00 20.12 H new ATOM 0 HG13 VAL A 16 2.973 0.331 -4.497 1.00 20.12 H new ATOM 0 HG21 VAL A 16 5.418 -1.567 -4.338 1.00 1.15 H new ATOM 0 HG22 VAL A 16 3.908 -2.015 -5.166 1.00 1.15 H new ATOM 0 HG23 VAL A 16 5.455 -2.078 -6.043 1.00 1.15 H new ATOM 245 N VAL A 17 2.442 -1.934 -7.337 1.00 12.30 N ATOM 246 CA VAL A 17 1.164 -2.655 -7.281 1.00 4.42 C ATOM 247 C VAL A 17 1.136 -3.696 -6.147 1.00 22.34 C ATOM 248 O VAL A 17 2.087 -4.459 -5.959 1.00 11.12 O ATOM 249 CB VAL A 17 0.849 -3.344 -8.635 1.00 3.51 C ATOM 250 CG1 VAL A 17 1.921 -4.368 -9.002 1.00 44.52 C ATOM 251 CG2 VAL A 17 -0.537 -3.989 -8.613 1.00 32.34 C ATOM 0 H VAL A 17 3.221 -2.484 -7.700 1.00 12.30 H new ATOM 0 HA VAL A 17 0.396 -1.910 -7.075 1.00 4.42 H new ATOM 0 HB VAL A 17 0.851 -2.572 -9.405 1.00 3.51 H new ATOM 0 HG11 VAL A 17 1.670 -4.832 -9.956 1.00 44.52 H new ATOM 0 HG12 VAL A 17 2.887 -3.870 -9.084 1.00 44.52 H new ATOM 0 HG13 VAL A 17 1.973 -5.134 -8.228 1.00 44.52 H new ATOM 0 HG21 VAL A 17 -0.732 -4.465 -9.574 1.00 32.34 H new ATOM 0 HG22 VAL A 17 -0.577 -4.738 -7.822 1.00 32.34 H new ATOM 0 HG23 VAL A 17 -1.291 -3.224 -8.427 1.00 32.34 H new ATOM 261 N VAL A 18 0.035 -3.717 -5.394 1.00 2.14 N ATOM 262 CA VAL A 18 -0.151 -4.669 -4.288 1.00 40.21 C ATOM 263 C VAL A 18 -1.486 -5.421 -4.422 1.00 4.22 C ATOM 264 O VAL A 18 -2.498 -4.841 -4.804 1.00 31.23 O ATOM 265 CB VAL A 18 -0.095 -3.956 -2.909 1.00 50.52 C ATOM 266 CG1 VAL A 18 -1.096 -2.802 -2.845 1.00 52.14 C ATOM 267 CG2 VAL A 18 -0.342 -4.951 -1.770 1.00 24.42 C ATOM 0 H VAL A 18 -0.751 -3.081 -5.529 1.00 2.14 H new ATOM 0 HA VAL A 18 0.668 -5.386 -4.345 1.00 40.21 H new ATOM 0 HB VAL A 18 0.906 -3.541 -2.789 1.00 50.52 H new ATOM 0 HG11 VAL A 18 -1.035 -2.321 -1.869 1.00 52.14 H new ATOM 0 HG12 VAL A 18 -0.863 -2.075 -3.623 1.00 52.14 H new ATOM 0 HG13 VAL A 18 -2.105 -3.186 -2.998 1.00 52.14 H new ATOM 0 HG21 VAL A 18 -0.298 -4.428 -0.814 1.00 24.42 H new ATOM 0 HG22 VAL A 18 -1.326 -5.405 -1.890 1.00 24.42 H new ATOM 0 HG23 VAL A 18 0.422 -5.728 -1.794 1.00 24.42 H new ATOM 277 N ARG A 19 -1.488 -6.716 -4.106 1.00 21.32 N ATOM 278 CA ARG A 19 -2.697 -7.538 -4.231 1.00 51.35 C ATOM 279 C ARG A 19 -3.443 -7.659 -2.890 1.00 71.51 C ATOM 280 O ARG A 19 -2.888 -8.145 -1.906 1.00 42.50 O ATOM 281 CB ARG A 19 -2.343 -8.935 -4.758 1.00 53.14 C ATOM 282 CG ARG A 19 -1.655 -8.927 -6.121 1.00 64.33 C ATOM 283 CD ARG A 19 -1.440 -10.338 -6.659 1.00 23.21 C ATOM 284 NE ARG A 19 -2.706 -11.033 -6.894 1.00 41.04 N ATOM 285 CZ ARG A 19 -2.811 -12.184 -7.497 1.00 44.33 C ATOM 286 NH1 ARG A 19 -1.755 -12.819 -7.884 1.00 44.14 N ATOM 287 NH2 ARG A 19 -3.978 -12.705 -7.693 1.00 71.43 N ATOM 0 H ARG A 19 -0.670 -7.219 -3.762 1.00 21.32 H new ATOM 0 HA ARG A 19 -3.358 -7.041 -4.941 1.00 51.35 H new ATOM 0 HB2 ARG A 19 -1.693 -9.430 -4.037 1.00 53.14 H new ATOM 0 HB3 ARG A 19 -3.255 -9.529 -4.826 1.00 53.14 H new ATOM 0 HG2 ARG A 19 -2.257 -8.357 -6.828 1.00 64.33 H new ATOM 0 HG3 ARG A 19 -0.694 -8.419 -6.039 1.00 64.33 H new ATOM 0 HD2 ARG A 19 -0.875 -10.289 -7.590 1.00 23.21 H new ATOM 0 HD3 ARG A 19 -0.839 -10.909 -5.951 1.00 23.21 H new ATOM 0 HE ARG A 19 -3.562 -10.588 -6.564 1.00 41.04 H new ATOM 0 HH11 ARG A 19 -0.831 -12.420 -7.718 1.00 44.14 H new ATOM 0 HH12 ARG A 19 -1.845 -13.719 -8.355 1.00 44.14 H new ATOM 0 HH21 ARG A 19 -4.815 -12.215 -7.376 1.00 71.43 H new ATOM 0 HH22 ARG A 19 -4.062 -13.605 -8.165 1.00 71.43 H new ATOM 301 N LEU A 20 -4.704 -7.225 -2.863 1.00 43.43 N ATOM 302 CA LEU A 20 -5.537 -7.301 -1.649 1.00 65.21 C ATOM 303 C LEU A 20 -6.833 -8.092 -1.917 1.00 35.52 C ATOM 304 O LEU A 20 -7.273 -8.205 -3.059 1.00 14.10 O ATOM 305 CB LEU A 20 -5.872 -5.882 -1.152 1.00 62.42 C ATOM 306 CG LEU A 20 -6.691 -5.800 0.151 1.00 20.31 C ATOM 307 CD1 LEU A 20 -5.942 -6.453 1.313 1.00 52.44 C ATOM 308 CD2 LEU A 20 -7.035 -4.346 0.478 1.00 2.33 C ATOM 0 H LEU A 20 -5.177 -6.815 -3.668 1.00 43.43 H new ATOM 0 HA LEU A 20 -4.974 -7.826 -0.878 1.00 65.21 H new ATOM 0 HB2 LEU A 20 -4.938 -5.339 -1.006 1.00 62.42 H new ATOM 0 HB3 LEU A 20 -6.422 -5.364 -1.937 1.00 62.42 H new ATOM 0 HG LEU A 20 -7.621 -6.349 0.001 1.00 20.31 H new ATOM 0 HD11 LEU A 20 -6.543 -6.381 2.220 1.00 52.44 H new ATOM 0 HD12 LEU A 20 -5.757 -7.502 1.083 1.00 52.44 H new ATOM 0 HD13 LEU A 20 -4.991 -5.942 1.466 1.00 52.44 H new ATOM 0 HD21 LEU A 20 -7.613 -4.308 1.401 1.00 2.33 H new ATOM 0 HD22 LEU A 20 -6.116 -3.774 0.602 1.00 2.33 H new ATOM 0 HD23 LEU A 20 -7.621 -3.919 -0.336 1.00 2.33 H new ATOM 320 N TYR A 21 -7.440 -8.638 -0.860 1.00 65.24 N ATOM 321 CA TYR A 21 -8.661 -9.449 -0.989 1.00 12.34 C ATOM 322 C TYR A 21 -9.876 -8.591 -1.404 1.00 42.23 C ATOM 323 O TYR A 21 -10.152 -7.564 -0.784 1.00 62.35 O ATOM 324 CB TYR A 21 -8.948 -10.172 0.335 1.00 74.52 C ATOM 325 CG TYR A 21 -7.835 -11.111 0.765 1.00 75.54 C ATOM 326 CD1 TYR A 21 -6.763 -10.649 1.524 1.00 34.14 C ATOM 327 CD2 TYR A 21 -7.851 -12.454 0.402 1.00 15.35 C ATOM 328 CE1 TYR A 21 -5.745 -11.497 1.909 1.00 62.01 C ATOM 329 CE2 TYR A 21 -6.836 -13.308 0.788 1.00 14.30 C ATOM 330 CZ TYR A 21 -5.785 -12.826 1.537 1.00 32.23 C ATOM 331 OH TYR A 21 -4.771 -13.673 1.917 1.00 23.35 O ATOM 0 H TYR A 21 -7.107 -8.535 0.099 1.00 65.24 H new ATOM 0 HA TYR A 21 -8.495 -10.184 -1.776 1.00 12.34 H new ATOM 0 HB2 TYR A 21 -9.110 -9.430 1.117 1.00 74.52 H new ATOM 0 HB3 TYR A 21 -9.874 -10.739 0.237 1.00 74.52 H new ATOM 0 HD1 TYR A 21 -6.728 -9.610 1.816 1.00 34.14 H new ATOM 0 HD2 TYR A 21 -8.670 -12.835 -0.191 1.00 15.35 H new ATOM 0 HE1 TYR A 21 -4.921 -11.123 2.498 1.00 62.01 H new ATOM 0 HE2 TYR A 21 -6.866 -14.349 0.504 1.00 14.30 H new ATOM 0 HH TYR A 21 -4.952 -14.574 1.575 1.00 23.35 H new ATOM 341 N PRO A 22 -10.628 -9.019 -2.446 1.00 31.42 N ATOM 342 CA PRO A 22 -11.775 -8.257 -2.990 1.00 62.24 C ATOM 343 C PRO A 22 -12.763 -7.786 -1.910 1.00 13.11 C ATOM 344 O PRO A 22 -13.161 -6.620 -1.881 1.00 41.40 O ATOM 345 CB PRO A 22 -12.447 -9.266 -3.932 1.00 5.11 C ATOM 346 CG PRO A 22 -11.337 -10.159 -4.365 1.00 71.24 C ATOM 347 CD PRO A 22 -10.424 -10.287 -3.173 1.00 43.31 C ATOM 0 HA PRO A 22 -11.450 -7.337 -3.475 1.00 62.24 H new ATOM 0 HB2 PRO A 22 -13.232 -9.825 -3.422 1.00 5.11 H new ATOM 0 HB3 PRO A 22 -12.912 -8.768 -4.783 1.00 5.11 H new ATOM 0 HG2 PRO A 22 -11.717 -11.133 -4.673 1.00 71.24 H new ATOM 0 HG3 PRO A 22 -10.807 -9.738 -5.220 1.00 71.24 H new ATOM 0 HD2 PRO A 22 -10.685 -11.149 -2.558 1.00 43.31 H new ATOM 0 HD3 PRO A 22 -9.384 -10.414 -3.475 1.00 43.31 H new ATOM 355 N ASP A 23 -13.149 -8.703 -1.023 1.00 43.33 N ATOM 356 CA ASP A 23 -14.057 -8.390 0.085 1.00 12.51 C ATOM 357 C ASP A 23 -13.564 -7.194 0.917 1.00 3.23 C ATOM 358 O ASP A 23 -14.340 -6.308 1.277 1.00 54.21 O ATOM 359 CB ASP A 23 -14.214 -9.619 0.985 1.00 33.12 C ATOM 360 CG ASP A 23 -14.803 -10.801 0.242 1.00 42.33 C ATOM 361 OD1 ASP A 23 -14.036 -11.558 -0.394 1.00 42.14 O ATOM 362 OD2 ASP A 23 -16.038 -10.976 0.286 1.00 31.52 O ATOM 0 H ASP A 23 -12.845 -9.676 -1.050 1.00 43.33 H new ATOM 0 HA ASP A 23 -15.021 -8.116 -0.344 1.00 12.51 H new ATOM 0 HB2 ASP A 23 -13.241 -9.896 1.392 1.00 33.12 H new ATOM 0 HB3 ASP A 23 -14.854 -9.368 1.831 1.00 33.12 H new ATOM 367 N GLU A 24 -12.268 -7.173 1.213 1.00 74.54 N ATOM 368 CA GLU A 24 -11.681 -6.117 2.040 1.00 55.30 C ATOM 369 C GLU A 24 -11.456 -4.821 1.239 1.00 70.10 C ATOM 370 O GLU A 24 -11.563 -3.723 1.787 1.00 62.34 O ATOM 371 CB GLU A 24 -10.378 -6.618 2.672 1.00 64.21 C ATOM 372 CG GLU A 24 -10.586 -7.861 3.532 1.00 34.33 C ATOM 373 CD GLU A 24 -9.330 -8.312 4.259 1.00 14.53 C ATOM 374 OE1 GLU A 24 -8.525 -9.056 3.658 1.00 42.03 O ATOM 375 OE2 GLU A 24 -9.161 -7.944 5.445 1.00 23.33 O ATOM 0 H GLU A 24 -11.601 -7.875 0.893 1.00 74.54 H new ATOM 0 HA GLU A 24 -12.385 -5.873 2.835 1.00 55.30 H new ATOM 0 HB2 GLU A 24 -9.658 -6.841 1.884 1.00 64.21 H new ATOM 0 HB3 GLU A 24 -9.946 -5.825 3.283 1.00 64.21 H new ATOM 0 HG2 GLU A 24 -11.368 -7.660 4.264 1.00 34.33 H new ATOM 0 HG3 GLU A 24 -10.943 -8.675 2.900 1.00 34.33 H new ATOM 382 N ILE A 25 -11.159 -4.952 -0.056 1.00 24.02 N ATOM 383 CA ILE A 25 -11.091 -3.791 -0.959 1.00 64.40 C ATOM 384 C ILE A 25 -12.441 -3.053 -0.984 1.00 52.11 C ATOM 385 O ILE A 25 -12.510 -1.827 -0.838 1.00 43.25 O ATOM 386 CB ILE A 25 -10.722 -4.216 -2.408 1.00 53.11 C ATOM 387 CG1 ILE A 25 -9.345 -4.901 -2.443 1.00 61.44 C ATOM 388 CG2 ILE A 25 -10.744 -3.009 -3.348 1.00 34.02 C ATOM 389 CD1 ILE A 25 -8.935 -5.389 -3.821 1.00 71.15 C ATOM 0 H ILE A 25 -10.962 -5.846 -0.506 1.00 24.02 H new ATOM 0 HA ILE A 25 -10.312 -3.130 -0.579 1.00 64.40 H new ATOM 0 HB ILE A 25 -11.469 -4.932 -2.750 1.00 53.11 H new ATOM 0 HG12 ILE A 25 -8.593 -4.202 -2.077 1.00 61.44 H new ATOM 0 HG13 ILE A 25 -9.354 -5.747 -1.756 1.00 61.44 H new ATOM 0 HG21 ILE A 25 -10.483 -3.329 -4.357 1.00 34.02 H new ATOM 0 HG22 ILE A 25 -11.742 -2.570 -3.353 1.00 34.02 H new ATOM 0 HG23 ILE A 25 -10.023 -2.267 -3.004 1.00 34.02 H new ATOM 0 HD11 ILE A 25 -7.954 -5.860 -3.763 1.00 71.15 H new ATOM 0 HD12 ILE A 25 -9.665 -6.114 -4.182 1.00 71.15 H new ATOM 0 HD13 ILE A 25 -8.892 -4.544 -4.508 1.00 71.15 H new ATOM 401 N GLU A 26 -13.509 -3.823 -1.161 1.00 52.32 N ATOM 402 CA GLU A 26 -14.876 -3.295 -1.159 1.00 55.11 C ATOM 403 C GLU A 26 -15.235 -2.687 0.209 1.00 1.50 C ATOM 404 O GLU A 26 -15.786 -1.585 0.290 1.00 64.32 O ATOM 405 CB GLU A 26 -15.850 -4.422 -1.524 1.00 74.32 C ATOM 406 CG GLU A 26 -17.312 -3.996 -1.608 1.00 30.32 C ATOM 407 CD GLU A 26 -18.207 -5.117 -2.115 1.00 20.25 C ATOM 408 OE1 GLU A 26 -18.707 -5.910 -1.291 1.00 21.32 O ATOM 409 OE2 GLU A 26 -18.400 -5.222 -3.348 1.00 65.21 O ATOM 0 H GLU A 26 -13.456 -4.831 -1.310 1.00 52.32 H new ATOM 0 HA GLU A 26 -14.950 -2.498 -1.898 1.00 55.11 H new ATOM 0 HB2 GLU A 26 -15.553 -4.845 -2.484 1.00 74.32 H new ATOM 0 HB3 GLU A 26 -15.759 -5.217 -0.784 1.00 74.32 H new ATOM 0 HG2 GLU A 26 -17.653 -3.678 -0.623 1.00 30.32 H new ATOM 0 HG3 GLU A 26 -17.401 -3.135 -2.270 1.00 30.32 H new ATOM 416 N ALA A 27 -14.902 -3.403 1.283 1.00 70.14 N ATOM 417 CA ALA A 27 -15.132 -2.909 2.647 1.00 65.33 C ATOM 418 C ALA A 27 -14.311 -1.637 2.937 1.00 73.33 C ATOM 419 O ALA A 27 -14.695 -0.808 3.765 1.00 52.40 O ATOM 420 CB ALA A 27 -14.799 -3.997 3.662 1.00 42.44 C ATOM 0 H ALA A 27 -14.472 -4.327 1.238 1.00 70.14 H new ATOM 0 HA ALA A 27 -16.187 -2.648 2.734 1.00 65.33 H new ATOM 0 HB1 ALA A 27 -14.973 -3.620 4.670 1.00 42.44 H new ATOM 0 HB2 ALA A 27 -15.433 -4.866 3.485 1.00 42.44 H new ATOM 0 HB3 ALA A 27 -13.753 -4.284 3.558 1.00 42.44 H new ATOM 426 N LEU A 28 -13.177 -1.495 2.256 1.00 13.44 N ATOM 427 CA LEU A 28 -12.309 -0.323 2.425 1.00 22.30 C ATOM 428 C LEU A 28 -12.899 0.924 1.745 1.00 3.14 C ATOM 429 O LEU A 28 -13.058 1.969 2.380 1.00 65.42 O ATOM 430 CB LEU A 28 -10.908 -0.615 1.867 1.00 12.13 C ATOM 431 CG LEU A 28 -9.869 0.507 2.060 1.00 45.55 C ATOM 432 CD1 LEU A 28 -9.667 0.815 3.544 1.00 2.44 C ATOM 433 CD2 LEU A 28 -8.543 0.127 1.405 1.00 2.12 C ATOM 0 H LEU A 28 -12.833 -2.176 1.579 1.00 13.44 H new ATOM 0 HA LEU A 28 -12.236 -0.117 3.493 1.00 22.30 H new ATOM 0 HB2 LEU A 28 -10.530 -1.522 2.339 1.00 12.13 H new ATOM 0 HB3 LEU A 28 -10.997 -0.824 0.801 1.00 12.13 H new ATOM 0 HG LEU A 28 -10.248 1.407 1.576 1.00 45.55 H new ATOM 0 HD11 LEU A 28 -8.929 1.610 3.653 1.00 2.44 H new ATOM 0 HD12 LEU A 28 -10.613 1.135 3.981 1.00 2.44 H new ATOM 0 HD13 LEU A 28 -9.315 -0.080 4.057 1.00 2.44 H new ATOM 0 HD21 LEU A 28 -7.821 0.931 1.551 1.00 2.12 H new ATOM 0 HD22 LEU A 28 -8.163 -0.789 1.858 1.00 2.12 H new ATOM 0 HD23 LEU A 28 -8.697 -0.033 0.338 1.00 2.12 H new ATOM 445 N LYS A 29 -13.234 0.809 0.456 1.00 63.01 N ATOM 446 CA LYS A 29 -13.794 1.942 -0.303 1.00 14.33 C ATOM 447 C LYS A 29 -15.089 2.467 0.345 1.00 32.41 C ATOM 448 O LYS A 29 -15.446 3.636 0.192 1.00 44.43 O ATOM 449 CB LYS A 29 -14.064 1.551 -1.767 1.00 43.41 C ATOM 450 CG LYS A 29 -15.176 0.520 -1.943 1.00 55.22 C ATOM 451 CD LYS A 29 -15.533 0.305 -3.415 1.00 64.21 C ATOM 452 CE LYS A 29 -14.390 -0.330 -4.204 1.00 41.12 C ATOM 453 NZ LYS A 29 -14.737 -0.494 -5.642 1.00 54.14 N ATOM 0 H LYS A 29 -13.130 -0.050 -0.085 1.00 63.01 H new ATOM 0 HA LYS A 29 -13.050 2.739 -0.285 1.00 14.33 H new ATOM 0 HB2 LYS A 29 -14.323 2.448 -2.329 1.00 43.41 H new ATOM 0 HB3 LYS A 29 -13.146 1.156 -2.202 1.00 43.41 H new ATOM 0 HG2 LYS A 29 -14.864 -0.428 -1.504 1.00 55.22 H new ATOM 0 HG3 LYS A 29 -16.062 0.847 -1.399 1.00 55.22 H new ATOM 0 HD2 LYS A 29 -16.415 -0.331 -3.483 1.00 64.21 H new ATOM 0 HD3 LYS A 29 -15.795 1.262 -3.866 1.00 64.21 H new ATOM 0 HE2 LYS A 29 -13.498 0.289 -4.114 1.00 41.12 H new ATOM 0 HE3 LYS A 29 -14.148 -1.302 -3.775 1.00 41.12 H new ATOM 0 HZ1 LYS A 29 -13.937 -0.928 -6.145 1.00 54.14 H new ATOM 0 HZ2 LYS A 29 -15.574 -1.105 -5.730 1.00 54.14 H new ATOM 0 HZ3 LYS A 29 -14.943 0.437 -6.058 1.00 54.14 H new ATOM 467 N SER A 30 -15.775 1.591 1.077 1.00 2.40 N ATOM 468 CA SER A 30 -17.006 1.956 1.796 1.00 3.31 C ATOM 469 C SER A 30 -16.792 3.146 2.748 1.00 44.32 C ATOM 470 O SER A 30 -17.716 3.919 3.003 1.00 61.23 O ATOM 471 CB SER A 30 -17.525 0.752 2.595 1.00 74.42 C ATOM 472 OG SER A 30 -18.701 1.078 3.324 1.00 4.43 O ATOM 0 H SER A 30 -15.501 0.615 1.191 1.00 2.40 H new ATOM 0 HA SER A 30 -17.740 2.254 1.047 1.00 3.31 H new ATOM 0 HB2 SER A 30 -17.734 -0.074 1.915 1.00 74.42 H new ATOM 0 HB3 SER A 30 -16.752 0.410 3.283 1.00 74.42 H new ATOM 0 HG SER A 30 -19.007 0.290 3.821 1.00 4.43 H new ATOM 478 N ARG A 31 -15.569 3.303 3.258 1.00 42.35 N ATOM 479 CA ARG A 31 -15.279 4.350 4.251 1.00 73.02 C ATOM 480 C ARG A 31 -14.134 5.285 3.811 1.00 33.20 C ATOM 481 O ARG A 31 -13.454 5.887 4.646 1.00 10.02 O ATOM 482 CB ARG A 31 -14.963 3.702 5.611 1.00 22.30 C ATOM 483 CG ARG A 31 -13.699 2.841 5.635 1.00 70.40 C ATOM 484 CD ARG A 31 -13.566 2.079 6.952 1.00 23.44 C ATOM 485 NE ARG A 31 -12.292 1.369 7.066 1.00 53.44 N ATOM 486 CZ ARG A 31 -12.059 0.181 6.583 1.00 2.34 C ATOM 487 NH1 ARG A 31 -12.949 -0.430 5.861 1.00 25.31 N ATOM 488 NH2 ARG A 31 -10.925 -0.394 6.823 1.00 30.33 N ATOM 0 H ARG A 31 -14.767 2.726 3.005 1.00 42.35 H new ATOM 0 HA ARG A 31 -16.169 4.973 4.342 1.00 73.02 H new ATOM 0 HB2 ARG A 31 -14.863 4.489 6.358 1.00 22.30 H new ATOM 0 HB3 ARG A 31 -15.811 3.085 5.909 1.00 22.30 H new ATOM 0 HG2 ARG A 31 -13.723 2.134 4.805 1.00 70.40 H new ATOM 0 HG3 ARG A 31 -12.824 3.474 5.490 1.00 70.40 H new ATOM 0 HD2 ARG A 31 -13.664 2.778 7.783 1.00 23.44 H new ATOM 0 HD3 ARG A 31 -14.385 1.365 7.038 1.00 23.44 H new ATOM 0 HE ARG A 31 -11.532 1.837 7.559 1.00 53.44 H new ATOM 0 HH11 ARG A 31 -13.843 0.020 5.666 1.00 25.31 H new ATOM 0 HH12 ARG A 31 -12.754 -1.360 5.489 1.00 25.31 H new ATOM 0 HH21 ARG A 31 -10.221 0.082 7.387 1.00 30.33 H new ATOM 0 HH22 ARG A 31 -10.735 -1.324 6.449 1.00 30.33 H new ATOM 502 N VAL A 32 -13.928 5.424 2.500 1.00 40.50 N ATOM 503 CA VAL A 32 -12.952 6.394 1.980 1.00 44.31 C ATOM 504 C VAL A 32 -13.638 7.734 1.643 1.00 31.33 C ATOM 505 O VAL A 32 -14.747 7.751 1.098 1.00 22.51 O ATOM 506 CB VAL A 32 -12.195 5.861 0.729 1.00 25.44 C ATOM 507 CG1 VAL A 32 -11.506 4.535 1.038 1.00 33.32 C ATOM 508 CG2 VAL A 32 -13.127 5.726 -0.475 1.00 21.22 C ATOM 0 H VAL A 32 -14.415 4.886 1.783 1.00 40.50 H new ATOM 0 HA VAL A 32 -12.218 6.551 2.770 1.00 44.31 H new ATOM 0 HB VAL A 32 -11.429 6.592 0.469 1.00 25.44 H new ATOM 0 HG11 VAL A 32 -10.983 4.181 0.150 1.00 33.32 H new ATOM 0 HG12 VAL A 32 -10.790 4.677 1.848 1.00 33.32 H new ATOM 0 HG13 VAL A 32 -12.252 3.799 1.338 1.00 33.32 H new ATOM 0 HG21 VAL A 32 -12.565 5.351 -1.330 1.00 21.22 H new ATOM 0 HG22 VAL A 32 -13.931 5.030 -0.236 1.00 21.22 H new ATOM 0 HG23 VAL A 32 -13.551 6.700 -0.718 1.00 21.22 H new ATOM 518 N PRO A 33 -12.997 8.874 1.981 1.00 34.42 N ATOM 519 CA PRO A 33 -13.570 10.219 1.752 1.00 52.41 C ATOM 520 C PRO A 33 -13.992 10.473 0.292 1.00 74.02 C ATOM 521 O PRO A 33 -13.299 10.081 -0.646 1.00 13.03 O ATOM 522 CB PRO A 33 -12.423 11.162 2.143 1.00 63.44 C ATOM 523 CG PRO A 33 -11.596 10.372 3.099 1.00 54.54 C ATOM 524 CD PRO A 33 -11.669 8.947 2.622 1.00 71.12 C ATOM 0 HA PRO A 33 -14.487 10.357 2.325 1.00 52.41 H new ATOM 0 HB2 PRO A 33 -11.842 11.463 1.271 1.00 63.44 H new ATOM 0 HB3 PRO A 33 -12.800 12.074 2.605 1.00 63.44 H new ATOM 0 HG2 PRO A 33 -10.566 10.728 3.112 1.00 54.54 H new ATOM 0 HG3 PRO A 33 -11.978 10.464 4.116 1.00 54.54 H new ATOM 0 HD2 PRO A 33 -10.869 8.716 1.919 1.00 71.12 H new ATOM 0 HD3 PRO A 33 -11.581 8.241 3.448 1.00 71.12 H new ATOM 532 N ALA A 34 -15.123 11.164 0.113 1.00 0.22 N ATOM 533 CA ALA A 34 -15.657 11.475 -1.224 1.00 72.42 C ATOM 534 C ALA A 34 -14.670 12.297 -2.071 1.00 34.33 C ATOM 535 O ALA A 34 -14.614 12.152 -3.295 1.00 31.11 O ATOM 536 CB ALA A 34 -16.984 12.219 -1.092 1.00 60.20 C ATOM 0 H ALA A 34 -15.692 11.522 0.880 1.00 0.22 H new ATOM 0 HA ALA A 34 -15.815 10.529 -1.742 1.00 72.42 H new ATOM 0 HB1 ALA A 34 -17.374 12.446 -2.084 1.00 60.20 H new ATOM 0 HB2 ALA A 34 -17.699 11.595 -0.555 1.00 60.20 H new ATOM 0 HB3 ALA A 34 -16.828 13.147 -0.542 1.00 60.20 H new ATOM 542 N ASN A 35 -13.896 13.159 -1.418 1.00 75.40 N ATOM 543 CA ASN A 35 -12.902 13.993 -2.112 1.00 22.25 C ATOM 544 C ASN A 35 -11.621 13.211 -2.450 1.00 20.25 C ATOM 545 O ASN A 35 -10.811 13.658 -3.268 1.00 12.05 O ATOM 546 CB ASN A 35 -12.547 15.217 -1.259 1.00 21.12 C ATOM 547 CG ASN A 35 -13.696 16.204 -1.147 1.00 4.34 C ATOM 548 OD1 ASN A 35 -13.823 17.117 -1.954 1.00 53.41 O ATOM 549 ND2 ASN A 35 -14.536 16.037 -0.148 1.00 62.22 N ATOM 0 H ASN A 35 -13.933 13.303 -0.409 1.00 75.40 H new ATOM 0 HA ASN A 35 -13.353 14.315 -3.051 1.00 22.25 H new ATOM 0 HB2 ASN A 35 -12.257 14.888 -0.261 1.00 21.12 H new ATOM 0 HB3 ASN A 35 -11.682 15.719 -1.693 1.00 21.12 H new ATOM 0 HD21 ASN A 35 -15.320 16.678 -0.029 1.00 62.22 H new ATOM 0 HD22 ASN A 35 -14.403 15.267 0.507 1.00 62.22 H new ATOM 556 N THR A 36 -11.445 12.047 -1.830 1.00 21.11 N ATOM 557 CA THR A 36 -10.216 11.253 -1.989 1.00 35.20 C ATOM 558 C THR A 36 -10.422 10.057 -2.933 1.00 41.10 C ATOM 559 O THR A 36 -11.500 9.463 -2.987 1.00 13.23 O ATOM 560 CB THR A 36 -9.711 10.730 -0.617 1.00 21.31 C ATOM 561 OG1 THR A 36 -9.567 11.824 0.308 1.00 42.15 O ATOM 562 CG2 THR A 36 -8.371 10.007 -0.746 1.00 55.05 C ATOM 0 H THR A 36 -12.137 11.626 -1.210 1.00 21.11 H new ATOM 0 HA THR A 36 -9.471 11.918 -2.426 1.00 35.20 H new ATOM 0 HB THR A 36 -10.452 10.021 -0.247 1.00 21.31 H new ATOM 0 HG1 THR A 36 -9.250 11.484 1.170 1.00 42.15 H new ATOM 0 HG21 THR A 36 -8.051 9.656 0.235 1.00 55.05 H new ATOM 0 HG22 THR A 36 -8.480 9.156 -1.418 1.00 55.05 H new ATOM 0 HG23 THR A 36 -7.625 10.693 -1.147 1.00 55.05 H new ATOM 570 N SER A 37 -9.385 9.715 -3.691 1.00 30.50 N ATOM 571 CA SER A 37 -9.408 8.519 -4.547 1.00 45.24 C ATOM 572 C SER A 37 -8.836 7.315 -3.796 1.00 30.44 C ATOM 573 O SER A 37 -8.082 7.477 -2.835 1.00 65.44 O ATOM 574 CB SER A 37 -8.599 8.750 -5.829 1.00 22.31 C ATOM 575 OG SER A 37 -7.221 8.940 -5.543 1.00 15.41 O ATOM 0 H SER A 37 -8.515 10.245 -3.735 1.00 30.50 H new ATOM 0 HA SER A 37 -10.445 8.319 -4.815 1.00 45.24 H new ATOM 0 HB2 SER A 37 -8.720 7.897 -6.496 1.00 22.31 H new ATOM 0 HB3 SER A 37 -8.987 9.623 -6.354 1.00 22.31 H new ATOM 0 HG SER A 37 -6.730 9.083 -6.379 1.00 15.41 H new ATOM 581 N MET A 38 -9.183 6.106 -4.229 1.00 12.23 N ATOM 582 CA MET A 38 -8.674 4.894 -3.580 1.00 32.02 C ATOM 583 C MET A 38 -7.146 4.792 -3.699 1.00 32.34 C ATOM 584 O MET A 38 -6.461 4.562 -2.708 1.00 11.31 O ATOM 585 CB MET A 38 -9.329 3.638 -4.162 1.00 51.13 C ATOM 586 CG MET A 38 -10.820 3.536 -3.877 1.00 63.32 C ATOM 587 SD MET A 38 -11.514 1.960 -4.414 1.00 4.21 S ATOM 588 CE MET A 38 -10.581 0.808 -3.402 1.00 64.14 C ATOM 0 H MET A 38 -9.807 5.936 -5.017 1.00 12.23 H new ATOM 0 HA MET A 38 -8.932 4.964 -2.523 1.00 32.02 H new ATOM 0 HB2 MET A 38 -9.173 3.624 -5.241 1.00 51.13 H new ATOM 0 HB3 MET A 38 -8.830 2.758 -3.757 1.00 51.13 H new ATOM 0 HG2 MET A 38 -10.993 3.661 -2.808 1.00 63.32 H new ATOM 0 HG3 MET A 38 -11.340 4.350 -4.381 1.00 63.32 H new ATOM 0 HE1 MET A 38 -11.255 0.055 -2.993 1.00 64.14 H new ATOM 0 HE2 MET A 38 -9.820 0.321 -4.012 1.00 64.14 H new ATOM 0 HE3 MET A 38 -10.101 1.347 -2.585 1.00 64.14 H new ATOM 598 N SER A 39 -6.618 4.984 -4.908 1.00 41.21 N ATOM 599 CA SER A 39 -5.162 4.916 -5.133 1.00 13.24 C ATOM 600 C SER A 39 -4.402 5.941 -4.272 1.00 30.14 C ATOM 601 O SER A 39 -3.296 5.669 -3.801 1.00 20.43 O ATOM 602 CB SER A 39 -4.825 5.122 -6.616 1.00 12.23 C ATOM 603 OG SER A 39 -5.281 4.031 -7.404 1.00 14.14 O ATOM 0 H SER A 39 -7.166 5.187 -5.744 1.00 41.21 H new ATOM 0 HA SER A 39 -4.839 3.919 -4.833 1.00 13.24 H new ATOM 0 HB2 SER A 39 -5.282 6.046 -6.970 1.00 12.23 H new ATOM 0 HB3 SER A 39 -3.747 5.234 -6.734 1.00 12.23 H new ATOM 0 HG SER A 39 -4.584 3.343 -7.445 1.00 14.14 H new ATOM 609 N ALA A 40 -4.992 7.118 -4.065 1.00 63.34 N ATOM 610 CA ALA A 40 -4.396 8.128 -3.180 1.00 73.01 C ATOM 611 C ALA A 40 -4.546 7.725 -1.704 1.00 42.32 C ATOM 612 O ALA A 40 -3.624 7.890 -0.901 1.00 21.21 O ATOM 613 CB ALA A 40 -5.027 9.496 -3.425 1.00 30.30 C ATOM 0 H ALA A 40 -5.875 7.398 -4.492 1.00 63.34 H new ATOM 0 HA ALA A 40 -3.332 8.190 -3.409 1.00 73.01 H new ATOM 0 HB1 ALA A 40 -4.573 10.231 -2.760 1.00 30.30 H new ATOM 0 HB2 ALA A 40 -4.862 9.793 -4.461 1.00 30.30 H new ATOM 0 HB3 ALA A 40 -6.098 9.443 -3.229 1.00 30.30 H new ATOM 619 N TYR A 41 -5.712 7.178 -1.362 1.00 20.23 N ATOM 620 CA TYR A 41 -6.001 6.751 0.011 1.00 60.35 C ATOM 621 C TYR A 41 -5.068 5.611 0.452 1.00 20.21 C ATOM 622 O TYR A 41 -4.622 5.568 1.601 1.00 44.55 O ATOM 623 CB TYR A 41 -7.470 6.316 0.127 1.00 71.13 C ATOM 624 CG TYR A 41 -7.923 6.036 1.550 1.00 22.12 C ATOM 625 CD1 TYR A 41 -8.232 7.080 2.417 1.00 54.13 C ATOM 626 CD2 TYR A 41 -8.038 4.732 2.025 1.00 51.43 C ATOM 627 CE1 TYR A 41 -8.644 6.833 3.713 1.00 2.33 C ATOM 628 CE2 TYR A 41 -8.449 4.480 3.321 1.00 53.15 C ATOM 629 CZ TYR A 41 -8.749 5.534 4.159 1.00 24.14 C ATOM 630 OH TYR A 41 -9.153 5.285 5.452 1.00 44.13 O ATOM 0 H TYR A 41 -6.476 7.019 -2.018 1.00 20.23 H new ATOM 0 HA TYR A 41 -5.825 7.598 0.674 1.00 60.35 H new ATOM 0 HB2 TYR A 41 -8.103 7.095 -0.298 1.00 71.13 H new ATOM 0 HB3 TYR A 41 -7.621 5.419 -0.474 1.00 71.13 H new ATOM 0 HD1 TYR A 41 -8.148 8.100 2.071 1.00 54.13 H new ATOM 0 HD2 TYR A 41 -7.803 3.905 1.371 1.00 51.43 H new ATOM 0 HE1 TYR A 41 -8.882 7.654 4.373 1.00 2.33 H new ATOM 0 HE2 TYR A 41 -8.535 3.463 3.675 1.00 53.15 H new ATOM 0 HH TYR A 41 -9.176 4.318 5.607 1.00 44.13 H new ATOM 640 N ILE A 42 -4.771 4.692 -0.467 1.00 74.32 N ATOM 641 CA ILE A 42 -3.833 3.601 -0.184 1.00 64.25 C ATOM 642 C ILE A 42 -2.433 4.152 0.136 1.00 55.43 C ATOM 643 O ILE A 42 -1.735 3.628 1.007 1.00 21.00 O ATOM 644 CB ILE A 42 -3.734 2.598 -1.366 1.00 13.11 C ATOM 645 CG1 ILE A 42 -5.113 1.995 -1.692 1.00 4.33 C ATOM 646 CG2 ILE A 42 -2.730 1.487 -1.052 1.00 75.11 C ATOM 647 CD1 ILE A 42 -5.719 1.196 -0.557 1.00 64.21 C ATOM 0 H ILE A 42 -5.163 4.679 -1.409 1.00 74.32 H new ATOM 0 HA ILE A 42 -4.222 3.069 0.684 1.00 64.25 H new ATOM 0 HB ILE A 42 -3.383 3.145 -2.241 1.00 13.11 H new ATOM 0 HG12 ILE A 42 -5.796 2.801 -1.961 1.00 4.33 H new ATOM 0 HG13 ILE A 42 -5.019 1.351 -2.567 1.00 4.33 H new ATOM 0 HG21 ILE A 42 -2.677 0.796 -1.893 1.00 75.11 H new ATOM 0 HG22 ILE A 42 -1.747 1.924 -0.878 1.00 75.11 H new ATOM 0 HG23 ILE A 42 -3.050 0.948 -0.160 1.00 75.11 H new ATOM 0 HD11 ILE A 42 -6.689 0.805 -0.865 1.00 64.21 H new ATOM 0 HD12 ILE A 42 -5.058 0.368 -0.302 1.00 64.21 H new ATOM 0 HD13 ILE A 42 -5.847 1.840 0.313 1.00 64.21 H new ATOM 659 N ARG A 43 -2.031 5.223 -0.565 1.00 61.44 N ATOM 660 CA ARG A 43 -0.749 5.884 -0.286 1.00 24.14 C ATOM 661 C ARG A 43 -0.705 6.376 1.168 1.00 53.33 C ATOM 662 O ARG A 43 0.321 6.275 1.834 1.00 23.35 O ATOM 663 CB ARG A 43 -0.490 7.057 -1.256 1.00 41.05 C ATOM 664 CG ARG A 43 0.865 7.733 -1.037 1.00 55.50 C ATOM 665 CD ARG A 43 1.223 8.719 -2.152 1.00 73.22 C ATOM 666 NE ARG A 43 0.388 9.922 -2.145 1.00 14.45 N ATOM 667 CZ ARG A 43 0.695 11.039 -2.765 1.00 63.30 C ATOM 668 NH1 ARG A 43 1.811 11.149 -3.422 1.00 23.01 N ATOM 669 NH2 ARG A 43 -0.111 12.050 -2.701 1.00 1.41 N ATOM 0 H ARG A 43 -2.569 5.646 -1.321 1.00 61.44 H new ATOM 0 HA ARG A 43 0.041 5.148 -0.436 1.00 24.14 H new ATOM 0 HB2 ARG A 43 -0.544 6.691 -2.281 1.00 41.05 H new ATOM 0 HB3 ARG A 43 -1.281 7.798 -1.140 1.00 41.05 H new ATOM 0 HG2 ARG A 43 0.853 8.259 -0.083 1.00 55.50 H new ATOM 0 HG3 ARG A 43 1.640 6.970 -0.970 1.00 55.50 H new ATOM 0 HD2 ARG A 43 2.269 9.009 -2.050 1.00 73.22 H new ATOM 0 HD3 ARG A 43 1.123 8.220 -3.116 1.00 73.22 H new ATOM 0 HE ARG A 43 -0.489 9.891 -1.625 1.00 14.45 H new ATOM 0 HH11 ARG A 43 2.460 10.363 -3.460 1.00 23.01 H new ATOM 0 HH12 ARG A 43 2.038 12.021 -3.899 1.00 23.01 H new ATOM 0 HH21 ARG A 43 -0.980 11.977 -2.171 1.00 1.41 H new ATOM 0 HH22 ARG A 43 0.122 12.920 -3.180 1.00 1.41 H new ATOM 683 N ARG A 44 -1.830 6.897 1.654 1.00 42.11 N ATOM 684 CA ARG A 44 -1.959 7.288 3.062 1.00 42.43 C ATOM 685 C ARG A 44 -1.794 6.072 3.989 1.00 73.52 C ATOM 686 O ARG A 44 -1.011 6.105 4.939 1.00 43.13 O ATOM 687 CB ARG A 44 -3.323 7.950 3.302 1.00 62.22 C ATOM 688 CG ARG A 44 -3.601 8.280 4.767 1.00 10.13 C ATOM 689 CD ARG A 44 -4.993 8.872 4.962 1.00 22.43 C ATOM 690 NE ARG A 44 -5.304 9.096 6.374 1.00 42.10 N ATOM 691 CZ ARG A 44 -6.488 9.412 6.823 1.00 41.40 C ATOM 692 NH1 ARG A 44 -7.472 9.602 6.003 1.00 21.23 N ATOM 693 NH2 ARG A 44 -6.683 9.551 8.094 1.00 0.23 N ATOM 0 H ARG A 44 -2.668 7.059 1.095 1.00 42.11 H new ATOM 0 HA ARG A 44 -1.168 8.002 3.291 1.00 42.43 H new ATOM 0 HB2 ARG A 44 -3.379 8.867 2.716 1.00 62.22 H new ATOM 0 HB3 ARG A 44 -4.107 7.288 2.934 1.00 62.22 H new ATOM 0 HG2 ARG A 44 -3.504 7.376 5.368 1.00 10.13 H new ATOM 0 HG3 ARG A 44 -2.853 8.985 5.129 1.00 10.13 H new ATOM 0 HD2 ARG A 44 -5.064 9.816 4.422 1.00 22.43 H new ATOM 0 HD3 ARG A 44 -5.735 8.201 4.530 1.00 22.43 H new ATOM 0 HE ARG A 44 -4.547 8.999 7.051 1.00 42.10 H new ATOM 0 HH11 ARG A 44 -7.325 9.505 4.998 1.00 21.23 H new ATOM 0 HH12 ARG A 44 -8.394 9.849 6.362 1.00 21.23 H new ATOM 0 HH21 ARG A 44 -5.911 9.414 8.746 1.00 0.23 H new ATOM 0 HH22 ARG A 44 -7.609 9.798 8.444 1.00 0.23 H new ATOM 707 N ILE A 45 -2.533 5.001 3.690 1.00 0.33 N ATOM 708 CA ILE A 45 -2.487 3.764 4.485 1.00 73.40 C ATOM 709 C ILE A 45 -1.053 3.237 4.651 1.00 34.11 C ATOM 710 O ILE A 45 -0.610 2.946 5.767 1.00 34.41 O ATOM 711 CB ILE A 45 -3.361 2.651 3.843 1.00 51.32 C ATOM 712 CG1 ILE A 45 -4.844 3.062 3.840 1.00 35.13 C ATOM 713 CG2 ILE A 45 -3.169 1.315 4.565 1.00 21.35 C ATOM 714 CD1 ILE A 45 -5.767 2.023 3.231 1.00 3.23 C ATOM 0 H ILE A 45 -3.175 4.963 2.899 1.00 0.33 H new ATOM 0 HA ILE A 45 -2.882 4.018 5.469 1.00 73.40 H new ATOM 0 HB ILE A 45 -3.038 2.522 2.810 1.00 51.32 H new ATOM 0 HG12 ILE A 45 -5.159 3.258 4.865 1.00 35.13 H new ATOM 0 HG13 ILE A 45 -4.951 3.997 3.289 1.00 35.13 H new ATOM 0 HG21 ILE A 45 -3.792 0.554 4.095 1.00 21.35 H new ATOM 0 HG22 ILE A 45 -2.123 1.015 4.504 1.00 21.35 H new ATOM 0 HG23 ILE A 45 -3.455 1.422 5.611 1.00 21.35 H new ATOM 0 HD11 ILE A 45 -6.795 2.385 3.265 1.00 3.23 H new ATOM 0 HD12 ILE A 45 -5.480 1.844 2.195 1.00 3.23 H new ATOM 0 HD13 ILE A 45 -5.691 1.093 3.795 1.00 3.23 H new ATOM 726 N ILE A 46 -0.335 3.103 3.537 1.00 14.32 N ATOM 727 CA ILE A 46 1.040 2.602 3.571 1.00 22.14 C ATOM 728 C ILE A 46 2.010 3.633 4.176 1.00 40.10 C ATOM 729 O ILE A 46 2.894 3.272 4.953 1.00 41.44 O ATOM 730 CB ILE A 46 1.534 2.166 2.164 1.00 30.31 C ATOM 731 CG1 ILE A 46 1.506 3.341 1.174 1.00 43.21 C ATOM 732 CG2 ILE A 46 0.687 1.004 1.645 1.00 63.43 C ATOM 733 CD1 ILE A 46 1.929 2.972 -0.236 1.00 70.25 C ATOM 0 H ILE A 46 -0.679 3.332 2.605 1.00 14.32 H new ATOM 0 HA ILE A 46 1.029 1.723 4.215 1.00 22.14 H new ATOM 0 HB ILE A 46 2.568 1.835 2.255 1.00 30.31 H new ATOM 0 HG12 ILE A 46 0.497 3.753 1.143 1.00 43.21 H new ATOM 0 HG13 ILE A 46 2.161 4.130 1.544 1.00 43.21 H new ATOM 0 HG21 ILE A 46 1.042 0.707 0.658 1.00 63.43 H new ATOM 0 HG22 ILE A 46 0.769 0.160 2.330 1.00 63.43 H new ATOM 0 HG23 ILE A 46 -0.355 1.316 1.577 1.00 63.43 H new ATOM 0 HD11 ILE A 46 1.882 3.855 -0.873 1.00 70.25 H new ATOM 0 HD12 ILE A 46 2.949 2.589 -0.221 1.00 70.25 H new ATOM 0 HD13 ILE A 46 1.260 2.206 -0.628 1.00 70.25 H new ATOM 745 N LEU A 47 1.828 4.915 3.844 1.00 21.31 N ATOM 746 CA LEU A 47 2.675 5.991 4.386 1.00 43.22 C ATOM 747 C LEU A 47 2.653 5.991 5.923 1.00 22.43 C ATOM 748 O LEU A 47 3.700 6.004 6.572 1.00 61.01 O ATOM 749 CB LEU A 47 2.204 7.354 3.854 1.00 12.14 C ATOM 750 CG LEU A 47 3.032 8.568 4.310 1.00 30.24 C ATOM 751 CD1 LEU A 47 4.489 8.426 3.876 1.00 13.32 C ATOM 752 CD2 LEU A 47 2.426 9.863 3.767 1.00 71.22 C ATOM 0 H LEU A 47 1.103 5.236 3.203 1.00 21.31 H new ATOM 0 HA LEU A 47 3.699 5.812 4.059 1.00 43.22 H new ATOM 0 HB2 LEU A 47 2.211 7.321 2.765 1.00 12.14 H new ATOM 0 HB3 LEU A 47 1.169 7.506 4.162 1.00 12.14 H new ATOM 0 HG LEU A 47 3.009 8.609 5.399 1.00 30.24 H new ATOM 0 HD11 LEU A 47 5.054 9.296 4.210 1.00 13.32 H new ATOM 0 HD12 LEU A 47 4.914 7.525 4.319 1.00 13.32 H new ATOM 0 HD13 LEU A 47 4.540 8.355 2.789 1.00 13.32 H new ATOM 0 HD21 LEU A 47 3.024 10.712 4.099 1.00 71.22 H new ATOM 0 HD22 LEU A 47 2.415 9.831 2.678 1.00 71.22 H new ATOM 0 HD23 LEU A 47 1.406 9.971 4.137 1.00 71.22 H new ATOM 764 N ASN A 48 1.446 5.936 6.494 1.00 22.11 N ATOM 765 CA ASN A 48 1.267 5.908 7.954 1.00 20.44 C ATOM 766 C ASN A 48 1.920 4.674 8.599 1.00 44.14 C ATOM 767 O ASN A 48 1.993 4.572 9.825 1.00 20.32 O ATOM 768 CB ASN A 48 -0.226 5.949 8.304 1.00 11.43 C ATOM 769 CG ASN A 48 -0.868 7.275 7.942 1.00 10.42 C ATOM 770 OD1 ASN A 48 -0.228 8.316 7.978 1.00 71.42 O ATOM 771 ND2 ASN A 48 -2.134 7.252 7.583 1.00 63.35 N ATOM 0 H ASN A 48 0.573 5.910 5.967 1.00 22.11 H new ATOM 0 HA ASN A 48 1.765 6.790 8.356 1.00 20.44 H new ATOM 0 HB2 ASN A 48 -0.741 5.144 7.781 1.00 11.43 H new ATOM 0 HB3 ASN A 48 -0.351 5.767 9.371 1.00 11.43 H new ATOM 0 HD21 ASN A 48 -2.607 8.118 7.325 1.00 63.35 H new ATOM 0 HD22 ASN A 48 -2.642 6.368 7.562 1.00 63.35 H new ATOM 778 N HIS A 49 2.379 3.733 7.777 1.00 54.10 N ATOM 779 CA HIS A 49 3.072 2.544 8.276 1.00 65.31 C ATOM 780 C HIS A 49 4.553 2.539 7.846 1.00 54.54 C ATOM 781 O HIS A 49 5.386 1.878 8.469 1.00 71.01 O ATOM 782 CB HIS A 49 2.360 1.277 7.791 1.00 23.11 C ATOM 783 CG HIS A 49 2.688 0.061 8.599 1.00 20.13 C ATOM 784 ND1 HIS A 49 2.139 -0.186 9.838 1.00 44.32 N ATOM 785 CD2 HIS A 49 3.501 -0.987 8.340 1.00 41.15 C ATOM 786 CE1 HIS A 49 2.595 -1.330 10.300 1.00 61.32 C ATOM 787 NE2 HIS A 49 3.426 -1.839 9.412 1.00 75.54 N ATOM 0 H HIS A 49 2.284 3.769 6.762 1.00 54.10 H new ATOM 0 HA HIS A 49 3.046 2.565 9.365 1.00 65.31 H new ATOM 0 HB2 HIS A 49 1.283 1.442 7.819 1.00 23.11 H new ATOM 0 HB3 HIS A 49 2.628 1.095 6.750 1.00 23.11 H new ATOM 0 HD2 HIS A 49 4.100 -1.128 7.452 1.00 41.15 H new ATOM 0 HE1 HIS A 49 2.333 -1.777 11.247 1.00 61.32 H new ATOM 0 HE2 HIS A 49 3.930 -2.721 9.507 1.00 75.54 H new ATOM 796 N LEU A 50 4.873 3.284 6.787 1.00 42.00 N ATOM 797 CA LEU A 50 6.263 3.449 6.338 1.00 34.23 C ATOM 798 C LEU A 50 7.036 4.382 7.282 1.00 72.53 C ATOM 799 O LEU A 50 8.054 3.992 7.860 1.00 40.24 O ATOM 800 CB LEU A 50 6.311 3.985 4.892 1.00 15.30 C ATOM 801 CG LEU A 50 6.499 2.920 3.794 1.00 42.23 C ATOM 802 CD1 LEU A 50 7.857 2.236 3.933 1.00 20.23 C ATOM 803 CD2 LEU A 50 5.372 1.890 3.827 1.00 11.11 C ATOM 0 H LEU A 50 4.189 3.785 6.220 1.00 42.00 H new ATOM 0 HA LEU A 50 6.741 2.470 6.358 1.00 34.23 H new ATOM 0 HB2 LEU A 50 5.386 4.527 4.693 1.00 15.30 H new ATOM 0 HB3 LEU A 50 7.125 4.706 4.817 1.00 15.30 H new ATOM 0 HG LEU A 50 6.465 3.425 2.829 1.00 42.23 H new ATOM 0 HD11 LEU A 50 7.970 1.488 3.148 1.00 20.23 H new ATOM 0 HD12 LEU A 50 8.650 2.979 3.842 1.00 20.23 H new ATOM 0 HD13 LEU A 50 7.923 1.752 4.908 1.00 20.23 H new ATOM 0 HD21 LEU A 50 5.531 1.151 3.041 1.00 11.11 H new ATOM 0 HD22 LEU A 50 5.362 1.392 4.797 1.00 11.11 H new ATOM 0 HD23 LEU A 50 4.417 2.390 3.667 1.00 11.11 H new ATOM 815 N GLU A 51 6.539 5.610 7.455 1.00 31.32 N ATOM 816 CA GLU A 51 7.144 6.556 8.400 1.00 44.14 C ATOM 817 C GLU A 51 6.985 6.056 9.847 1.00 33.03 C ATOM 818 O GLU A 51 7.654 6.537 10.766 1.00 25.11 O ATOM 819 CB GLU A 51 6.516 7.950 8.249 1.00 71.43 C ATOM 820 CG GLU A 51 5.050 8.026 8.668 1.00 61.04 C ATOM 821 CD GLU A 51 4.483 9.432 8.547 1.00 1.22 C ATOM 822 OE1 GLU A 51 4.932 10.323 9.299 1.00 73.30 O ATOM 823 OE2 GLU A 51 3.594 9.657 7.700 1.00 2.03 O ATOM 0 H GLU A 51 5.725 5.972 6.958 1.00 31.32 H new ATOM 0 HA GLU A 51 8.208 6.627 8.172 1.00 44.14 H new ATOM 0 HB2 GLU A 51 7.089 8.661 8.844 1.00 71.43 H new ATOM 0 HB3 GLU A 51 6.601 8.264 7.209 1.00 71.43 H new ATOM 0 HG2 GLU A 51 4.463 7.346 8.050 1.00 61.04 H new ATOM 0 HG3 GLU A 51 4.952 7.685 9.699 1.00 61.04 H new ATOM 830 N ASP A 52 6.079 5.101 10.040 1.00 14.40 N ATOM 831 CA ASP A 52 5.900 4.437 11.331 1.00 10.24 C ATOM 832 C ASP A 52 7.047 3.448 11.591 1.00 22.02 C ATOM 833 O ASP A 52 7.650 3.439 12.669 1.00 3.30 O ATOM 834 CB ASP A 52 4.552 3.708 11.358 1.00 75.42 C ATOM 835 CG ASP A 52 4.288 3.016 12.682 1.00 4.41 C ATOM 836 OD1 ASP A 52 3.906 3.708 13.648 1.00 34.45 O ATOM 837 OD2 ASP A 52 4.449 1.780 12.761 1.00 33.14 O ATOM 0 H ASP A 52 5.450 4.766 9.310 1.00 14.40 H new ATOM 0 HA ASP A 52 5.912 5.190 12.119 1.00 10.24 H new ATOM 0 HB2 ASP A 52 3.753 4.423 11.160 1.00 75.42 H new ATOM 0 HB3 ASP A 52 4.526 2.971 10.556 1.00 75.42 H new ATOM 842 N GLU A 53 7.341 2.615 10.594 1.00 74.45 N ATOM 843 CA GLU A 53 8.461 1.672 10.671 1.00 42.33 C ATOM 844 C GLU A 53 9.583 2.090 9.715 1.00 31.12 C ATOM 845 O GLU A 53 10.690 1.539 9.747 1.00 62.32 O ATOM 846 CB GLU A 53 7.988 0.245 10.347 1.00 43.34 C ATOM 847 CG GLU A 53 6.847 -0.245 11.238 1.00 1.55 C ATOM 848 CD GLU A 53 6.413 -1.669 10.921 1.00 53.41 C ATOM 849 OE1 GLU A 53 6.153 -1.970 9.739 1.00 31.00 O ATOM 850 OE2 GLU A 53 6.312 -2.494 11.854 1.00 72.02 O ATOM 0 H GLU A 53 6.818 2.572 9.719 1.00 74.45 H new ATOM 0 HA GLU A 53 8.850 1.686 11.689 1.00 42.33 H new ATOM 0 HB2 GLU A 53 7.666 0.207 9.306 1.00 43.34 H new ATOM 0 HB3 GLU A 53 8.832 -0.438 10.445 1.00 43.34 H new ATOM 0 HG2 GLU A 53 7.159 -0.190 12.281 1.00 1.55 H new ATOM 0 HG3 GLU A 53 5.993 0.423 11.125 1.00 1.55 H new TER 857 GLU A 53 ATOM 858 N MET B 201 -23.417 -16.031 5.498 1.00 33.22 N ATOM 859 CA MET B 201 -22.543 -15.744 4.360 1.00 30.11 C ATOM 860 C MET B 201 -23.354 -15.535 3.074 1.00 43.21 C ATOM 861 O MET B 201 -24.110 -16.412 2.660 1.00 33.43 O ATOM 862 CB MET B 201 -21.543 -16.892 4.153 1.00 63.12 C ATOM 863 CG MET B 201 -20.644 -17.160 5.351 1.00 35.03 C ATOM 864 SD MET B 201 -19.441 -18.466 5.028 1.00 13.30 S ATOM 865 CE MET B 201 -18.581 -18.535 6.598 1.00 15.33 C ATOM 0 HA MET B 201 -22.002 -14.824 4.582 1.00 30.11 H new ATOM 0 HB2 MET B 201 -22.095 -17.802 3.917 1.00 63.12 H new ATOM 0 HB3 MET B 201 -20.919 -16.664 3.289 1.00 63.12 H new ATOM 0 HG2 MET B 201 -20.118 -16.244 5.620 1.00 35.03 H new ATOM 0 HG3 MET B 201 -21.258 -17.439 6.208 1.00 35.03 H new ATOM 0 HE1 MET B 201 -17.506 -18.583 6.422 1.00 15.33 H new ATOM 0 HE2 MET B 201 -18.814 -17.643 7.180 1.00 15.33 H new ATOM 0 HE3 MET B 201 -18.899 -19.421 7.148 1.00 15.33 H new ATOM 875 N VAL B 202 -23.217 -14.362 2.454 1.00 12.15 N ATOM 876 CA VAL B 202 -23.846 -14.101 1.148 1.00 11.53 C ATOM 877 C VAL B 202 -22.790 -14.021 0.026 1.00 62.21 C ATOM 878 O VAL B 202 -23.061 -13.521 -1.070 1.00 44.23 O ATOM 879 CB VAL B 202 -24.693 -12.799 1.170 1.00 61.53 C ATOM 880 CG1 VAL B 202 -25.828 -12.910 2.188 1.00 74.53 C ATOM 881 CG2 VAL B 202 -23.827 -11.576 1.462 1.00 71.11 C ATOM 0 H VAL B 202 -22.681 -13.579 2.828 1.00 12.15 H new ATOM 0 HA VAL B 202 -24.512 -14.939 0.944 1.00 11.53 H new ATOM 0 HB VAL B 202 -25.128 -12.670 0.179 1.00 61.53 H new ATOM 0 HG11 VAL B 202 -26.409 -11.988 2.187 1.00 74.53 H new ATOM 0 HG12 VAL B 202 -26.475 -13.746 1.922 1.00 74.53 H new ATOM 0 HG13 VAL B 202 -25.411 -13.075 3.181 1.00 74.53 H new ATOM 0 HG21 VAL B 202 -24.451 -10.682 1.470 1.00 71.11 H new ATOM 0 HG22 VAL B 202 -23.348 -11.693 2.434 1.00 71.11 H new ATOM 0 HG23 VAL B 202 -23.063 -11.478 0.690 1.00 71.11 H new ATOM 891 N GLY B 203 -21.598 -14.545 0.306 1.00 50.12 N ATOM 892 CA GLY B 203 -20.513 -14.544 -0.672 1.00 42.15 C ATOM 893 C GLY B 203 -19.208 -15.102 -0.104 1.00 15.33 C ATOM 894 O GLY B 203 -19.172 -16.239 0.370 1.00 64.53 O ATOM 0 H GLY B 203 -21.360 -14.975 1.200 1.00 50.12 H new ATOM 0 HA2 GLY B 203 -20.810 -15.135 -1.539 1.00 42.15 H new ATOM 0 HA3 GLY B 203 -20.346 -13.526 -1.023 1.00 42.15 H new ATOM 898 N ARG B 204 -18.145 -14.289 -0.149 1.00 21.42 N ATOM 899 CA ARG B 204 -16.816 -14.664 0.371 1.00 42.44 C ATOM 900 C ARG B 204 -16.129 -15.741 -0.486 1.00 62.35 C ATOM 901 O ARG B 204 -16.755 -16.367 -1.344 1.00 24.21 O ATOM 902 CB ARG B 204 -16.905 -15.136 1.835 1.00 55.21 C ATOM 903 CG ARG B 204 -17.390 -14.064 2.805 1.00 32.24 C ATOM 904 CD ARG B 204 -17.507 -14.598 4.229 1.00 54.02 C ATOM 905 NE ARG B 204 -17.861 -13.549 5.181 1.00 44.41 N ATOM 906 CZ ARG B 204 -18.269 -13.768 6.401 1.00 62.34 C ATOM 907 NH1 ARG B 204 -18.403 -14.976 6.848 1.00 61.11 N ATOM 908 NH2 ARG B 204 -18.531 -12.770 7.179 1.00 62.34 N ATOM 0 H ARG B 204 -18.178 -13.350 -0.547 1.00 21.42 H new ATOM 0 HA ARG B 204 -16.203 -13.764 0.322 1.00 42.44 H new ATOM 0 HB2 ARG B 204 -17.578 -15.992 1.890 1.00 55.21 H new ATOM 0 HB3 ARG B 204 -15.922 -15.482 2.154 1.00 55.21 H new ATOM 0 HG2 ARG B 204 -16.700 -13.221 2.789 1.00 32.24 H new ATOM 0 HG3 ARG B 204 -18.359 -13.689 2.477 1.00 32.24 H new ATOM 0 HD2 ARG B 204 -18.261 -15.385 4.260 1.00 54.02 H new ATOM 0 HD3 ARG B 204 -16.561 -15.051 4.525 1.00 54.02 H new ATOM 0 HE ARG B 204 -17.784 -12.580 4.872 1.00 44.41 H new ATOM 0 HH11 ARG B 204 -18.189 -15.770 6.244 1.00 61.11 H new ATOM 0 HH12 ARG B 204 -18.723 -15.134 7.804 1.00 61.11 H new ATOM 0 HH21 ARG B 204 -18.419 -11.815 6.839 1.00 62.34 H new ATOM 0 HH22 ARG B 204 -18.850 -12.937 8.133 1.00 62.34 H new ATOM 922 N ARG B 205 -14.828 -15.938 -0.246 1.00 31.53 N ATOM 923 CA ARG B 205 -14.040 -16.974 -0.935 1.00 54.04 C ATOM 924 C ARG B 205 -14.159 -16.858 -2.473 1.00 72.13 C ATOM 925 O ARG B 205 -14.556 -17.814 -3.147 1.00 74.31 O ATOM 926 CB ARG B 205 -14.491 -18.372 -0.468 1.00 54.40 C ATOM 927 CG ARG B 205 -14.664 -18.497 1.046 1.00 44.11 C ATOM 928 CD ARG B 205 -13.376 -18.197 1.803 1.00 22.03 C ATOM 929 NE ARG B 205 -13.576 -18.206 3.254 1.00 32.53 N ATOM 930 CZ ARG B 205 -12.853 -18.900 4.093 1.00 73.41 C ATOM 931 NH1 ARG B 205 -11.923 -19.693 3.665 1.00 62.51 N ATOM 932 NH2 ARG B 205 -13.079 -18.816 5.362 1.00 3.11 N ATOM 0 H ARG B 205 -14.292 -15.389 0.426 1.00 31.53 H new ATOM 0 HA ARG B 205 -12.992 -16.825 -0.676 1.00 54.04 H new ATOM 0 HB2 ARG B 205 -15.436 -18.618 -0.953 1.00 54.40 H new ATOM 0 HB3 ARG B 205 -13.760 -19.108 -0.802 1.00 54.40 H new ATOM 0 HG2 ARG B 205 -15.445 -17.813 1.378 1.00 44.11 H new ATOM 0 HG3 ARG B 205 -14.999 -19.505 1.289 1.00 44.11 H new ATOM 0 HD2 ARG B 205 -12.619 -18.935 1.537 1.00 22.03 H new ATOM 0 HD3 ARG B 205 -12.994 -17.224 1.496 1.00 22.03 H new ATOM 0 HE ARG B 205 -14.329 -17.633 3.635 1.00 32.53 H new ATOM 0 HH11 ARG B 205 -11.749 -19.781 2.664 1.00 62.51 H new ATOM 0 HH12 ARG B 205 -11.365 -20.230 4.329 1.00 62.51 H new ATOM 0 HH21 ARG B 205 -13.821 -18.208 5.709 1.00 3.11 H new ATOM 0 HH22 ARG B 205 -12.515 -19.357 6.017 1.00 3.11 H new ATOM 946 N PRO B 206 -13.799 -15.690 -3.052 1.00 61.54 N ATOM 947 CA PRO B 206 -13.979 -15.427 -4.498 1.00 71.21 C ATOM 948 C PRO B 206 -13.081 -16.294 -5.402 1.00 43.43 C ATOM 949 O PRO B 206 -13.404 -16.531 -6.565 1.00 31.10 O ATOM 950 CB PRO B 206 -13.614 -13.941 -4.631 1.00 34.43 C ATOM 951 CG PRO B 206 -12.697 -13.669 -3.485 1.00 53.55 C ATOM 952 CD PRO B 206 -13.181 -14.539 -2.356 1.00 42.01 C ATOM 0 HA PRO B 206 -14.990 -15.671 -4.824 1.00 71.21 H new ATOM 0 HB2 PRO B 206 -13.127 -13.737 -5.584 1.00 34.43 H new ATOM 0 HB3 PRO B 206 -14.502 -13.310 -4.586 1.00 34.43 H new ATOM 0 HG2 PRO B 206 -11.665 -13.905 -3.746 1.00 53.55 H new ATOM 0 HG3 PRO B 206 -12.722 -12.616 -3.205 1.00 53.55 H new ATOM 0 HD2 PRO B 206 -12.361 -14.853 -1.710 1.00 42.01 H new ATOM 0 HD3 PRO B 206 -13.901 -14.016 -1.726 1.00 42.01 H new ATOM 960 N GLY B 207 -11.962 -16.766 -4.867 1.00 21.45 N ATOM 961 CA GLY B 207 -11.046 -17.585 -5.655 1.00 21.43 C ATOM 962 C GLY B 207 -10.691 -18.910 -4.987 1.00 75.20 C ATOM 963 O GLY B 207 -11.233 -19.959 -5.338 1.00 54.20 O ATOM 0 H GLY B 207 -11.668 -16.600 -3.904 1.00 21.45 H new ATOM 0 HA2 GLY B 207 -11.495 -17.786 -6.628 1.00 21.43 H new ATOM 0 HA3 GLY B 207 -10.131 -17.021 -5.837 1.00 21.43 H new ATOM 967 N GLY B 208 -9.775 -18.859 -4.028 1.00 75.01 N ATOM 968 CA GLY B 208 -9.307 -20.062 -3.352 1.00 71.43 C ATOM 969 C GLY B 208 -7.837 -19.977 -2.948 1.00 15.43 C ATOM 970 O GLY B 208 -6.950 -20.305 -3.743 1.00 12.14 O ATOM 0 H GLY B 208 -9.341 -17.996 -3.701 1.00 75.01 H new ATOM 0 HA2 GLY B 208 -9.914 -20.234 -2.463 1.00 71.43 H new ATOM 0 HA3 GLY B 208 -9.450 -20.921 -4.007 1.00 71.43 H new ATOM 974 N GLY B 209 -7.582 -19.507 -1.727 1.00 72.23 N ATOM 975 CA GLY B 209 -6.222 -19.470 -1.194 1.00 4.32 C ATOM 976 C GLY B 209 -5.465 -18.181 -1.511 1.00 74.32 C ATOM 977 O GLY B 209 -5.404 -17.266 -0.687 1.00 75.11 O ATOM 0 H GLY B 209 -8.295 -19.149 -1.092 1.00 72.23 H new ATOM 0 HA2 GLY B 209 -6.263 -19.598 -0.112 1.00 4.32 H new ATOM 0 HA3 GLY B 209 -5.663 -20.316 -1.594 1.00 4.32 H new ATOM 981 N LEU B 210 -4.874 -18.113 -2.705 1.00 11.14 N ATOM 982 CA LEU B 210 -4.017 -16.979 -3.086 1.00 51.42 C ATOM 983 C LEU B 210 -4.607 -16.167 -4.254 1.00 43.22 C ATOM 984 O LEU B 210 -4.522 -14.933 -4.276 1.00 1.02 O ATOM 985 CB LEU B 210 -2.621 -17.495 -3.476 1.00 51.45 C ATOM 986 CG LEU B 210 -1.909 -18.353 -2.413 1.00 75.45 C ATOM 987 CD1 LEU B 210 -0.568 -18.867 -2.940 1.00 74.20 C ATOM 988 CD2 LEU B 210 -1.718 -17.566 -1.117 1.00 2.22 C ATOM 0 H LEU B 210 -4.970 -18.827 -3.427 1.00 11.14 H new ATOM 0 HA LEU B 210 -3.950 -16.316 -2.223 1.00 51.42 H new ATOM 0 HB2 LEU B 210 -2.712 -18.082 -4.390 1.00 51.45 H new ATOM 0 HB3 LEU B 210 -1.989 -16.638 -3.709 1.00 51.45 H new ATOM 0 HG LEU B 210 -2.540 -19.214 -2.195 1.00 75.45 H new ATOM 0 HD11 LEU B 210 -0.083 -19.470 -2.173 1.00 74.20 H new ATOM 0 HD12 LEU B 210 -0.735 -19.476 -3.828 1.00 74.20 H new ATOM 0 HD13 LEU B 210 0.071 -18.022 -3.195 1.00 74.20 H new ATOM 0 HD21 LEU B 210 -1.213 -18.193 -0.382 1.00 2.22 H new ATOM 0 HD22 LEU B 210 -1.114 -16.680 -1.315 1.00 2.22 H new ATOM 0 HD23 LEU B 210 -2.690 -17.263 -0.729 1.00 2.22 H new ATOM 1000 N LYS B 211 -5.204 -16.867 -5.219 1.00 1.12 N ATOM 1001 CA LYS B 211 -5.696 -16.240 -6.458 1.00 22.32 C ATOM 1002 C LYS B 211 -6.841 -15.235 -6.215 1.00 25.34 C ATOM 1003 O LYS B 211 -7.247 -14.516 -7.131 1.00 14.51 O ATOM 1004 CB LYS B 211 -6.143 -17.322 -7.454 1.00 4.10 C ATOM 1005 CG LYS B 211 -7.235 -18.252 -6.926 1.00 24.31 C ATOM 1006 CD LYS B 211 -7.643 -19.283 -7.978 1.00 31.05 C ATOM 1007 CE LYS B 211 -8.724 -20.230 -7.467 1.00 31.54 C ATOM 1008 NZ LYS B 211 -8.244 -21.075 -6.342 1.00 22.13 N ATOM 0 H LYS B 211 -5.362 -17.874 -5.171 1.00 1.12 H new ATOM 0 HA LYS B 211 -4.865 -15.671 -6.875 1.00 22.32 H new ATOM 0 HB2 LYS B 211 -6.503 -16.837 -8.362 1.00 4.10 H new ATOM 0 HB3 LYS B 211 -5.277 -17.921 -7.735 1.00 4.10 H new ATOM 0 HG2 LYS B 211 -6.879 -18.763 -6.032 1.00 24.31 H new ATOM 0 HG3 LYS B 211 -8.105 -17.665 -6.633 1.00 24.31 H new ATOM 0 HD2 LYS B 211 -8.005 -18.768 -8.868 1.00 31.05 H new ATOM 0 HD3 LYS B 211 -6.768 -19.860 -8.277 1.00 31.05 H new ATOM 0 HE2 LYS B 211 -9.588 -19.651 -7.141 1.00 31.54 H new ATOM 0 HE3 LYS B 211 -9.059 -20.870 -8.283 1.00 31.54 H new ATOM 0 HZ1 LYS B 211 -9.026 -21.666 -5.994 1.00 22.13 H new ATOM 0 HZ2 LYS B 211 -7.469 -21.685 -6.672 1.00 22.13 H new ATOM 0 HZ3 LYS B 211 -7.901 -20.466 -5.572 1.00 22.13 H new ATOM 1022 N ASP B 212 -7.355 -15.186 -4.990 1.00 74.44 N ATOM 1023 CA ASP B 212 -8.420 -14.245 -4.618 1.00 33.24 C ATOM 1024 C ASP B 212 -7.965 -12.783 -4.772 1.00 1.12 C ATOM 1025 O ASP B 212 -8.686 -11.942 -5.308 1.00 73.42 O ATOM 1026 CB ASP B 212 -8.831 -14.483 -3.160 1.00 32.31 C ATOM 1027 CG ASP B 212 -9.135 -15.940 -2.878 1.00 45.53 C ATOM 1028 OD1 ASP B 212 -8.200 -16.762 -2.939 1.00 34.15 O ATOM 1029 OD2 ASP B 212 -10.307 -16.272 -2.603 1.00 22.42 O ATOM 0 H ASP B 212 -7.051 -15.791 -4.227 1.00 74.44 H new ATOM 0 HA ASP B 212 -9.263 -14.418 -5.287 1.00 33.24 H new ATOM 0 HB2 ASP B 212 -8.031 -14.147 -2.500 1.00 32.31 H new ATOM 0 HB3 ASP B 212 -9.709 -13.880 -2.929 1.00 32.31 H new ATOM 1034 N THR B 213 -6.754 -12.506 -4.301 1.00 30.20 N ATOM 1035 CA THR B 213 -6.239 -11.133 -4.196 1.00 2.43 C ATOM 1036 C THR B 213 -6.174 -10.388 -5.546 1.00 3.11 C ATOM 1037 O THR B 213 -5.589 -10.872 -6.519 1.00 64.21 O ATOM 1038 CB THR B 213 -4.836 -11.117 -3.546 1.00 63.01 C ATOM 1039 OG1 THR B 213 -3.911 -11.891 -4.331 1.00 63.32 O ATOM 1040 CG2 THR B 213 -4.882 -11.668 -2.123 1.00 52.44 C ATOM 0 H THR B 213 -6.099 -13.219 -3.981 1.00 30.20 H new ATOM 0 HA THR B 213 -6.956 -10.606 -3.567 1.00 2.43 H new ATOM 0 HB THR B 213 -4.500 -10.081 -3.508 1.00 63.01 H new ATOM 0 HG1 THR B 213 -4.159 -12.838 -4.289 1.00 63.32 H new ATOM 0 HG21 THR B 213 -3.881 -11.645 -1.691 1.00 52.44 H new ATOM 0 HG22 THR B 213 -5.553 -11.058 -1.518 1.00 52.44 H new ATOM 0 HG23 THR B 213 -5.245 -12.696 -2.142 1.00 52.44 H new ATOM 1048 N LYS B 214 -6.767 -9.193 -5.580 1.00 21.12 N ATOM 1049 CA LYS B 214 -6.763 -8.328 -6.769 1.00 44.42 C ATOM 1050 C LYS B 214 -5.620 -7.296 -6.704 1.00 32.21 C ATOM 1051 O LYS B 214 -5.333 -6.747 -5.639 1.00 73.04 O ATOM 1052 CB LYS B 214 -8.111 -7.594 -6.879 1.00 0.12 C ATOM 1053 CG LYS B 214 -9.308 -8.510 -7.122 1.00 43.24 C ATOM 1054 CD LYS B 214 -9.266 -9.157 -8.503 1.00 35.14 C ATOM 1055 CE LYS B 214 -9.253 -8.119 -9.621 1.00 74.33 C ATOM 1056 NZ LYS B 214 -10.395 -7.169 -9.525 1.00 71.12 N ATOM 0 H LYS B 214 -7.265 -8.794 -4.784 1.00 21.12 H new ATOM 0 HA LYS B 214 -6.609 -8.956 -7.646 1.00 44.42 H new ATOM 0 HB2 LYS B 214 -8.280 -7.030 -5.962 1.00 0.12 H new ATOM 0 HB3 LYS B 214 -8.052 -6.870 -7.692 1.00 0.12 H new ATOM 0 HG2 LYS B 214 -9.329 -9.288 -6.359 1.00 43.24 H new ATOM 0 HG3 LYS B 214 -10.229 -7.937 -7.019 1.00 43.24 H new ATOM 0 HD2 LYS B 214 -8.379 -9.786 -8.582 1.00 35.14 H new ATOM 0 HD3 LYS B 214 -10.131 -9.809 -8.624 1.00 35.14 H new ATOM 0 HE2 LYS B 214 -8.317 -7.562 -9.586 1.00 74.33 H new ATOM 0 HE3 LYS B 214 -9.286 -8.627 -10.585 1.00 74.33 H new ATOM 0 HZ1 LYS B 214 -10.442 -6.594 -10.390 1.00 71.12 H new ATOM 0 HZ2 LYS B 214 -11.281 -7.702 -9.415 1.00 71.12 H new ATOM 0 HZ3 LYS B 214 -10.261 -6.547 -8.703 1.00 71.12 H new ATOM 1070 N PRO B 215 -4.949 -7.019 -7.843 1.00 52.14 N ATOM 1071 CA PRO B 215 -3.840 -6.050 -7.909 1.00 73.33 C ATOM 1072 C PRO B 215 -4.305 -4.576 -7.917 1.00 13.24 C ATOM 1073 O PRO B 215 -4.865 -4.092 -8.904 1.00 33.31 O ATOM 1074 CB PRO B 215 -3.131 -6.398 -9.240 1.00 31.25 C ATOM 1075 CG PRO B 215 -3.815 -7.626 -9.761 1.00 12.50 C ATOM 1076 CD PRO B 215 -5.188 -7.633 -9.152 1.00 4.34 C ATOM 0 HA PRO B 215 -3.202 -6.127 -7.029 1.00 73.33 H new ATOM 0 HB2 PRO B 215 -3.210 -5.576 -9.951 1.00 31.25 H new ATOM 0 HB3 PRO B 215 -2.068 -6.581 -9.080 1.00 31.25 H new ATOM 0 HG2 PRO B 215 -3.872 -7.607 -10.849 1.00 12.50 H new ATOM 0 HG3 PRO B 215 -3.263 -8.525 -9.486 1.00 12.50 H new ATOM 0 HD2 PRO B 215 -5.900 -7.060 -9.746 1.00 4.34 H new ATOM 0 HD3 PRO B 215 -5.588 -8.643 -9.061 1.00 4.34 H new ATOM 1084 N VAL B 216 -4.081 -3.879 -6.806 1.00 61.41 N ATOM 1085 CA VAL B 216 -4.370 -2.441 -6.699 1.00 61.23 C ATOM 1086 C VAL B 216 -3.102 -1.605 -6.968 1.00 15.42 C ATOM 1087 O VAL B 216 -2.028 -1.907 -6.440 1.00 3.22 O ATOM 1088 CB VAL B 216 -4.928 -2.087 -5.293 1.00 71.50 C ATOM 1089 CG1 VAL B 216 -5.288 -0.602 -5.197 1.00 51.20 C ATOM 1090 CG2 VAL B 216 -6.132 -2.966 -4.952 1.00 53.21 C ATOM 0 H VAL B 216 -3.696 -4.288 -5.955 1.00 61.41 H new ATOM 0 HA VAL B 216 -5.123 -2.204 -7.450 1.00 61.23 H new ATOM 0 HB VAL B 216 -4.145 -2.285 -4.561 1.00 71.50 H new ATOM 0 HG11 VAL B 216 -5.676 -0.385 -4.202 1.00 51.20 H new ATOM 0 HG12 VAL B 216 -4.398 0.001 -5.379 1.00 51.20 H new ATOM 0 HG13 VAL B 216 -6.047 -0.363 -5.942 1.00 51.20 H new ATOM 0 HG21 VAL B 216 -6.507 -2.702 -3.963 1.00 53.21 H new ATOM 0 HG22 VAL B 216 -6.917 -2.810 -5.692 1.00 53.21 H new ATOM 0 HG23 VAL B 216 -5.831 -4.014 -4.958 1.00 53.21 H new ATOM 1100 N VAL B 217 -3.225 -0.558 -7.789 1.00 21.42 N ATOM 1101 CA VAL B 217 -2.074 0.283 -8.151 1.00 13.03 C ATOM 1102 C VAL B 217 -1.971 1.526 -7.250 1.00 30.43 C ATOM 1103 O VAL B 217 -2.895 2.344 -7.184 1.00 3.44 O ATOM 1104 CB VAL B 217 -2.148 0.732 -9.633 1.00 71.33 C ATOM 1105 CG1 VAL B 217 -0.939 1.585 -10.008 1.00 54.33 C ATOM 1106 CG2 VAL B 217 -2.270 -0.478 -10.558 1.00 24.02 C ATOM 0 H VAL B 217 -4.106 -0.271 -8.216 1.00 21.42 H new ATOM 0 HA VAL B 217 -1.184 -0.330 -8.006 1.00 13.03 H new ATOM 0 HB VAL B 217 -3.040 1.346 -9.756 1.00 71.33 H new ATOM 0 HG11 VAL B 217 -1.016 1.886 -11.053 1.00 54.33 H new ATOM 0 HG12 VAL B 217 -0.910 2.472 -9.376 1.00 54.33 H new ATOM 0 HG13 VAL B 217 -0.027 1.006 -9.864 1.00 54.33 H new ATOM 0 HG21 VAL B 217 -2.321 -0.141 -11.593 1.00 24.02 H new ATOM 0 HG22 VAL B 217 -1.402 -1.124 -10.429 1.00 24.02 H new ATOM 0 HG23 VAL B 217 -3.175 -1.034 -10.313 1.00 24.02 H new ATOM 1116 N VAL B 218 -0.834 1.669 -6.568 1.00 30.22 N ATOM 1117 CA VAL B 218 -0.607 2.792 -5.648 1.00 71.41 C ATOM 1118 C VAL B 218 0.792 3.416 -5.858 1.00 4.34 C ATOM 1119 O VAL B 218 1.625 2.872 -6.578 1.00 74.32 O ATOM 1120 CB VAL B 218 -0.766 2.325 -4.172 1.00 14.50 C ATOM 1121 CG1 VAL B 218 0.303 1.296 -3.804 1.00 71.21 C ATOM 1122 CG2 VAL B 218 -0.744 3.510 -3.204 1.00 14.24 C ATOM 0 H VAL B 218 -0.050 1.019 -6.634 1.00 30.22 H new ATOM 0 HA VAL B 218 -1.355 3.555 -5.863 1.00 71.41 H new ATOM 0 HB VAL B 218 -1.741 1.845 -4.082 1.00 14.50 H new ATOM 0 HG11 VAL B 218 0.169 0.987 -2.767 1.00 71.21 H new ATOM 0 HG12 VAL B 218 0.212 0.428 -4.457 1.00 71.21 H new ATOM 0 HG13 VAL B 218 1.292 1.739 -3.925 1.00 71.21 H new ATOM 0 HG21 VAL B 218 -0.857 3.147 -2.182 1.00 14.24 H new ATOM 0 HG22 VAL B 218 0.204 4.039 -3.298 1.00 14.24 H new ATOM 0 HG23 VAL B 218 -1.563 4.189 -3.441 1.00 14.24 H new ATOM 1132 N ARG B 219 1.032 4.577 -5.250 1.00 24.42 N ATOM 1133 CA ARG B 219 2.343 5.238 -5.310 1.00 50.51 C ATOM 1134 C ARG B 219 2.960 5.389 -3.908 1.00 73.31 C ATOM 1135 O ARG B 219 2.250 5.633 -2.933 1.00 34.02 O ATOM 1136 CB ARG B 219 2.211 6.621 -5.959 1.00 45.10 C ATOM 1137 CG ARG B 219 1.944 6.597 -7.461 1.00 72.53 C ATOM 1138 CD ARG B 219 1.787 8.008 -8.025 1.00 32.20 C ATOM 1139 NE ARG B 219 1.683 8.012 -9.482 1.00 24.01 N ATOM 1140 CZ ARG B 219 0.682 8.514 -10.152 1.00 3.42 C ATOM 1141 NH1 ARG B 219 -0.329 9.047 -9.540 1.00 53.10 N ATOM 1142 NH2 ARG B 219 0.700 8.492 -11.442 1.00 55.12 N ATOM 0 H ARG B 219 0.334 5.085 -4.706 1.00 24.42 H new ATOM 0 HA ARG B 219 3.001 4.611 -5.912 1.00 50.51 H new ATOM 0 HB2 ARG B 219 1.402 7.162 -5.468 1.00 45.10 H new ATOM 0 HB3 ARG B 219 3.127 7.183 -5.775 1.00 45.10 H new ATOM 0 HG2 ARG B 219 2.764 6.090 -7.969 1.00 72.53 H new ATOM 0 HG3 ARG B 219 1.040 6.021 -7.662 1.00 72.53 H new ATOM 0 HD2 ARG B 219 0.898 8.471 -7.598 1.00 32.20 H new ATOM 0 HD3 ARG B 219 2.640 8.616 -7.722 1.00 32.20 H new ATOM 0 HE ARG B 219 2.446 7.593 -10.013 1.00 24.01 H new ATOM 0 HH11 ARG B 219 -0.350 9.078 -8.521 1.00 53.10 H new ATOM 0 HH12 ARG B 219 -1.104 9.435 -10.078 1.00 53.10 H new ATOM 0 HH21 ARG B 219 1.495 8.083 -11.934 1.00 55.12 H new ATOM 0 HH22 ARG B 219 -0.080 8.883 -11.970 1.00 55.12 H new ATOM 1156 N LEU B 220 4.283 5.251 -3.818 1.00 24.05 N ATOM 1157 CA LEU B 220 5.005 5.437 -2.549 1.00 13.12 C ATOM 1158 C LEU B 220 6.329 6.188 -2.781 1.00 32.35 C ATOM 1159 O LEU B 220 6.922 6.099 -3.857 1.00 4.33 O ATOM 1160 CB LEU B 220 5.261 4.076 -1.880 1.00 21.52 C ATOM 1161 CG LEU B 220 5.932 4.126 -0.495 1.00 43.41 C ATOM 1162 CD1 LEU B 220 5.097 4.942 0.491 1.00 33.52 C ATOM 1163 CD2 LEU B 220 6.171 2.711 0.035 1.00 20.51 C ATOM 0 H LEU B 220 4.882 5.011 -4.608 1.00 24.05 H new ATOM 0 HA LEU B 220 4.388 6.040 -1.883 1.00 13.12 H new ATOM 0 HB2 LEU B 220 4.308 3.555 -1.783 1.00 21.52 H new ATOM 0 HB3 LEU B 220 5.885 3.478 -2.544 1.00 21.52 H new ATOM 0 HG LEU B 220 6.897 4.621 -0.603 1.00 43.41 H new ATOM 0 HD11 LEU B 220 5.594 4.961 1.461 1.00 33.52 H new ATOM 0 HD12 LEU B 220 4.988 5.961 0.119 1.00 33.52 H new ATOM 0 HD13 LEU B 220 4.112 4.487 0.597 1.00 33.52 H new ATOM 0 HD21 LEU B 220 6.646 2.765 1.015 1.00 20.51 H new ATOM 0 HD22 LEU B 220 5.218 2.189 0.122 1.00 20.51 H new ATOM 0 HD23 LEU B 220 6.820 2.169 -0.653 1.00 20.51 H new ATOM 1175 N TYR B 221 6.786 6.935 -1.778 1.00 61.51 N ATOM 1176 CA TYR B 221 7.984 7.776 -1.914 1.00 22.03 C ATOM 1177 C TYR B 221 9.263 6.935 -2.089 1.00 41.13 C ATOM 1178 O TYR B 221 9.567 6.081 -1.259 1.00 65.33 O ATOM 1179 CB TYR B 221 8.121 8.692 -0.688 1.00 72.31 C ATOM 1180 CG TYR B 221 6.941 9.632 -0.497 1.00 40.20 C ATOM 1181 CD1 TYR B 221 5.763 9.191 0.102 1.00 20.54 C ATOM 1182 CD2 TYR B 221 7.002 10.955 -0.924 1.00 13.13 C ATOM 1183 CE1 TYR B 221 4.687 10.041 0.271 1.00 64.24 C ATOM 1184 CE2 TYR B 221 5.929 11.809 -0.756 1.00 15.23 C ATOM 1185 CZ TYR B 221 4.773 11.347 -0.161 1.00 42.21 C ATOM 1186 OH TYR B 221 3.701 12.196 0.005 1.00 15.24 O ATOM 0 H TYR B 221 6.347 6.978 -0.858 1.00 61.51 H new ATOM 0 HA TYR B 221 7.863 8.380 -2.813 1.00 22.03 H new ATOM 0 HB2 TYR B 221 8.233 8.076 0.205 1.00 72.31 H new ATOM 0 HB3 TYR B 221 9.033 9.281 -0.785 1.00 72.31 H new ATOM 0 HD1 TYR B 221 5.690 8.168 0.440 1.00 20.54 H new ATOM 0 HD2 TYR B 221 7.903 11.320 -1.394 1.00 13.13 H new ATOM 0 HE1 TYR B 221 3.782 9.683 0.740 1.00 64.24 H new ATOM 0 HE2 TYR B 221 5.995 12.834 -1.089 1.00 15.23 H new ATOM 0 HH TYR B 221 3.926 13.080 -0.352 1.00 15.24 H new ATOM 1196 N PRO B 222 10.047 7.184 -3.167 1.00 34.44 N ATOM 1197 CA PRO B 222 11.294 6.437 -3.445 1.00 24.23 C ATOM 1198 C PRO B 222 12.270 6.448 -2.257 1.00 53.53 C ATOM 1199 O PRO B 222 13.023 5.496 -2.045 1.00 43.34 O ATOM 1200 CB PRO B 222 11.899 7.173 -4.658 1.00 12.20 C ATOM 1201 CG PRO B 222 11.161 8.473 -4.745 1.00 72.01 C ATOM 1202 CD PRO B 222 9.788 8.203 -4.199 1.00 32.14 C ATOM 0 HA PRO B 222 11.097 5.381 -3.631 1.00 24.23 H new ATOM 0 HB2 PRO B 222 12.968 7.337 -4.524 1.00 12.20 H new ATOM 0 HB3 PRO B 222 11.777 6.591 -5.571 1.00 12.20 H new ATOM 0 HG2 PRO B 222 11.665 9.248 -4.168 1.00 72.01 H new ATOM 0 HG3 PRO B 222 11.110 8.825 -5.775 1.00 72.01 H new ATOM 0 HD2 PRO B 222 9.336 9.101 -3.778 1.00 32.14 H new ATOM 0 HD3 PRO B 222 9.110 7.836 -4.970 1.00 32.14 H new ATOM 1210 N ASP B 223 12.235 7.536 -1.488 1.00 11.20 N ATOM 1211 CA ASP B 223 13.039 7.674 -0.270 1.00 54.22 C ATOM 1212 C ASP B 223 12.720 6.545 0.727 1.00 64.21 C ATOM 1213 O ASP B 223 13.617 5.946 1.324 1.00 41.33 O ATOM 1214 CB ASP B 223 12.747 9.046 0.362 1.00 70.45 C ATOM 1215 CG ASP B 223 13.639 9.368 1.553 1.00 22.54 C ATOM 1216 OD1 ASP B 223 13.333 8.916 2.676 1.00 65.52 O ATOM 1217 OD2 ASP B 223 14.640 10.090 1.371 1.00 21.40 O ATOM 0 H ASP B 223 11.650 8.347 -1.690 1.00 11.20 H new ATOM 0 HA ASP B 223 14.096 7.602 -0.524 1.00 54.22 H new ATOM 0 HB2 ASP B 223 12.872 9.820 -0.395 1.00 70.45 H new ATOM 0 HB3 ASP B 223 11.705 9.076 0.680 1.00 70.45 H new ATOM 1222 N GLU B 224 11.430 6.245 0.876 1.00 52.44 N ATOM 1223 CA GLU B 224 10.965 5.247 1.845 1.00 34.14 C ATOM 1224 C GLU B 224 10.902 3.833 1.237 1.00 64.44 C ATOM 1225 O GLU B 224 11.098 2.844 1.940 1.00 60.34 O ATOM 1226 CB GLU B 224 9.595 5.674 2.389 1.00 14.20 C ATOM 1227 CG GLU B 224 9.625 7.052 3.050 1.00 71.15 C ATOM 1228 CD GLU B 224 8.251 7.546 3.477 1.00 42.14 C ATOM 1229 OE1 GLU B 224 7.548 8.140 2.635 1.00 43.23 O ATOM 1230 OE2 GLU B 224 7.887 7.361 4.660 1.00 42.32 O ATOM 0 H GLU B 224 10.683 6.681 0.335 1.00 52.44 H new ATOM 0 HA GLU B 224 11.684 5.199 2.663 1.00 34.14 H new ATOM 0 HB2 GLU B 224 8.872 5.683 1.574 1.00 14.20 H new ATOM 0 HB3 GLU B 224 9.250 4.936 3.113 1.00 14.20 H new ATOM 0 HG2 GLU B 224 10.277 7.014 3.923 1.00 71.15 H new ATOM 0 HG3 GLU B 224 10.062 7.770 2.356 1.00 71.15 H new ATOM 1237 N ILE B 225 10.638 3.738 -0.070 1.00 23.04 N ATOM 1238 CA ILE B 225 10.636 2.441 -0.771 1.00 23.24 C ATOM 1239 C ILE B 225 12.000 1.745 -0.658 1.00 22.00 C ATOM 1240 O ILE B 225 12.084 0.536 -0.419 1.00 54.24 O ATOM 1241 CB ILE B 225 10.283 2.596 -2.278 1.00 72.31 C ATOM 1242 CG1 ILE B 225 8.858 3.144 -2.451 1.00 43.20 C ATOM 1243 CG2 ILE B 225 10.435 1.263 -3.017 1.00 64.10 C ATOM 1244 CD1 ILE B 225 8.426 3.287 -3.898 1.00 3.12 C ATOM 0 H ILE B 225 10.423 4.538 -0.666 1.00 23.04 H new ATOM 0 HA ILE B 225 9.871 1.834 -0.287 1.00 23.24 H new ATOM 0 HB ILE B 225 10.983 3.310 -2.713 1.00 72.31 H new ATOM 0 HG12 ILE B 225 8.160 2.483 -1.937 1.00 43.20 H new ATOM 0 HG13 ILE B 225 8.792 4.117 -1.964 1.00 43.20 H new ATOM 0 HG21 ILE B 225 10.182 1.399 -4.069 1.00 64.10 H new ATOM 0 HG22 ILE B 225 11.465 0.916 -2.933 1.00 64.10 H new ATOM 0 HG23 ILE B 225 9.766 0.524 -2.576 1.00 64.10 H new ATOM 0 HD11 ILE B 225 7.410 3.679 -3.937 1.00 3.12 H new ATOM 0 HD12 ILE B 225 9.100 3.972 -4.413 1.00 3.12 H new ATOM 0 HD13 ILE B 225 8.458 2.312 -4.385 1.00 3.12 H new ATOM 1256 N GLU B 226 13.070 2.520 -0.829 1.00 3.11 N ATOM 1257 CA GLU B 226 14.432 1.982 -0.778 1.00 1.22 C ATOM 1258 C GLU B 226 14.798 1.532 0.648 1.00 42.21 C ATOM 1259 O GLU B 226 15.615 0.634 0.837 1.00 64.30 O ATOM 1260 CB GLU B 226 15.425 3.025 -1.310 1.00 31.13 C ATOM 1261 CG GLU B 226 16.801 2.456 -1.655 1.00 14.31 C ATOM 1262 CD GLU B 226 17.524 3.284 -2.709 1.00 12.32 C ATOM 1263 OE1 GLU B 226 17.035 3.327 -3.860 1.00 30.13 O ATOM 1264 OE2 GLU B 226 18.574 3.884 -2.405 1.00 43.44 O ATOM 0 H GLU B 226 13.022 3.524 -1.004 1.00 3.11 H new ATOM 0 HA GLU B 226 14.485 1.100 -1.416 1.00 1.22 H new ATOM 0 HB2 GLU B 226 15.003 3.492 -2.200 1.00 31.13 H new ATOM 0 HB3 GLU B 226 15.545 3.811 -0.564 1.00 31.13 H new ATOM 0 HG2 GLU B 226 17.409 2.411 -0.752 1.00 14.31 H new ATOM 0 HG3 GLU B 226 16.688 1.433 -2.015 1.00 14.31 H new ATOM 1271 N ALA B 227 14.175 2.158 1.647 1.00 31.32 N ATOM 1272 CA ALA B 227 14.308 1.719 3.042 1.00 22.14 C ATOM 1273 C ALA B 227 13.448 0.472 3.308 1.00 34.44 C ATOM 1274 O ALA B 227 13.866 -0.460 3.995 1.00 60.41 O ATOM 1275 CB ALA B 227 13.915 2.847 3.989 1.00 65.44 C ATOM 0 H ALA B 227 13.573 2.971 1.519 1.00 31.32 H new ATOM 0 HA ALA B 227 15.351 1.457 3.221 1.00 22.14 H new ATOM 0 HB1 ALA B 227 14.018 2.509 5.020 1.00 65.44 H new ATOM 0 HB2 ALA B 227 14.565 3.706 3.822 1.00 65.44 H new ATOM 0 HB3 ALA B 227 12.880 3.134 3.803 1.00 65.44 H new ATOM 1281 N LEU B 228 12.247 0.466 2.733 1.00 40.51 N ATOM 1282 CA LEU B 228 11.301 -0.647 2.875 1.00 45.13 C ATOM 1283 C LEU B 228 11.899 -1.976 2.379 1.00 3.01 C ATOM 1284 O LEU B 228 11.766 -3.011 3.029 1.00 14.14 O ATOM 1285 CB LEU B 228 10.020 -0.331 2.092 1.00 14.40 C ATOM 1286 CG LEU B 228 8.926 -1.412 2.131 1.00 1.23 C ATOM 1287 CD1 LEU B 228 8.417 -1.624 3.558 1.00 4.44 C ATOM 1288 CD2 LEU B 228 7.782 -1.042 1.191 1.00 61.00 C ATOM 0 H LEU B 228 11.899 1.231 2.155 1.00 40.51 H new ATOM 0 HA LEU B 228 11.075 -0.762 3.935 1.00 45.13 H new ATOM 0 HB2 LEU B 228 9.600 0.598 2.479 1.00 14.40 H new ATOM 0 HB3 LEU B 228 10.288 -0.150 1.051 1.00 14.40 H new ATOM 0 HG LEU B 228 9.359 -2.353 1.791 1.00 1.23 H new ATOM 0 HD11 LEU B 228 7.644 -2.393 3.558 1.00 4.44 H new ATOM 0 HD12 LEU B 228 9.243 -1.939 4.196 1.00 4.44 H new ATOM 0 HD13 LEU B 228 8.001 -0.691 3.938 1.00 4.44 H new ATOM 0 HD21 LEU B 228 7.015 -1.816 1.229 1.00 61.00 H new ATOM 0 HD22 LEU B 228 7.352 -0.089 1.499 1.00 61.00 H new ATOM 0 HD23 LEU B 228 8.161 -0.956 0.173 1.00 61.00 H new ATOM 1300 N LYS B 229 12.560 -1.941 1.227 1.00 51.11 N ATOM 1301 CA LYS B 229 13.180 -3.147 0.661 1.00 23.21 C ATOM 1302 C LYS B 229 14.413 -3.593 1.471 1.00 74.15 C ATOM 1303 O LYS B 229 14.983 -4.648 1.211 1.00 4.03 O ATOM 1304 CB LYS B 229 13.562 -2.913 -0.807 1.00 65.34 C ATOM 1305 CG LYS B 229 14.558 -1.776 -1.018 1.00 13.11 C ATOM 1306 CD LYS B 229 14.852 -1.548 -2.499 1.00 74.44 C ATOM 1307 CE LYS B 229 13.589 -1.197 -3.282 1.00 21.04 C ATOM 1308 NZ LYS B 229 13.867 -1.005 -4.728 1.00 23.42 N ATOM 0 H LYS B 229 12.683 -1.099 0.665 1.00 51.11 H new ATOM 0 HA LYS B 229 12.444 -3.949 0.715 1.00 23.21 H new ATOM 0 HB2 LYS B 229 13.985 -3.832 -1.212 1.00 65.34 H new ATOM 0 HB3 LYS B 229 12.658 -2.700 -1.377 1.00 65.34 H new ATOM 0 HG2 LYS B 229 14.162 -0.860 -0.581 1.00 13.11 H new ATOM 0 HG3 LYS B 229 15.486 -2.004 -0.494 1.00 13.11 H new ATOM 0 HD2 LYS B 229 15.580 -0.744 -2.605 1.00 74.44 H new ATOM 0 HD3 LYS B 229 15.304 -2.445 -2.922 1.00 74.44 H new ATOM 0 HE2 LYS B 229 12.852 -1.991 -3.157 1.00 21.04 H new ATOM 0 HE3 LYS B 229 13.150 -0.287 -2.873 1.00 21.04 H new ATOM 0 HZ1 LYS B 229 12.983 -0.768 -5.223 1.00 23.42 H new ATOM 0 HZ2 LYS B 229 14.551 -0.231 -4.850 1.00 23.42 H new ATOM 0 HZ3 LYS B 229 14.262 -1.881 -5.125 1.00 23.42 H new ATOM 1322 N SER B 230 14.816 -2.787 2.453 1.00 41.13 N ATOM 1323 CA SER B 230 15.962 -3.121 3.315 1.00 34.24 C ATOM 1324 C SER B 230 15.524 -3.900 4.569 1.00 44.30 C ATOM 1325 O SER B 230 16.356 -4.288 5.393 1.00 10.23 O ATOM 1326 CB SER B 230 16.709 -1.840 3.731 1.00 62.43 C ATOM 1327 OG SER B 230 17.866 -2.133 4.504 1.00 51.10 O ATOM 0 H SER B 230 14.370 -1.897 2.676 1.00 41.13 H new ATOM 0 HA SER B 230 16.630 -3.760 2.738 1.00 34.24 H new ATOM 0 HB2 SER B 230 16.998 -1.282 2.840 1.00 62.43 H new ATOM 0 HB3 SER B 230 16.040 -1.199 4.306 1.00 62.43 H new ATOM 0 HG SER B 230 17.745 -2.991 4.961 1.00 51.10 H new ATOM 1333 N ARG B 231 14.214 -4.126 4.712 1.00 70.14 N ATOM 1334 CA ARG B 231 13.668 -4.857 5.872 1.00 71.40 C ATOM 1335 C ARG B 231 12.853 -6.094 5.445 1.00 53.11 C ATOM 1336 O ARG B 231 12.112 -6.663 6.249 1.00 25.11 O ATOM 1337 CB ARG B 231 12.789 -3.919 6.718 1.00 33.40 C ATOM 1338 CG ARG B 231 11.591 -3.349 5.963 1.00 51.25 C ATOM 1339 CD ARG B 231 10.721 -2.453 6.841 1.00 54.32 C ATOM 1340 NE ARG B 231 10.095 -3.188 7.941 1.00 21.42 N ATOM 1341 CZ ARG B 231 8.904 -2.931 8.415 1.00 11.13 C ATOM 1342 NH1 ARG B 231 8.179 -1.986 7.906 1.00 54.10 N ATOM 1343 NH2 ARG B 231 8.437 -3.620 9.405 1.00 10.51 N ATOM 0 H ARG B 231 13.509 -3.816 4.043 1.00 70.14 H new ATOM 0 HA ARG B 231 14.512 -5.207 6.466 1.00 71.40 H new ATOM 0 HB2 ARG B 231 12.430 -4.463 7.592 1.00 33.40 H new ATOM 0 HB3 ARG B 231 13.401 -3.095 7.084 1.00 33.40 H new ATOM 0 HG2 ARG B 231 11.945 -2.778 5.104 1.00 51.25 H new ATOM 0 HG3 ARG B 231 10.987 -4.169 5.574 1.00 51.25 H new ATOM 0 HD2 ARG B 231 11.330 -1.645 7.247 1.00 54.32 H new ATOM 0 HD3 ARG B 231 9.946 -1.991 6.229 1.00 54.32 H new ATOM 0 HE ARG B 231 10.623 -3.951 8.366 1.00 21.42 H new ATOM 0 HH11 ARG B 231 8.536 -1.433 7.127 1.00 54.10 H new ATOM 0 HH12 ARG B 231 7.251 -1.795 8.284 1.00 54.10 H new ATOM 0 HH21 ARG B 231 8.998 -4.365 9.817 1.00 10.51 H new ATOM 0 HH22 ARG B 231 7.508 -3.418 9.773 1.00 10.51 H new ATOM 1357 N VAL B 232 13.007 -6.521 4.189 1.00 73.30 N ATOM 1358 CA VAL B 232 12.232 -7.654 3.653 1.00 30.43 C ATOM 1359 C VAL B 232 13.100 -8.918 3.474 1.00 12.52 C ATOM 1360 O VAL B 232 14.218 -8.847 2.960 1.00 54.01 O ATOM 1361 CB VAL B 232 11.567 -7.293 2.298 1.00 1.01 C ATOM 1362 CG1 VAL B 232 10.570 -6.149 2.473 1.00 50.55 C ATOM 1363 CG2 VAL B 232 12.616 -6.943 1.240 1.00 62.15 C ATOM 0 H VAL B 232 13.657 -6.104 3.523 1.00 73.30 H new ATOM 0 HA VAL B 232 11.456 -7.869 4.388 1.00 30.43 H new ATOM 0 HB VAL B 232 11.023 -8.171 1.949 1.00 1.01 H new ATOM 0 HG11 VAL B 232 10.116 -5.912 1.511 1.00 50.55 H new ATOM 0 HG12 VAL B 232 9.794 -6.448 3.177 1.00 50.55 H new ATOM 0 HG13 VAL B 232 11.088 -5.270 2.856 1.00 50.55 H new ATOM 0 HG21 VAL B 232 12.118 -6.695 0.302 1.00 62.15 H new ATOM 0 HG22 VAL B 232 13.202 -6.088 1.577 1.00 62.15 H new ATOM 0 HG23 VAL B 232 13.276 -7.797 1.086 1.00 62.15 H new ATOM 1373 N PRO B 233 12.601 -10.094 3.915 1.00 51.21 N ATOM 1374 CA PRO B 233 13.299 -11.377 3.743 1.00 74.32 C ATOM 1375 C PRO B 233 13.086 -11.991 2.345 1.00 22.33 C ATOM 1376 O PRO B 233 12.105 -11.689 1.661 1.00 22.51 O ATOM 1377 CB PRO B 233 12.671 -12.278 4.834 1.00 3.31 C ATOM 1378 CG PRO B 233 11.671 -11.421 5.556 1.00 64.42 C ATOM 1379 CD PRO B 233 11.340 -10.279 4.635 1.00 22.31 C ATOM 0 HA PRO B 233 14.379 -11.263 3.833 1.00 74.32 H new ATOM 0 HB2 PRO B 233 12.189 -13.149 4.390 1.00 3.31 H new ATOM 0 HB3 PRO B 233 13.433 -12.649 5.519 1.00 3.31 H new ATOM 0 HG2 PRO B 233 10.776 -11.993 5.801 1.00 64.42 H new ATOM 0 HG3 PRO B 233 12.082 -11.054 6.496 1.00 64.42 H new ATOM 0 HD2 PRO B 233 10.518 -10.523 3.962 1.00 22.31 H new ATOM 0 HD3 PRO B 233 11.048 -9.384 5.184 1.00 22.31 H new ATOM 1387 N ALA B 234 13.987 -12.889 1.943 1.00 41.12 N ATOM 1388 CA ALA B 234 13.924 -13.530 0.616 1.00 65.01 C ATOM 1389 C ALA B 234 12.819 -14.605 0.516 1.00 44.21 C ATOM 1390 O ALA B 234 12.861 -15.473 -0.359 1.00 43.14 O ATOM 1391 CB ALA B 234 15.281 -14.136 0.278 1.00 31.35 C ATOM 0 H ALA B 234 14.774 -13.194 2.516 1.00 41.12 H new ATOM 0 HA ALA B 234 13.668 -12.754 -0.106 1.00 65.01 H new ATOM 0 HB1 ALA B 234 15.234 -14.610 -0.703 1.00 31.35 H new ATOM 0 HB2 ALA B 234 16.037 -13.351 0.266 1.00 31.35 H new ATOM 0 HB3 ALA B 234 15.544 -14.881 1.029 1.00 31.35 H new ATOM 1397 N ASN B 235 11.826 -14.535 1.402 1.00 43.13 N ATOM 1398 CA ASN B 235 10.696 -15.480 1.391 1.00 64.41 C ATOM 1399 C ASN B 235 9.400 -14.828 0.879 1.00 51.02 C ATOM 1400 O ASN B 235 8.399 -15.511 0.658 1.00 23.24 O ATOM 1401 CB ASN B 235 10.460 -16.046 2.798 1.00 23.13 C ATOM 1402 CG ASN B 235 11.509 -17.064 3.201 1.00 72.32 C ATOM 1403 OD1 ASN B 235 11.352 -18.256 2.971 1.00 33.43 O ATOM 1404 ND2 ASN B 235 12.587 -16.608 3.798 1.00 34.44 N ATOM 0 H ASN B 235 11.776 -13.834 2.141 1.00 43.13 H new ATOM 0 HA ASN B 235 10.961 -16.286 0.707 1.00 64.41 H new ATOM 0 HB2 ASN B 235 10.457 -15.228 3.519 1.00 23.13 H new ATOM 0 HB3 ASN B 235 9.475 -16.510 2.838 1.00 23.13 H new ATOM 0 HD21 ASN B 235 13.323 -17.253 4.084 1.00 34.44 H new ATOM 0 HD22 ASN B 235 12.688 -15.609 3.975 1.00 34.44 H new ATOM 1411 N THR B 236 9.420 -13.513 0.685 1.00 20.34 N ATOM 1412 CA THR B 236 8.212 -12.774 0.291 1.00 41.13 C ATOM 1413 C THR B 236 8.535 -11.629 -0.682 1.00 52.35 C ATOM 1414 O THR B 236 9.489 -10.878 -0.477 1.00 14.15 O ATOM 1415 CB THR B 236 7.492 -12.187 1.534 1.00 72.34 C ATOM 1416 OG1 THR B 236 7.235 -13.228 2.492 1.00 43.12 O ATOM 1417 CG2 THR B 236 6.174 -11.519 1.156 1.00 1.44 C ATOM 0 H THR B 236 10.253 -12.934 0.792 1.00 20.34 H new ATOM 0 HA THR B 236 7.559 -13.488 -0.211 1.00 41.13 H new ATOM 0 HB THR B 236 8.149 -11.433 1.968 1.00 72.34 H new ATOM 0 HG1 THR B 236 6.782 -12.849 3.274 1.00 43.12 H new ATOM 0 HG21 THR B 236 5.698 -11.120 2.052 1.00 1.44 H new ATOM 0 HG22 THR B 236 6.366 -10.707 0.454 1.00 1.44 H new ATOM 0 HG23 THR B 236 5.515 -12.252 0.691 1.00 1.44 H new ATOM 1425 N SER B 237 7.738 -11.509 -1.746 1.00 14.00 N ATOM 1426 CA SER B 237 7.883 -10.403 -2.708 1.00 13.02 C ATOM 1427 C SER B 237 7.337 -9.092 -2.125 1.00 23.22 C ATOM 1428 O SER B 237 6.513 -9.115 -1.210 1.00 61.32 O ATOM 1429 CB SER B 237 7.149 -10.727 -4.015 1.00 3.20 C ATOM 1430 OG SER B 237 7.315 -9.691 -4.972 1.00 1.32 O ATOM 0 H SER B 237 6.985 -12.161 -1.967 1.00 14.00 H new ATOM 0 HA SER B 237 8.946 -10.280 -2.914 1.00 13.02 H new ATOM 0 HB2 SER B 237 7.526 -11.665 -4.423 1.00 3.20 H new ATOM 0 HB3 SER B 237 6.088 -10.871 -3.812 1.00 3.20 H new ATOM 0 HG SER B 237 6.838 -9.926 -5.795 1.00 1.32 H new ATOM 1436 N MET B 238 7.775 -7.953 -2.666 1.00 1.03 N ATOM 1437 CA MET B 238 7.366 -6.638 -2.147 1.00 21.14 C ATOM 1438 C MET B 238 5.835 -6.480 -2.110 1.00 33.13 C ATOM 1439 O MET B 238 5.276 -6.073 -1.091 1.00 30.14 O ATOM 1440 CB MET B 238 7.989 -5.503 -2.975 1.00 3.33 C ATOM 1441 CG MET B 238 9.512 -5.449 -2.904 1.00 54.14 C ATOM 1442 SD MET B 238 10.188 -3.952 -3.656 1.00 71.11 S ATOM 1443 CE MET B 238 9.509 -2.688 -2.580 1.00 11.12 C ATOM 0 H MET B 238 8.412 -7.910 -3.462 1.00 1.03 H new ATOM 0 HA MET B 238 7.733 -6.576 -1.123 1.00 21.14 H new ATOM 0 HB2 MET B 238 7.688 -5.619 -4.016 1.00 3.33 H new ATOM 0 HB3 MET B 238 7.585 -4.551 -2.630 1.00 3.33 H new ATOM 0 HG2 MET B 238 9.826 -5.501 -1.861 1.00 54.14 H new ATOM 0 HG3 MET B 238 9.927 -6.323 -3.406 1.00 54.14 H new ATOM 0 HE1 MET B 238 10.136 -1.797 -2.625 1.00 11.12 H new ATOM 0 HE2 MET B 238 8.499 -2.438 -2.905 1.00 11.12 H new ATOM 0 HE3 MET B 238 9.479 -3.060 -1.556 1.00 11.12 H new ATOM 1453 N SER B 239 5.162 -6.810 -3.212 1.00 70.11 N ATOM 1454 CA SER B 239 3.688 -6.725 -3.276 1.00 1.11 C ATOM 1455 C SER B 239 3.033 -7.595 -2.192 1.00 24.53 C ATOM 1456 O SER B 239 2.137 -7.147 -1.474 1.00 63.53 O ATOM 1457 CB SER B 239 3.181 -7.166 -4.656 1.00 24.21 C ATOM 1458 OG SER B 239 3.504 -8.526 -4.910 1.00 13.53 O ATOM 0 H SER B 239 5.603 -7.138 -4.072 1.00 70.11 H new ATOM 0 HA SER B 239 3.413 -5.684 -3.104 1.00 1.11 H new ATOM 0 HB2 SER B 239 2.101 -7.029 -4.711 1.00 24.21 H new ATOM 0 HB3 SER B 239 3.622 -6.534 -5.427 1.00 24.21 H new ATOM 0 HG SER B 239 3.168 -8.782 -5.794 1.00 13.53 H new ATOM 1464 N ALA B 240 3.493 -8.838 -2.079 1.00 33.31 N ATOM 1465 CA ALA B 240 2.988 -9.769 -1.065 1.00 35.31 C ATOM 1466 C ALA B 240 3.312 -9.287 0.360 1.00 60.22 C ATOM 1467 O ALA B 240 2.553 -9.537 1.301 1.00 2.32 O ATOM 1468 CB ALA B 240 3.558 -11.163 -1.307 1.00 42.14 C ATOM 0 H ALA B 240 4.219 -9.229 -2.679 1.00 33.31 H new ATOM 0 HA ALA B 240 1.902 -9.809 -1.154 1.00 35.31 H new ATOM 0 HB1 ALA B 240 3.178 -11.848 -0.549 1.00 42.14 H new ATOM 0 HB2 ALA B 240 3.258 -11.512 -2.295 1.00 42.14 H new ATOM 0 HB3 ALA B 240 4.646 -11.126 -1.250 1.00 42.14 H new ATOM 1474 N TYR B 241 4.438 -8.595 0.513 1.00 74.22 N ATOM 1475 CA TYR B 241 4.830 -8.026 1.808 1.00 31.44 C ATOM 1476 C TYR B 241 3.905 -6.859 2.190 1.00 32.23 C ATOM 1477 O TYR B 241 3.448 -6.759 3.329 1.00 52.30 O ATOM 1478 CB TYR B 241 6.294 -7.561 1.762 1.00 31.02 C ATOM 1479 CG TYR B 241 6.825 -7.048 3.091 1.00 63.14 C ATOM 1480 CD1 TYR B 241 7.081 -7.923 4.145 1.00 51.02 C ATOM 1481 CD2 TYR B 241 7.071 -5.692 3.292 1.00 2.35 C ATOM 1482 CE1 TYR B 241 7.565 -7.462 5.355 1.00 53.34 C ATOM 1483 CE2 TYR B 241 7.556 -5.227 4.499 1.00 4.35 C ATOM 1484 CZ TYR B 241 7.800 -6.114 5.527 1.00 14.11 C ATOM 1485 OH TYR B 241 8.280 -5.648 6.731 1.00 14.52 O ATOM 0 H TYR B 241 5.099 -8.412 -0.242 1.00 74.22 H new ATOM 0 HA TYR B 241 4.734 -8.800 2.570 1.00 31.44 H new ATOM 0 HB2 TYR B 241 6.917 -8.391 1.430 1.00 31.02 H new ATOM 0 HB3 TYR B 241 6.390 -6.772 1.016 1.00 31.02 H new ATOM 0 HD1 TYR B 241 6.898 -8.979 4.014 1.00 51.02 H new ATOM 0 HD2 TYR B 241 6.880 -4.993 2.491 1.00 2.35 H new ATOM 0 HE1 TYR B 241 7.758 -8.154 6.161 1.00 53.34 H new ATOM 0 HE2 TYR B 241 7.744 -4.172 4.637 1.00 4.35 H new ATOM 0 HH TYR B 241 9.055 -5.070 6.572 1.00 14.52 H new ATOM 1495 N ILE B 242 3.618 -5.987 1.224 1.00 42.22 N ATOM 1496 CA ILE B 242 2.667 -4.890 1.434 1.00 14.53 C ATOM 1497 C ILE B 242 1.259 -5.434 1.726 1.00 23.44 C ATOM 1498 O ILE B 242 0.501 -4.842 2.490 1.00 11.35 O ATOM 1499 CB ILE B 242 2.614 -3.936 0.211 1.00 41.24 C ATOM 1500 CG1 ILE B 242 4.003 -3.340 -0.069 1.00 30.01 C ATOM 1501 CG2 ILE B 242 1.592 -2.819 0.432 1.00 53.42 C ATOM 1502 CD1 ILE B 242 4.551 -2.493 1.064 1.00 34.33 C ATOM 0 H ILE B 242 4.028 -6.016 0.290 1.00 42.22 H new ATOM 0 HA ILE B 242 3.018 -4.323 2.296 1.00 14.53 H new ATOM 0 HB ILE B 242 2.302 -4.518 -0.656 1.00 41.24 H new ATOM 0 HG12 ILE B 242 4.701 -4.152 -0.272 1.00 30.01 H new ATOM 0 HG13 ILE B 242 3.951 -2.731 -0.972 1.00 30.01 H new ATOM 0 HG21 ILE B 242 1.574 -2.164 -0.439 1.00 53.42 H new ATOM 0 HG22 ILE B 242 0.604 -3.254 0.579 1.00 53.42 H new ATOM 0 HG23 ILE B 242 1.869 -2.242 1.314 1.00 53.42 H new ATOM 0 HD11 ILE B 242 5.533 -2.109 0.789 1.00 34.33 H new ATOM 0 HD12 ILE B 242 3.876 -1.659 1.254 1.00 34.33 H new ATOM 0 HD13 ILE B 242 4.638 -3.102 1.964 1.00 34.33 H new ATOM 1514 N ARG B 243 0.930 -6.576 1.122 1.00 55.10 N ATOM 1515 CA ARG B 243 -0.363 -7.234 1.343 1.00 52.44 C ATOM 1516 C ARG B 243 -0.620 -7.505 2.837 1.00 5.15 C ATOM 1517 O ARG B 243 -1.695 -7.196 3.352 1.00 12.32 O ATOM 1518 CB ARG B 243 -0.445 -8.545 0.545 1.00 63.41 C ATOM 1519 CG ARG B 243 -1.743 -9.320 0.766 1.00 51.32 C ATOM 1520 CD ARG B 243 -1.857 -10.524 -0.165 1.00 45.42 C ATOM 1521 NE ARG B 243 -0.780 -11.494 0.028 1.00 51.23 N ATOM 1522 CZ ARG B 243 -0.585 -12.535 -0.740 1.00 70.23 C ATOM 1523 NH1 ARG B 243 -1.344 -12.750 -1.771 1.00 10.41 N ATOM 1524 NH2 ARG B 243 0.380 -13.357 -0.482 1.00 12.24 N ATOM 0 H ARG B 243 1.543 -7.069 0.472 1.00 55.10 H new ATOM 0 HA ARG B 243 -1.138 -6.553 0.991 1.00 52.44 H new ATOM 0 HB2 ARG B 243 -0.343 -8.320 -0.517 1.00 63.41 H new ATOM 0 HB3 ARG B 243 0.398 -9.180 0.819 1.00 63.41 H new ATOM 0 HG2 ARG B 243 -1.792 -9.657 1.802 1.00 51.32 H new ATOM 0 HG3 ARG B 243 -2.593 -8.657 0.606 1.00 51.32 H new ATOM 0 HD2 ARG B 243 -2.816 -11.015 -0.000 1.00 45.42 H new ATOM 0 HD3 ARG B 243 -1.849 -10.180 -1.199 1.00 45.42 H new ATOM 0 HE ARG B 243 -0.141 -11.350 0.810 1.00 51.23 H new ATOM 0 HH11 ARG B 243 -2.102 -12.104 -1.990 1.00 10.41 H new ATOM 0 HH12 ARG B 243 -1.182 -13.565 -2.362 1.00 10.41 H new ATOM 0 HH21 ARG B 243 0.989 -13.193 0.320 1.00 12.24 H new ATOM 0 HH22 ARG B 243 0.532 -14.169 -1.081 1.00 12.24 H new ATOM 1538 N ARG B 244 0.363 -8.080 3.534 1.00 10.44 N ATOM 1539 CA ARG B 244 0.212 -8.346 4.971 1.00 10.41 C ATOM 1540 C ARG B 244 0.224 -7.035 5.775 1.00 42.42 C ATOM 1541 O ARG B 244 -0.422 -6.929 6.814 1.00 65.33 O ATOM 1542 CB ARG B 244 1.303 -9.305 5.486 1.00 21.23 C ATOM 1543 CG ARG B 244 2.723 -8.744 5.442 1.00 11.44 C ATOM 1544 CD ARG B 244 3.707 -9.638 6.193 1.00 22.32 C ATOM 1545 NE ARG B 244 3.320 -9.800 7.593 1.00 11.40 N ATOM 1546 CZ ARG B 244 4.107 -10.236 8.538 1.00 12.11 C ATOM 1547 NH1 ARG B 244 5.333 -10.562 8.281 1.00 25.34 N ATOM 1548 NH2 ARG B 244 3.661 -10.333 9.747 1.00 42.52 N ATOM 0 H ARG B 244 1.258 -8.367 3.138 1.00 10.44 H new ATOM 0 HA ARG B 244 -0.754 -8.831 5.114 1.00 10.41 H new ATOM 0 HB2 ARG B 244 1.068 -9.581 6.514 1.00 21.23 H new ATOM 0 HB3 ARG B 244 1.271 -10.220 4.895 1.00 21.23 H new ATOM 0 HG2 ARG B 244 3.042 -8.643 4.405 1.00 11.44 H new ATOM 0 HG3 ARG B 244 2.733 -7.745 5.878 1.00 11.44 H new ATOM 0 HD2 ARG B 244 3.754 -10.615 5.712 1.00 22.32 H new ATOM 0 HD3 ARG B 244 4.707 -9.207 6.138 1.00 22.32 H new ATOM 0 HE ARG B 244 2.364 -9.554 7.850 1.00 11.40 H new ATOM 0 HH11 ARG B 244 5.694 -10.479 7.331 1.00 25.34 H new ATOM 0 HH12 ARG B 244 5.938 -10.901 9.029 1.00 25.34 H new ATOM 0 HH21 ARG B 244 2.699 -10.069 9.958 1.00 42.52 H new ATOM 0 HH22 ARG B 244 4.271 -10.673 10.490 1.00 42.52 H new ATOM 1562 N ILE B 245 0.952 -6.034 5.278 1.00 22.25 N ATOM 1563 CA ILE B 245 0.982 -4.708 5.910 1.00 35.02 C ATOM 1564 C ILE B 245 -0.410 -4.056 5.909 1.00 25.43 C ATOM 1565 O ILE B 245 -0.940 -3.689 6.960 1.00 62.11 O ATOM 1566 CB ILE B 245 1.994 -3.763 5.205 1.00 73.01 C ATOM 1567 CG1 ILE B 245 3.434 -4.257 5.430 1.00 53.33 C ATOM 1568 CG2 ILE B 245 1.828 -2.319 5.685 1.00 32.44 C ATOM 1569 CD1 ILE B 245 4.493 -3.383 4.790 1.00 0.10 C ATOM 0 H ILE B 245 1.529 -6.113 4.441 1.00 22.25 H new ATOM 0 HA ILE B 245 1.302 -4.859 6.941 1.00 35.02 H new ATOM 0 HB ILE B 245 1.788 -3.780 4.135 1.00 73.01 H new ATOM 0 HG12 ILE B 245 3.624 -4.314 6.502 1.00 53.33 H new ATOM 0 HG13 ILE B 245 3.526 -5.269 5.035 1.00 53.33 H new ATOM 0 HG21 ILE B 245 2.549 -1.681 5.175 1.00 32.44 H new ATOM 0 HG22 ILE B 245 0.818 -1.975 5.462 1.00 32.44 H new ATOM 0 HG23 ILE B 245 1.999 -2.271 6.761 1.00 32.44 H new ATOM 0 HD11 ILE B 245 5.480 -3.798 4.994 1.00 0.10 H new ATOM 0 HD12 ILE B 245 4.331 -3.345 3.713 1.00 0.10 H new ATOM 0 HD13 ILE B 245 4.431 -2.376 5.202 1.00 0.10 H new ATOM 1581 N ILE B 246 -1.003 -3.919 4.723 1.00 22.32 N ATOM 1582 CA ILE B 246 -2.337 -3.330 4.595 1.00 73.12 C ATOM 1583 C ILE B 246 -3.412 -4.227 5.236 1.00 51.03 C ATOM 1584 O ILE B 246 -4.450 -3.738 5.679 1.00 61.00 O ATOM 1585 CB ILE B 246 -2.701 -3.040 3.113 1.00 34.13 C ATOM 1586 CG1 ILE B 246 -2.697 -4.335 2.286 1.00 50.43 C ATOM 1587 CG2 ILE B 246 -1.731 -2.016 2.519 1.00 31.32 C ATOM 1588 CD1 ILE B 246 -3.060 -4.138 0.828 1.00 42.45 C ATOM 0 H ILE B 246 -0.583 -4.207 3.839 1.00 22.32 H new ATOM 0 HA ILE B 246 -2.312 -2.381 5.130 1.00 73.12 H new ATOM 0 HB ILE B 246 -3.708 -2.623 3.081 1.00 34.13 H new ATOM 0 HG12 ILE B 246 -1.707 -4.788 2.345 1.00 50.43 H new ATOM 0 HG13 ILE B 246 -3.398 -5.041 2.732 1.00 50.43 H new ATOM 0 HG21 ILE B 246 -1.998 -1.822 1.480 1.00 31.32 H new ATOM 0 HG22 ILE B 246 -1.789 -1.088 3.088 1.00 31.32 H new ATOM 0 HG23 ILE B 246 -0.715 -2.408 2.566 1.00 31.32 H new ATOM 0 HD11 ILE B 246 -3.034 -5.099 0.314 1.00 42.45 H new ATOM 0 HD12 ILE B 246 -4.062 -3.715 0.756 1.00 42.45 H new ATOM 0 HD13 ILE B 246 -2.345 -3.459 0.364 1.00 42.45 H new ATOM 1600 N LEU B 247 -3.151 -5.535 5.299 1.00 31.32 N ATOM 1601 CA LEU B 247 -4.049 -6.472 5.988 1.00 30.12 C ATOM 1602 C LEU B 247 -4.227 -6.063 7.459 1.00 25.31 C ATOM 1603 O LEU B 247 -5.353 -5.910 7.942 1.00 22.21 O ATOM 1604 CB LEU B 247 -3.502 -7.905 5.899 1.00 51.52 C ATOM 1605 CG LEU B 247 -4.393 -8.995 6.517 1.00 33.31 C ATOM 1606 CD1 LEU B 247 -5.734 -9.074 5.792 1.00 71.21 C ATOM 1607 CD2 LEU B 247 -3.683 -10.345 6.492 1.00 13.12 C ATOM 0 H LEU B 247 -2.328 -5.971 4.883 1.00 31.32 H new ATOM 0 HA LEU B 247 -5.021 -6.439 5.497 1.00 30.12 H new ATOM 0 HB2 LEU B 247 -3.337 -8.147 4.849 1.00 51.52 H new ATOM 0 HB3 LEU B 247 -2.529 -7.935 6.390 1.00 51.52 H new ATOM 0 HG LEU B 247 -4.587 -8.730 7.556 1.00 33.31 H new ATOM 0 HD11 LEU B 247 -6.348 -9.852 6.246 1.00 71.21 H new ATOM 0 HD12 LEU B 247 -6.247 -8.115 5.870 1.00 71.21 H new ATOM 0 HD13 LEU B 247 -5.566 -9.311 4.741 1.00 71.21 H new ATOM 0 HD21 LEU B 247 -4.329 -11.104 6.933 1.00 13.12 H new ATOM 0 HD22 LEU B 247 -3.455 -10.617 5.461 1.00 13.12 H new ATOM 0 HD23 LEU B 247 -2.757 -10.280 7.063 1.00 13.12 H new ATOM 1619 N ASN B 248 -3.105 -5.856 8.155 1.00 13.22 N ATOM 1620 CA ASN B 248 -3.123 -5.395 9.550 1.00 63.52 C ATOM 1621 C ASN B 248 -3.877 -4.060 9.698 1.00 23.33 C ATOM 1622 O ASN B 248 -4.295 -3.685 10.797 1.00 63.10 O ATOM 1623 CB ASN B 248 -1.698 -5.259 10.091 1.00 72.03 C ATOM 1624 CG ASN B 248 -0.978 -6.594 10.176 1.00 42.43 C ATOM 1625 OD1 ASN B 248 -1.217 -7.501 9.387 1.00 61.13 O ATOM 1626 ND2 ASN B 248 -0.095 -6.732 11.143 1.00 73.42 N ATOM 0 H ASN B 248 -2.169 -6.000 7.775 1.00 13.22 H new ATOM 0 HA ASN B 248 -3.654 -6.146 10.135 1.00 63.52 H new ATOM 0 HB2 ASN B 248 -1.132 -4.585 9.448 1.00 72.03 H new ATOM 0 HB3 ASN B 248 -1.731 -4.804 11.081 1.00 72.03 H new ATOM 0 HD21 ASN B 248 0.411 -7.611 11.250 1.00 73.42 H new ATOM 0 HD22 ASN B 248 0.083 -5.960 11.785 1.00 73.42 H new ATOM 1633 N HIS B 249 -4.038 -3.340 8.589 1.00 43.02 N ATOM 1634 CA HIS B 249 -4.873 -2.138 8.564 1.00 51.23 C ATOM 1635 C HIS B 249 -6.359 -2.524 8.450 1.00 72.32 C ATOM 1636 O HIS B 249 -7.173 -2.123 9.272 1.00 32.10 O ATOM 1637 CB HIS B 249 -4.460 -1.225 7.394 1.00 32.32 C ATOM 1638 CG HIS B 249 -5.222 0.071 7.317 1.00 51.12 C ATOM 1639 ND1 HIS B 249 -4.695 1.281 7.707 1.00 61.22 N ATOM 1640 CD2 HIS B 249 -6.476 0.340 6.877 1.00 72.13 C ATOM 1641 CE1 HIS B 249 -5.587 2.234 7.515 1.00 42.05 C ATOM 1642 NE2 HIS B 249 -6.679 1.691 7.013 1.00 44.52 N ATOM 0 H HIS B 249 -3.602 -3.567 7.695 1.00 43.02 H new ATOM 0 HA HIS B 249 -4.728 -1.591 9.496 1.00 51.23 H new ATOM 0 HB2 HIS B 249 -3.397 -1.002 7.481 1.00 32.32 H new ATOM 0 HB3 HIS B 249 -4.597 -1.769 6.459 1.00 32.32 H new ATOM 0 HD2 HIS B 249 -7.185 -0.377 6.490 1.00 72.13 H new ATOM 0 HE1 HIS B 249 -5.447 3.283 7.732 1.00 42.05 H new ATOM 0 HE2 HIS B 249 -7.533 2.192 6.767 1.00 44.52 H new ATOM 1651 N LEU B 250 -6.695 -3.330 7.441 1.00 40.21 N ATOM 1652 CA LEU B 250 -8.091 -3.730 7.180 1.00 2.24 C ATOM 1653 C LEU B 250 -8.722 -4.518 8.346 1.00 3.30 C ATOM 1654 O LEU B 250 -9.945 -4.525 8.503 1.00 12.24 O ATOM 1655 CB LEU B 250 -8.182 -4.550 5.877 1.00 60.30 C ATOM 1656 CG LEU B 250 -8.286 -3.733 4.573 1.00 64.44 C ATOM 1657 CD1 LEU B 250 -9.561 -2.895 4.560 1.00 31.31 C ATOM 1658 CD2 LEU B 250 -7.057 -2.847 4.372 1.00 43.41 C ATOM 0 H LEU B 250 -6.020 -3.723 6.785 1.00 40.21 H new ATOM 0 HA LEU B 250 -8.662 -2.808 7.075 1.00 2.24 H new ATOM 0 HB2 LEU B 250 -7.303 -5.191 5.812 1.00 60.30 H new ATOM 0 HB3 LEU B 250 -9.051 -5.205 5.943 1.00 60.30 H new ATOM 0 HG LEU B 250 -8.328 -4.438 3.743 1.00 64.44 H new ATOM 0 HD11 LEU B 250 -9.614 -2.327 3.631 1.00 31.31 H new ATOM 0 HD12 LEU B 250 -10.428 -3.551 4.634 1.00 31.31 H new ATOM 0 HD13 LEU B 250 -9.553 -2.207 5.406 1.00 31.31 H new ATOM 0 HD21 LEU B 250 -7.162 -2.285 3.444 1.00 43.41 H new ATOM 0 HD22 LEU B 250 -6.967 -2.154 5.208 1.00 43.41 H new ATOM 0 HD23 LEU B 250 -6.164 -3.470 4.320 1.00 43.41 H new ATOM 1670 N GLU B 251 -7.901 -5.192 9.150 1.00 71.25 N ATOM 1671 CA GLU B 251 -8.408 -5.961 10.301 1.00 40.43 C ATOM 1672 C GLU B 251 -8.533 -5.099 11.572 1.00 41.54 C ATOM 1673 O GLU B 251 -8.913 -5.601 12.633 1.00 51.12 O ATOM 1674 CB GLU B 251 -7.484 -7.155 10.586 1.00 33.51 C ATOM 1675 CG GLU B 251 -6.062 -6.749 10.971 1.00 42.11 C ATOM 1676 CD GLU B 251 -5.176 -7.930 11.347 1.00 73.40 C ATOM 1677 OE1 GLU B 251 -5.109 -8.905 10.567 1.00 41.14 O ATOM 1678 OE2 GLU B 251 -4.543 -7.886 12.428 1.00 32.21 O ATOM 0 H GLU B 251 -6.888 -5.226 9.033 1.00 71.25 H new ATOM 0 HA GLU B 251 -9.405 -6.312 10.036 1.00 40.43 H new ATOM 0 HB2 GLU B 251 -7.913 -7.752 11.391 1.00 33.51 H new ATOM 0 HB3 GLU B 251 -7.445 -7.792 9.703 1.00 33.51 H new ATOM 0 HG2 GLU B 251 -5.607 -6.214 10.138 1.00 42.11 H new ATOM 0 HG3 GLU B 251 -6.105 -6.055 11.810 1.00 42.11 H new ATOM 1685 N ASP B 252 -8.227 -3.804 11.469 1.00 34.34 N ATOM 1686 CA ASP B 252 -8.196 -2.928 12.649 1.00 41.21 C ATOM 1687 C ASP B 252 -8.938 -1.599 12.405 1.00 62.35 C ATOM 1688 O ASP B 252 -9.830 -1.217 13.171 1.00 13.42 O ATOM 1689 CB ASP B 252 -6.734 -2.652 13.036 1.00 63.25 C ATOM 1690 CG ASP B 252 -6.592 -2.085 14.439 1.00 0.21 C ATOM 1691 OD1 ASP B 252 -6.837 -0.878 14.634 1.00 64.42 O ATOM 1692 OD2 ASP B 252 -6.240 -2.852 15.360 1.00 63.32 O ATOM 0 H ASP B 252 -7.999 -3.339 10.590 1.00 34.34 H new ATOM 0 HA ASP B 252 -8.711 -3.439 13.463 1.00 41.21 H new ATOM 0 HB2 ASP B 252 -6.163 -3.578 12.964 1.00 63.25 H new ATOM 0 HB3 ASP B 252 -6.300 -1.953 12.321 1.00 63.25 H new ATOM 1697 N GLU B 253 -8.562 -0.905 11.334 1.00 34.31 N ATOM 1698 CA GLU B 253 -9.086 0.434 11.031 1.00 2.50 C ATOM 1699 C GLU B 253 -9.601 0.549 9.575 1.00 74.24 C ATOM 1700 O GLU B 253 -8.879 0.141 8.637 1.00 38.74 O ATOM 1701 CB GLU B 253 -7.994 1.482 11.312 1.00 21.12 C ATOM 1702 CG GLU B 253 -6.647 1.162 10.667 1.00 63.31 C ATOM 1703 CD GLU B 253 -5.574 2.190 10.994 1.00 63.53 C ATOM 1704 OE1 GLU B 253 -5.717 3.359 10.579 1.00 23.12 O ATOM 1705 OE2 GLU B 253 -4.573 1.834 11.653 1.00 10.22 O ATOM 1706 OXT GLU B 253 -10.719 1.071 9.375 1.00 38.74 O ATOM 0 H GLU B 253 -7.888 -1.249 10.650 1.00 34.31 H new ATOM 0 HA GLU B 253 -9.945 0.617 11.677 1.00 2.50 H new ATOM 0 HB2 GLU B 253 -8.336 2.453 10.954 1.00 21.12 H new ATOM 0 HB3 GLU B 253 -7.858 1.570 12.390 1.00 21.12 H new ATOM 0 HG2 GLU B 253 -6.315 0.179 11.001 1.00 63.31 H new ATOM 0 HG3 GLU B 253 -6.772 1.106 9.586 1.00 63.31 H new TER 1713 GLU B 253