USER MOD reduce.3.24.130724 H: found=0, std=0, add=713, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 711 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 109:sc= -2.88! USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0176 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.254! USER MOD Single : A 48 GLN : amide:sc= -3.46! C(o=-3.5!,f=-3!) USER MOD Single : A 49 LYS NZ :NH3+ -138:sc= -5.31! (180deg=-8.13!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.532) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= 0.149 K(o=0.15,f=-3.8!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -4.81! C(o=-4.8!,f=-7.1!) USER MOD Single : A 75 THR OG1 : rot 148:sc= -1.99! USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 167:sc=-0.00227 (180deg=-0.219) USER MOD Single : A 79 MET CE :methyl -141:sc= -0.119 (180deg=-2.02) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 THR OG1 : rot 39:sc= 0.514 USER MOD Single : A 85 SER OG : rot 40:sc= 0.809 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc=-0.000791 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 16.674 10.431 7.399 1.00 0.00 N ATOM 2 CA GLY A 1 18.104 10.591 7.603 1.00 0.00 C ATOM 3 C GLY A 1 18.866 10.432 6.286 1.00 0.00 C ATOM 4 O GLY A 1 19.032 9.318 5.790 1.00 0.00 O ATOM 0 H1 GLY A 1 16.179 10.543 8.307 1.00 0.00 H new ATOM 0 H2 GLY A 1 16.336 11.151 6.729 1.00 0.00 H new ATOM 0 H3 GLY A 1 16.482 9.484 7.015 1.00 0.00 H new ATOM 0 HA2 GLY A 1 18.307 11.574 8.028 1.00 0.00 H new ATOM 0 HA3 GLY A 1 18.457 9.853 8.323 1.00 0.00 H new ATOM 8 N SER A 2 19.311 11.562 5.756 1.00 0.00 N ATOM 9 CA SER A 2 20.052 11.563 4.506 1.00 0.00 C ATOM 10 C SER A 2 19.307 10.736 3.456 1.00 0.00 C ATOM 11 O SER A 2 19.559 9.542 3.307 1.00 0.00 O ATOM 12 CB SER A 2 21.467 11.017 4.705 1.00 0.00 C ATOM 13 OG SER A 2 22.450 11.849 4.096 1.00 0.00 O ATOM 0 H SER A 2 19.172 12.484 6.170 1.00 0.00 H new ATOM 0 HA SER A 2 20.134 12.592 4.157 1.00 0.00 H new ATOM 0 HB2 SER A 2 21.676 10.930 5.771 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.531 10.013 4.285 1.00 0.00 H new ATOM 0 HG SER A 2 23.340 11.468 4.247 1.00 0.00 H new ATOM 19 N SER A 3 18.403 11.405 2.755 1.00 0.00 N ATOM 20 CA SER A 3 17.619 10.747 1.723 1.00 0.00 C ATOM 21 C SER A 3 18.352 10.823 0.382 1.00 0.00 C ATOM 22 O SER A 3 19.110 11.760 0.137 1.00 0.00 O ATOM 23 CB SER A 3 16.229 11.373 1.604 1.00 0.00 C ATOM 24 OG SER A 3 16.294 12.768 1.319 1.00 0.00 O ATOM 0 H SER A 3 18.196 12.396 2.881 1.00 0.00 H new ATOM 0 HA SER A 3 17.494 9.701 2.003 1.00 0.00 H new ATOM 0 HB2 SER A 3 15.670 10.868 0.816 1.00 0.00 H new ATOM 0 HB3 SER A 3 15.681 11.218 2.533 1.00 0.00 H new ATOM 0 HG SER A 3 15.386 13.130 1.249 1.00 0.00 H new ATOM 30 N GLY A 4 18.099 9.824 -0.451 1.00 0.00 N ATOM 31 CA GLY A 4 18.725 9.765 -1.761 1.00 0.00 C ATOM 32 C GLY A 4 17.867 10.473 -2.811 1.00 0.00 C ATOM 33 O GLY A 4 17.841 11.702 -2.872 1.00 0.00 O ATOM 0 H GLY A 4 17.469 9.049 -0.244 1.00 0.00 H new ATOM 0 HA2 GLY A 4 19.710 10.229 -1.718 1.00 0.00 H new ATOM 0 HA3 GLY A 4 18.875 8.725 -2.050 1.00 0.00 H new ATOM 37 N SER A 5 17.184 9.668 -3.612 1.00 0.00 N ATOM 38 CA SER A 5 16.327 10.202 -4.656 1.00 0.00 C ATOM 39 C SER A 5 15.058 10.793 -4.040 1.00 0.00 C ATOM 40 O SER A 5 14.308 10.092 -3.362 1.00 0.00 O ATOM 41 CB SER A 5 15.967 9.123 -5.679 1.00 0.00 C ATOM 42 OG SER A 5 14.952 9.557 -6.579 1.00 0.00 O ATOM 0 H SER A 5 17.207 8.650 -3.559 1.00 0.00 H new ATOM 0 HA SER A 5 16.872 10.990 -5.176 1.00 0.00 H new ATOM 0 HB2 SER A 5 16.858 8.847 -6.243 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.630 8.227 -5.157 1.00 0.00 H new ATOM 0 HG SER A 5 14.752 8.840 -7.217 1.00 0.00 H new ATOM 48 N SER A 6 14.855 12.077 -4.297 1.00 0.00 N ATOM 49 CA SER A 6 13.690 12.771 -3.776 1.00 0.00 C ATOM 50 C SER A 6 12.414 12.042 -4.202 1.00 0.00 C ATOM 51 O SER A 6 12.257 11.688 -5.370 1.00 0.00 O ATOM 52 CB SER A 6 13.655 14.224 -4.252 1.00 0.00 C ATOM 53 OG SER A 6 14.629 15.026 -3.590 1.00 0.00 O ATOM 0 H SER A 6 15.479 12.655 -4.860 1.00 0.00 H new ATOM 0 HA SER A 6 13.753 12.776 -2.688 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.828 14.257 -5.328 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.663 14.639 -4.076 1.00 0.00 H new ATOM 0 HG SER A 6 14.576 15.946 -3.923 1.00 0.00 H new ATOM 59 N GLY A 7 11.534 11.839 -3.232 1.00 0.00 N ATOM 60 CA GLY A 7 10.277 11.159 -3.492 1.00 0.00 C ATOM 61 C GLY A 7 9.595 10.749 -2.185 1.00 0.00 C ATOM 62 O GLY A 7 9.924 11.268 -1.120 1.00 0.00 O ATOM 0 H GLY A 7 11.667 12.134 -2.265 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.617 11.813 -4.061 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.457 10.276 -4.105 1.00 0.00 H new ATOM 66 N LEU A 8 8.658 9.820 -2.310 1.00 0.00 N ATOM 67 CA LEU A 8 7.927 9.334 -1.152 1.00 0.00 C ATOM 68 C LEU A 8 7.944 7.804 -1.149 1.00 0.00 C ATOM 69 O LEU A 8 7.143 7.169 -1.834 1.00 0.00 O ATOM 70 CB LEU A 8 6.520 9.933 -1.116 1.00 0.00 C ATOM 71 CG LEU A 8 5.895 10.096 0.271 1.00 0.00 C ATOM 72 CD1 LEU A 8 6.636 11.158 1.085 1.00 0.00 C ATOM 73 CD2 LEU A 8 4.398 10.395 0.166 1.00 0.00 C ATOM 0 H LEU A 8 8.388 9.391 -3.195 1.00 0.00 H new ATOM 0 HA LEU A 8 8.411 9.661 -0.232 1.00 0.00 H new ATOM 0 HB2 LEU A 8 6.551 10.911 -1.596 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.863 9.304 -1.717 1.00 0.00 H new ATOM 0 HG LEU A 8 5.998 9.151 0.805 1.00 0.00 H new ATOM 0 HD11 LEU A 8 6.171 11.254 2.066 1.00 0.00 H new ATOM 0 HD12 LEU A 8 7.679 10.863 1.204 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.587 12.115 0.565 1.00 0.00 H new ATOM 0 HD21 LEU A 8 3.978 10.506 1.166 1.00 0.00 H new ATOM 0 HD22 LEU A 8 4.250 11.318 -0.395 1.00 0.00 H new ATOM 0 HD23 LEU A 8 3.898 9.574 -0.348 1.00 0.00 H new ATOM 85 N PRO A 9 8.890 7.241 -0.350 1.00 0.00 N ATOM 86 CA PRO A 9 9.021 5.798 -0.249 1.00 0.00 C ATOM 87 C PRO A 9 7.898 5.203 0.603 1.00 0.00 C ATOM 88 O PRO A 9 7.534 5.763 1.635 1.00 0.00 O ATOM 89 CB PRO A 9 10.402 5.569 0.345 1.00 0.00 C ATOM 90 CG PRO A 9 10.804 6.889 0.984 1.00 0.00 C ATOM 91 CD PRO A 9 9.855 7.961 0.475 1.00 0.00 C ATOM 0 HA PRO A 9 8.929 5.299 -1.214 1.00 0.00 H new ATOM 0 HB2 PRO A 9 10.382 4.768 1.083 1.00 0.00 H new ATOM 0 HB3 PRO A 9 11.115 5.275 -0.425 1.00 0.00 H new ATOM 0 HG2 PRO A 9 10.753 6.818 2.071 1.00 0.00 H new ATOM 0 HG3 PRO A 9 11.834 7.139 0.729 1.00 0.00 H new ATOM 0 HD2 PRO A 9 9.363 8.478 1.299 1.00 0.00 H new ATOM 0 HD3 PRO A 9 10.385 8.717 -0.104 1.00 0.00 H new ATOM 99 N ILE A 10 7.380 4.075 0.138 1.00 0.00 N ATOM 100 CA ILE A 10 6.306 3.398 0.844 1.00 0.00 C ATOM 101 C ILE A 10 6.722 1.955 1.134 1.00 0.00 C ATOM 102 O ILE A 10 6.854 1.147 0.215 1.00 0.00 O ATOM 103 CB ILE A 10 4.995 3.516 0.065 1.00 0.00 C ATOM 104 CG1 ILE A 10 4.480 4.957 0.072 1.00 0.00 C ATOM 105 CG2 ILE A 10 3.951 2.532 0.595 1.00 0.00 C ATOM 106 CD1 ILE A 10 3.591 5.228 -1.144 1.00 0.00 C ATOM 0 H ILE A 10 7.685 3.613 -0.719 1.00 0.00 H new ATOM 0 HA ILE A 10 6.122 3.876 1.806 1.00 0.00 H new ATOM 0 HB ILE A 10 5.191 3.249 -0.974 1.00 0.00 H new ATOM 0 HG12 ILE A 10 3.917 5.141 0.987 1.00 0.00 H new ATOM 0 HG13 ILE A 10 5.323 5.648 0.072 1.00 0.00 H new ATOM 0 HG21 ILE A 10 3.029 2.637 0.024 1.00 0.00 H new ATOM 0 HG22 ILE A 10 4.326 1.514 0.494 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.753 2.743 1.646 1.00 0.00 H new ATOM 0 HD11 ILE A 10 3.238 6.259 -1.114 1.00 0.00 H new ATOM 0 HD12 ILE A 10 4.164 5.067 -2.057 1.00 0.00 H new ATOM 0 HD13 ILE A 10 2.736 4.552 -1.128 1.00 0.00 H new ATOM 118 N ILE A 11 6.916 1.674 2.414 1.00 0.00 N ATOM 119 CA ILE A 11 7.314 0.342 2.836 1.00 0.00 C ATOM 120 C ILE A 11 6.064 -0.499 3.101 1.00 0.00 C ATOM 121 O ILE A 11 5.141 -0.050 3.779 1.00 0.00 O ATOM 122 CB ILE A 11 8.267 0.420 4.030 1.00 0.00 C ATOM 123 CG1 ILE A 11 9.568 1.128 3.648 1.00 0.00 C ATOM 124 CG2 ILE A 11 8.522 -0.968 4.621 1.00 0.00 C ATOM 125 CD1 ILE A 11 10.384 1.485 4.892 1.00 0.00 C ATOM 0 H ILE A 11 6.805 2.346 3.173 1.00 0.00 H new ATOM 0 HA ILE A 11 7.873 -0.157 2.044 1.00 0.00 H new ATOM 0 HB ILE A 11 7.791 1.018 4.807 1.00 0.00 H new ATOM 0 HG12 ILE A 11 10.158 0.485 2.994 1.00 0.00 H new ATOM 0 HG13 ILE A 11 9.342 2.034 3.085 1.00 0.00 H new ATOM 0 HG21 ILE A 11 9.203 -0.883 5.468 1.00 0.00 H new ATOM 0 HG22 ILE A 11 7.579 -1.400 4.955 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.967 -1.611 3.861 1.00 0.00 H new ATOM 0 HD11 ILE A 11 11.304 1.987 4.592 1.00 0.00 H new ATOM 0 HD12 ILE A 11 9.801 2.147 5.532 1.00 0.00 H new ATOM 0 HD13 ILE A 11 10.630 0.575 5.440 1.00 0.00 H new ATOM 137 N VAL A 12 6.073 -1.705 2.551 1.00 0.00 N ATOM 138 CA VAL A 12 4.951 -2.613 2.720 1.00 0.00 C ATOM 139 C VAL A 12 5.431 -3.883 3.425 1.00 0.00 C ATOM 140 O VAL A 12 6.218 -4.647 2.869 1.00 0.00 O ATOM 141 CB VAL A 12 4.296 -2.892 1.366 1.00 0.00 C ATOM 142 CG1 VAL A 12 3.016 -3.713 1.535 1.00 0.00 C ATOM 143 CG2 VAL A 12 4.017 -1.590 0.613 1.00 0.00 C ATOM 0 H VAL A 12 6.839 -2.074 1.988 1.00 0.00 H new ATOM 0 HA VAL A 12 4.185 -2.161 3.350 1.00 0.00 H new ATOM 0 HB VAL A 12 4.995 -3.480 0.771 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.570 -3.897 0.558 1.00 0.00 H new ATOM 0 HG12 VAL A 12 3.254 -4.664 2.011 1.00 0.00 H new ATOM 0 HG13 VAL A 12 2.310 -3.163 2.158 1.00 0.00 H new ATOM 0 HG21 VAL A 12 3.551 -1.817 -0.346 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.347 -0.965 1.203 1.00 0.00 H new ATOM 0 HG23 VAL A 12 4.954 -1.059 0.445 1.00 0.00 H new ATOM 153 N LYS A 13 4.936 -4.070 4.640 1.00 0.00 N ATOM 154 CA LYS A 13 5.303 -5.234 5.427 1.00 0.00 C ATOM 155 C LYS A 13 4.134 -6.221 5.447 1.00 0.00 C ATOM 156 O LYS A 13 3.130 -5.986 6.117 1.00 0.00 O ATOM 157 CB LYS A 13 5.775 -4.812 6.820 1.00 0.00 C ATOM 158 CG LYS A 13 5.854 -6.016 7.761 1.00 0.00 C ATOM 159 CD LYS A 13 7.202 -6.062 8.482 1.00 0.00 C ATOM 160 CE LYS A 13 7.027 -5.850 9.987 1.00 0.00 C ATOM 161 NZ LYS A 13 8.070 -6.582 10.739 1.00 0.00 N ATOM 0 H LYS A 13 4.283 -3.434 5.098 1.00 0.00 H new ATOM 0 HA LYS A 13 6.148 -5.750 4.972 1.00 0.00 H new ATOM 0 HB2 LYS A 13 6.754 -4.338 6.748 1.00 0.00 H new ATOM 0 HB3 LYS A 13 5.090 -4.070 7.230 1.00 0.00 H new ATOM 0 HG2 LYS A 13 5.048 -5.963 8.493 1.00 0.00 H new ATOM 0 HG3 LYS A 13 5.710 -6.935 7.194 1.00 0.00 H new ATOM 0 HD2 LYS A 13 7.683 -7.023 8.300 1.00 0.00 H new ATOM 0 HD3 LYS A 13 7.861 -5.294 8.077 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.082 -4.786 10.219 1.00 0.00 H new ATOM 0 HE3 LYS A 13 6.040 -6.193 10.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 7.936 -6.427 11.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 7.999 -7.599 10.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 9.009 -6.236 10.457 1.00 0.00 H new ATOM 175 N TRP A 14 4.304 -7.306 4.705 1.00 0.00 N ATOM 176 CA TRP A 14 3.276 -8.329 4.629 1.00 0.00 C ATOM 177 C TRP A 14 3.965 -9.695 4.657 1.00 0.00 C ATOM 178 O TRP A 14 4.944 -9.915 3.947 1.00 0.00 O ATOM 179 CB TRP A 14 2.394 -8.130 3.394 1.00 0.00 C ATOM 180 CG TRP A 14 1.597 -9.372 2.992 1.00 0.00 C ATOM 181 CD1 TRP A 14 0.464 -9.838 3.536 1.00 0.00 C ATOM 182 CD2 TRP A 14 1.920 -10.295 1.930 1.00 0.00 C ATOM 183 NE1 TRP A 14 0.036 -10.988 2.905 1.00 0.00 N ATOM 184 CE2 TRP A 14 0.949 -11.274 1.897 1.00 0.00 C ATOM 185 CE3 TRP A 14 2.998 -10.301 1.026 1.00 0.00 C ATOM 186 CZ2 TRP A 14 0.958 -12.333 0.981 1.00 0.00 C ATOM 187 CZ3 TRP A 14 2.992 -11.365 0.117 1.00 0.00 C ATOM 188 CH2 TRP A 14 2.022 -12.359 0.071 1.00 0.00 C ATOM 0 H TRP A 14 5.139 -7.498 4.151 1.00 0.00 H new ATOM 0 HA TRP A 14 2.601 -8.261 5.483 1.00 0.00 H new ATOM 0 HB2 TRP A 14 1.700 -7.311 3.584 1.00 0.00 H new ATOM 0 HB3 TRP A 14 3.022 -7.827 2.556 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -0.049 -9.372 4.364 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -0.797 -11.529 3.136 1.00 0.00 H new ATOM 0 HE3 TRP A 14 3.769 -9.545 1.033 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 0.186 -13.089 0.977 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 3.798 -11.417 -0.600 1.00 0.00 H new ATOM 0 HH2 TRP A 14 2.088 -13.148 -0.663 1.00 0.00 H new ATOM 199 N GLY A 15 3.425 -10.577 5.486 1.00 0.00 N ATOM 200 CA GLY A 15 3.976 -11.915 5.617 1.00 0.00 C ATOM 201 C GLY A 15 5.456 -11.864 6.001 1.00 0.00 C ATOM 202 O GLY A 15 6.254 -12.665 5.518 1.00 0.00 O ATOM 0 H GLY A 15 2.612 -10.391 6.073 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.419 -12.469 6.373 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.859 -12.454 4.677 1.00 0.00 H new ATOM 206 N GLY A 16 5.777 -10.913 6.866 1.00 0.00 N ATOM 207 CA GLY A 16 7.147 -10.747 7.321 1.00 0.00 C ATOM 208 C GLY A 16 8.046 -10.254 6.185 1.00 0.00 C ATOM 209 O GLY A 16 9.266 -10.208 6.330 1.00 0.00 O ATOM 0 H GLY A 16 5.112 -10.250 7.264 1.00 0.00 H new ATOM 0 HA2 GLY A 16 7.176 -10.036 8.147 1.00 0.00 H new ATOM 0 HA3 GLY A 16 7.525 -11.695 7.703 1.00 0.00 H new ATOM 213 N GLN A 17 7.407 -9.897 5.081 1.00 0.00 N ATOM 214 CA GLN A 17 8.133 -9.409 3.921 1.00 0.00 C ATOM 215 C GLN A 17 7.951 -7.896 3.779 1.00 0.00 C ATOM 216 O GLN A 17 6.826 -7.408 3.690 1.00 0.00 O ATOM 217 CB GLN A 17 7.690 -10.136 2.650 1.00 0.00 C ATOM 218 CG GLN A 17 7.811 -11.653 2.816 1.00 0.00 C ATOM 219 CD GLN A 17 7.869 -12.350 1.455 1.00 0.00 C ATOM 220 OE1 GLN A 17 6.900 -12.917 0.978 1.00 0.00 O ATOM 221 NE2 GLN A 17 9.056 -12.276 0.860 1.00 0.00 N ATOM 0 H GLN A 17 6.394 -9.936 4.965 1.00 0.00 H new ATOM 0 HA GLN A 17 9.193 -9.616 4.067 1.00 0.00 H new ATOM 0 HB2 GLN A 17 6.658 -9.873 2.417 1.00 0.00 H new ATOM 0 HB3 GLN A 17 8.300 -9.809 1.808 1.00 0.00 H new ATOM 0 HG2 GLN A 17 8.708 -11.890 3.388 1.00 0.00 H new ATOM 0 HG3 GLN A 17 6.961 -12.029 3.385 1.00 0.00 H new ATOM 0 HE21 GLN A 17 9.825 -11.785 1.316 1.00 0.00 H new ATOM 0 HE22 GLN A 17 9.197 -12.710 -0.052 1.00 0.00 H new ATOM 230 N GLU A 18 9.076 -7.196 3.761 1.00 0.00 N ATOM 231 CA GLU A 18 9.055 -5.749 3.631 1.00 0.00 C ATOM 232 C GLU A 18 9.455 -5.338 2.213 1.00 0.00 C ATOM 233 O GLU A 18 10.511 -5.734 1.722 1.00 0.00 O ATOM 234 CB GLU A 18 9.966 -5.092 4.670 1.00 0.00 C ATOM 235 CG GLU A 18 9.498 -5.413 6.091 1.00 0.00 C ATOM 236 CD GLU A 18 10.210 -4.528 7.116 1.00 0.00 C ATOM 237 OE1 GLU A 18 10.494 -3.364 6.761 1.00 0.00 O ATOM 238 OE2 GLU A 18 10.455 -5.037 8.231 1.00 0.00 O ATOM 0 H GLU A 18 10.008 -7.604 3.834 1.00 0.00 H new ATOM 0 HA GLU A 18 8.039 -5.402 3.816 1.00 0.00 H new ATOM 0 HB2 GLU A 18 10.990 -5.440 4.533 1.00 0.00 H new ATOM 0 HB3 GLU A 18 9.974 -4.012 4.521 1.00 0.00 H new ATOM 0 HG2 GLU A 18 8.420 -5.266 6.165 1.00 0.00 H new ATOM 0 HG3 GLU A 18 9.693 -6.462 6.314 1.00 0.00 H new ATOM 245 N TYR A 19 8.590 -4.548 1.594 1.00 0.00 N ATOM 246 CA TYR A 19 8.840 -4.078 0.242 1.00 0.00 C ATOM 247 C TYR A 19 8.932 -2.551 0.199 1.00 0.00 C ATOM 248 O TYR A 19 8.052 -1.859 0.706 1.00 0.00 O ATOM 249 CB TYR A 19 7.637 -4.528 -0.590 1.00 0.00 C ATOM 250 CG TYR A 19 7.424 -6.043 -0.608 1.00 0.00 C ATOM 251 CD1 TYR A 19 8.035 -6.814 -1.576 1.00 0.00 C ATOM 252 CD2 TYR A 19 6.622 -6.638 0.344 1.00 0.00 C ATOM 253 CE1 TYR A 19 7.834 -8.240 -1.593 1.00 0.00 C ATOM 254 CE2 TYR A 19 6.422 -8.064 0.327 1.00 0.00 C ATOM 255 CZ TYR A 19 7.038 -8.794 -0.640 1.00 0.00 C ATOM 256 OH TYR A 19 6.849 -10.141 -0.656 1.00 0.00 O ATOM 0 H TYR A 19 7.715 -4.221 2.004 1.00 0.00 H new ATOM 0 HA TYR A 19 9.782 -4.477 -0.134 1.00 0.00 H new ATOM 0 HB2 TYR A 19 6.739 -4.050 -0.199 1.00 0.00 H new ATOM 0 HB3 TYR A 19 7.765 -4.177 -1.614 1.00 0.00 H new ATOM 0 HD1 TYR A 19 8.664 -6.348 -2.320 1.00 0.00 H new ATOM 0 HD2 TYR A 19 6.144 -6.035 1.102 1.00 0.00 H new ATOM 0 HE1 TYR A 19 8.305 -8.855 -2.346 1.00 0.00 H new ATOM 0 HE2 TYR A 19 5.797 -8.543 1.066 1.00 0.00 H new ATOM 0 HH TYR A 19 6.259 -10.397 0.083 1.00 0.00 H new ATOM 266 N SER A 20 10.007 -2.072 -0.410 1.00 0.00 N ATOM 267 CA SER A 20 10.225 -0.640 -0.525 1.00 0.00 C ATOM 268 C SER A 20 9.659 -0.129 -1.851 1.00 0.00 C ATOM 269 O SER A 20 10.121 -0.524 -2.920 1.00 0.00 O ATOM 270 CB SER A 20 11.713 -0.300 -0.417 1.00 0.00 C ATOM 271 OG SER A 20 12.339 -0.978 0.669 1.00 0.00 O ATOM 0 H SER A 20 10.736 -2.650 -0.829 1.00 0.00 H new ATOM 0 HA SER A 20 9.706 -0.148 0.298 1.00 0.00 H new ATOM 0 HB2 SER A 20 12.214 -0.566 -1.348 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.830 0.776 -0.288 1.00 0.00 H new ATOM 0 HG SER A 20 13.288 -0.736 0.703 1.00 0.00 H new ATOM 277 N VAL A 21 8.667 0.742 -1.737 1.00 0.00 N ATOM 278 CA VAL A 21 8.032 1.311 -2.914 1.00 0.00 C ATOM 279 C VAL A 21 8.587 2.716 -3.158 1.00 0.00 C ATOM 280 O VAL A 21 8.389 3.615 -2.343 1.00 0.00 O ATOM 281 CB VAL A 21 6.511 1.289 -2.751 1.00 0.00 C ATOM 282 CG1 VAL A 21 5.826 2.040 -3.895 1.00 0.00 C ATOM 283 CG2 VAL A 21 5.992 -0.147 -2.648 1.00 0.00 C ATOM 0 H VAL A 21 8.287 1.068 -0.848 1.00 0.00 H new ATOM 0 HA VAL A 21 8.259 0.713 -3.797 1.00 0.00 H new ATOM 0 HB VAL A 21 6.266 1.801 -1.821 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.745 2.009 -3.755 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.162 3.077 -3.902 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.082 1.569 -4.844 1.00 0.00 H new ATOM 0 HG21 VAL A 21 4.908 -0.135 -2.533 1.00 0.00 H new ATOM 0 HG22 VAL A 21 6.255 -0.695 -3.553 1.00 0.00 H new ATOM 0 HG23 VAL A 21 6.443 -0.636 -1.785 1.00 0.00 H new ATOM 293 N THR A 22 9.271 2.860 -4.284 1.00 0.00 N ATOM 294 CA THR A 22 9.856 4.140 -4.645 1.00 0.00 C ATOM 295 C THR A 22 9.816 4.335 -6.162 1.00 0.00 C ATOM 296 O THR A 22 10.741 4.900 -6.744 1.00 0.00 O ATOM 297 CB THR A 22 11.269 4.196 -4.062 1.00 0.00 C ATOM 298 OG1 THR A 22 11.912 3.043 -4.600 1.00 0.00 O ATOM 299 CG2 THR A 22 11.289 3.962 -2.551 1.00 0.00 C ATOM 0 H THR A 22 9.433 2.112 -4.958 1.00 0.00 H new ATOM 0 HA THR A 22 9.284 4.968 -4.227 1.00 0.00 H new ATOM 0 HB THR A 22 11.715 5.165 -4.285 1.00 0.00 H new ATOM 0 HG1 THR A 22 12.835 3.002 -4.274 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.316 4.012 -2.189 1.00 0.00 H new ATOM 0 HG22 THR A 22 10.692 4.728 -2.056 1.00 0.00 H new ATOM 0 HG23 THR A 22 10.874 2.979 -2.330 1.00 0.00 H new ATOM 307 N THR A 23 8.735 3.857 -6.760 1.00 0.00 N ATOM 308 CA THR A 23 8.562 3.971 -8.198 1.00 0.00 C ATOM 309 C THR A 23 7.492 5.015 -8.526 1.00 0.00 C ATOM 310 O THR A 23 7.599 5.727 -9.523 1.00 0.00 O ATOM 311 CB THR A 23 8.243 2.580 -8.749 1.00 0.00 C ATOM 312 OG1 THR A 23 6.957 2.281 -8.212 1.00 0.00 O ATOM 313 CG2 THR A 23 9.152 1.496 -8.164 1.00 0.00 C ATOM 0 H THR A 23 7.969 3.389 -6.274 1.00 0.00 H new ATOM 0 HA THR A 23 9.474 4.325 -8.678 1.00 0.00 H new ATOM 0 HB THR A 23 8.340 2.588 -9.835 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.288 2.311 -8.928 1.00 0.00 H new ATOM 0 HG21 THR A 23 8.884 0.528 -8.588 1.00 0.00 H new ATOM 0 HG22 THR A 23 10.190 1.723 -8.406 1.00 0.00 H new ATOM 0 HG23 THR A 23 9.030 1.464 -7.081 1.00 0.00 H new ATOM 321 N LEU A 24 6.485 5.072 -7.667 1.00 0.00 N ATOM 322 CA LEU A 24 5.396 6.016 -7.852 1.00 0.00 C ATOM 323 C LEU A 24 5.637 7.244 -6.972 1.00 0.00 C ATOM 324 O LEU A 24 6.387 7.178 -5.999 1.00 0.00 O ATOM 325 CB LEU A 24 4.049 5.336 -7.603 1.00 0.00 C ATOM 326 CG LEU A 24 3.996 4.365 -6.422 1.00 0.00 C ATOM 327 CD1 LEU A 24 2.644 4.441 -5.709 1.00 0.00 C ATOM 328 CD2 LEU A 24 4.328 2.939 -6.868 1.00 0.00 C ATOM 0 H LEU A 24 6.400 4.480 -6.841 1.00 0.00 H new ATOM 0 HA LEU A 24 5.365 6.364 -8.884 1.00 0.00 H new ATOM 0 HB2 LEU A 24 3.297 6.110 -7.446 1.00 0.00 H new ATOM 0 HB3 LEU A 24 3.765 4.795 -8.506 1.00 0.00 H new ATOM 0 HG LEU A 24 4.758 4.663 -5.702 1.00 0.00 H new ATOM 0 HD11 LEU A 24 2.633 3.741 -4.874 1.00 0.00 H new ATOM 0 HD12 LEU A 24 2.486 5.453 -5.336 1.00 0.00 H new ATOM 0 HD13 LEU A 24 1.849 4.183 -6.409 1.00 0.00 H new ATOM 0 HD21 LEU A 24 4.283 2.269 -6.009 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.607 2.615 -7.619 1.00 0.00 H new ATOM 0 HD23 LEU A 24 5.331 2.915 -7.294 1.00 0.00 H new ATOM 340 N SER A 25 4.986 8.337 -7.345 1.00 0.00 N ATOM 341 CA SER A 25 5.120 9.578 -6.602 1.00 0.00 C ATOM 342 C SER A 25 3.737 10.132 -6.255 1.00 0.00 C ATOM 343 O SER A 25 2.720 9.579 -6.672 1.00 0.00 O ATOM 344 CB SER A 25 5.922 10.612 -7.396 1.00 0.00 C ATOM 345 OG SER A 25 5.249 11.008 -8.588 1.00 0.00 O ATOM 0 H SER A 25 4.364 8.388 -8.152 1.00 0.00 H new ATOM 0 HA SER A 25 5.662 9.368 -5.680 1.00 0.00 H new ATOM 0 HB2 SER A 25 6.102 11.488 -6.773 1.00 0.00 H new ATOM 0 HB3 SER A 25 6.897 10.197 -7.651 1.00 0.00 H new ATOM 0 HG SER A 25 5.792 11.670 -9.066 1.00 0.00 H new ATOM 351 N GLU A 26 3.743 11.216 -5.494 1.00 0.00 N ATOM 352 CA GLU A 26 2.501 11.851 -5.086 1.00 0.00 C ATOM 353 C GLU A 26 1.501 11.855 -6.244 1.00 0.00 C ATOM 354 O GLU A 26 0.310 11.625 -6.041 1.00 0.00 O ATOM 355 CB GLU A 26 2.753 13.271 -4.574 1.00 0.00 C ATOM 356 CG GLU A 26 3.692 13.260 -3.366 1.00 0.00 C ATOM 357 CD GLU A 26 4.715 14.394 -3.457 1.00 0.00 C ATOM 358 OE1 GLU A 26 4.359 15.433 -4.053 1.00 0.00 O ATOM 359 OE2 GLU A 26 5.830 14.196 -2.927 1.00 0.00 O ATOM 0 H GLU A 26 4.588 11.671 -5.149 1.00 0.00 H new ATOM 0 HA GLU A 26 2.074 11.275 -4.265 1.00 0.00 H new ATOM 0 HB2 GLU A 26 3.186 13.877 -5.370 1.00 0.00 H new ATOM 0 HB3 GLU A 26 1.806 13.736 -4.299 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.112 13.361 -2.449 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.209 12.302 -3.312 1.00 0.00 H new ATOM 366 N ASP A 27 2.023 12.117 -7.433 1.00 0.00 N ATOM 367 CA ASP A 27 1.191 12.154 -8.624 1.00 0.00 C ATOM 368 C ASP A 27 0.317 10.898 -8.669 1.00 0.00 C ATOM 369 O ASP A 27 -0.903 10.982 -8.539 1.00 0.00 O ATOM 370 CB ASP A 27 2.045 12.181 -9.892 1.00 0.00 C ATOM 371 CG ASP A 27 1.263 12.055 -11.201 1.00 0.00 C ATOM 372 OD1 ASP A 27 0.686 13.082 -11.618 1.00 0.00 O ATOM 373 OD2 ASP A 27 1.261 10.935 -11.756 1.00 0.00 O ATOM 0 H ASP A 27 3.012 12.306 -7.597 1.00 0.00 H new ATOM 0 HA ASP A 27 0.581 13.056 -8.581 1.00 0.00 H new ATOM 0 HB2 ASP A 27 2.610 13.113 -9.912 1.00 0.00 H new ATOM 0 HB3 ASP A 27 2.771 11.370 -9.840 1.00 0.00 H new ATOM 378 N ASP A 28 0.976 9.764 -8.854 1.00 0.00 N ATOM 379 CA ASP A 28 0.275 8.493 -8.918 1.00 0.00 C ATOM 380 C ASP A 28 -0.782 8.442 -7.813 1.00 0.00 C ATOM 381 O ASP A 28 -0.723 9.214 -6.857 1.00 0.00 O ATOM 382 CB ASP A 28 1.237 7.322 -8.705 1.00 0.00 C ATOM 383 CG ASP A 28 2.227 7.084 -9.847 1.00 0.00 C ATOM 384 OD1 ASP A 28 3.189 7.877 -9.939 1.00 0.00 O ATOM 385 OD2 ASP A 28 2.001 6.113 -10.602 1.00 0.00 O ATOM 0 H ASP A 28 1.988 9.699 -8.962 1.00 0.00 H new ATOM 0 HA ASP A 28 -0.183 8.410 -9.904 1.00 0.00 H new ATOM 0 HB2 ASP A 28 1.799 7.495 -7.787 1.00 0.00 H new ATOM 0 HB3 ASP A 28 0.653 6.414 -8.555 1.00 0.00 H new ATOM 390 N THR A 29 -1.724 7.526 -7.981 1.00 0.00 N ATOM 391 CA THR A 29 -2.793 7.365 -7.010 1.00 0.00 C ATOM 392 C THR A 29 -2.676 6.011 -6.308 1.00 0.00 C ATOM 393 O THR A 29 -1.883 5.163 -6.715 1.00 0.00 O ATOM 394 CB THR A 29 -4.125 7.559 -7.737 1.00 0.00 C ATOM 395 OG1 THR A 29 -4.014 6.732 -8.892 1.00 0.00 O ATOM 396 CG2 THR A 29 -4.283 8.971 -8.304 1.00 0.00 C ATOM 0 H THR A 29 -1.769 6.887 -8.775 1.00 0.00 H new ATOM 0 HA THR A 29 -2.725 8.113 -6.220 1.00 0.00 H new ATOM 0 HB THR A 29 -4.946 7.349 -7.051 1.00 0.00 H new ATOM 0 HG1 THR A 29 -4.837 6.796 -9.421 1.00 0.00 H new ATOM 0 HG21 THR A 29 -5.245 9.055 -8.810 1.00 0.00 H new ATOM 0 HG22 THR A 29 -4.236 9.697 -7.492 1.00 0.00 H new ATOM 0 HG23 THR A 29 -3.481 9.169 -9.015 1.00 0.00 H new ATOM 404 N VAL A 30 -3.477 5.850 -5.265 1.00 0.00 N ATOM 405 CA VAL A 30 -3.472 4.613 -4.502 1.00 0.00 C ATOM 406 C VAL A 30 -3.494 3.425 -5.465 1.00 0.00 C ATOM 407 O VAL A 30 -2.783 2.442 -5.260 1.00 0.00 O ATOM 408 CB VAL A 30 -4.641 4.604 -3.514 1.00 0.00 C ATOM 409 CG1 VAL A 30 -4.764 3.244 -2.824 1.00 0.00 C ATOM 410 CG2 VAL A 30 -4.501 5.729 -2.488 1.00 0.00 C ATOM 0 H VAL A 30 -4.134 6.555 -4.930 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.561 4.533 -3.909 1.00 0.00 H new ATOM 0 HB VAL A 30 -5.558 4.778 -4.078 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.602 3.264 -2.127 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.933 2.470 -3.573 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.845 3.028 -2.280 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.345 5.700 -1.798 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.573 5.600 -1.931 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.486 6.690 -3.002 1.00 0.00 H new ATOM 420 N LEU A 31 -4.318 3.553 -6.495 1.00 0.00 N ATOM 421 CA LEU A 31 -4.441 2.502 -7.490 1.00 0.00 C ATOM 422 C LEU A 31 -3.046 2.074 -7.949 1.00 0.00 C ATOM 423 O LEU A 31 -2.668 0.913 -7.797 1.00 0.00 O ATOM 424 CB LEU A 31 -5.353 2.952 -8.634 1.00 0.00 C ATOM 425 CG LEU A 31 -5.721 1.878 -9.659 1.00 0.00 C ATOM 426 CD1 LEU A 31 -6.938 1.073 -9.198 1.00 0.00 C ATOM 427 CD2 LEU A 31 -5.932 2.492 -11.045 1.00 0.00 C ATOM 0 H LEU A 31 -4.907 4.369 -6.662 1.00 0.00 H new ATOM 0 HA LEU A 31 -4.919 1.623 -7.058 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.274 3.347 -8.205 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.867 3.775 -9.158 1.00 0.00 H new ATOM 0 HG LEU A 31 -4.886 1.182 -9.738 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -7.178 0.316 -9.945 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -6.714 0.587 -8.248 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -7.790 1.741 -9.072 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -6.193 1.707 -11.755 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -6.739 3.223 -11.000 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -5.015 2.984 -11.369 1.00 0.00 H new ATOM 439 N ASP A 32 -2.318 3.034 -8.500 1.00 0.00 N ATOM 440 CA ASP A 32 -0.973 2.770 -8.982 1.00 0.00 C ATOM 441 C ASP A 32 -0.239 1.885 -7.973 1.00 0.00 C ATOM 442 O ASP A 32 0.407 0.909 -8.352 1.00 0.00 O ATOM 443 CB ASP A 32 -0.179 4.069 -9.137 1.00 0.00 C ATOM 444 CG ASP A 32 -0.140 4.638 -10.556 1.00 0.00 C ATOM 445 OD1 ASP A 32 0.284 3.884 -11.459 1.00 0.00 O ATOM 446 OD2 ASP A 32 -0.536 5.814 -10.707 1.00 0.00 O ATOM 0 H ASP A 32 -2.634 3.996 -8.623 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.052 2.278 -9.951 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.606 4.820 -8.472 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.844 3.894 -8.804 1.00 0.00 H new ATOM 451 N LEU A 33 -0.363 2.256 -6.707 1.00 0.00 N ATOM 452 CA LEU A 33 0.280 1.508 -5.641 1.00 0.00 C ATOM 453 C LEU A 33 -0.347 0.116 -5.550 1.00 0.00 C ATOM 454 O LEU A 33 0.358 -0.891 -5.593 1.00 0.00 O ATOM 455 CB LEU A 33 0.228 2.293 -4.328 1.00 0.00 C ATOM 456 CG LEU A 33 1.173 1.816 -3.224 1.00 0.00 C ATOM 457 CD1 LEU A 33 2.632 1.907 -3.674 1.00 0.00 C ATOM 458 CD2 LEU A 33 0.926 2.582 -1.923 1.00 0.00 C ATOM 0 H LEU A 33 -0.900 3.066 -6.396 1.00 0.00 H new ATOM 0 HA LEU A 33 1.339 1.367 -5.860 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.451 3.338 -4.543 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -0.792 2.257 -3.946 1.00 0.00 H new ATOM 0 HG LEU A 33 0.963 0.765 -3.024 1.00 0.00 H new ATOM 0 HD11 LEU A 33 3.283 1.562 -2.871 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.781 1.283 -4.555 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.874 2.942 -3.918 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.611 2.224 -1.154 1.00 0.00 H new ATOM 0 HD22 LEU A 33 1.093 3.646 -2.090 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -0.102 2.423 -1.596 1.00 0.00 H new ATOM 470 N LYS A 34 -1.666 0.103 -5.427 1.00 0.00 N ATOM 471 CA LYS A 34 -2.397 -1.150 -5.329 1.00 0.00 C ATOM 472 C LYS A 34 -1.984 -2.066 -6.483 1.00 0.00 C ATOM 473 O LYS A 34 -1.434 -3.144 -6.258 1.00 0.00 O ATOM 474 CB LYS A 34 -3.903 -0.888 -5.261 1.00 0.00 C ATOM 475 CG LYS A 34 -4.284 -0.226 -3.935 1.00 0.00 C ATOM 476 CD LYS A 34 -5.740 0.243 -3.956 1.00 0.00 C ATOM 477 CE LYS A 34 -6.460 -0.146 -2.663 1.00 0.00 C ATOM 478 NZ LYS A 34 -7.882 0.262 -2.718 1.00 0.00 N ATOM 0 H LYS A 34 -2.248 0.940 -5.393 1.00 0.00 H new ATOM 0 HA LYS A 34 -2.145 -1.667 -4.403 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -4.202 -0.248 -6.091 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -4.445 -1.827 -5.372 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -4.137 -0.931 -3.117 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -3.627 0.623 -3.746 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -5.776 1.325 -4.085 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -6.255 -0.197 -4.810 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -6.390 -1.223 -2.511 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -5.972 0.328 -1.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -8.356 -0.010 -1.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.943 1.293 -2.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -8.348 -0.210 -3.519 1.00 0.00 H new ATOM 492 N GLN A 35 -2.265 -1.606 -7.693 1.00 0.00 N ATOM 493 CA GLN A 35 -1.930 -2.371 -8.881 1.00 0.00 C ATOM 494 C GLN A 35 -0.506 -2.921 -8.775 1.00 0.00 C ATOM 495 O GLN A 35 -0.248 -4.063 -9.150 1.00 0.00 O ATOM 496 CB GLN A 35 -2.097 -1.523 -10.144 1.00 0.00 C ATOM 497 CG GLN A 35 -3.562 -1.474 -10.581 1.00 0.00 C ATOM 498 CD GLN A 35 -3.683 -1.541 -12.105 1.00 0.00 C ATOM 499 OE1 GLN A 35 -3.883 -2.591 -12.692 1.00 0.00 O ATOM 500 NE2 GLN A 35 -3.549 -0.364 -12.710 1.00 0.00 N ATOM 0 H GLN A 35 -2.721 -0.712 -7.876 1.00 0.00 H new ATOM 0 HA GLN A 35 -2.619 -3.212 -8.953 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -1.735 -0.512 -9.958 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -1.488 -1.937 -10.947 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -4.107 -2.305 -10.133 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -4.023 -0.556 -10.216 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -3.383 0.477 -12.158 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -3.612 -0.303 -13.726 1.00 0.00 H new ATOM 509 N PHE A 36 0.382 -2.081 -8.261 1.00 0.00 N ATOM 510 CA PHE A 36 1.773 -2.469 -8.100 1.00 0.00 C ATOM 511 C PHE A 36 1.923 -3.530 -7.008 1.00 0.00 C ATOM 512 O PHE A 36 2.444 -4.615 -7.259 1.00 0.00 O ATOM 513 CB PHE A 36 2.542 -1.213 -7.685 1.00 0.00 C ATOM 514 CG PHE A 36 4.059 -1.335 -7.836 1.00 0.00 C ATOM 515 CD1 PHE A 36 4.595 -1.728 -9.022 1.00 0.00 C ATOM 516 CD2 PHE A 36 4.873 -1.049 -6.784 1.00 0.00 C ATOM 517 CE1 PHE A 36 6.004 -1.841 -9.163 1.00 0.00 C ATOM 518 CE2 PHE A 36 6.281 -1.162 -6.924 1.00 0.00 C ATOM 519 CZ PHE A 36 6.817 -1.555 -8.110 1.00 0.00 C ATOM 0 H PHE A 36 0.165 -1.134 -7.951 1.00 0.00 H new ATOM 0 HA PHE A 36 2.153 -2.889 -9.031 1.00 0.00 H new ATOM 0 HB2 PHE A 36 2.194 -0.372 -8.284 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.308 -0.983 -6.646 1.00 0.00 H new ATOM 0 HD1 PHE A 36 3.949 -1.954 -9.857 1.00 0.00 H new ATOM 0 HD2 PHE A 36 4.448 -0.736 -5.842 1.00 0.00 H new ATOM 0 HE1 PHE A 36 6.430 -2.154 -10.105 1.00 0.00 H new ATOM 0 HE2 PHE A 36 6.927 -0.936 -6.088 1.00 0.00 H new ATOM 0 HZ PHE A 36 7.888 -1.640 -8.216 1.00 0.00 H new ATOM 529 N LEU A 37 1.459 -3.178 -5.818 1.00 0.00 N ATOM 530 CA LEU A 37 1.535 -4.086 -4.686 1.00 0.00 C ATOM 531 C LEU A 37 1.090 -5.482 -5.127 1.00 0.00 C ATOM 532 O LEU A 37 1.771 -6.469 -4.855 1.00 0.00 O ATOM 533 CB LEU A 37 0.742 -3.533 -3.501 1.00 0.00 C ATOM 534 CG LEU A 37 1.186 -2.166 -2.976 1.00 0.00 C ATOM 535 CD1 LEU A 37 -0.012 -1.354 -2.479 1.00 0.00 C ATOM 536 CD2 LEU A 37 2.263 -2.315 -1.900 1.00 0.00 C ATOM 0 H LEU A 37 1.029 -2.276 -5.613 1.00 0.00 H new ATOM 0 HA LEU A 37 2.564 -4.174 -4.337 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.307 -3.466 -3.791 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.801 -4.251 -2.683 1.00 0.00 H new ATOM 0 HG LEU A 37 1.631 -1.611 -3.802 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.331 -0.387 -2.111 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.714 -1.202 -3.299 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.508 -1.894 -1.672 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.561 -1.329 -1.544 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.868 -2.897 -1.068 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.129 -2.826 -2.321 1.00 0.00 H new ATOM 548 N LYS A 38 -0.050 -5.519 -5.800 1.00 0.00 N ATOM 549 CA LYS A 38 -0.595 -6.778 -6.281 1.00 0.00 C ATOM 550 C LYS A 38 0.516 -7.583 -6.958 1.00 0.00 C ATOM 551 O LYS A 38 0.630 -8.789 -6.745 1.00 0.00 O ATOM 552 CB LYS A 38 -1.808 -6.528 -7.179 1.00 0.00 C ATOM 553 CG LYS A 38 -2.234 -7.812 -7.894 1.00 0.00 C ATOM 554 CD LYS A 38 -3.296 -7.521 -8.956 1.00 0.00 C ATOM 555 CE LYS A 38 -2.839 -8.002 -10.335 1.00 0.00 C ATOM 556 NZ LYS A 38 -2.522 -6.849 -11.207 1.00 0.00 N ATOM 0 H LYS A 38 -0.612 -4.698 -6.024 1.00 0.00 H new ATOM 0 HA LYS A 38 -0.962 -7.378 -5.448 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -2.636 -6.149 -6.580 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -1.568 -5.760 -7.915 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -1.366 -8.278 -8.361 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.626 -8.524 -7.168 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.230 -8.014 -8.686 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -3.499 -6.451 -8.989 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -1.961 -8.640 -10.232 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -3.621 -8.608 -10.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -2.214 -7.193 -12.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -3.369 -6.256 -11.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -1.761 -6.287 -10.776 1.00 0.00 H new ATOM 570 N THR A 39 1.306 -6.884 -7.759 1.00 0.00 N ATOM 571 CA THR A 39 2.404 -7.520 -8.468 1.00 0.00 C ATOM 572 C THR A 39 3.546 -7.842 -7.503 1.00 0.00 C ATOM 573 O THR A 39 4.321 -8.768 -7.740 1.00 0.00 O ATOM 574 CB THR A 39 2.820 -6.599 -9.617 1.00 0.00 C ATOM 575 OG1 THR A 39 1.834 -6.827 -10.620 1.00 0.00 O ATOM 576 CG2 THR A 39 4.130 -7.039 -10.275 1.00 0.00 C ATOM 0 H THR A 39 1.208 -5.884 -7.933 1.00 0.00 H new ATOM 0 HA THR A 39 2.100 -8.477 -8.893 1.00 0.00 H new ATOM 0 HB THR A 39 2.925 -5.580 -9.245 1.00 0.00 H new ATOM 0 HG1 THR A 39 2.027 -6.267 -11.401 1.00 0.00 H new ATOM 0 HG21 THR A 39 4.380 -6.352 -11.084 1.00 0.00 H new ATOM 0 HG22 THR A 39 4.929 -7.033 -9.534 1.00 0.00 H new ATOM 0 HG23 THR A 39 4.015 -8.046 -10.677 1.00 0.00 H new ATOM 584 N LEU A 40 3.616 -7.060 -6.436 1.00 0.00 N ATOM 585 CA LEU A 40 4.651 -7.251 -5.434 1.00 0.00 C ATOM 586 C LEU A 40 4.365 -8.534 -4.650 1.00 0.00 C ATOM 587 O LEU A 40 5.238 -9.389 -4.514 1.00 0.00 O ATOM 588 CB LEU A 40 4.779 -6.007 -4.552 1.00 0.00 C ATOM 589 CG LEU A 40 5.391 -4.773 -5.218 1.00 0.00 C ATOM 590 CD1 LEU A 40 5.405 -3.582 -4.258 1.00 0.00 C ATOM 591 CD2 LEU A 40 6.785 -5.082 -5.769 1.00 0.00 C ATOM 0 H LEU A 40 2.973 -6.292 -6.243 1.00 0.00 H new ATOM 0 HA LEU A 40 5.623 -7.377 -5.910 1.00 0.00 H new ATOM 0 HB2 LEU A 40 3.787 -5.743 -4.184 1.00 0.00 H new ATOM 0 HB3 LEU A 40 5.384 -6.263 -3.682 1.00 0.00 H new ATOM 0 HG LEU A 40 4.764 -4.496 -6.065 1.00 0.00 H new ATOM 0 HD11 LEU A 40 5.845 -2.718 -4.756 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.385 -3.346 -3.956 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.995 -3.832 -3.377 1.00 0.00 H new ATOM 0 HD21 LEU A 40 7.198 -4.188 -6.237 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.436 -5.398 -4.954 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.715 -5.880 -6.509 1.00 0.00 H new ATOM 603 N THR A 41 3.140 -8.627 -4.156 1.00 0.00 N ATOM 604 CA THR A 41 2.728 -9.791 -3.389 1.00 0.00 C ATOM 605 C THR A 41 2.100 -10.840 -4.308 1.00 0.00 C ATOM 606 O THR A 41 2.619 -11.947 -4.439 1.00 0.00 O ATOM 607 CB THR A 41 1.790 -9.317 -2.277 1.00 0.00 C ATOM 608 OG1 THR A 41 0.596 -8.950 -2.963 1.00 0.00 O ATOM 609 CG2 THR A 41 2.262 -8.015 -1.628 1.00 0.00 C ATOM 0 H THR A 41 2.418 -7.915 -4.272 1.00 0.00 H new ATOM 0 HA THR A 41 3.583 -10.282 -2.925 1.00 0.00 H new ATOM 0 HB THR A 41 1.709 -10.093 -1.516 1.00 0.00 H new ATOM 0 HG1 THR A 41 -0.068 -8.632 -2.316 1.00 0.00 H new ATOM 0 HG21 THR A 41 1.561 -7.723 -0.846 1.00 0.00 H new ATOM 0 HG22 THR A 41 3.250 -8.163 -1.193 1.00 0.00 H new ATOM 0 HG23 THR A 41 2.312 -7.230 -2.382 1.00 0.00 H new ATOM 617 N GLY A 42 0.991 -10.455 -4.922 1.00 0.00 N ATOM 618 CA GLY A 42 0.286 -11.348 -5.826 1.00 0.00 C ATOM 619 C GLY A 42 -1.161 -11.554 -5.375 1.00 0.00 C ATOM 620 O GLY A 42 -1.713 -12.644 -5.523 1.00 0.00 O ATOM 0 H GLY A 42 0.563 -9.536 -4.811 1.00 0.00 H new ATOM 0 HA2 GLY A 42 0.301 -10.936 -6.835 1.00 0.00 H new ATOM 0 HA3 GLY A 42 0.798 -12.309 -5.866 1.00 0.00 H new ATOM 624 N VAL A 43 -1.736 -10.490 -4.833 1.00 0.00 N ATOM 625 CA VAL A 43 -3.108 -10.541 -4.359 1.00 0.00 C ATOM 626 C VAL A 43 -3.902 -9.393 -4.986 1.00 0.00 C ATOM 627 O VAL A 43 -3.432 -8.256 -5.025 1.00 0.00 O ATOM 628 CB VAL A 43 -3.135 -10.520 -2.830 1.00 0.00 C ATOM 629 CG1 VAL A 43 -4.573 -10.557 -2.306 1.00 0.00 C ATOM 630 CG2 VAL A 43 -2.312 -11.673 -2.251 1.00 0.00 C ATOM 0 H VAL A 43 -1.276 -9.588 -4.712 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.584 -11.472 -4.666 1.00 0.00 H new ATOM 0 HB VAL A 43 -2.682 -9.585 -2.500 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.564 -10.541 -1.216 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -5.118 -9.689 -2.677 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.063 -11.467 -2.651 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.348 -11.635 -1.162 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -2.723 -12.622 -2.595 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -1.278 -11.584 -2.583 1.00 0.00 H new ATOM 640 N LEU A 44 -5.092 -9.729 -5.462 1.00 0.00 N ATOM 641 CA LEU A 44 -5.955 -8.740 -6.086 1.00 0.00 C ATOM 642 C LEU A 44 -5.891 -7.437 -5.287 1.00 0.00 C ATOM 643 O LEU A 44 -5.627 -7.453 -4.085 1.00 0.00 O ATOM 644 CB LEU A 44 -7.373 -9.293 -6.248 1.00 0.00 C ATOM 645 CG LEU A 44 -7.527 -10.471 -7.211 1.00 0.00 C ATOM 646 CD1 LEU A 44 -8.999 -10.851 -7.382 1.00 0.00 C ATOM 647 CD2 LEU A 44 -6.852 -10.175 -8.552 1.00 0.00 C ATOM 0 H LEU A 44 -5.479 -10.672 -5.428 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.608 -8.513 -7.094 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.736 -9.601 -5.267 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.020 -8.485 -6.588 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.020 -11.334 -6.779 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.080 -11.691 -8.072 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -9.417 -11.133 -6.416 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -9.551 -10.000 -7.781 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -6.976 -11.029 -9.218 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -7.309 -9.294 -9.002 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -5.790 -9.991 -8.392 1.00 0.00 H new ATOM 659 N PRO A 45 -6.143 -6.310 -6.005 1.00 0.00 N ATOM 660 CA PRO A 45 -6.116 -5.000 -5.376 1.00 0.00 C ATOM 661 C PRO A 45 -7.366 -4.777 -4.521 1.00 0.00 C ATOM 662 O PRO A 45 -7.300 -4.130 -3.477 1.00 0.00 O ATOM 663 CB PRO A 45 -5.999 -4.014 -6.526 1.00 0.00 C ATOM 664 CG PRO A 45 -6.431 -4.771 -7.771 1.00 0.00 C ATOM 665 CD PRO A 45 -6.459 -6.252 -7.429 1.00 0.00 C ATOM 0 HA PRO A 45 -5.283 -4.883 -4.683 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -6.633 -3.143 -6.359 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.976 -3.650 -6.626 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -7.415 -4.436 -8.099 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -5.740 -4.582 -8.592 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -7.437 -6.688 -7.636 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.731 -6.808 -8.019 1.00 0.00 H new ATOM 673 N GLU A 46 -8.474 -5.325 -4.996 1.00 0.00 N ATOM 674 CA GLU A 46 -9.737 -5.194 -4.289 1.00 0.00 C ATOM 675 C GLU A 46 -9.691 -5.974 -2.973 1.00 0.00 C ATOM 676 O GLU A 46 -10.319 -5.579 -1.992 1.00 0.00 O ATOM 677 CB GLU A 46 -10.905 -5.658 -5.161 1.00 0.00 C ATOM 678 CG GLU A 46 -10.931 -7.183 -5.277 1.00 0.00 C ATOM 679 CD GLU A 46 -11.998 -7.640 -6.274 1.00 0.00 C ATOM 680 OE1 GLU A 46 -11.777 -7.415 -7.483 1.00 0.00 O ATOM 681 OE2 GLU A 46 -13.011 -8.202 -5.804 1.00 0.00 O ATOM 0 H GLU A 46 -8.524 -5.861 -5.862 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.895 -4.140 -4.060 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.844 -5.306 -4.734 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -10.820 -5.216 -6.154 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.953 -7.544 -5.595 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -11.130 -7.622 -4.299 1.00 0.00 H new ATOM 688 N ARG A 47 -8.943 -7.067 -2.995 1.00 0.00 N ATOM 689 CA ARG A 47 -8.808 -7.905 -1.816 1.00 0.00 C ATOM 690 C ARG A 47 -7.634 -7.429 -0.958 1.00 0.00 C ATOM 691 O ARG A 47 -7.675 -7.531 0.267 1.00 0.00 O ATOM 692 CB ARG A 47 -8.587 -9.369 -2.204 1.00 0.00 C ATOM 693 CG ARG A 47 -9.804 -9.931 -2.940 1.00 0.00 C ATOM 694 CD ARG A 47 -10.229 -11.277 -2.350 1.00 0.00 C ATOM 695 NE ARG A 47 -10.720 -12.169 -3.424 1.00 0.00 N ATOM 696 CZ ARG A 47 -10.886 -13.491 -3.286 1.00 0.00 C ATOM 697 NH1 ARG A 47 -10.601 -14.084 -2.118 1.00 0.00 N ATOM 698 NH2 ARG A 47 -11.337 -14.221 -4.315 1.00 0.00 N ATOM 0 H ARG A 47 -8.424 -7.392 -3.811 1.00 0.00 H new ATOM 0 HA ARG A 47 -9.734 -7.827 -1.246 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -7.704 -9.452 -2.838 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -8.393 -9.961 -1.309 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -10.631 -9.224 -2.875 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -9.570 -10.051 -3.998 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -9.386 -11.741 -1.838 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -11.011 -11.126 -1.606 1.00 0.00 H new ATOM 0 HE ARG A 47 -10.946 -11.751 -4.326 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -10.258 -13.529 -1.334 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -10.727 -15.091 -2.013 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -11.554 -13.770 -5.204 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -11.463 -15.228 -4.210 1.00 0.00 H new ATOM 712 N GLN A 48 -6.616 -6.919 -1.636 1.00 0.00 N ATOM 713 CA GLN A 48 -5.433 -6.427 -0.951 1.00 0.00 C ATOM 714 C GLN A 48 -5.829 -5.448 0.156 1.00 0.00 C ATOM 715 O GLN A 48 -6.123 -4.285 -0.115 1.00 0.00 O ATOM 716 CB GLN A 48 -4.459 -5.777 -1.936 1.00 0.00 C ATOM 717 CG GLN A 48 -3.307 -6.725 -2.274 1.00 0.00 C ATOM 718 CD GLN A 48 -2.169 -5.977 -2.971 1.00 0.00 C ATOM 719 OE1 GLN A 48 -1.031 -5.973 -2.529 1.00 0.00 O ATOM 720 NE2 GLN A 48 -2.537 -5.346 -4.083 1.00 0.00 N ATOM 0 H GLN A 48 -6.586 -6.836 -2.652 1.00 0.00 H new ATOM 0 HA GLN A 48 -4.923 -7.275 -0.494 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.988 -5.502 -2.848 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.063 -4.856 -1.507 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -2.935 -7.191 -1.362 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -3.668 -7.527 -2.918 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -3.506 -5.390 -4.397 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -1.850 -4.818 -4.621 1.00 0.00 H new ATOM 729 N LYS A 49 -5.824 -5.955 1.380 1.00 0.00 N ATOM 730 CA LYS A 49 -6.179 -5.139 2.529 1.00 0.00 C ATOM 731 C LYS A 49 -4.988 -4.259 2.912 1.00 0.00 C ATOM 732 O LYS A 49 -3.850 -4.725 2.938 1.00 0.00 O ATOM 733 CB LYS A 49 -6.688 -6.018 3.674 1.00 0.00 C ATOM 734 CG LYS A 49 -7.932 -5.408 4.323 1.00 0.00 C ATOM 735 CD LYS A 49 -7.706 -5.161 5.816 1.00 0.00 C ATOM 736 CE LYS A 49 -6.504 -4.242 6.044 1.00 0.00 C ATOM 737 NZ LYS A 49 -5.407 -4.979 6.712 1.00 0.00 N ATOM 0 H LYS A 49 -5.580 -6.920 1.601 1.00 0.00 H new ATOM 0 HA LYS A 49 -7.003 -4.470 2.281 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -6.922 -7.014 3.297 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -5.904 -6.136 4.422 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -8.181 -4.469 3.829 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -8.783 -6.076 4.186 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -8.599 -4.714 6.253 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.544 -6.111 6.325 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -6.156 -3.846 5.090 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -6.801 -3.389 6.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -4.982 -4.378 7.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -5.785 -5.844 7.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -4.682 -5.233 6.011 1.00 0.00 H new ATOM 751 N LEU A 50 -5.291 -3.002 3.201 1.00 0.00 N ATOM 752 CA LEU A 50 -4.259 -2.052 3.582 1.00 0.00 C ATOM 753 C LEU A 50 -4.419 -1.697 5.061 1.00 0.00 C ATOM 754 O LEU A 50 -5.538 -1.586 5.559 1.00 0.00 O ATOM 755 CB LEU A 50 -4.280 -0.837 2.652 1.00 0.00 C ATOM 756 CG LEU A 50 -3.883 -1.098 1.198 1.00 0.00 C ATOM 757 CD1 LEU A 50 -3.526 0.208 0.484 1.00 0.00 C ATOM 758 CD2 LEU A 50 -2.752 -2.125 1.114 1.00 0.00 C ATOM 0 H LEU A 50 -6.236 -2.619 3.179 1.00 0.00 H new ATOM 0 HA LEU A 50 -3.271 -2.497 3.466 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -5.284 -0.413 2.663 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.610 -0.080 3.060 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.743 -1.523 0.680 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.247 -0.006 -0.548 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.387 0.877 0.496 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -2.689 0.685 0.994 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.489 -2.292 0.069 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.881 -1.752 1.652 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.079 -3.064 1.560 1.00 0.00 H new ATOM 770 N LEU A 51 -3.283 -1.530 5.723 1.00 0.00 N ATOM 771 CA LEU A 51 -3.283 -1.191 7.136 1.00 0.00 C ATOM 772 C LEU A 51 -2.241 -0.100 7.394 1.00 0.00 C ATOM 773 O LEU A 51 -1.054 -0.301 7.145 1.00 0.00 O ATOM 774 CB LEU A 51 -3.085 -2.445 7.988 1.00 0.00 C ATOM 775 CG LEU A 51 -4.009 -2.586 9.200 1.00 0.00 C ATOM 776 CD1 LEU A 51 -5.478 -2.508 8.781 1.00 0.00 C ATOM 777 CD2 LEU A 51 -3.702 -3.868 9.978 1.00 0.00 C ATOM 0 H LEU A 51 -2.356 -1.623 5.307 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.250 -0.784 7.430 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.220 -3.318 7.350 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -2.053 -2.462 8.339 1.00 0.00 H new ATOM 0 HG LEU A 51 -3.821 -1.749 9.872 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -6.113 -2.611 9.661 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -5.670 -1.546 8.305 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -5.699 -3.311 8.078 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -4.373 -3.944 10.834 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -3.845 -4.731 9.328 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -2.670 -3.843 10.327 1.00 0.00 H new ATOM 789 N GLY A 52 -2.724 1.030 7.890 1.00 0.00 N ATOM 790 CA GLY A 52 -1.849 2.152 8.184 1.00 0.00 C ATOM 791 C GLY A 52 -2.438 3.460 7.652 1.00 0.00 C ATOM 792 O GLY A 52 -2.180 4.530 8.201 1.00 0.00 O ATOM 0 H GLY A 52 -3.710 1.192 8.096 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.699 2.228 9.261 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.870 1.981 7.737 1.00 0.00 H new ATOM 796 N LEU A 53 -3.216 3.331 6.587 1.00 0.00 N ATOM 797 CA LEU A 53 -3.843 4.490 5.974 1.00 0.00 C ATOM 798 C LEU A 53 -5.353 4.262 5.889 1.00 0.00 C ATOM 799 O LEU A 53 -5.808 3.330 5.229 1.00 0.00 O ATOM 800 CB LEU A 53 -3.191 4.801 4.625 1.00 0.00 C ATOM 801 CG LEU A 53 -3.023 3.615 3.673 1.00 0.00 C ATOM 802 CD1 LEU A 53 -3.597 3.936 2.292 1.00 0.00 C ATOM 803 CD2 LEU A 53 -1.559 3.177 3.597 1.00 0.00 C ATOM 0 H LEU A 53 -3.426 2.442 6.133 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.688 5.377 6.589 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -3.787 5.563 4.123 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.208 5.235 4.810 1.00 0.00 H new ATOM 0 HG LEU A 53 -3.591 2.774 4.071 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -3.465 3.077 1.634 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -4.659 4.163 2.383 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.077 4.797 1.873 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -1.467 2.333 2.914 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.950 4.005 3.235 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.216 2.881 4.588 1.00 0.00 H new ATOM 815 N LYS A 54 -6.090 5.130 6.568 1.00 0.00 N ATOM 816 CA LYS A 54 -7.539 5.036 6.577 1.00 0.00 C ATOM 817 C LYS A 54 -8.139 6.441 6.500 1.00 0.00 C ATOM 818 O LYS A 54 -7.429 7.432 6.667 1.00 0.00 O ATOM 819 CB LYS A 54 -8.016 4.230 7.787 1.00 0.00 C ATOM 820 CG LYS A 54 -7.995 2.729 7.490 1.00 0.00 C ATOM 821 CD LYS A 54 -7.989 1.913 8.784 1.00 0.00 C ATOM 822 CE LYS A 54 -7.899 0.415 8.488 1.00 0.00 C ATOM 823 NZ LYS A 54 -9.003 -0.312 9.153 1.00 0.00 N ATOM 0 H LYS A 54 -5.709 5.902 7.116 1.00 0.00 H new ATOM 0 HA LYS A 54 -7.890 4.491 5.701 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -7.378 4.443 8.645 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -9.027 4.537 8.057 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -8.866 2.461 6.891 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -7.113 2.484 6.898 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -7.146 2.216 9.405 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -8.895 2.121 9.353 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -7.942 0.248 7.412 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -6.941 0.027 8.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -8.927 -1.327 8.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -8.944 -0.167 10.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -9.915 0.047 8.804 1.00 0.00 H new ATOM 837 N VAL A 55 -9.439 6.483 6.246 1.00 0.00 N ATOM 838 CA VAL A 55 -10.141 7.750 6.145 1.00 0.00 C ATOM 839 C VAL A 55 -11.470 7.654 6.896 1.00 0.00 C ATOM 840 O VAL A 55 -12.436 7.089 6.386 1.00 0.00 O ATOM 841 CB VAL A 55 -10.313 8.137 4.674 1.00 0.00 C ATOM 842 CG1 VAL A 55 -11.297 9.299 4.525 1.00 0.00 C ATOM 843 CG2 VAL A 55 -8.964 8.476 4.036 1.00 0.00 C ATOM 0 H VAL A 55 -10.024 5.659 6.107 1.00 0.00 H new ATOM 0 HA VAL A 55 -9.561 8.546 6.612 1.00 0.00 H new ATOM 0 HB VAL A 55 -10.727 7.277 4.147 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -11.401 9.554 3.471 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.268 9.007 4.926 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -10.924 10.164 5.073 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -9.114 8.748 2.991 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -8.510 9.313 4.567 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -8.306 7.609 4.095 1.00 0.00 H new ATOM 853 N LYS A 56 -11.477 8.214 8.097 1.00 0.00 N ATOM 854 CA LYS A 56 -12.671 8.197 8.924 1.00 0.00 C ATOM 855 C LYS A 56 -13.412 6.875 8.717 1.00 0.00 C ATOM 856 O LYS A 56 -14.599 6.868 8.395 1.00 0.00 O ATOM 857 CB LYS A 56 -13.530 9.433 8.649 1.00 0.00 C ATOM 858 CG LYS A 56 -14.111 9.394 7.234 1.00 0.00 C ATOM 859 CD LYS A 56 -14.643 10.767 6.821 1.00 0.00 C ATOM 860 CE LYS A 56 -16.146 10.874 7.083 1.00 0.00 C ATOM 861 NZ LYS A 56 -16.406 11.121 8.519 1.00 0.00 N ATOM 0 H LYS A 56 -10.674 8.682 8.517 1.00 0.00 H new ATOM 0 HA LYS A 56 -12.404 8.250 9.979 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -14.340 9.487 9.377 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -12.928 10.333 8.774 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -13.343 9.071 6.531 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -14.915 8.660 7.187 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -14.118 11.546 7.374 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -14.442 10.936 5.763 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -16.568 11.683 6.487 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -16.642 9.955 6.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -17.359 11.521 8.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -16.340 10.225 9.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -15.702 11.791 8.889 1.00 0.00 H new ATOM 875 N GLY A 57 -12.681 5.787 8.909 1.00 0.00 N ATOM 876 CA GLY A 57 -13.254 4.462 8.747 1.00 0.00 C ATOM 877 C GLY A 57 -12.585 3.713 7.593 1.00 0.00 C ATOM 878 O GLY A 57 -11.619 2.980 7.801 1.00 0.00 O ATOM 0 H GLY A 57 -11.696 5.796 9.175 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.135 3.895 9.670 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -14.324 4.545 8.559 1.00 0.00 H new ATOM 882 N LYS A 58 -13.125 3.923 6.402 1.00 0.00 N ATOM 883 CA LYS A 58 -12.593 3.276 5.214 1.00 0.00 C ATOM 884 C LYS A 58 -11.411 4.089 4.683 1.00 0.00 C ATOM 885 O LYS A 58 -11.315 5.289 4.935 1.00 0.00 O ATOM 886 CB LYS A 58 -13.701 3.056 4.182 1.00 0.00 C ATOM 887 CG LYS A 58 -14.663 1.957 4.637 1.00 0.00 C ATOM 888 CD LYS A 58 -14.851 0.905 3.543 1.00 0.00 C ATOM 889 CE LYS A 58 -16.297 0.405 3.505 1.00 0.00 C ATOM 890 NZ LYS A 58 -16.357 -0.966 2.952 1.00 0.00 N ATOM 0 H LYS A 58 -13.926 4.532 6.234 1.00 0.00 H new ATOM 0 HA LYS A 58 -12.215 2.283 5.458 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -14.250 3.985 4.029 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -13.261 2.785 3.223 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -14.278 1.483 5.540 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -15.627 2.396 4.894 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -14.584 1.330 2.575 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -14.177 0.067 3.720 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -16.719 0.417 4.510 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -16.904 1.076 2.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -17.345 -1.290 2.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -15.974 -0.967 1.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -15.794 -1.606 3.548 1.00 0.00 H new ATOM 904 N PRO A 59 -10.517 3.385 3.938 1.00 0.00 N ATOM 905 CA PRO A 59 -9.345 4.028 3.369 1.00 0.00 C ATOM 906 C PRO A 59 -9.724 4.890 2.163 1.00 0.00 C ATOM 907 O PRO A 59 -10.799 4.723 1.590 1.00 0.00 O ATOM 908 CB PRO A 59 -8.405 2.888 3.013 1.00 0.00 C ATOM 909 CG PRO A 59 -9.266 1.637 2.964 1.00 0.00 C ATOM 910 CD PRO A 59 -10.599 1.963 3.619 1.00 0.00 C ATOM 0 HA PRO A 59 -8.866 4.720 4.062 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -7.921 3.067 2.053 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -7.613 2.788 3.756 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -9.415 1.317 1.933 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -8.775 0.815 3.485 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -11.432 1.755 2.947 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -10.756 1.364 4.516 1.00 0.00 H new ATOM 918 N ALA A 60 -8.819 5.792 1.813 1.00 0.00 N ATOM 919 CA ALA A 60 -9.045 6.681 0.686 1.00 0.00 C ATOM 920 C ALA A 60 -9.337 5.848 -0.564 1.00 0.00 C ATOM 921 O ALA A 60 -8.898 4.703 -0.668 1.00 0.00 O ATOM 922 CB ALA A 60 -7.832 7.596 0.506 1.00 0.00 C ATOM 0 H ALA A 60 -7.928 5.926 2.290 1.00 0.00 H new ATOM 0 HA ALA A 60 -9.910 7.319 0.868 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -8.002 8.263 -0.339 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -7.684 8.187 1.410 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -6.945 6.991 0.319 1.00 0.00 H new ATOM 928 N GLU A 61 -10.077 6.454 -1.480 1.00 0.00 N ATOM 929 CA GLU A 61 -10.433 5.782 -2.719 1.00 0.00 C ATOM 930 C GLU A 61 -9.172 5.364 -3.477 1.00 0.00 C ATOM 931 O GLU A 61 -8.060 5.529 -2.979 1.00 0.00 O ATOM 932 CB GLU A 61 -11.327 6.670 -3.587 1.00 0.00 C ATOM 933 CG GLU A 61 -12.666 6.940 -2.899 1.00 0.00 C ATOM 934 CD GLU A 61 -13.835 6.514 -3.789 1.00 0.00 C ATOM 935 OE1 GLU A 61 -14.015 5.287 -3.941 1.00 0.00 O ATOM 936 OE2 GLU A 61 -14.523 7.426 -4.297 1.00 0.00 O ATOM 0 H GLU A 61 -10.440 7.403 -1.390 1.00 0.00 H new ATOM 0 HA GLU A 61 -10.999 4.884 -2.473 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -10.821 7.614 -3.789 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -11.499 6.188 -4.549 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -12.709 6.400 -1.953 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.751 8.001 -2.664 1.00 0.00 H new ATOM 943 N ASN A 62 -9.388 4.831 -4.671 1.00 0.00 N ATOM 944 CA ASN A 62 -8.282 4.388 -5.504 1.00 0.00 C ATOM 945 C ASN A 62 -7.841 5.538 -6.412 1.00 0.00 C ATOM 946 O ASN A 62 -6.666 5.641 -6.761 1.00 0.00 O ATOM 947 CB ASN A 62 -8.699 3.216 -6.394 1.00 0.00 C ATOM 948 CG ASN A 62 -9.990 3.533 -7.151 1.00 0.00 C ATOM 949 OD1 ASN A 62 -11.034 3.782 -6.572 1.00 0.00 O ATOM 950 ND2 ASN A 62 -9.860 3.511 -8.474 1.00 0.00 N ATOM 0 H ASN A 62 -10.312 4.696 -5.081 1.00 0.00 H new ATOM 0 HA ASN A 62 -7.471 4.072 -4.848 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -7.903 2.993 -7.104 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -8.841 2.324 -5.784 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -10.664 3.710 -9.069 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -8.956 3.295 -8.894 1.00 0.00 H new ATOM 957 N ASP A 63 -8.806 6.373 -6.768 1.00 0.00 N ATOM 958 CA ASP A 63 -8.532 7.511 -7.628 1.00 0.00 C ATOM 959 C ASP A 63 -8.206 8.731 -6.764 1.00 0.00 C ATOM 960 O ASP A 63 -8.693 9.830 -7.027 1.00 0.00 O ATOM 961 CB ASP A 63 -9.747 7.854 -8.492 1.00 0.00 C ATOM 962 CG ASP A 63 -9.421 8.508 -9.836 1.00 0.00 C ATOM 963 OD1 ASP A 63 -8.995 9.683 -9.806 1.00 0.00 O ATOM 964 OD2 ASP A 63 -9.606 7.819 -10.862 1.00 0.00 O ATOM 0 H ASP A 63 -9.779 6.284 -6.476 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.693 7.251 -8.273 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -10.312 6.940 -8.677 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -10.398 8.522 -7.928 1.00 0.00 H new ATOM 969 N VAL A 64 -7.385 8.497 -5.751 1.00 0.00 N ATOM 970 CA VAL A 64 -6.989 9.563 -4.847 1.00 0.00 C ATOM 971 C VAL A 64 -5.492 9.834 -5.010 1.00 0.00 C ATOM 972 O VAL A 64 -4.743 8.960 -5.445 1.00 0.00 O ATOM 973 CB VAL A 64 -7.379 9.204 -3.412 1.00 0.00 C ATOM 974 CG1 VAL A 64 -6.408 9.829 -2.408 1.00 0.00 C ATOM 975 CG2 VAL A 64 -8.820 9.622 -3.115 1.00 0.00 C ATOM 0 H VAL A 64 -6.983 7.584 -5.536 1.00 0.00 H new ATOM 0 HA VAL A 64 -7.515 10.486 -5.091 1.00 0.00 H new ATOM 0 HB VAL A 64 -7.317 8.121 -3.308 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -6.708 9.559 -1.395 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -5.400 9.461 -2.599 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -6.424 10.914 -2.513 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -9.072 9.355 -2.089 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -8.920 10.700 -3.245 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -9.496 9.109 -3.799 1.00 0.00 H new ATOM 985 N LYS A 65 -5.100 11.048 -4.653 1.00 0.00 N ATOM 986 CA LYS A 65 -3.706 11.445 -4.754 1.00 0.00 C ATOM 987 C LYS A 65 -3.003 11.166 -3.424 1.00 0.00 C ATOM 988 O LYS A 65 -3.276 11.827 -2.423 1.00 0.00 O ATOM 989 CB LYS A 65 -3.595 12.900 -5.215 1.00 0.00 C ATOM 990 CG LYS A 65 -3.248 12.979 -6.703 1.00 0.00 C ATOM 991 CD LYS A 65 -1.844 13.552 -6.908 1.00 0.00 C ATOM 992 CE LYS A 65 -1.870 14.725 -7.890 1.00 0.00 C ATOM 993 NZ LYS A 65 -2.296 15.966 -7.204 1.00 0.00 N ATOM 0 H LYS A 65 -5.724 11.770 -4.293 1.00 0.00 H new ATOM 0 HA LYS A 65 -3.196 10.854 -5.515 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -4.537 13.417 -5.030 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -2.830 13.413 -4.632 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -3.308 11.986 -7.147 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -3.978 13.603 -7.218 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -1.439 13.882 -5.952 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.180 12.773 -7.283 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -0.881 14.864 -8.325 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -2.552 14.504 -8.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.308 16.752 -7.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -3.249 15.835 -6.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -1.630 16.184 -6.435 1.00 0.00 H new ATOM 1007 N LEU A 66 -2.112 10.186 -3.457 1.00 0.00 N ATOM 1008 CA LEU A 66 -1.368 9.811 -2.267 1.00 0.00 C ATOM 1009 C LEU A 66 -0.777 11.068 -1.623 1.00 0.00 C ATOM 1010 O LEU A 66 -0.581 11.114 -0.410 1.00 0.00 O ATOM 1011 CB LEU A 66 -0.325 8.743 -2.601 1.00 0.00 C ATOM 1012 CG LEU A 66 -0.863 7.446 -3.208 1.00 0.00 C ATOM 1013 CD1 LEU A 66 0.014 6.980 -4.371 1.00 0.00 C ATOM 1014 CD2 LEU A 66 -1.020 6.364 -2.138 1.00 0.00 C ATOM 0 H LEU A 66 -1.889 9.640 -4.289 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.031 9.356 -1.531 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.397 9.173 -3.295 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.218 8.496 -1.689 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.855 7.644 -3.613 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.391 6.056 -4.784 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.030 7.747 -5.145 1.00 0.00 H new ATOM 0 HD13 LEU A 66 1.029 6.804 -4.014 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -1.404 5.452 -2.596 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.051 6.161 -1.681 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.717 6.707 -1.373 1.00 0.00 H new ATOM 1026 N GLY A 67 -0.510 12.055 -2.465 1.00 0.00 N ATOM 1027 CA GLY A 67 0.054 13.309 -1.993 1.00 0.00 C ATOM 1028 C GLY A 67 -0.982 14.114 -1.206 1.00 0.00 C ATOM 1029 O GLY A 67 -0.671 14.670 -0.154 1.00 0.00 O ATOM 0 H GLY A 67 -0.673 12.012 -3.471 1.00 0.00 H new ATOM 0 HA2 GLY A 67 0.920 13.108 -1.362 1.00 0.00 H new ATOM 0 HA3 GLY A 67 0.407 13.895 -2.841 1.00 0.00 H new ATOM 1033 N ALA A 68 -2.191 14.152 -1.747 1.00 0.00 N ATOM 1034 CA ALA A 68 -3.274 14.880 -1.108 1.00 0.00 C ATOM 1035 C ALA A 68 -3.366 14.463 0.361 1.00 0.00 C ATOM 1036 O ALA A 68 -3.704 15.276 1.220 1.00 0.00 O ATOM 1037 CB ALA A 68 -4.577 14.628 -1.869 1.00 0.00 C ATOM 0 H ALA A 68 -2.444 13.690 -2.621 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.084 15.953 -1.134 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.390 15.174 -1.390 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -4.469 14.969 -2.899 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -4.802 13.562 -1.861 1.00 0.00 H new ATOM 1043 N LEU A 69 -3.059 13.198 0.605 1.00 0.00 N ATOM 1044 CA LEU A 69 -3.103 12.663 1.955 1.00 0.00 C ATOM 1045 C LEU A 69 -1.933 13.230 2.761 1.00 0.00 C ATOM 1046 O LEU A 69 -2.033 13.394 3.976 1.00 0.00 O ATOM 1047 CB LEU A 69 -3.146 11.134 1.925 1.00 0.00 C ATOM 1048 CG LEU A 69 -4.540 10.503 1.911 1.00 0.00 C ATOM 1049 CD1 LEU A 69 -5.446 11.150 2.960 1.00 0.00 C ATOM 1050 CD2 LEU A 69 -5.153 10.559 0.510 1.00 0.00 C ATOM 0 H LEU A 69 -2.778 12.527 -0.110 1.00 0.00 H new ATOM 0 HA LEU A 69 -4.018 12.974 2.459 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -2.605 10.792 1.043 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.607 10.758 2.795 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.441 9.451 2.177 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -6.430 10.683 2.929 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -5.011 11.014 3.950 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -5.543 12.215 2.750 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.143 10.104 0.528 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.237 11.598 0.191 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.516 10.015 -0.188 1.00 0.00 H new ATOM 1062 N LYS A 70 -0.849 13.513 2.053 1.00 0.00 N ATOM 1063 CA LYS A 70 0.339 14.057 2.688 1.00 0.00 C ATOM 1064 C LYS A 70 0.730 13.172 3.873 1.00 0.00 C ATOM 1065 O LYS A 70 0.781 13.638 5.010 1.00 0.00 O ATOM 1066 CB LYS A 70 0.122 15.525 3.061 1.00 0.00 C ATOM 1067 CG LYS A 70 0.754 16.454 2.023 1.00 0.00 C ATOM 1068 CD LYS A 70 2.280 16.425 2.118 1.00 0.00 C ATOM 1069 CE LYS A 70 2.852 17.842 2.197 1.00 0.00 C ATOM 1070 NZ LYS A 70 4.234 17.873 1.667 1.00 0.00 N ATOM 0 H LYS A 70 -0.769 13.376 1.045 1.00 0.00 H new ATOM 0 HA LYS A 70 1.179 14.049 1.994 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.946 15.731 3.136 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.554 15.722 4.042 1.00 0.00 H new ATOM 0 HG2 LYS A 70 0.443 16.153 1.023 1.00 0.00 H new ATOM 0 HG3 LYS A 70 0.396 17.472 2.175 1.00 0.00 H new ATOM 0 HD2 LYS A 70 2.582 15.857 2.998 1.00 0.00 H new ATOM 0 HD3 LYS A 70 2.692 15.911 1.250 1.00 0.00 H new ATOM 0 HE2 LYS A 70 2.223 18.527 1.629 1.00 0.00 H new ATOM 0 HE3 LYS A 70 2.845 18.186 3.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 4.607 18.842 1.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 4.835 17.235 2.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 4.232 17.565 0.674 1.00 0.00 H new ATOM 1084 N LEU A 71 0.996 11.911 3.566 1.00 0.00 N ATOM 1085 CA LEU A 71 1.380 10.956 4.592 1.00 0.00 C ATOM 1086 C LEU A 71 2.832 11.212 5.001 1.00 0.00 C ATOM 1087 O LEU A 71 3.480 12.116 4.475 1.00 0.00 O ATOM 1088 CB LEU A 71 1.118 9.526 4.118 1.00 0.00 C ATOM 1089 CG LEU A 71 -0.315 9.216 3.681 1.00 0.00 C ATOM 1090 CD1 LEU A 71 -0.330 8.425 2.371 1.00 0.00 C ATOM 1091 CD2 LEU A 71 -1.085 8.500 4.792 1.00 0.00 C ATOM 0 H LEU A 71 0.953 11.528 2.621 1.00 0.00 H new ATOM 0 HA LEU A 71 0.768 11.088 5.484 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.785 9.313 3.283 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.387 8.842 4.923 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.826 10.160 3.493 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.361 8.218 2.083 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.155 9.008 1.588 1.00 0.00 H new ATOM 0 HD13 LEU A 71 0.205 7.485 2.507 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.100 8.292 4.455 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -0.584 7.563 5.036 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.120 9.134 5.678 1.00 0.00 H new ATOM 1103 N LYS A 72 3.302 10.399 5.937 1.00 0.00 N ATOM 1104 CA LYS A 72 4.665 10.526 6.423 1.00 0.00 C ATOM 1105 C LYS A 72 5.607 9.761 5.491 1.00 0.00 C ATOM 1106 O LYS A 72 5.177 8.865 4.766 1.00 0.00 O ATOM 1107 CB LYS A 72 4.756 10.086 7.885 1.00 0.00 C ATOM 1108 CG LYS A 72 3.972 11.036 8.793 1.00 0.00 C ATOM 1109 CD LYS A 72 4.236 10.727 10.268 1.00 0.00 C ATOM 1110 CE LYS A 72 5.148 11.784 10.895 1.00 0.00 C ATOM 1111 NZ LYS A 72 6.221 11.139 11.685 1.00 0.00 N ATOM 0 H LYS A 72 2.762 9.650 6.371 1.00 0.00 H new ATOM 0 HA LYS A 72 4.979 11.570 6.408 1.00 0.00 H new ATOM 0 HB2 LYS A 72 4.366 9.073 7.989 1.00 0.00 H new ATOM 0 HB3 LYS A 72 5.800 10.059 8.196 1.00 0.00 H new ATOM 0 HG2 LYS A 72 4.254 12.067 8.577 1.00 0.00 H new ATOM 0 HG3 LYS A 72 2.906 10.947 8.584 1.00 0.00 H new ATOM 0 HD2 LYS A 72 3.291 10.689 10.810 1.00 0.00 H new ATOM 0 HD3 LYS A 72 4.696 9.743 10.360 1.00 0.00 H new ATOM 0 HE2 LYS A 72 5.586 12.405 10.113 1.00 0.00 H new ATOM 0 HE3 LYS A 72 4.563 12.444 11.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 6.831 11.870 12.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 5.798 10.566 12.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 6.789 10.528 11.065 1.00 0.00 H new ATOM 1125 N PRO A 73 6.909 10.152 5.542 1.00 0.00 N ATOM 1126 CA PRO A 73 7.915 9.514 4.711 1.00 0.00 C ATOM 1127 C PRO A 73 8.275 8.128 5.253 1.00 0.00 C ATOM 1128 O PRO A 73 8.064 7.845 6.431 1.00 0.00 O ATOM 1129 CB PRO A 73 9.093 10.475 4.710 1.00 0.00 C ATOM 1130 CG PRO A 73 8.885 11.389 5.907 1.00 0.00 C ATOM 1131 CD PRO A 73 7.454 11.209 6.388 1.00 0.00 C ATOM 0 HA PRO A 73 7.566 9.331 3.694 1.00 0.00 H new ATOM 0 HB2 PRO A 73 10.037 9.936 4.789 1.00 0.00 H new ATOM 0 HB3 PRO A 73 9.130 11.047 3.783 1.00 0.00 H new ATOM 0 HG2 PRO A 73 9.589 11.143 6.702 1.00 0.00 H new ATOM 0 HG3 PRO A 73 9.067 12.428 5.630 1.00 0.00 H new ATOM 0 HD2 PRO A 73 7.422 10.929 7.441 1.00 0.00 H new ATOM 0 HD3 PRO A 73 6.883 12.132 6.286 1.00 0.00 H new ATOM 1139 N ASN A 74 8.811 7.302 4.366 1.00 0.00 N ATOM 1140 CA ASN A 74 9.201 5.954 4.741 1.00 0.00 C ATOM 1141 C ASN A 74 8.135 5.355 5.660 1.00 0.00 C ATOM 1142 O ASN A 74 8.445 4.543 6.530 1.00 0.00 O ATOM 1143 CB ASN A 74 10.531 5.956 5.498 1.00 0.00 C ATOM 1144 CG ASN A 74 10.647 7.187 6.399 1.00 0.00 C ATOM 1145 OD1 ASN A 74 10.916 8.290 5.954 1.00 0.00 O ATOM 1146 ND2 ASN A 74 10.431 6.936 7.687 1.00 0.00 N ATOM 0 H ASN A 74 8.984 7.540 3.389 1.00 0.00 H new ATOM 0 HA ASN A 74 9.306 5.368 3.828 1.00 0.00 H new ATOM 0 HB2 ASN A 74 10.612 5.051 6.100 1.00 0.00 H new ATOM 0 HB3 ASN A 74 11.358 5.941 4.788 1.00 0.00 H new ATOM 0 HD21 ASN A 74 10.486 7.691 8.370 1.00 0.00 H new ATOM 0 HD22 ASN A 74 10.210 5.988 7.992 1.00 0.00 H new ATOM 1153 N THR A 75 6.900 5.780 5.435 1.00 0.00 N ATOM 1154 CA THR A 75 5.786 5.296 6.232 1.00 0.00 C ATOM 1155 C THR A 75 5.608 3.788 6.041 1.00 0.00 C ATOM 1156 O THR A 75 5.145 3.342 4.992 1.00 0.00 O ATOM 1157 CB THR A 75 4.545 6.107 5.853 1.00 0.00 C ATOM 1158 OG1 THR A 75 4.709 7.339 6.549 1.00 0.00 O ATOM 1159 CG2 THR A 75 3.259 5.517 6.436 1.00 0.00 C ATOM 0 H THR A 75 6.647 6.454 4.712 1.00 0.00 H new ATOM 0 HA THR A 75 5.972 5.437 7.297 1.00 0.00 H new ATOM 0 HB THR A 75 4.462 6.156 4.767 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.306 8.065 6.029 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.409 6.130 6.137 1.00 0.00 H new ATOM 0 HG22 THR A 75 3.123 4.502 6.063 1.00 0.00 H new ATOM 0 HG23 THR A 75 3.328 5.498 7.524 1.00 0.00 H new ATOM 1167 N LYS A 76 5.985 3.045 7.070 1.00 0.00 N ATOM 1168 CA LYS A 76 5.874 1.597 7.029 1.00 0.00 C ATOM 1169 C LYS A 76 4.399 1.200 7.122 1.00 0.00 C ATOM 1170 O LYS A 76 3.814 1.222 8.204 1.00 0.00 O ATOM 1171 CB LYS A 76 6.751 0.960 8.108 1.00 0.00 C ATOM 1172 CG LYS A 76 8.217 1.361 7.931 1.00 0.00 C ATOM 1173 CD LYS A 76 8.928 1.454 9.282 1.00 0.00 C ATOM 1174 CE LYS A 76 9.585 0.122 9.649 1.00 0.00 C ATOM 1175 NZ LYS A 76 10.259 0.221 10.963 1.00 0.00 N ATOM 0 H LYS A 76 6.368 3.419 7.938 1.00 0.00 H new ATOM 0 HA LYS A 76 6.249 1.214 6.080 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.402 1.268 9.094 1.00 0.00 H new ATOM 0 HB3 LYS A 76 6.659 -0.125 8.062 1.00 0.00 H new ATOM 0 HG2 LYS A 76 8.723 0.631 7.299 1.00 0.00 H new ATOM 0 HG3 LYS A 76 8.276 2.321 7.419 1.00 0.00 H new ATOM 0 HD2 LYS A 76 9.684 2.239 9.246 1.00 0.00 H new ATOM 0 HD3 LYS A 76 8.213 1.736 10.055 1.00 0.00 H new ATOM 0 HE2 LYS A 76 8.832 -0.666 9.678 1.00 0.00 H new ATOM 0 HE3 LYS A 76 10.308 -0.157 8.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 10.700 -0.692 11.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 10.991 0.959 10.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 9.561 0.466 11.694 1.00 0.00 H new ATOM 1189 N ILE A 77 3.840 0.848 5.974 1.00 0.00 N ATOM 1190 CA ILE A 77 2.444 0.447 5.913 1.00 0.00 C ATOM 1191 C ILE A 77 2.351 -1.077 6.007 1.00 0.00 C ATOM 1192 O ILE A 77 3.367 -1.769 5.958 1.00 0.00 O ATOM 1193 CB ILE A 77 1.774 1.028 4.666 1.00 0.00 C ATOM 1194 CG1 ILE A 77 2.102 0.192 3.428 1.00 0.00 C ATOM 1195 CG2 ILE A 77 2.147 2.500 4.479 1.00 0.00 C ATOM 1196 CD1 ILE A 77 0.927 -0.713 3.051 1.00 0.00 C ATOM 0 H ILE A 77 4.328 0.832 5.078 1.00 0.00 H new ATOM 0 HA ILE A 77 1.893 0.853 6.761 1.00 0.00 H new ATOM 0 HB ILE A 77 0.694 0.985 4.807 1.00 0.00 H new ATOM 0 HG12 ILE A 77 2.341 0.850 2.593 1.00 0.00 H new ATOM 0 HG13 ILE A 77 2.987 -0.415 3.619 1.00 0.00 H new ATOM 0 HG21 ILE A 77 1.658 2.889 3.586 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.822 3.071 5.349 1.00 0.00 H new ATOM 0 HG23 ILE A 77 3.228 2.590 4.369 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.186 -1.297 2.168 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.706 -1.387 3.879 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.051 -0.101 2.837 1.00 0.00 H new ATOM 1208 N MET A 78 1.123 -1.556 6.141 1.00 0.00 N ATOM 1209 CA MET A 78 0.884 -2.985 6.243 1.00 0.00 C ATOM 1210 C MET A 78 -0.174 -3.437 5.235 1.00 0.00 C ATOM 1211 O MET A 78 -0.998 -2.637 4.794 1.00 0.00 O ATOM 1212 CB MET A 78 0.418 -3.325 7.660 1.00 0.00 C ATOM 1213 CG MET A 78 1.280 -4.433 8.270 1.00 0.00 C ATOM 1214 SD MET A 78 1.391 -4.216 10.038 1.00 0.00 S ATOM 1215 CE MET A 78 3.164 -4.211 10.240 1.00 0.00 C ATOM 0 H MET A 78 0.283 -0.979 6.181 1.00 0.00 H new ATOM 0 HA MET A 78 1.815 -3.507 6.022 1.00 0.00 H new ATOM 0 HB2 MET A 78 0.468 -2.434 8.286 1.00 0.00 H new ATOM 0 HB3 MET A 78 -0.625 -3.641 7.638 1.00 0.00 H new ATOM 0 HG2 MET A 78 0.849 -5.408 8.041 1.00 0.00 H new ATOM 0 HG3 MET A 78 2.277 -4.414 7.830 1.00 0.00 H new ATOM 0 HE1 MET A 78 3.415 -3.857 11.240 1.00 0.00 H new ATOM 0 HE2 MET A 78 3.548 -5.222 10.105 1.00 0.00 H new ATOM 0 HE3 MET A 78 3.613 -3.550 9.498 1.00 0.00 H new ATOM 1225 N MET A 79 -0.118 -4.718 4.900 1.00 0.00 N ATOM 1226 CA MET A 79 -1.061 -5.286 3.952 1.00 0.00 C ATOM 1227 C MET A 79 -1.548 -6.659 4.419 1.00 0.00 C ATOM 1228 O MET A 79 -0.797 -7.410 5.040 1.00 0.00 O ATOM 1229 CB MET A 79 -0.391 -5.420 2.583 1.00 0.00 C ATOM 1230 CG MET A 79 -1.421 -5.744 1.498 1.00 0.00 C ATOM 1231 SD MET A 79 -0.639 -6.626 0.158 1.00 0.00 S ATOM 1232 CE MET A 79 -0.951 -8.308 0.670 1.00 0.00 C ATOM 0 H MET A 79 0.566 -5.379 5.269 1.00 0.00 H new ATOM 0 HA MET A 79 -1.922 -4.621 3.881 1.00 0.00 H new ATOM 0 HB2 MET A 79 0.125 -4.493 2.334 1.00 0.00 H new ATOM 0 HB3 MET A 79 0.364 -6.205 2.619 1.00 0.00 H new ATOM 0 HG2 MET A 79 -2.227 -6.345 1.918 1.00 0.00 H new ATOM 0 HG3 MET A 79 -1.870 -4.824 1.125 1.00 0.00 H new ATOM 0 HE1 MET A 79 -0.077 -8.922 0.453 1.00 0.00 H new ATOM 0 HE2 MET A 79 -1.154 -8.331 1.741 1.00 0.00 H new ATOM 0 HE3 MET A 79 -1.813 -8.699 0.129 1.00 0.00 H new ATOM 1242 N MET A 80 -2.802 -6.946 4.102 1.00 0.00 N ATOM 1243 CA MET A 80 -3.398 -8.216 4.482 1.00 0.00 C ATOM 1244 C MET A 80 -4.217 -8.803 3.330 1.00 0.00 C ATOM 1245 O MET A 80 -5.105 -8.142 2.795 1.00 0.00 O ATOM 1246 CB MET A 80 -4.303 -8.012 5.699 1.00 0.00 C ATOM 1247 CG MET A 80 -3.560 -8.340 6.996 1.00 0.00 C ATOM 1248 SD MET A 80 -4.407 -9.644 7.872 1.00 0.00 S ATOM 1249 CE MET A 80 -5.630 -8.684 8.748 1.00 0.00 C ATOM 0 H MET A 80 -3.422 -6.321 3.586 1.00 0.00 H new ATOM 0 HA MET A 80 -2.597 -8.913 4.727 1.00 0.00 H new ATOM 0 HB2 MET A 80 -4.653 -6.980 5.727 1.00 0.00 H new ATOM 0 HB3 MET A 80 -5.185 -8.646 5.611 1.00 0.00 H new ATOM 0 HG2 MET A 80 -2.538 -8.646 6.772 1.00 0.00 H new ATOM 0 HG3 MET A 80 -3.497 -7.451 7.623 1.00 0.00 H new ATOM 0 HE1 MET A 80 -6.251 -9.348 9.350 1.00 0.00 H new ATOM 0 HE2 MET A 80 -5.131 -7.965 9.398 1.00 0.00 H new ATOM 0 HE3 MET A 80 -6.256 -8.152 8.032 1.00 0.00 H new ATOM 1259 N GLY A 81 -3.888 -10.039 2.983 1.00 0.00 N ATOM 1260 CA GLY A 81 -4.581 -10.723 1.905 1.00 0.00 C ATOM 1261 C GLY A 81 -4.050 -12.147 1.728 1.00 0.00 C ATOM 1262 O GLY A 81 -3.160 -12.577 2.460 1.00 0.00 O ATOM 0 H GLY A 81 -3.151 -10.584 3.430 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -5.650 -10.753 2.117 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.456 -10.166 0.976 1.00 0.00 H new ATOM 1266 N THR A 82 -4.617 -12.838 0.751 1.00 0.00 N ATOM 1267 CA THR A 82 -4.212 -14.205 0.468 1.00 0.00 C ATOM 1268 C THR A 82 -4.173 -14.448 -1.042 1.00 0.00 C ATOM 1269 O THR A 82 -5.186 -14.301 -1.725 1.00 0.00 O ATOM 1270 CB THR A 82 -5.164 -15.144 1.210 1.00 0.00 C ATOM 1271 OG1 THR A 82 -6.459 -14.747 0.767 1.00 0.00 O ATOM 1272 CG2 THR A 82 -5.189 -14.882 2.717 1.00 0.00 C ATOM 0 H THR A 82 -5.354 -12.477 0.145 1.00 0.00 H new ATOM 0 HA THR A 82 -3.200 -14.399 0.823 1.00 0.00 H new ATOM 0 HB THR A 82 -4.870 -16.177 1.026 1.00 0.00 H new ATOM 0 HG1 THR A 82 -6.426 -14.531 -0.188 1.00 0.00 H new ATOM 0 HG21 THR A 82 -5.880 -15.576 3.195 1.00 0.00 H new ATOM 0 HG22 THR A 82 -4.189 -15.025 3.128 1.00 0.00 H new ATOM 0 HG23 THR A 82 -5.515 -13.859 2.903 1.00 0.00 H new ATOM 1280 N ARG A 83 -2.993 -14.815 -1.520 1.00 0.00 N ATOM 1281 CA ARG A 83 -2.809 -15.080 -2.937 1.00 0.00 C ATOM 1282 C ARG A 83 -3.624 -16.304 -3.359 1.00 0.00 C ATOM 1283 O ARG A 83 -3.961 -17.146 -2.528 1.00 0.00 O ATOM 1284 CB ARG A 83 -1.334 -15.320 -3.265 1.00 0.00 C ATOM 1285 CG ARG A 83 -0.821 -16.592 -2.588 1.00 0.00 C ATOM 1286 CD ARG A 83 0.503 -17.047 -3.204 1.00 0.00 C ATOM 1287 NE ARG A 83 1.617 -16.772 -2.269 1.00 0.00 N ATOM 1288 CZ ARG A 83 2.256 -15.597 -2.187 1.00 0.00 C ATOM 1289 NH1 ARG A 83 1.896 -14.581 -2.983 1.00 0.00 N ATOM 1290 NH2 ARG A 83 3.256 -15.438 -1.309 1.00 0.00 N ATOM 0 H ARG A 83 -2.155 -14.935 -0.951 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.154 -14.204 -3.486 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -1.207 -15.402 -4.344 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -0.741 -14.466 -2.938 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -0.687 -16.411 -1.522 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -1.563 -17.385 -2.686 1.00 0.00 H new ATOM 0 HD2 ARG A 83 0.461 -18.113 -3.430 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.672 -16.528 -4.147 1.00 0.00 H new ATOM 0 HE ARG A 83 1.917 -17.524 -1.648 1.00 0.00 H new ATOM 0 HH11 ARG A 83 1.135 -14.702 -3.652 1.00 0.00 H new ATOM 0 HH12 ARG A 83 2.383 -13.687 -2.920 1.00 0.00 H new ATOM 0 HH21 ARG A 83 3.531 -16.211 -0.703 1.00 0.00 H new ATOM 0 HH22 ARG A 83 3.742 -14.544 -1.247 1.00 0.00 H new ATOM 1304 N GLU A 84 -3.917 -16.364 -4.649 1.00 0.00 N ATOM 1305 CA GLU A 84 -4.686 -17.471 -5.191 1.00 0.00 C ATOM 1306 C GLU A 84 -6.121 -17.430 -4.661 1.00 0.00 C ATOM 1307 O GLU A 84 -6.400 -16.761 -3.668 1.00 0.00 O ATOM 1308 CB GLU A 84 -4.021 -18.811 -4.870 1.00 0.00 C ATOM 1309 CG GLU A 84 -3.525 -19.497 -6.144 1.00 0.00 C ATOM 1310 CD GLU A 84 -3.612 -21.019 -6.017 1.00 0.00 C ATOM 1311 OE1 GLU A 84 -4.753 -21.528 -6.073 1.00 0.00 O ATOM 1312 OE2 GLU A 84 -2.538 -21.639 -5.867 1.00 0.00 O ATOM 0 H GLU A 84 -3.636 -15.664 -5.335 1.00 0.00 H new ATOM 0 HA GLU A 84 -4.717 -17.369 -6.276 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -3.185 -18.652 -4.189 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -4.731 -19.459 -4.357 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -4.120 -19.165 -6.995 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.494 -19.203 -6.342 1.00 0.00 H new ATOM 1319 N SER A 85 -6.992 -18.154 -5.348 1.00 0.00 N ATOM 1320 CA SER A 85 -8.391 -18.209 -4.959 1.00 0.00 C ATOM 1321 C SER A 85 -8.981 -19.574 -5.319 1.00 0.00 C ATOM 1322 O SER A 85 -9.417 -19.788 -6.449 1.00 0.00 O ATOM 1323 CB SER A 85 -9.193 -17.091 -5.629 1.00 0.00 C ATOM 1324 OG SER A 85 -9.152 -17.182 -7.050 1.00 0.00 O ATOM 0 H SER A 85 -6.756 -18.707 -6.172 1.00 0.00 H new ATOM 0 HA SER A 85 -8.452 -18.067 -3.880 1.00 0.00 H new ATOM 0 HB2 SER A 85 -10.229 -17.136 -5.293 1.00 0.00 H new ATOM 0 HB3 SER A 85 -8.798 -16.124 -5.316 1.00 0.00 H new ATOM 0 HG SER A 85 -9.213 -18.122 -7.319 1.00 0.00 H new ATOM 1330 N GLY A 86 -8.977 -20.462 -4.336 1.00 0.00 N ATOM 1331 CA GLY A 86 -9.506 -21.801 -4.535 1.00 0.00 C ATOM 1332 C GLY A 86 -8.812 -22.807 -3.615 1.00 0.00 C ATOM 1333 O GLY A 86 -7.676 -22.590 -3.197 1.00 0.00 O ATOM 0 H GLY A 86 -8.616 -20.281 -3.399 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -10.579 -21.805 -4.341 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -9.369 -22.099 -5.575 1.00 0.00 H new ATOM 1337 N PRO A 87 -9.542 -23.916 -3.320 1.00 0.00 N ATOM 1338 CA PRO A 87 -9.008 -24.957 -2.458 1.00 0.00 C ATOM 1339 C PRO A 87 -7.965 -25.798 -3.196 1.00 0.00 C ATOM 1340 O PRO A 87 -8.213 -26.268 -4.305 1.00 0.00 O ATOM 1341 CB PRO A 87 -10.219 -25.763 -2.019 1.00 0.00 C ATOM 1342 CG PRO A 87 -11.322 -25.435 -3.013 1.00 0.00 C ATOM 1343 CD PRO A 87 -10.891 -24.207 -3.798 1.00 0.00 C ATOM 0 HA PRO A 87 -8.478 -24.557 -1.594 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -9.998 -26.830 -2.019 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -10.517 -25.499 -1.004 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -11.494 -26.276 -3.684 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -12.261 -25.246 -2.493 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -10.898 -24.400 -4.871 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -11.564 -23.368 -3.621 1.00 0.00 H new ATOM 1351 N SER A 88 -6.820 -25.963 -2.550 1.00 0.00 N ATOM 1352 CA SER A 88 -5.738 -26.739 -3.131 1.00 0.00 C ATOM 1353 C SER A 88 -5.809 -28.186 -2.638 1.00 0.00 C ATOM 1354 O SER A 88 -5.366 -28.491 -1.531 1.00 0.00 O ATOM 1355 CB SER A 88 -4.377 -26.129 -2.791 1.00 0.00 C ATOM 1356 OG SER A 88 -4.180 -24.873 -3.434 1.00 0.00 O ATOM 0 H SER A 88 -6.618 -25.572 -1.630 1.00 0.00 H new ATOM 0 HA SER A 88 -5.851 -26.725 -4.215 1.00 0.00 H new ATOM 0 HB2 SER A 88 -4.297 -26.000 -1.712 1.00 0.00 H new ATOM 0 HB3 SER A 88 -3.586 -26.817 -3.090 1.00 0.00 H new ATOM 0 HG SER A 88 -3.301 -24.515 -3.191 1.00 0.00 H new ATOM 1362 N SER A 89 -6.370 -29.039 -3.482 1.00 0.00 N ATOM 1363 CA SER A 89 -6.504 -30.446 -3.146 1.00 0.00 C ATOM 1364 C SER A 89 -6.334 -31.303 -4.402 1.00 0.00 C ATOM 1365 O SER A 89 -5.451 -32.158 -4.460 1.00 0.00 O ATOM 1366 CB SER A 89 -7.857 -30.729 -2.490 1.00 0.00 C ATOM 1367 OG SER A 89 -8.934 -30.135 -3.210 1.00 0.00 O ATOM 0 H SER A 89 -6.737 -28.783 -4.398 1.00 0.00 H new ATOM 0 HA SER A 89 -5.723 -30.702 -2.431 1.00 0.00 H new ATOM 0 HB2 SER A 89 -8.012 -31.806 -2.429 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.851 -30.349 -1.468 1.00 0.00 H new ATOM 0 HG SER A 89 -9.780 -30.340 -2.761 1.00 0.00 H new ATOM 1373 N GLY A 90 -7.192 -31.044 -5.378 1.00 0.00 N ATOM 1374 CA GLY A 90 -7.148 -31.781 -6.629 1.00 0.00 C ATOM 1375 C GLY A 90 -8.452 -32.547 -6.861 1.00 0.00 C ATOM 1376 O GLY A 90 -8.648 -33.138 -7.921 1.00 0.00 O ATOM 0 H GLY A 90 -7.922 -30.333 -5.327 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -6.975 -31.092 -7.455 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -6.310 -32.478 -6.615 1.00 0.00 H new TER 1380 GLY A 90