USER MOD reduce.3.24.130724 H: found=0, std=0, add=962, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 961 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 161 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 171 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 66 MET CE :methyl 150:sc= -4.83 (180deg=-4.02!) USER MOD Set 2.2: A 159 THR OG1 : rot 180:sc= -0.181 USER MOD Set 2.3: A 173 HIS : no HD1:sc= -1.76 K(o=-6.8,f=-8.7) USER MOD Set 3.1: A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 58 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 24 SER OG : rot 104:sc= 0.745 USER MOD Set 4.2: A 64 HIS :FLIP no HD1:sc= -3.03! F(o=-3.3,f=-2.3!) USER MOD Set 5.1: A 21 THR OG1 : rot 22:sc= 0.724 USER MOD Set 5.2: A 42 LYS NZ :NH3+ 159:sc= -0.0511 (180deg=-0.157) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.0133 USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.0638 USER MOD Single : A 19 THR OG1 : rot 12:sc= -1.71 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= -0.497 X(o=-0.5,f=-0.0054) USER MOD Single : A 41 ASN : amide:sc= -0.977 K(o=-0.98,f=-3.5!) USER MOD Single : A 43 TYR OH : rot 165:sc= -3.83 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 ASN : amide:sc= -3.58! C(o=-3.6!,f=-3.6!) USER MOD Single : A 48 HIS : no HE2:sc= -3.95! C(o=-3.9!,f=-6.7!) USER MOD Single : A 50 SER OG : rot 51:sc= 1.19 USER MOD Single : A 51 SER OG : rot 57:sc= 0.46 USER MOD Single : A 54 THR OG1 : rot -30:sc= -0.676 USER MOD Single : A 56 SER OG : rot 180:sc= -3.98! USER MOD Single : A 62 GLN :FLIP amide:sc= -0.557 F(o=-1.1,f=-0.56) USER MOD Single : A 65 THR OG1 : rot -170:sc= -3.65! USER MOD Single : A 67 TYR OH : rot 180:sc= -5.06! USER MOD Single : A 69 ASN : amide:sc= -2.86! C(o=-2.9!,f=-10!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 MET CE :methyl -172:sc= -6.89! (180deg=-7.48!) USER MOD Single : A 110 SER OG : rot 17:sc= 0.483 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ -129:sc= -0.325 (180deg=-1.56!) USER MOD Single : A 121 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 123 GLN : amide:sc= -2.58 K(o=-2.6,f=-7.8!) USER MOD Single : A 132 TYR OH : rot 180:sc= -0.014 USER MOD Single : A 135 LYS NZ :NH3+ -167:sc= -0.913 (180deg=-1.42!) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN : amide:sc= 0.156 K(o=0.16,f=-2.9!) USER MOD Single : A 144 MET CE :methyl -164:sc= -6.97! (180deg=-7.84!) USER MOD Single : A 146 GLN : amide:sc= -0.303 K(o=-0.3,f=-2.5!) USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 160 TYR OH : rot 30:sc= -2.16 USER MOD Single : A 163 GLN : amide:sc= -1.95 K(o=-2,f=-4!) USER MOD Single : A 167 ASN : amide:sc= -0.505 K(o=-0.51,f=-5.4!) USER MOD Single : A 169 ASN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 175 HIS : no HD1:sc= -0.248 X(o=-0.25,f=0.0052) USER MOD Single : A 176 TYR OH : rot 165:sc= -4.11! USER MOD ----------------------------------------------------------------- ATOM 79 N GLU A 7 6.061 -0.834 12.690 1.00 0.00 N ATOM 80 CA GLU A 7 6.466 -1.800 11.676 1.00 0.00 C ATOM 81 C GLU A 7 5.445 -2.927 11.559 1.00 0.00 C ATOM 82 O GLU A 7 5.747 -4.086 11.844 1.00 0.00 O ATOM 83 CB GLU A 7 7.845 -2.373 12.009 1.00 0.00 C ATOM 84 CG GLU A 7 8.996 -1.555 11.446 1.00 0.00 C ATOM 85 CD GLU A 7 10.308 -2.314 11.451 1.00 0.00 C ATOM 86 OE1 GLU A 7 10.486 -3.185 12.328 1.00 0.00 O ATOM 87 OE2 GLU A 7 11.158 -2.036 10.579 1.00 0.00 O ATOM 0 HA GLU A 7 6.519 -1.283 10.718 1.00 0.00 H new ATOM 0 HB2 GLU A 7 7.951 -2.436 13.092 1.00 0.00 H new ATOM 0 HB3 GLU A 7 7.910 -3.390 11.622 1.00 0.00 H new ATOM 0 HG2 GLU A 7 8.758 -1.255 10.426 1.00 0.00 H new ATOM 0 HG3 GLU A 7 9.107 -0.641 12.030 1.00 0.00 H new ATOM 94 N GLU A 8 4.234 -2.580 11.137 1.00 0.00 N ATOM 95 CA GLU A 8 3.168 -3.562 10.982 1.00 0.00 C ATOM 96 C GLU A 8 3.514 -4.567 9.888 1.00 0.00 C ATOM 97 O GLU A 8 3.874 -5.710 10.172 1.00 0.00 O ATOM 98 CB GLU A 8 1.846 -2.865 10.653 1.00 0.00 C ATOM 99 CG GLU A 8 0.991 -2.576 11.876 1.00 0.00 C ATOM 100 CD GLU A 8 -0.493 -2.587 11.565 1.00 0.00 C ATOM 101 OE1 GLU A 8 -0.860 -2.282 10.411 1.00 0.00 O ATOM 102 OE2 GLU A 8 -1.289 -2.900 12.476 1.00 0.00 O ATOM 0 H GLU A 8 3.966 -1.626 10.896 1.00 0.00 H new ATOM 0 HA GLU A 8 3.060 -4.099 11.925 1.00 0.00 H new ATOM 0 HB2 GLU A 8 2.057 -1.928 10.138 1.00 0.00 H new ATOM 0 HB3 GLU A 8 1.278 -3.488 9.962 1.00 0.00 H new ATOM 0 HG2 GLU A 8 1.203 -3.318 12.646 1.00 0.00 H new ATOM 0 HG3 GLU A 8 1.266 -1.604 12.285 1.00 0.00 H new ATOM 109 N PHE A 9 3.403 -4.133 8.635 1.00 0.00 N ATOM 110 CA PHE A 9 3.705 -4.994 7.496 1.00 0.00 C ATOM 111 C PHE A 9 5.129 -5.540 7.582 1.00 0.00 C ATOM 112 O PHE A 9 5.445 -6.568 6.986 1.00 0.00 O ATOM 113 CB PHE A 9 3.517 -4.224 6.187 1.00 0.00 C ATOM 114 CG PHE A 9 2.283 -4.620 5.429 1.00 0.00 C ATOM 115 CD1 PHE A 9 2.299 -5.711 4.575 1.00 0.00 C ATOM 116 CD2 PHE A 9 1.107 -3.900 5.569 1.00 0.00 C ATOM 117 CE1 PHE A 9 1.164 -6.077 3.875 1.00 0.00 C ATOM 118 CE2 PHE A 9 -0.030 -4.262 4.872 1.00 0.00 C ATOM 119 CZ PHE A 9 -0.001 -5.351 4.024 1.00 0.00 C ATOM 0 H PHE A 9 3.106 -3.190 8.383 1.00 0.00 H new ATOM 0 HA PHE A 9 3.015 -5.837 7.517 1.00 0.00 H new ATOM 0 HB2 PHE A 9 3.472 -3.157 6.406 1.00 0.00 H new ATOM 0 HB3 PHE A 9 4.389 -4.383 5.553 1.00 0.00 H new ATOM 0 HD1 PHE A 9 3.208 -6.282 4.455 1.00 0.00 H new ATOM 0 HD2 PHE A 9 1.079 -3.047 6.230 1.00 0.00 H new ATOM 0 HE1 PHE A 9 1.189 -6.930 3.213 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -0.941 -3.693 4.991 1.00 0.00 H new ATOM 0 HZ PHE A 9 -0.888 -5.635 3.478 1.00 0.00 H new ATOM 129 N ALA A 10 5.983 -4.844 8.330 1.00 0.00 N ATOM 130 CA ALA A 10 7.372 -5.257 8.501 1.00 0.00 C ATOM 131 C ALA A 10 8.064 -5.461 7.157 1.00 0.00 C ATOM 132 O ALA A 10 7.857 -6.472 6.486 1.00 0.00 O ATOM 133 CB ALA A 10 7.444 -6.527 9.336 1.00 0.00 C ATOM 0 H ALA A 10 5.735 -3.989 8.828 1.00 0.00 H new ATOM 0 HA ALA A 10 7.897 -4.458 9.025 1.00 0.00 H new ATOM 0 HB1 ALA A 10 8.486 -6.825 9.456 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.004 -6.344 10.316 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.894 -7.324 8.835 1.00 0.00 H new ATOM 139 N VAL A 11 8.894 -4.497 6.775 1.00 0.00 N ATOM 140 CA VAL A 11 9.624 -4.573 5.515 1.00 0.00 C ATOM 141 C VAL A 11 11.096 -4.877 5.754 1.00 0.00 C ATOM 142 O VAL A 11 11.707 -4.346 6.682 1.00 0.00 O ATOM 143 CB VAL A 11 9.517 -3.264 4.707 1.00 0.00 C ATOM 144 CG1 VAL A 11 8.240 -3.248 3.881 1.00 0.00 C ATOM 145 CG2 VAL A 11 9.583 -2.052 5.626 1.00 0.00 C ATOM 0 H VAL A 11 9.078 -3.654 7.319 1.00 0.00 H new ATOM 0 HA VAL A 11 9.167 -5.380 4.943 1.00 0.00 H new ATOM 0 HB VAL A 11 10.366 -3.215 4.025 1.00 0.00 H new ATOM 0 HG11 VAL A 11 8.183 -2.316 3.318 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.243 -4.090 3.189 1.00 0.00 H new ATOM 0 HG13 VAL A 11 7.378 -3.326 4.543 1.00 0.00 H new ATOM 0 HG21 VAL A 11 9.505 -1.141 5.033 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.760 -2.091 6.340 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.531 -2.055 6.164 1.00 0.00 H new ATOM 155 N GLU A 12 11.664 -5.728 4.908 1.00 0.00 N ATOM 156 CA GLU A 12 13.067 -6.093 5.026 1.00 0.00 C ATOM 157 C GLU A 12 13.770 -5.949 3.682 1.00 0.00 C ATOM 158 O GLU A 12 13.597 -6.777 2.789 1.00 0.00 O ATOM 159 CB GLU A 12 13.205 -7.527 5.541 1.00 0.00 C ATOM 160 CG GLU A 12 13.395 -7.618 7.046 1.00 0.00 C ATOM 161 CD GLU A 12 12.081 -7.619 7.801 1.00 0.00 C ATOM 162 OE1 GLU A 12 11.369 -8.644 7.753 1.00 0.00 O ATOM 163 OE2 GLU A 12 11.763 -6.594 8.441 1.00 0.00 O ATOM 0 H GLU A 12 11.174 -6.177 4.134 1.00 0.00 H new ATOM 0 HA GLU A 12 13.538 -5.418 5.741 1.00 0.00 H new ATOM 0 HB2 GLU A 12 12.316 -8.092 5.261 1.00 0.00 H new ATOM 0 HB3 GLU A 12 14.053 -8.001 5.047 1.00 0.00 H new ATOM 0 HG2 GLU A 12 13.947 -8.527 7.284 1.00 0.00 H new ATOM 0 HG3 GLU A 12 14.003 -6.778 7.383 1.00 0.00 H new ATOM 170 N ILE A 13 14.562 -4.892 3.546 1.00 0.00 N ATOM 171 CA ILE A 13 15.288 -4.638 2.309 1.00 0.00 C ATOM 172 C ILE A 13 16.676 -5.266 2.349 1.00 0.00 C ATOM 173 O ILE A 13 17.521 -4.877 3.155 1.00 0.00 O ATOM 174 CB ILE A 13 15.433 -3.128 2.041 1.00 0.00 C ATOM 175 CG1 ILE A 13 14.091 -2.419 2.235 1.00 0.00 C ATOM 176 CG2 ILE A 13 15.967 -2.890 0.637 1.00 0.00 C ATOM 177 CD1 ILE A 13 13.854 -1.953 3.655 1.00 0.00 C ATOM 0 H ILE A 13 14.717 -4.198 4.277 1.00 0.00 H new ATOM 0 HA ILE A 13 14.707 -5.090 1.505 1.00 0.00 H new ATOM 0 HB ILE A 13 16.145 -2.714 2.755 1.00 0.00 H new ATOM 0 HG12 ILE A 13 14.043 -1.560 1.566 1.00 0.00 H new ATOM 0 HG13 ILE A 13 13.287 -3.095 1.944 1.00 0.00 H new ATOM 0 HG21 ILE A 13 16.064 -1.819 0.462 1.00 0.00 H new ATOM 0 HG22 ILE A 13 16.943 -3.365 0.533 1.00 0.00 H new ATOM 0 HG23 ILE A 13 15.277 -3.316 -0.092 1.00 0.00 H new ATOM 0 HD11 ILE A 13 12.884 -1.459 3.719 1.00 0.00 H new ATOM 0 HD12 ILE A 13 13.869 -2.811 4.327 1.00 0.00 H new ATOM 0 HD13 ILE A 13 14.637 -1.252 3.944 1.00 0.00 H new ATOM 189 N SER A 14 16.908 -6.237 1.473 1.00 0.00 N ATOM 190 CA SER A 14 18.197 -6.915 1.407 1.00 0.00 C ATOM 191 C SER A 14 18.769 -6.847 -0.005 1.00 0.00 C ATOM 192 O SER A 14 18.185 -7.379 -0.949 1.00 0.00 O ATOM 193 CB SER A 14 18.054 -8.375 1.843 1.00 0.00 C ATOM 194 OG SER A 14 18.239 -8.509 3.242 1.00 0.00 O ATOM 0 H SER A 14 16.220 -6.572 0.799 1.00 0.00 H new ATOM 0 HA SER A 14 18.883 -6.409 2.086 1.00 0.00 H new ATOM 0 HB2 SER A 14 17.067 -8.746 1.566 1.00 0.00 H new ATOM 0 HB3 SER A 14 18.784 -8.989 1.316 1.00 0.00 H new ATOM 0 HG SER A 14 18.141 -9.450 3.496 1.00 0.00 H new ATOM 200 N GLY A 15 19.913 -6.183 -0.144 1.00 0.00 N ATOM 201 CA GLY A 15 20.540 -6.053 -1.447 1.00 0.00 C ATOM 202 C GLY A 15 19.607 -5.446 -2.475 1.00 0.00 C ATOM 203 O GLY A 15 19.187 -4.297 -2.341 1.00 0.00 O ATOM 0 H GLY A 15 20.416 -5.734 0.621 1.00 0.00 H new ATOM 0 HA2 GLY A 15 21.432 -5.433 -1.358 1.00 0.00 H new ATOM 0 HA3 GLY A 15 20.867 -7.035 -1.790 1.00 0.00 H new ATOM 207 N THR A 16 19.274 -6.222 -3.500 1.00 0.00 N ATOM 208 CA THR A 16 18.376 -5.757 -4.549 1.00 0.00 C ATOM 209 C THR A 16 16.991 -6.383 -4.395 1.00 0.00 C ATOM 210 O THR A 16 16.179 -6.349 -5.319 1.00 0.00 O ATOM 211 CB THR A 16 18.950 -6.092 -5.926 1.00 0.00 C ATOM 212 OG1 THR A 16 19.751 -7.258 -5.866 1.00 0.00 O ATOM 213 CG2 THR A 16 19.798 -4.981 -6.507 1.00 0.00 C ATOM 0 H THR A 16 19.613 -7.176 -3.627 1.00 0.00 H new ATOM 0 HA THR A 16 18.279 -4.675 -4.458 1.00 0.00 H new ATOM 0 HB THR A 16 18.084 -6.242 -6.571 1.00 0.00 H new ATOM 0 HG1 THR A 16 20.107 -7.456 -6.757 1.00 0.00 H new ATOM 0 HG21 THR A 16 20.174 -5.283 -7.484 1.00 0.00 H new ATOM 0 HG22 THR A 16 19.194 -4.080 -6.614 1.00 0.00 H new ATOM 0 HG23 THR A 16 20.638 -4.778 -5.842 1.00 0.00 H new ATOM 221 N THR A 17 16.727 -6.955 -3.221 1.00 0.00 N ATOM 222 CA THR A 17 15.442 -7.589 -2.951 1.00 0.00 C ATOM 223 C THR A 17 14.928 -7.213 -1.564 1.00 0.00 C ATOM 224 O THR A 17 15.689 -7.179 -0.597 1.00 0.00 O ATOM 225 CB THR A 17 15.568 -9.109 -3.067 1.00 0.00 C ATOM 226 OG1 THR A 17 16.011 -9.478 -4.361 1.00 0.00 O ATOM 227 CG2 THR A 17 14.271 -9.842 -2.800 1.00 0.00 C ATOM 0 H THR A 17 17.387 -6.991 -2.444 1.00 0.00 H new ATOM 0 HA THR A 17 14.726 -7.232 -3.691 1.00 0.00 H new ATOM 0 HB THR A 17 16.291 -9.396 -2.304 1.00 0.00 H new ATOM 0 HG1 THR A 17 16.087 -10.454 -4.415 1.00 0.00 H new ATOM 0 HG21 THR A 17 14.433 -10.915 -2.899 1.00 0.00 H new ATOM 0 HG22 THR A 17 13.928 -9.619 -1.790 1.00 0.00 H new ATOM 0 HG23 THR A 17 13.517 -9.521 -3.518 1.00 0.00 H new ATOM 235 N VAL A 18 13.631 -6.939 -1.474 1.00 0.00 N ATOM 236 CA VAL A 18 13.009 -6.573 -0.206 1.00 0.00 C ATOM 237 C VAL A 18 11.745 -7.401 0.027 1.00 0.00 C ATOM 238 O VAL A 18 11.020 -7.719 -0.915 1.00 0.00 O ATOM 239 CB VAL A 18 12.672 -5.063 -0.153 1.00 0.00 C ATOM 240 CG1 VAL A 18 12.095 -4.589 -1.477 1.00 0.00 C ATOM 241 CG2 VAL A 18 11.716 -4.754 0.991 1.00 0.00 C ATOM 0 H VAL A 18 12.989 -6.963 -2.266 1.00 0.00 H new ATOM 0 HA VAL A 18 13.727 -6.785 0.586 1.00 0.00 H new ATOM 0 HB VAL A 18 13.600 -4.521 0.028 1.00 0.00 H new ATOM 0 HG11 VAL A 18 11.866 -3.525 -1.414 1.00 0.00 H new ATOM 0 HG12 VAL A 18 12.822 -4.758 -2.272 1.00 0.00 H new ATOM 0 HG13 VAL A 18 11.183 -5.144 -1.696 1.00 0.00 H new ATOM 0 HG21 VAL A 18 11.497 -3.686 1.004 1.00 0.00 H new ATOM 0 HG22 VAL A 18 10.790 -5.313 0.853 1.00 0.00 H new ATOM 0 HG23 VAL A 18 12.175 -5.042 1.937 1.00 0.00 H new ATOM 251 N THR A 19 11.495 -7.764 1.284 1.00 0.00 N ATOM 252 CA THR A 19 10.327 -8.573 1.626 1.00 0.00 C ATOM 253 C THR A 19 9.365 -7.829 2.552 1.00 0.00 C ATOM 254 O THR A 19 9.780 -7.004 3.367 1.00 0.00 O ATOM 255 CB THR A 19 10.773 -9.882 2.281 1.00 0.00 C ATOM 256 OG1 THR A 19 9.690 -10.789 2.375 1.00 0.00 O ATOM 257 CG2 THR A 19 11.340 -9.699 3.673 1.00 0.00 C ATOM 0 H THR A 19 12.083 -7.512 2.079 1.00 0.00 H new ATOM 0 HA THR A 19 9.793 -8.787 0.700 1.00 0.00 H new ATOM 0 HB THR A 19 11.561 -10.270 1.636 1.00 0.00 H new ATOM 0 HG1 THR A 19 8.941 -10.461 1.835 1.00 0.00 H new ATOM 0 HG21 THR A 19 11.635 -10.668 4.076 1.00 0.00 H new ATOM 0 HG22 THR A 19 12.210 -9.044 3.628 1.00 0.00 H new ATOM 0 HG23 THR A 19 10.583 -9.253 4.318 1.00 0.00 H new ATOM 265 N ILE A 20 8.076 -8.140 2.420 1.00 0.00 N ATOM 266 CA ILE A 20 7.037 -7.522 3.242 1.00 0.00 C ATOM 267 C ILE A 20 6.084 -8.584 3.785 1.00 0.00 C ATOM 268 O ILE A 20 5.545 -9.384 3.025 1.00 0.00 O ATOM 269 CB ILE A 20 6.211 -6.486 2.448 1.00 0.00 C ATOM 270 CG1 ILE A 20 7.105 -5.664 1.513 1.00 0.00 C ATOM 271 CG2 ILE A 20 5.452 -5.573 3.401 1.00 0.00 C ATOM 272 CD1 ILE A 20 6.685 -5.741 0.062 1.00 0.00 C ATOM 0 H ILE A 20 7.725 -8.821 1.747 1.00 0.00 H new ATOM 0 HA ILE A 20 7.546 -7.013 4.061 1.00 0.00 H new ATOM 0 HB ILE A 20 5.492 -7.026 1.833 1.00 0.00 H new ATOM 0 HG12 ILE A 20 7.092 -4.622 1.833 1.00 0.00 H new ATOM 0 HG13 ILE A 20 8.133 -6.013 1.605 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.874 -4.848 2.828 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.778 -6.169 4.016 1.00 0.00 H new ATOM 0 HG23 ILE A 20 6.160 -5.047 4.042 1.00 0.00 H new ATOM 0 HD11 ILE A 20 7.360 -5.137 -0.545 1.00 0.00 H new ATOM 0 HD12 ILE A 20 6.725 -6.777 -0.274 1.00 0.00 H new ATOM 0 HD13 ILE A 20 5.667 -5.364 -0.043 1.00 0.00 H new ATOM 284 N THR A 21 5.879 -8.594 5.100 1.00 0.00 N ATOM 285 CA THR A 21 4.991 -9.574 5.722 1.00 0.00 C ATOM 286 C THR A 21 3.584 -9.010 5.913 1.00 0.00 C ATOM 287 O THR A 21 3.408 -7.806 6.099 1.00 0.00 O ATOM 288 CB THR A 21 5.563 -10.041 7.066 1.00 0.00 C ATOM 289 OG1 THR A 21 4.885 -11.197 7.524 1.00 0.00 O ATOM 290 CG2 THR A 21 5.481 -9.000 8.162 1.00 0.00 C ATOM 0 H THR A 21 6.312 -7.940 5.752 1.00 0.00 H new ATOM 0 HA THR A 21 4.921 -10.430 5.051 1.00 0.00 H new ATOM 0 HB THR A 21 6.615 -10.245 6.867 1.00 0.00 H new ATOM 0 HG1 THR A 21 4.454 -11.645 6.767 1.00 0.00 H new ATOM 0 HG21 THR A 21 5.905 -9.405 9.081 1.00 0.00 H new ATOM 0 HG22 THR A 21 6.040 -8.113 7.864 1.00 0.00 H new ATOM 0 HG23 THR A 21 4.438 -8.731 8.331 1.00 0.00 H new ATOM 298 N CYS A 22 2.585 -9.890 5.871 1.00 0.00 N ATOM 299 CA CYS A 22 1.194 -9.477 6.045 1.00 0.00 C ATOM 300 C CYS A 22 0.801 -9.539 7.523 1.00 0.00 C ATOM 301 O CYS A 22 0.737 -10.620 8.109 1.00 0.00 O ATOM 302 CB CYS A 22 0.258 -10.372 5.226 1.00 0.00 C ATOM 303 SG CYS A 22 -1.495 -9.870 5.292 1.00 0.00 S ATOM 0 H CYS A 22 2.712 -10.890 5.718 1.00 0.00 H new ATOM 0 HA CYS A 22 1.099 -8.450 5.692 1.00 0.00 H new ATOM 0 HB2 CYS A 22 0.587 -10.370 4.187 1.00 0.00 H new ATOM 0 HB3 CYS A 22 0.345 -11.397 5.586 1.00 0.00 H new ATOM 308 N PRO A 23 0.539 -8.376 8.150 1.00 0.00 N ATOM 309 CA PRO A 23 0.159 -8.307 9.569 1.00 0.00 C ATOM 310 C PRO A 23 -1.113 -9.090 9.882 1.00 0.00 C ATOM 311 O PRO A 23 -1.397 -9.390 11.041 1.00 0.00 O ATOM 312 CB PRO A 23 -0.068 -6.811 9.813 1.00 0.00 C ATOM 313 CG PRO A 23 0.675 -6.124 8.720 1.00 0.00 C ATOM 314 CD PRO A 23 0.598 -7.039 7.534 1.00 0.00 C ATOM 0 HA PRO A 23 0.926 -8.748 10.206 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -1.129 -6.563 9.785 1.00 0.00 H new ATOM 0 HB3 PRO A 23 0.304 -6.510 10.792 1.00 0.00 H new ATOM 0 HG2 PRO A 23 0.231 -5.154 8.495 1.00 0.00 H new ATOM 0 HG3 PRO A 23 1.711 -5.941 9.006 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -0.283 -6.836 6.924 1.00 0.00 H new ATOM 0 HD3 PRO A 23 1.467 -6.932 6.885 1.00 0.00 H new ATOM 322 N SER A 24 -1.880 -9.413 8.845 1.00 0.00 N ATOM 323 CA SER A 24 -3.125 -10.155 9.012 1.00 0.00 C ATOM 324 C SER A 24 -2.898 -11.458 9.778 1.00 0.00 C ATOM 325 O SER A 24 -1.810 -11.705 10.298 1.00 0.00 O ATOM 326 CB SER A 24 -3.740 -10.453 7.646 1.00 0.00 C ATOM 327 OG SER A 24 -4.058 -9.256 6.957 1.00 0.00 O ATOM 0 H SER A 24 -1.661 -9.172 7.878 1.00 0.00 H new ATOM 0 HA SER A 24 -3.811 -9.538 9.593 1.00 0.00 H new ATOM 0 HB2 SER A 24 -3.044 -11.044 7.051 1.00 0.00 H new ATOM 0 HB3 SER A 24 -4.641 -11.054 7.773 1.00 0.00 H new ATOM 0 HG SER A 24 -3.387 -9.090 6.262 1.00 0.00 H new ATOM 333 N SER A 25 -3.938 -12.287 9.846 1.00 0.00 N ATOM 334 CA SER A 25 -3.866 -13.565 10.551 1.00 0.00 C ATOM 335 C SER A 25 -2.621 -14.356 10.157 1.00 0.00 C ATOM 336 O SER A 25 -1.767 -14.643 10.996 1.00 0.00 O ATOM 337 CB SER A 25 -5.119 -14.395 10.268 1.00 0.00 C ATOM 338 OG SER A 25 -5.531 -15.107 11.422 1.00 0.00 O ATOM 0 H SER A 25 -4.844 -12.095 9.419 1.00 0.00 H new ATOM 0 HA SER A 25 -3.805 -13.350 11.618 1.00 0.00 H new ATOM 0 HB2 SER A 25 -5.924 -13.741 9.934 1.00 0.00 H new ATOM 0 HB3 SER A 25 -4.920 -15.095 9.457 1.00 0.00 H new ATOM 0 HG SER A 25 -6.335 -15.628 11.215 1.00 0.00 H new ATOM 344 N GLY A 26 -2.524 -14.711 8.879 1.00 0.00 N ATOM 345 CA GLY A 26 -1.379 -15.469 8.409 1.00 0.00 C ATOM 346 C GLY A 26 -1.711 -16.925 8.140 1.00 0.00 C ATOM 347 O GLY A 26 -1.308 -17.809 8.896 1.00 0.00 O ATOM 0 H GLY A 26 -3.215 -14.488 8.163 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -0.997 -15.013 7.496 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -0.582 -15.413 9.151 1.00 0.00 H new ATOM 351 N ASP A 27 -2.446 -17.176 7.061 1.00 0.00 N ATOM 352 CA ASP A 27 -2.831 -18.536 6.694 1.00 0.00 C ATOM 353 C ASP A 27 -2.937 -18.682 5.178 1.00 0.00 C ATOM 354 O ASP A 27 -2.434 -19.645 4.599 1.00 0.00 O ATOM 355 CB ASP A 27 -4.163 -18.906 7.348 1.00 0.00 C ATOM 356 CG ASP A 27 -4.214 -20.359 7.776 1.00 0.00 C ATOM 357 OD1 ASP A 27 -4.591 -21.210 6.943 1.00 0.00 O ATOM 358 OD2 ASP A 27 -3.876 -20.647 8.944 1.00 0.00 O ATOM 0 H ASP A 27 -2.787 -16.456 6.425 1.00 0.00 H new ATOM 0 HA ASP A 27 -2.057 -19.215 7.053 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -4.327 -18.268 8.217 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -4.975 -18.708 6.649 1.00 0.00 H new ATOM 363 N ASP A 28 -3.592 -17.716 4.543 1.00 0.00 N ATOM 364 CA ASP A 28 -3.766 -17.724 3.096 1.00 0.00 C ATOM 365 C ASP A 28 -3.886 -16.297 2.577 1.00 0.00 C ATOM 366 O ASP A 28 -4.860 -15.938 1.914 1.00 0.00 O ATOM 367 CB ASP A 28 -5.005 -18.534 2.709 1.00 0.00 C ATOM 368 CG ASP A 28 -4.682 -19.990 2.434 1.00 0.00 C ATOM 369 OD1 ASP A 28 -4.166 -20.286 1.335 1.00 0.00 O ATOM 370 OD2 ASP A 28 -4.944 -20.833 3.317 1.00 0.00 O ATOM 0 H ASP A 28 -4.013 -16.914 5.011 1.00 0.00 H new ATOM 0 HA ASP A 28 -2.893 -18.193 2.643 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -5.740 -18.473 3.511 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.462 -18.093 1.823 1.00 0.00 H new ATOM 375 N ILE A 29 -2.889 -15.487 2.904 1.00 0.00 N ATOM 376 CA ILE A 29 -2.862 -14.089 2.501 1.00 0.00 C ATOM 377 C ILE A 29 -2.962 -13.927 0.988 1.00 0.00 C ATOM 378 O ILE A 29 -2.465 -14.755 0.224 1.00 0.00 O ATOM 379 CB ILE A 29 -1.585 -13.401 3.020 1.00 0.00 C ATOM 380 CG1 ILE A 29 -1.572 -13.436 4.546 1.00 0.00 C ATOM 381 CG2 ILE A 29 -1.496 -11.973 2.514 1.00 0.00 C ATOM 382 CD1 ILE A 29 -0.771 -14.585 5.114 1.00 0.00 C ATOM 0 H ILE A 29 -2.080 -15.779 3.453 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.735 -13.611 2.945 1.00 0.00 H new ATOM 0 HB ILE A 29 -0.715 -13.939 2.644 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.162 -12.498 4.920 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.598 -13.503 4.909 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -0.586 -11.508 2.894 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.475 -11.974 1.424 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -2.363 -11.410 2.860 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.805 -14.549 6.203 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.194 -15.529 4.769 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.264 -14.507 4.780 1.00 0.00 H new ATOM 394 N LYS A 30 -3.619 -12.848 0.568 1.00 0.00 N ATOM 395 CA LYS A 30 -3.803 -12.556 -0.847 1.00 0.00 C ATOM 396 C LYS A 30 -3.301 -11.154 -1.187 1.00 0.00 C ATOM 397 O LYS A 30 -3.692 -10.174 -0.552 1.00 0.00 O ATOM 398 CB LYS A 30 -5.283 -12.677 -1.216 1.00 0.00 C ATOM 399 CG LYS A 30 -5.792 -14.109 -1.225 1.00 0.00 C ATOM 400 CD LYS A 30 -5.577 -14.768 -2.577 1.00 0.00 C ATOM 401 CE LYS A 30 -6.595 -15.870 -2.827 1.00 0.00 C ATOM 402 NZ LYS A 30 -6.081 -16.896 -3.777 1.00 0.00 N ATOM 0 H LYS A 30 -4.034 -12.159 1.195 1.00 0.00 H new ATOM 0 HA LYS A 30 -3.223 -13.278 -1.422 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -5.874 -12.094 -0.509 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -5.440 -12.238 -2.201 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.279 -14.683 -0.453 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -6.854 -14.120 -0.978 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -5.650 -14.018 -3.364 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -4.570 -15.183 -2.625 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -6.853 -16.347 -1.882 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -7.512 -15.434 -3.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -6.804 -17.629 -3.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -5.859 -16.446 -4.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -5.221 -17.330 -3.387 1.00 0.00 H new ATOM 416 N TRP A 31 -2.438 -11.066 -2.194 1.00 0.00 N ATOM 417 CA TRP A 31 -1.888 -9.784 -2.622 1.00 0.00 C ATOM 418 C TRP A 31 -2.622 -9.274 -3.861 1.00 0.00 C ATOM 419 O TRP A 31 -3.551 -9.920 -4.345 1.00 0.00 O ATOM 420 CB TRP A 31 -0.388 -9.919 -2.895 1.00 0.00 C ATOM 421 CG TRP A 31 0.388 -10.345 -1.684 1.00 0.00 C ATOM 422 CD1 TRP A 31 0.691 -11.624 -1.313 1.00 0.00 C ATOM 423 CD2 TRP A 31 0.950 -9.493 -0.679 1.00 0.00 C ATOM 424 NE1 TRP A 31 1.407 -11.620 -0.141 1.00 0.00 N ATOM 425 CE2 TRP A 31 1.580 -10.325 0.268 1.00 0.00 C ATOM 426 CE3 TRP A 31 0.986 -8.109 -0.487 1.00 0.00 C ATOM 427 CZ2 TRP A 31 2.234 -9.818 1.387 1.00 0.00 C ATOM 428 CZ3 TRP A 31 1.637 -7.608 0.625 1.00 0.00 C ATOM 429 CH2 TRP A 31 2.253 -8.460 1.549 1.00 0.00 C ATOM 0 H TRP A 31 -2.104 -11.867 -2.729 1.00 0.00 H new ATOM 0 HA TRP A 31 -2.029 -9.057 -1.822 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -0.233 -10.644 -3.694 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -0.001 -8.964 -3.251 1.00 0.00 H new ATOM 0 HD1 TRP A 31 0.408 -12.510 -1.862 1.00 0.00 H new ATOM 0 HE1 TRP A 31 1.753 -12.447 0.345 1.00 0.00 H new ATOM 0 HE3 TRP A 31 0.514 -7.443 -1.194 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 2.709 -10.473 2.102 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 1.671 -6.540 0.784 1.00 0.00 H new ATOM 0 HH2 TRP A 31 2.753 -8.037 2.407 1.00 0.00 H new ATOM 440 N LYS A 32 -2.217 -8.111 -4.367 1.00 0.00 N ATOM 441 CA LYS A 32 -2.869 -7.534 -5.544 1.00 0.00 C ATOM 442 C LYS A 32 -1.879 -6.788 -6.443 1.00 0.00 C ATOM 443 O LYS A 32 -1.649 -7.198 -7.581 1.00 0.00 O ATOM 444 CB LYS A 32 -4.014 -6.596 -5.131 1.00 0.00 C ATOM 445 CG LYS A 32 -4.327 -6.609 -3.641 1.00 0.00 C ATOM 446 CD LYS A 32 -5.623 -5.876 -3.338 1.00 0.00 C ATOM 447 CE LYS A 32 -6.141 -6.211 -1.949 1.00 0.00 C ATOM 448 NZ LYS A 32 -7.214 -7.243 -1.990 1.00 0.00 N ATOM 0 H LYS A 32 -1.451 -7.555 -3.988 1.00 0.00 H new ATOM 0 HA LYS A 32 -3.279 -8.365 -6.118 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -3.760 -5.579 -5.428 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.913 -6.874 -5.682 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -4.400 -7.639 -3.293 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -3.508 -6.144 -3.092 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -5.461 -4.801 -3.418 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -6.375 -6.141 -4.082 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -5.317 -6.568 -1.331 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -6.525 -5.307 -1.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.540 -7.443 -1.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -8.011 -6.893 -2.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -6.841 -8.115 -2.417 1.00 0.00 H new ATOM 462 N PRO A 33 -1.288 -5.675 -5.955 1.00 0.00 N ATOM 463 CA PRO A 33 -0.336 -4.866 -6.715 1.00 0.00 C ATOM 464 C PRO A 33 0.499 -5.686 -7.696 1.00 0.00 C ATOM 465 O PRO A 33 0.668 -5.305 -8.854 1.00 0.00 O ATOM 466 CB PRO A 33 0.557 -4.263 -5.624 1.00 0.00 C ATOM 467 CG PRO A 33 -0.169 -4.456 -4.322 1.00 0.00 C ATOM 468 CD PRO A 33 -1.499 -5.096 -4.628 1.00 0.00 C ATOM 0 HA PRO A 33 -0.842 -4.128 -7.338 1.00 0.00 H new ATOM 0 HB2 PRO A 33 1.529 -4.755 -5.603 1.00 0.00 H new ATOM 0 HB3 PRO A 33 0.740 -3.205 -5.813 1.00 0.00 H new ATOM 0 HG2 PRO A 33 0.413 -5.086 -3.650 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -0.312 -3.500 -3.819 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -1.759 -5.857 -3.892 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -2.308 -4.365 -4.630 1.00 0.00 H new ATOM 476 N ASP A 34 1.012 -6.814 -7.224 1.00 0.00 N ATOM 477 CA ASP A 34 1.822 -7.694 -8.055 1.00 0.00 C ATOM 478 C ASP A 34 1.982 -9.056 -7.388 1.00 0.00 C ATOM 479 O ASP A 34 2.902 -9.267 -6.597 1.00 0.00 O ATOM 480 CB ASP A 34 3.193 -7.068 -8.321 1.00 0.00 C ATOM 481 CG ASP A 34 3.473 -6.897 -9.801 1.00 0.00 C ATOM 482 OD1 ASP A 34 2.505 -6.740 -10.575 1.00 0.00 O ATOM 483 OD2 ASP A 34 4.661 -6.920 -10.187 1.00 0.00 O ATOM 0 H ASP A 34 0.881 -7.142 -6.267 1.00 0.00 H new ATOM 0 HA ASP A 34 1.313 -7.831 -9.009 1.00 0.00 H new ATOM 0 HB2 ASP A 34 3.248 -6.097 -7.829 1.00 0.00 H new ATOM 0 HB3 ASP A 34 3.967 -7.694 -7.877 1.00 0.00 H new ATOM 488 N PRO A 35 1.083 -10.002 -7.702 1.00 0.00 N ATOM 489 CA PRO A 35 1.119 -11.351 -7.136 1.00 0.00 C ATOM 490 C PRO A 35 2.378 -12.095 -7.551 1.00 0.00 C ATOM 491 O PRO A 35 2.831 -13.009 -6.861 1.00 0.00 O ATOM 492 CB PRO A 35 -0.129 -12.030 -7.718 1.00 0.00 C ATOM 493 CG PRO A 35 -0.984 -10.911 -8.211 1.00 0.00 C ATOM 494 CD PRO A 35 -0.034 -9.833 -8.637 1.00 0.00 C ATOM 0 HA PRO A 35 1.129 -11.341 -6.046 1.00 0.00 H new ATOM 0 HB2 PRO A 35 0.134 -12.712 -8.527 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -0.647 -12.619 -6.961 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -1.609 -11.233 -9.044 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -1.654 -10.556 -7.428 1.00 0.00 H new ATOM 0 HD2 PRO A 35 0.282 -9.958 -9.673 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -0.483 -8.843 -8.558 1.00 0.00 H new ATOM 502 N ALA A 36 2.947 -11.686 -8.681 1.00 0.00 N ATOM 503 CA ALA A 36 4.167 -12.303 -9.187 1.00 0.00 C ATOM 504 C ALA A 36 5.257 -12.290 -8.120 1.00 0.00 C ATOM 505 O ALA A 36 6.126 -13.161 -8.090 1.00 0.00 O ATOM 506 CB ALA A 36 4.642 -11.586 -10.442 1.00 0.00 C ATOM 0 H ALA A 36 2.583 -10.931 -9.262 1.00 0.00 H new ATOM 0 HA ALA A 36 3.949 -13.340 -9.442 1.00 0.00 H new ATOM 0 HB1 ALA A 36 5.554 -12.058 -10.808 1.00 0.00 H new ATOM 0 HB2 ALA A 36 3.870 -11.645 -11.209 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.843 -10.540 -10.209 1.00 0.00 H new ATOM 512 N LEU A 37 5.193 -11.296 -7.238 1.00 0.00 N ATOM 513 CA LEU A 37 6.162 -11.163 -6.157 1.00 0.00 C ATOM 514 C LEU A 37 5.451 -11.159 -4.806 1.00 0.00 C ATOM 515 O LEU A 37 5.747 -10.343 -3.934 1.00 0.00 O ATOM 516 CB LEU A 37 6.983 -9.879 -6.323 1.00 0.00 C ATOM 517 CG LEU A 37 6.280 -8.747 -7.076 1.00 0.00 C ATOM 518 CD1 LEU A 37 6.940 -7.412 -6.768 1.00 0.00 C ATOM 519 CD2 LEU A 37 6.291 -9.017 -8.573 1.00 0.00 C ATOM 0 H LEU A 37 4.477 -10.569 -7.252 1.00 0.00 H new ATOM 0 HA LEU A 37 6.839 -12.016 -6.197 1.00 0.00 H new ATOM 0 HB2 LEU A 37 7.264 -9.516 -5.334 1.00 0.00 H new ATOM 0 HB3 LEU A 37 7.907 -10.123 -6.847 1.00 0.00 H new ATOM 0 HG LEU A 37 5.243 -8.702 -6.743 1.00 0.00 H new ATOM 0 HD11 LEU A 37 6.427 -6.619 -7.312 1.00 0.00 H new ATOM 0 HD12 LEU A 37 6.881 -7.215 -5.698 1.00 0.00 H new ATOM 0 HD13 LEU A 37 7.986 -7.444 -7.074 1.00 0.00 H new ATOM 0 HD21 LEU A 37 5.787 -8.202 -9.093 1.00 0.00 H new ATOM 0 HD22 LEU A 37 7.321 -9.089 -8.922 1.00 0.00 H new ATOM 0 HD23 LEU A 37 5.773 -9.954 -8.778 1.00 0.00 H new ATOM 531 N GLY A 38 4.508 -12.082 -4.645 1.00 0.00 N ATOM 532 CA GLY A 38 3.760 -12.180 -3.406 1.00 0.00 C ATOM 533 C GLY A 38 3.783 -13.580 -2.830 1.00 0.00 C ATOM 534 O GLY A 38 3.187 -14.499 -3.390 1.00 0.00 O ATOM 0 H GLY A 38 4.248 -12.767 -5.355 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.175 -11.483 -2.678 1.00 0.00 H new ATOM 0 HA3 GLY A 38 2.727 -11.879 -3.583 1.00 0.00 H new ATOM 538 N ASP A 39 4.471 -13.741 -1.707 1.00 0.00 N ATOM 539 CA ASP A 39 4.568 -15.042 -1.052 1.00 0.00 C ATOM 540 C ASP A 39 3.496 -15.184 0.024 1.00 0.00 C ATOM 541 O ASP A 39 2.743 -14.248 0.288 1.00 0.00 O ATOM 542 CB ASP A 39 5.955 -15.223 -0.434 1.00 0.00 C ATOM 543 CG ASP A 39 6.930 -15.888 -1.386 1.00 0.00 C ATOM 544 OD1 ASP A 39 7.255 -15.277 -2.425 1.00 0.00 O ATOM 545 OD2 ASP A 39 7.367 -17.021 -1.092 1.00 0.00 O ATOM 0 H ASP A 39 4.970 -12.990 -1.230 1.00 0.00 H new ATOM 0 HA ASP A 39 4.411 -15.815 -1.804 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.347 -14.250 -0.137 1.00 0.00 H new ATOM 0 HB3 ASP A 39 5.870 -15.822 0.472 1.00 0.00 H new ATOM 550 N ASN A 40 3.430 -16.356 0.648 1.00 0.00 N ATOM 551 CA ASN A 40 2.446 -16.591 1.696 1.00 0.00 C ATOM 552 C ASN A 40 2.799 -15.792 2.940 1.00 0.00 C ATOM 553 O ASN A 40 3.857 -15.984 3.538 1.00 0.00 O ATOM 554 CB ASN A 40 2.352 -18.071 2.044 1.00 0.00 C ATOM 555 CG ASN A 40 2.248 -18.953 0.815 1.00 0.00 C ATOM 556 OD1 ASN A 40 1.151 -19.274 0.358 1.00 0.00 O ATOM 557 ND2 ASN A 40 3.394 -19.350 0.273 1.00 0.00 N ATOM 0 H ASN A 40 4.039 -17.149 0.448 1.00 0.00 H new ATOM 0 HA ASN A 40 1.476 -16.265 1.321 1.00 0.00 H new ATOM 0 HB2 ASN A 40 3.230 -18.361 2.622 1.00 0.00 H new ATOM 0 HB3 ASN A 40 1.483 -18.236 2.680 1.00 0.00 H new ATOM 0 HD21 ASN A 40 3.387 -19.945 -0.555 1.00 0.00 H new ATOM 0 HD22 ASN A 40 4.281 -19.060 0.685 1.00 0.00 H new ATOM 564 N ASN A 41 1.913 -14.881 3.308 1.00 0.00 N ATOM 565 CA ASN A 41 2.130 -14.028 4.467 1.00 0.00 C ATOM 566 C ASN A 41 3.386 -13.191 4.269 1.00 0.00 C ATOM 567 O ASN A 41 3.962 -12.679 5.229 1.00 0.00 O ATOM 568 CB ASN A 41 2.254 -14.870 5.738 1.00 0.00 C ATOM 569 CG ASN A 41 2.113 -14.040 6.998 1.00 0.00 C ATOM 570 OD1 ASN A 41 2.139 -12.810 6.951 1.00 0.00 O ATOM 571 ND2 ASN A 41 1.962 -14.709 8.135 1.00 0.00 N ATOM 0 H ASN A 41 1.034 -14.712 2.820 1.00 0.00 H new ATOM 0 HA ASN A 41 1.273 -13.364 4.575 1.00 0.00 H new ATOM 0 HB2 ASN A 41 1.490 -15.648 5.731 1.00 0.00 H new ATOM 0 HB3 ASN A 41 3.221 -15.373 5.744 1.00 0.00 H new ATOM 0 HD21 ASN A 41 1.862 -14.203 9.015 1.00 0.00 H new ATOM 0 HD22 ASN A 41 1.946 -15.729 8.128 1.00 0.00 H new ATOM 578 N LYS A 42 3.809 -13.064 3.013 1.00 0.00 N ATOM 579 CA LYS A 42 5.000 -12.302 2.689 1.00 0.00 C ATOM 580 C LYS A 42 4.974 -11.826 1.239 1.00 0.00 C ATOM 581 O LYS A 42 4.257 -12.376 0.408 1.00 0.00 O ATOM 582 CB LYS A 42 6.242 -13.156 2.935 1.00 0.00 C ATOM 583 CG LYS A 42 7.430 -12.370 3.468 1.00 0.00 C ATOM 584 CD LYS A 42 7.935 -12.940 4.784 1.00 0.00 C ATOM 585 CE LYS A 42 6.885 -12.833 5.878 1.00 0.00 C ATOM 586 NZ LYS A 42 7.500 -12.655 7.223 1.00 0.00 N ATOM 0 H LYS A 42 3.341 -13.481 2.208 1.00 0.00 H new ATOM 0 HA LYS A 42 5.028 -11.423 3.333 1.00 0.00 H new ATOM 0 HB2 LYS A 42 5.994 -13.947 3.643 1.00 0.00 H new ATOM 0 HB3 LYS A 42 6.528 -13.642 2.002 1.00 0.00 H new ATOM 0 HG2 LYS A 42 8.235 -12.383 2.733 1.00 0.00 H new ATOM 0 HG3 LYS A 42 7.144 -11.328 3.609 1.00 0.00 H new ATOM 0 HD2 LYS A 42 8.213 -13.985 4.646 1.00 0.00 H new ATOM 0 HD3 LYS A 42 8.836 -12.408 5.090 1.00 0.00 H new ATOM 0 HE2 LYS A 42 6.225 -11.992 5.667 1.00 0.00 H new ATOM 0 HE3 LYS A 42 6.267 -13.731 5.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 6.802 -12.239 7.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 7.806 -13.579 7.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 8.322 -12.022 7.148 1.00 0.00 H new ATOM 600 N TYR A 43 5.766 -10.803 0.946 1.00 0.00 N ATOM 601 CA TYR A 43 5.845 -10.252 -0.402 1.00 0.00 C ATOM 602 C TYR A 43 7.301 -10.040 -0.798 1.00 0.00 C ATOM 603 O TYR A 43 7.932 -9.069 -0.384 1.00 0.00 O ATOM 604 CB TYR A 43 5.080 -8.931 -0.473 1.00 0.00 C ATOM 605 CG TYR A 43 4.786 -8.457 -1.878 1.00 0.00 C ATOM 606 CD1 TYR A 43 3.656 -8.894 -2.557 1.00 0.00 C ATOM 607 CD2 TYR A 43 5.636 -7.569 -2.524 1.00 0.00 C ATOM 608 CE1 TYR A 43 3.382 -8.460 -3.839 1.00 0.00 C ATOM 609 CE2 TYR A 43 5.369 -7.130 -3.806 1.00 0.00 C ATOM 610 CZ TYR A 43 4.241 -7.578 -4.459 1.00 0.00 C ATOM 611 OH TYR A 43 3.972 -7.142 -5.735 1.00 0.00 O ATOM 0 H TYR A 43 6.365 -10.336 1.626 1.00 0.00 H new ATOM 0 HA TYR A 43 5.393 -10.958 -1.099 1.00 0.00 H new ATOM 0 HB2 TYR A 43 4.139 -9.040 0.065 1.00 0.00 H new ATOM 0 HB3 TYR A 43 5.655 -8.163 0.044 1.00 0.00 H new ATOM 0 HD1 TYR A 43 2.980 -9.585 -2.074 1.00 0.00 H new ATOM 0 HD2 TYR A 43 6.521 -7.216 -2.015 1.00 0.00 H new ATOM 0 HE1 TYR A 43 2.499 -8.810 -4.353 1.00 0.00 H new ATOM 0 HE2 TYR A 43 6.041 -6.439 -4.294 1.00 0.00 H new ATOM 0 HH TYR A 43 4.525 -6.358 -5.936 1.00 0.00 H new ATOM 621 N ILE A 44 7.828 -10.961 -1.592 1.00 0.00 N ATOM 622 CA ILE A 44 9.214 -10.890 -2.035 1.00 0.00 C ATOM 623 C ILE A 44 9.375 -9.966 -3.238 1.00 0.00 C ATOM 624 O ILE A 44 9.063 -10.344 -4.367 1.00 0.00 O ATOM 625 CB ILE A 44 9.747 -12.286 -2.405 1.00 0.00 C ATOM 626 CG1 ILE A 44 9.381 -13.301 -1.320 1.00 0.00 C ATOM 627 CG2 ILE A 44 11.253 -12.242 -2.614 1.00 0.00 C ATOM 628 CD1 ILE A 44 9.912 -12.940 0.050 1.00 0.00 C ATOM 0 H ILE A 44 7.315 -11.769 -1.944 1.00 0.00 H new ATOM 0 HA ILE A 44 9.789 -10.487 -1.201 1.00 0.00 H new ATOM 0 HB ILE A 44 9.281 -12.599 -3.339 1.00 0.00 H new ATOM 0 HG12 ILE A 44 8.296 -13.390 -1.268 1.00 0.00 H new ATOM 0 HG13 ILE A 44 9.768 -14.280 -1.604 1.00 0.00 H new ATOM 0 HG21 ILE A 44 11.613 -13.237 -2.875 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.488 -11.548 -3.421 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.738 -11.910 -1.696 1.00 0.00 H new ATOM 0 HD11 ILE A 44 9.614 -13.704 0.768 1.00 0.00 H new ATOM 0 HD12 ILE A 44 11.000 -12.880 0.014 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.505 -11.976 0.356 1.00 0.00 H new ATOM 640 N ILE A 45 9.873 -8.757 -2.992 1.00 0.00 N ATOM 641 CA ILE A 45 10.081 -7.790 -4.064 1.00 0.00 C ATOM 642 C ILE A 45 11.449 -7.969 -4.707 1.00 0.00 C ATOM 643 O ILE A 45 12.443 -8.208 -4.020 1.00 0.00 O ATOM 644 CB ILE A 45 9.967 -6.339 -3.564 1.00 0.00 C ATOM 645 CG1 ILE A 45 8.786 -6.186 -2.609 1.00 0.00 C ATOM 646 CG2 ILE A 45 9.828 -5.388 -4.742 1.00 0.00 C ATOM 647 CD1 ILE A 45 8.720 -4.826 -1.952 1.00 0.00 C ATOM 0 H ILE A 45 10.139 -8.426 -2.065 1.00 0.00 H new ATOM 0 HA ILE A 45 9.296 -7.977 -4.797 1.00 0.00 H new ATOM 0 HB ILE A 45 10.877 -6.089 -3.019 1.00 0.00 H new ATOM 0 HG12 ILE A 45 7.860 -6.363 -3.156 1.00 0.00 H new ATOM 0 HG13 ILE A 45 8.851 -6.952 -1.836 1.00 0.00 H new ATOM 0 HG21 ILE A 45 9.748 -4.364 -4.376 1.00 0.00 H new ATOM 0 HG22 ILE A 45 10.703 -5.476 -5.386 1.00 0.00 H new ATOM 0 HG23 ILE A 45 8.933 -5.641 -5.310 1.00 0.00 H new ATOM 0 HD11 ILE A 45 7.858 -4.785 -1.286 1.00 0.00 H new ATOM 0 HD12 ILE A 45 9.630 -4.655 -1.378 1.00 0.00 H new ATOM 0 HD13 ILE A 45 8.624 -4.056 -2.718 1.00 0.00 H new ATOM 659 N GLN A 46 11.494 -7.849 -6.028 1.00 0.00 N ATOM 660 CA GLN A 46 12.737 -7.995 -6.764 1.00 0.00 C ATOM 661 C GLN A 46 12.780 -7.034 -7.945 1.00 0.00 C ATOM 662 O GLN A 46 11.742 -6.681 -8.504 1.00 0.00 O ATOM 663 CB GLN A 46 12.886 -9.433 -7.244 1.00 0.00 C ATOM 664 CG GLN A 46 13.155 -10.410 -6.115 1.00 0.00 C ATOM 665 CD GLN A 46 12.819 -11.841 -6.486 1.00 0.00 C ATOM 666 OE1 GLN A 46 13.707 -12.655 -6.738 1.00 0.00 O ATOM 667 NE2 GLN A 46 11.529 -12.156 -6.520 1.00 0.00 N ATOM 0 H GLN A 46 10.680 -7.650 -6.610 1.00 0.00 H new ATOM 0 HA GLN A 46 13.567 -7.753 -6.100 1.00 0.00 H new ATOM 0 HB2 GLN A 46 11.977 -9.732 -7.767 1.00 0.00 H new ATOM 0 HB3 GLN A 46 13.701 -9.487 -7.966 1.00 0.00 H new ATOM 0 HG2 GLN A 46 14.206 -10.350 -5.831 1.00 0.00 H new ATOM 0 HG3 GLN A 46 12.571 -10.119 -5.242 1.00 0.00 H new ATOM 0 HE21 GLN A 46 10.826 -11.450 -6.304 1.00 0.00 H new ATOM 0 HE22 GLN A 46 11.242 -13.104 -6.762 1.00 0.00 H new ATOM 676 N ASN A 47 13.986 -6.602 -8.310 1.00 0.00 N ATOM 677 CA ASN A 47 14.168 -5.667 -9.418 1.00 0.00 C ATOM 678 C ASN A 47 13.156 -4.526 -9.337 1.00 0.00 C ATOM 679 O ASN A 47 12.742 -3.972 -10.355 1.00 0.00 O ATOM 680 CB ASN A 47 14.043 -6.393 -10.762 1.00 0.00 C ATOM 681 CG ASN A 47 12.642 -6.910 -11.022 1.00 0.00 C ATOM 682 OD1 ASN A 47 11.685 -6.138 -11.087 1.00 0.00 O ATOM 683 ND2 ASN A 47 12.514 -8.223 -11.172 1.00 0.00 N ATOM 0 H ASN A 47 14.853 -6.885 -7.853 1.00 0.00 H new ATOM 0 HA ASN A 47 15.170 -5.244 -9.342 1.00 0.00 H new ATOM 0 HB2 ASN A 47 14.330 -5.714 -11.565 1.00 0.00 H new ATOM 0 HB3 ASN A 47 14.744 -7.228 -10.785 1.00 0.00 H new ATOM 0 HD21 ASN A 47 11.595 -8.629 -11.349 1.00 0.00 H new ATOM 0 HD22 ASN A 47 13.335 -8.826 -11.110 1.00 0.00 H new ATOM 690 N HIS A 48 12.761 -4.186 -8.112 1.00 0.00 N ATOM 691 CA HIS A 48 11.796 -3.119 -7.883 1.00 0.00 C ATOM 692 C HIS A 48 12.295 -1.799 -8.458 1.00 0.00 C ATOM 693 O HIS A 48 13.469 -1.664 -8.804 1.00 0.00 O ATOM 694 CB HIS A 48 11.522 -2.967 -6.385 1.00 0.00 C ATOM 695 CG HIS A 48 10.307 -2.149 -6.078 1.00 0.00 C ATOM 696 ND1 HIS A 48 9.073 -2.389 -6.647 1.00 0.00 N ATOM 697 CD2 HIS A 48 10.138 -1.088 -5.253 1.00 0.00 C ATOM 698 CE1 HIS A 48 8.200 -1.511 -6.187 1.00 0.00 C ATOM 699 NE2 HIS A 48 8.821 -0.711 -5.339 1.00 0.00 N ATOM 0 H HIS A 48 13.097 -4.637 -7.261 1.00 0.00 H new ATOM 0 HA HIS A 48 10.869 -3.385 -8.391 1.00 0.00 H new ATOM 0 HB2 HIS A 48 11.405 -3.957 -5.943 1.00 0.00 H new ATOM 0 HB3 HIS A 48 12.389 -2.507 -5.910 1.00 0.00 H new ATOM 0 HD1 HIS A 48 8.867 -3.129 -7.318 1.00 0.00 H new ATOM 0 HD2 HIS A 48 10.898 -0.625 -4.641 1.00 0.00 H new ATOM 0 HE1 HIS A 48 7.156 -1.456 -6.458 1.00 0.00 H new ATOM 707 N ASP A 49 11.394 -0.828 -8.558 1.00 0.00 N ATOM 708 CA ASP A 49 11.741 0.484 -9.092 1.00 0.00 C ATOM 709 C ASP A 49 11.511 1.574 -8.051 1.00 0.00 C ATOM 710 O ASP A 49 10.503 1.569 -7.344 1.00 0.00 O ATOM 711 CB ASP A 49 10.918 0.780 -10.347 1.00 0.00 C ATOM 712 CG ASP A 49 11.697 1.578 -11.374 1.00 0.00 C ATOM 713 OD1 ASP A 49 12.222 2.653 -11.016 1.00 0.00 O ATOM 714 OD2 ASP A 49 11.780 1.129 -12.536 1.00 0.00 O ATOM 0 H ASP A 49 10.418 -0.924 -8.276 1.00 0.00 H new ATOM 0 HA ASP A 49 12.799 0.474 -9.353 1.00 0.00 H new ATOM 0 HB2 ASP A 49 10.590 -0.159 -10.793 1.00 0.00 H new ATOM 0 HB3 ASP A 49 10.020 1.331 -10.068 1.00 0.00 H new ATOM 719 N SER A 50 12.451 2.510 -7.965 1.00 0.00 N ATOM 720 CA SER A 50 12.352 3.611 -7.014 1.00 0.00 C ATOM 721 C SER A 50 11.043 4.370 -7.200 1.00 0.00 C ATOM 722 O SER A 50 10.948 5.265 -8.040 1.00 0.00 O ATOM 723 CB SER A 50 13.535 4.566 -7.185 1.00 0.00 C ATOM 724 OG SER A 50 13.480 5.228 -8.437 1.00 0.00 O ATOM 0 H SER A 50 13.291 2.528 -8.543 1.00 0.00 H new ATOM 0 HA SER A 50 12.372 3.194 -6.007 1.00 0.00 H new ATOM 0 HB2 SER A 50 13.532 5.302 -6.381 1.00 0.00 H new ATOM 0 HB3 SER A 50 14.469 4.010 -7.105 1.00 0.00 H new ATOM 0 HG SER A 50 12.593 5.628 -8.557 1.00 0.00 H new ATOM 730 N SER A 51 10.033 4.006 -6.416 1.00 0.00 N ATOM 731 CA SER A 51 8.730 4.657 -6.509 1.00 0.00 C ATOM 732 C SER A 51 7.760 4.115 -5.466 1.00 0.00 C ATOM 733 O SER A 51 8.084 3.186 -4.722 1.00 0.00 O ATOM 734 CB SER A 51 8.145 4.472 -7.911 1.00 0.00 C ATOM 735 OG SER A 51 8.230 5.672 -8.661 1.00 0.00 O ATOM 0 H SER A 51 10.090 3.269 -5.713 1.00 0.00 H new ATOM 0 HA SER A 51 8.875 5.720 -6.315 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.680 3.676 -8.430 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.104 4.159 -7.836 1.00 0.00 H new ATOM 0 HG SER A 51 9.164 5.967 -8.702 1.00 0.00 H new ATOM 741 N PRO A 52 6.554 4.708 -5.396 1.00 0.00 N ATOM 742 CA PRO A 52 5.521 4.316 -4.446 1.00 0.00 C ATOM 743 C PRO A 52 4.595 3.231 -4.980 1.00 0.00 C ATOM 744 O PRO A 52 4.680 2.835 -6.142 1.00 0.00 O ATOM 745 CB PRO A 52 4.744 5.613 -4.262 1.00 0.00 C ATOM 746 CG PRO A 52 4.827 6.295 -5.582 1.00 0.00 C ATOM 747 CD PRO A 52 6.106 5.835 -6.239 1.00 0.00 C ATOM 0 HA PRO A 52 5.944 3.894 -3.534 1.00 0.00 H new ATOM 0 HB2 PRO A 52 3.709 5.418 -3.982 1.00 0.00 H new ATOM 0 HB3 PRO A 52 5.178 6.226 -3.472 1.00 0.00 H new ATOM 0 HG2 PRO A 52 3.965 6.045 -6.200 1.00 0.00 H new ATOM 0 HG3 PRO A 52 4.826 7.378 -5.457 1.00 0.00 H new ATOM 0 HD2 PRO A 52 5.935 5.520 -7.269 1.00 0.00 H new ATOM 0 HD3 PRO A 52 6.849 6.632 -6.268 1.00 0.00 H new ATOM 755 N LEU A 53 3.696 2.774 -4.115 1.00 0.00 N ATOM 756 CA LEU A 53 2.723 1.752 -4.473 1.00 0.00 C ATOM 757 C LEU A 53 1.830 1.434 -3.285 1.00 0.00 C ATOM 758 O LEU A 53 2.261 1.501 -2.134 1.00 0.00 O ATOM 759 CB LEU A 53 3.415 0.475 -4.984 1.00 0.00 C ATOM 760 CG LEU A 53 3.696 -0.616 -3.944 1.00 0.00 C ATOM 761 CD1 LEU A 53 2.414 -1.319 -3.520 1.00 0.00 C ATOM 762 CD2 LEU A 53 4.685 -1.630 -4.497 1.00 0.00 C ATOM 0 H LEU A 53 3.622 3.100 -3.151 1.00 0.00 H new ATOM 0 HA LEU A 53 2.106 2.143 -5.282 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.797 0.044 -5.771 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.362 0.761 -5.443 1.00 0.00 H new ATOM 0 HG LEU A 53 4.127 -0.136 -3.066 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.647 -2.087 -2.782 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.728 -0.593 -3.084 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.948 -1.781 -4.390 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.875 -2.399 -3.748 1.00 0.00 H new ATOM 0 HD22 LEU A 53 4.270 -2.091 -5.393 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.620 -1.128 -4.747 1.00 0.00 H new ATOM 774 N THR A 54 0.591 1.068 -3.571 1.00 0.00 N ATOM 775 CA THR A 54 -0.352 0.716 -2.526 1.00 0.00 C ATOM 776 C THR A 54 -0.399 -0.797 -2.372 1.00 0.00 C ATOM 777 O THR A 54 -0.942 -1.499 -3.223 1.00 0.00 O ATOM 778 CB THR A 54 -1.744 1.267 -2.851 1.00 0.00 C ATOM 779 OG1 THR A 54 -1.751 2.679 -2.776 1.00 0.00 O ATOM 780 CG2 THR A 54 -2.826 0.758 -1.922 1.00 0.00 C ATOM 0 H THR A 54 0.217 1.007 -4.518 1.00 0.00 H new ATOM 0 HA THR A 54 -0.024 1.160 -1.586 1.00 0.00 H new ATOM 0 HB THR A 54 -1.961 0.919 -3.861 1.00 0.00 H new ATOM 0 HG1 THR A 54 -1.089 2.975 -2.117 1.00 0.00 H new ATOM 0 HG21 THR A 54 -3.785 1.189 -2.210 1.00 0.00 H new ATOM 0 HG22 THR A 54 -2.881 -0.329 -1.989 1.00 0.00 H new ATOM 0 HG23 THR A 54 -2.592 1.047 -0.898 1.00 0.00 H new ATOM 788 N VAL A 55 0.180 -1.295 -1.286 1.00 0.00 N ATOM 789 CA VAL A 55 0.210 -2.727 -1.036 1.00 0.00 C ATOM 790 C VAL A 55 -0.904 -3.129 -0.087 1.00 0.00 C ATOM 791 O VAL A 55 -1.109 -2.509 0.957 1.00 0.00 O ATOM 792 CB VAL A 55 1.581 -3.180 -0.482 1.00 0.00 C ATOM 793 CG1 VAL A 55 1.694 -2.919 1.015 1.00 0.00 C ATOM 794 CG2 VAL A 55 1.818 -4.649 -0.793 1.00 0.00 C ATOM 0 H VAL A 55 0.633 -0.729 -0.568 1.00 0.00 H new ATOM 0 HA VAL A 55 0.055 -3.229 -1.991 1.00 0.00 H new ATOM 0 HB VAL A 55 2.353 -2.589 -0.975 1.00 0.00 H new ATOM 0 HG11 VAL A 55 2.670 -3.250 1.369 1.00 0.00 H new ATOM 0 HG12 VAL A 55 1.580 -1.852 1.208 1.00 0.00 H new ATOM 0 HG13 VAL A 55 0.912 -3.468 1.540 1.00 0.00 H new ATOM 0 HG21 VAL A 55 2.787 -4.953 -0.397 1.00 0.00 H new ATOM 0 HG22 VAL A 55 1.033 -5.250 -0.333 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.804 -4.799 -1.873 1.00 0.00 H new ATOM 804 N SER A 56 -1.640 -4.157 -0.476 1.00 0.00 N ATOM 805 CA SER A 56 -2.755 -4.631 0.317 1.00 0.00 C ATOM 806 C SER A 56 -2.779 -6.151 0.387 1.00 0.00 C ATOM 807 O SER A 56 -2.739 -6.830 -0.639 1.00 0.00 O ATOM 808 CB SER A 56 -4.056 -4.122 -0.295 1.00 0.00 C ATOM 809 OG SER A 56 -4.010 -2.720 -0.497 1.00 0.00 O ATOM 0 H SER A 56 -1.482 -4.678 -1.339 1.00 0.00 H new ATOM 0 HA SER A 56 -2.644 -4.251 1.333 1.00 0.00 H new ATOM 0 HB2 SER A 56 -4.235 -4.624 -1.246 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.891 -4.371 0.359 1.00 0.00 H new ATOM 0 HG SER A 56 -4.855 -2.418 -0.892 1.00 0.00 H new ATOM 815 N CYS A 57 -2.861 -6.680 1.601 1.00 0.00 N ATOM 816 CA CYS A 57 -2.912 -8.120 1.798 1.00 0.00 C ATOM 817 C CYS A 57 -4.178 -8.507 2.544 1.00 0.00 C ATOM 818 O CYS A 57 -4.757 -7.700 3.272 1.00 0.00 O ATOM 819 CB CYS A 57 -1.671 -8.619 2.539 1.00 0.00 C ATOM 820 SG CYS A 57 -1.559 -8.107 4.283 1.00 0.00 S ATOM 0 H CYS A 57 -2.893 -6.133 2.462 1.00 0.00 H new ATOM 0 HA CYS A 57 -2.928 -8.597 0.818 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -1.652 -9.708 2.494 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -0.785 -8.263 2.014 1.00 0.00 H new ATOM 825 N THR A 58 -4.616 -9.739 2.335 1.00 0.00 N ATOM 826 CA THR A 58 -5.836 -10.228 2.966 1.00 0.00 C ATOM 827 C THR A 58 -5.681 -11.660 3.462 1.00 0.00 C ATOM 828 O THR A 58 -5.620 -12.598 2.667 1.00 0.00 O ATOM 829 CB THR A 58 -6.990 -10.157 1.968 1.00 0.00 C ATOM 830 OG1 THR A 58 -7.190 -8.826 1.525 1.00 0.00 O ATOM 831 CG2 THR A 58 -8.305 -10.657 2.529 1.00 0.00 C ATOM 0 H THR A 58 -4.148 -10.418 1.735 1.00 0.00 H new ATOM 0 HA THR A 58 -6.044 -9.595 3.829 1.00 0.00 H new ATOM 0 HB THR A 58 -6.696 -10.808 1.145 1.00 0.00 H new ATOM 0 HG1 THR A 58 -7.932 -8.802 0.885 1.00 0.00 H new ATOM 0 HG21 THR A 58 -9.080 -10.578 1.766 1.00 0.00 H new ATOM 0 HG22 THR A 58 -8.199 -11.699 2.831 1.00 0.00 H new ATOM 0 HG23 THR A 58 -8.584 -10.055 3.394 1.00 0.00 H new ATOM 839 N ALA A 59 -5.643 -11.826 4.779 1.00 0.00 N ATOM 840 CA ALA A 59 -5.522 -13.149 5.374 1.00 0.00 C ATOM 841 C ALA A 59 -6.841 -13.568 6.012 1.00 0.00 C ATOM 842 O ALA A 59 -7.181 -13.114 7.106 1.00 0.00 O ATOM 843 CB ALA A 59 -4.408 -13.174 6.406 1.00 0.00 C ATOM 0 H ALA A 59 -5.694 -11.062 5.453 1.00 0.00 H new ATOM 0 HA ALA A 59 -5.275 -13.857 4.583 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -4.335 -14.172 6.838 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.463 -12.915 5.928 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -4.625 -12.453 7.194 1.00 0.00 H new ATOM 849 N GLY A 60 -7.586 -14.424 5.324 1.00 0.00 N ATOM 850 CA GLY A 60 -8.862 -14.871 5.847 1.00 0.00 C ATOM 851 C GLY A 60 -9.854 -13.732 5.978 1.00 0.00 C ATOM 852 O GLY A 60 -10.440 -13.294 4.988 1.00 0.00 O ATOM 0 H GLY A 60 -7.331 -14.815 4.417 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -9.274 -15.637 5.190 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -8.712 -15.334 6.822 1.00 0.00 H new ATOM 856 N ASP A 61 -10.040 -13.249 7.203 1.00 0.00 N ATOM 857 CA ASP A 61 -10.965 -12.151 7.459 1.00 0.00 C ATOM 858 C ASP A 61 -10.219 -10.910 7.944 1.00 0.00 C ATOM 859 O ASP A 61 -10.757 -10.112 8.710 1.00 0.00 O ATOM 860 CB ASP A 61 -12.010 -12.569 8.495 1.00 0.00 C ATOM 861 CG ASP A 61 -12.980 -13.600 7.954 1.00 0.00 C ATOM 862 OD1 ASP A 61 -13.588 -13.344 6.893 1.00 0.00 O ATOM 863 OD2 ASP A 61 -13.132 -14.664 8.590 1.00 0.00 O ATOM 0 H ASP A 61 -9.563 -13.601 8.033 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.467 -11.907 6.523 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -11.506 -12.974 9.373 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -12.564 -11.690 8.823 1.00 0.00 H new ATOM 868 N GLN A 62 -8.976 -10.755 7.494 1.00 0.00 N ATOM 869 CA GLN A 62 -8.159 -9.611 7.885 1.00 0.00 C ATOM 870 C GLN A 62 -7.872 -8.707 6.689 1.00 0.00 C ATOM 871 O GLN A 62 -7.765 -9.175 5.555 1.00 0.00 O ATOM 872 CB GLN A 62 -6.844 -10.088 8.505 1.00 0.00 C ATOM 873 CG GLN A 62 -6.897 -10.218 10.018 1.00 0.00 C ATOM 874 CD GLN A 62 -6.196 -9.075 10.727 1.00 0.00 C ATOM 875 OE1 GLN A 62 -5.199 -9.405 11.539 1.00 0.00 O flip ATOM 876 NE2 GLN A 62 -6.546 -7.909 10.545 1.00 0.00 N flip ATOM 0 H GLN A 62 -8.514 -11.406 6.859 1.00 0.00 H new ATOM 0 HA GLN A 62 -8.716 -9.035 8.624 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -6.578 -11.054 8.075 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -6.051 -9.390 8.236 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -7.938 -10.256 10.339 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -6.437 -11.161 10.314 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -7.318 -7.701 9.912 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -6.064 -7.151 11.028 1.00 0.00 H new ATOM 885 N GLU A 63 -7.749 -7.408 6.950 1.00 0.00 N ATOM 886 CA GLU A 63 -7.475 -6.436 5.896 1.00 0.00 C ATOM 887 C GLU A 63 -6.358 -5.482 6.308 1.00 0.00 C ATOM 888 O GLU A 63 -6.540 -4.641 7.188 1.00 0.00 O ATOM 889 CB GLU A 63 -8.739 -5.642 5.558 1.00 0.00 C ATOM 890 CG GLU A 63 -9.993 -6.498 5.467 1.00 0.00 C ATOM 891 CD GLU A 63 -10.766 -6.267 4.184 1.00 0.00 C ATOM 892 OE1 GLU A 63 -10.125 -6.119 3.123 1.00 0.00 O ATOM 893 OE2 GLU A 63 -12.014 -6.234 4.240 1.00 0.00 O ATOM 0 H GLU A 63 -7.835 -7.004 7.883 1.00 0.00 H new ATOM 0 HA GLU A 63 -7.152 -6.985 5.011 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -8.889 -4.874 6.317 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -8.591 -5.128 4.608 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -9.716 -7.550 5.535 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.638 -6.282 6.319 1.00 0.00 H new ATOM 900 N HIS A 64 -5.202 -5.618 5.664 1.00 0.00 N ATOM 901 CA HIS A 64 -4.056 -4.766 5.963 1.00 0.00 C ATOM 902 C HIS A 64 -3.535 -4.095 4.696 1.00 0.00 C ATOM 903 O HIS A 64 -3.509 -4.703 3.626 1.00 0.00 O ATOM 904 CB HIS A 64 -2.942 -5.583 6.619 1.00 0.00 C ATOM 905 CG HIS A 64 -3.078 -5.689 8.107 1.00 0.00 C ATOM 906 ND1 HIS A 64 -3.459 -6.726 8.890 1.00 0.00 N flip ATOM 907 CD2 HIS A 64 -2.810 -4.642 8.964 1.00 0.00 C flip ATOM 908 CE1 HIS A 64 -3.414 -6.290 10.192 1.00 0.00 C flip ATOM 909 NE2 HIS A 64 -3.019 -5.031 10.209 1.00 0.00 N flip ATOM 0 H HIS A 64 -5.035 -6.309 4.933 1.00 0.00 H new ATOM 0 HA HIS A 64 -4.381 -3.990 6.656 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -2.936 -6.585 6.190 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -1.980 -5.129 6.381 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -2.481 -3.658 8.664 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -3.662 -6.882 11.061 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -2.896 -4.456 11.042 1.00 0.00 H new ATOM 917 N THR A 65 -3.124 -2.837 4.822 1.00 0.00 N ATOM 918 CA THR A 65 -2.608 -2.085 3.684 1.00 0.00 C ATOM 919 C THR A 65 -1.457 -1.173 4.097 1.00 0.00 C ATOM 920 O THR A 65 -1.400 -0.702 5.233 1.00 0.00 O ATOM 921 CB THR A 65 -3.723 -1.251 3.049 1.00 0.00 C ATOM 922 OG1 THR A 65 -4.591 -0.734 4.039 1.00 0.00 O ATOM 923 CG2 THR A 65 -4.568 -2.030 2.068 1.00 0.00 C ATOM 0 H THR A 65 -3.138 -2.318 5.700 1.00 0.00 H new ATOM 0 HA THR A 65 -2.232 -2.803 2.955 1.00 0.00 H new ATOM 0 HB THR A 65 -3.212 -0.451 2.513 1.00 0.00 H new ATOM 0 HG1 THR A 65 -5.379 -0.340 3.610 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.339 -1.379 1.655 1.00 0.00 H new ATOM 0 HG22 THR A 65 -3.938 -2.403 1.261 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.038 -2.870 2.579 1.00 0.00 H new ATOM 931 N MET A 66 -0.546 -0.926 3.162 1.00 0.00 N ATOM 932 CA MET A 66 0.603 -0.063 3.419 1.00 0.00 C ATOM 933 C MET A 66 1.102 0.566 2.125 1.00 0.00 C ATOM 934 O MET A 66 0.875 0.035 1.039 1.00 0.00 O ATOM 935 CB MET A 66 1.734 -0.852 4.083 1.00 0.00 C ATOM 936 CG MET A 66 2.989 -0.026 4.324 1.00 0.00 C ATOM 937 SD MET A 66 4.099 -0.775 5.530 1.00 0.00 S ATOM 938 CE MET A 66 3.140 -0.594 7.031 1.00 0.00 C ATOM 0 H MET A 66 -0.580 -1.311 2.218 1.00 0.00 H new ATOM 0 HA MET A 66 0.284 0.730 4.095 1.00 0.00 H new ATOM 0 HB2 MET A 66 1.380 -1.247 5.035 1.00 0.00 H new ATOM 0 HB3 MET A 66 1.986 -1.708 3.456 1.00 0.00 H new ATOM 0 HG2 MET A 66 3.519 0.104 3.381 1.00 0.00 H new ATOM 0 HG3 MET A 66 2.703 0.968 4.668 1.00 0.00 H new ATOM 0 HE1 MET A 66 3.377 -1.409 7.715 1.00 0.00 H new ATOM 0 HE2 MET A 66 3.380 0.358 7.504 1.00 0.00 H new ATOM 0 HE3 MET A 66 2.077 -0.621 6.789 1.00 0.00 H new ATOM 948 N TYR A 67 1.788 1.698 2.244 1.00 0.00 N ATOM 949 CA TYR A 67 2.319 2.379 1.073 1.00 0.00 C ATOM 950 C TYR A 67 3.812 2.128 0.930 1.00 0.00 C ATOM 951 O TYR A 67 4.612 2.577 1.751 1.00 0.00 O ATOM 952 CB TYR A 67 2.044 3.881 1.133 1.00 0.00 C ATOM 953 CG TYR A 67 1.747 4.465 -0.225 1.00 0.00 C ATOM 954 CD1 TYR A 67 0.564 4.161 -0.880 1.00 0.00 C ATOM 955 CD2 TYR A 67 2.656 5.299 -0.865 1.00 0.00 C ATOM 956 CE1 TYR A 67 0.295 4.669 -2.132 1.00 0.00 C ATOM 957 CE2 TYR A 67 2.390 5.816 -2.113 1.00 0.00 C ATOM 958 CZ TYR A 67 1.210 5.497 -2.745 1.00 0.00 C ATOM 959 OH TYR A 67 0.948 5.998 -3.999 1.00 0.00 O ATOM 0 H TYR A 67 1.987 2.159 3.132 1.00 0.00 H new ATOM 0 HA TYR A 67 1.810 1.972 0.199 1.00 0.00 H new ATOM 0 HB2 TYR A 67 1.201 4.067 1.798 1.00 0.00 H new ATOM 0 HB3 TYR A 67 2.907 4.389 1.563 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -0.158 3.516 -0.402 1.00 0.00 H new ATOM 0 HD2 TYR A 67 3.586 5.546 -0.375 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -0.630 4.419 -2.631 1.00 0.00 H new ATOM 0 HE2 TYR A 67 3.104 6.469 -2.594 1.00 0.00 H new ATOM 0 HH TYR A 67 1.694 6.565 -4.287 1.00 0.00 H new ATOM 969 N LEU A 68 4.177 1.402 -0.118 1.00 0.00 N ATOM 970 CA LEU A 68 5.571 1.080 -0.376 1.00 0.00 C ATOM 971 C LEU A 68 6.186 2.063 -1.365 1.00 0.00 C ATOM 972 O LEU A 68 5.957 1.970 -2.570 1.00 0.00 O ATOM 973 CB LEU A 68 5.690 -0.348 -0.917 1.00 0.00 C ATOM 974 CG LEU A 68 7.066 -0.722 -1.471 1.00 0.00 C ATOM 975 CD1 LEU A 68 7.392 -2.171 -1.152 1.00 0.00 C ATOM 976 CD2 LEU A 68 7.125 -0.477 -2.974 1.00 0.00 C ATOM 0 H LEU A 68 3.524 1.025 -0.804 1.00 0.00 H new ATOM 0 HA LEU A 68 6.116 1.155 0.565 1.00 0.00 H new ATOM 0 HB2 LEU A 68 5.436 -1.045 -0.118 1.00 0.00 H new ATOM 0 HB3 LEU A 68 4.950 -0.484 -1.705 1.00 0.00 H new ATOM 0 HG LEU A 68 7.813 -0.088 -0.993 1.00 0.00 H new ATOM 0 HD11 LEU A 68 8.374 -2.420 -1.554 1.00 0.00 H new ATOM 0 HD12 LEU A 68 7.395 -2.314 -0.071 1.00 0.00 H new ATOM 0 HD13 LEU A 68 6.641 -2.820 -1.602 1.00 0.00 H new ATOM 0 HD21 LEU A 68 8.112 -0.749 -3.349 1.00 0.00 H new ATOM 0 HD22 LEU A 68 6.368 -1.083 -3.471 1.00 0.00 H new ATOM 0 HD23 LEU A 68 6.937 0.577 -3.178 1.00 0.00 H new ATOM 988 N ASN A 69 6.979 2.997 -0.853 1.00 0.00 N ATOM 989 CA ASN A 69 7.636 3.980 -1.705 1.00 0.00 C ATOM 990 C ASN A 69 9.117 4.060 -1.384 1.00 0.00 C ATOM 991 O ASN A 69 9.520 4.692 -0.407 1.00 0.00 O ATOM 992 CB ASN A 69 6.996 5.360 -1.545 1.00 0.00 C ATOM 993 CG ASN A 69 6.493 5.618 -0.137 1.00 0.00 C ATOM 994 OD1 ASN A 69 6.918 4.966 0.817 1.00 0.00 O ATOM 995 ND2 ASN A 69 5.581 6.574 -0.001 1.00 0.00 N ATOM 0 H ASN A 69 7.182 3.094 0.142 1.00 0.00 H new ATOM 0 HA ASN A 69 7.513 3.658 -2.739 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.725 6.126 -1.811 1.00 0.00 H new ATOM 0 HB3 ASN A 69 6.166 5.453 -2.245 1.00 0.00 H new ATOM 0 HD21 ASN A 69 5.205 6.792 0.922 1.00 0.00 H new ATOM 0 HD22 ASN A 69 5.257 7.090 -0.819 1.00 0.00 H new ATOM 1002 N ALA A 70 9.925 3.412 -2.211 1.00 0.00 N ATOM 1003 CA ALA A 70 11.365 3.409 -2.011 1.00 0.00 C ATOM 1004 C ALA A 70 12.089 2.790 -3.202 1.00 0.00 C ATOM 1005 O ALA A 70 11.458 2.359 -4.169 1.00 0.00 O ATOM 1006 CB ALA A 70 11.710 2.683 -0.721 1.00 0.00 C ATOM 0 H ALA A 70 9.608 2.884 -3.024 1.00 0.00 H new ATOM 0 HA ALA A 70 11.703 4.442 -1.929 1.00 0.00 H new ATOM 0 HB1 ALA A 70 12.791 2.686 -0.580 1.00 0.00 H new ATOM 0 HB2 ALA A 70 11.233 3.187 0.119 1.00 0.00 H new ATOM 0 HB3 ALA A 70 11.354 1.654 -0.776 1.00 0.00 H new ATOM 1012 N LYS A 71 13.415 2.746 -3.121 1.00 0.00 N ATOM 1013 CA LYS A 71 14.231 2.173 -4.185 1.00 0.00 C ATOM 1014 C LYS A 71 15.015 0.966 -3.673 1.00 0.00 C ATOM 1015 O LYS A 71 15.391 0.913 -2.502 1.00 0.00 O ATOM 1016 CB LYS A 71 15.194 3.225 -4.739 1.00 0.00 C ATOM 1017 CG LYS A 71 16.260 3.661 -3.747 1.00 0.00 C ATOM 1018 CD LYS A 71 16.973 4.920 -4.212 1.00 0.00 C ATOM 1019 CE LYS A 71 17.281 5.848 -3.047 1.00 0.00 C ATOM 1020 NZ LYS A 71 17.119 7.280 -3.420 1.00 0.00 N ATOM 0 H LYS A 71 13.948 3.101 -2.327 1.00 0.00 H new ATOM 0 HA LYS A 71 13.568 1.843 -4.984 1.00 0.00 H new ATOM 0 HB2 LYS A 71 15.680 2.826 -5.629 1.00 0.00 H new ATOM 0 HB3 LYS A 71 14.623 4.099 -5.052 1.00 0.00 H new ATOM 0 HG2 LYS A 71 15.802 3.839 -2.774 1.00 0.00 H new ATOM 0 HG3 LYS A 71 16.986 2.858 -3.615 1.00 0.00 H new ATOM 0 HD2 LYS A 71 17.900 4.649 -4.718 1.00 0.00 H new ATOM 0 HD3 LYS A 71 16.353 5.442 -4.941 1.00 0.00 H new ATOM 0 HE2 LYS A 71 16.621 5.614 -2.212 1.00 0.00 H new ATOM 0 HE3 LYS A 71 18.301 5.675 -2.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 17.338 7.880 -2.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 17.767 7.511 -4.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 16.139 7.451 -3.722 1.00 0.00 H new ATOM 1034 N VAL A 72 15.262 0.001 -4.554 1.00 0.00 N ATOM 1035 CA VAL A 72 16.007 -1.199 -4.181 1.00 0.00 C ATOM 1036 C VAL A 72 17.471 -1.082 -4.590 1.00 0.00 C ATOM 1037 O VAL A 72 17.789 -0.531 -5.644 1.00 0.00 O ATOM 1038 CB VAL A 72 15.411 -2.473 -4.817 1.00 0.00 C ATOM 1039 CG1 VAL A 72 14.207 -2.959 -4.025 1.00 0.00 C ATOM 1040 CG2 VAL A 72 15.040 -2.232 -6.273 1.00 0.00 C ATOM 0 H VAL A 72 14.959 0.025 -5.528 1.00 0.00 H new ATOM 0 HA VAL A 72 15.933 -1.283 -3.097 1.00 0.00 H new ATOM 0 HB VAL A 72 16.173 -3.252 -4.789 1.00 0.00 H new ATOM 0 HG11 VAL A 72 13.803 -3.858 -4.491 1.00 0.00 H new ATOM 0 HG12 VAL A 72 14.511 -3.186 -3.003 1.00 0.00 H new ATOM 0 HG13 VAL A 72 13.442 -2.182 -4.012 1.00 0.00 H new ATOM 0 HG21 VAL A 72 14.622 -3.145 -6.698 1.00 0.00 H new ATOM 0 HG22 VAL A 72 14.301 -1.433 -6.333 1.00 0.00 H new ATOM 0 HG23 VAL A 72 15.930 -1.945 -6.833 1.00 0.00 H new ATOM 1050 N GLY A 73 18.358 -1.602 -3.749 1.00 0.00 N ATOM 1051 CA GLY A 73 19.779 -1.545 -4.039 1.00 0.00 C ATOM 1052 C GLY A 73 20.599 -1.114 -2.838 1.00 0.00 C ATOM 1053 O GLY A 73 20.723 -1.857 -1.865 1.00 0.00 O ATOM 0 H GLY A 73 18.118 -2.062 -2.871 1.00 0.00 H new ATOM 0 HA2 GLY A 73 20.118 -2.525 -4.374 1.00 0.00 H new ATOM 0 HA3 GLY A 73 19.951 -0.850 -4.861 1.00 0.00 H new ATOM 1562 N MET A 109 -7.157 0.193 -3.596 1.00 0.00 N ATOM 1563 CA MET A 109 -7.001 1.603 -3.275 1.00 0.00 C ATOM 1564 C MET A 109 -5.636 2.105 -3.732 1.00 0.00 C ATOM 1565 O MET A 109 -4.686 1.332 -3.851 1.00 0.00 O ATOM 1566 CB MET A 109 -7.181 1.815 -1.765 1.00 0.00 C ATOM 1567 CG MET A 109 -6.090 2.644 -1.103 1.00 0.00 C ATOM 1568 SD MET A 109 -6.553 3.219 0.540 1.00 0.00 S ATOM 1569 CE MET A 109 -7.258 4.817 0.146 1.00 0.00 C ATOM 0 HA MET A 109 -7.765 2.175 -3.802 1.00 0.00 H new ATOM 0 HB2 MET A 109 -8.142 2.300 -1.592 1.00 0.00 H new ATOM 0 HB3 MET A 109 -7.224 0.841 -1.278 1.00 0.00 H new ATOM 0 HG2 MET A 109 -5.180 2.048 -1.032 1.00 0.00 H new ATOM 0 HG3 MET A 109 -5.860 3.503 -1.733 1.00 0.00 H new ATOM 0 HE1 MET A 109 -7.463 5.361 1.068 1.00 0.00 H new ATOM 0 HE2 MET A 109 -6.554 5.385 -0.462 1.00 0.00 H new ATOM 0 HE3 MET A 109 -8.187 4.678 -0.408 1.00 0.00 H new ATOM 1579 N SER A 110 -5.546 3.403 -3.974 1.00 0.00 N ATOM 1580 CA SER A 110 -4.297 4.011 -4.402 1.00 0.00 C ATOM 1581 C SER A 110 -4.255 5.480 -3.995 1.00 0.00 C ATOM 1582 O SER A 110 -5.232 6.012 -3.467 1.00 0.00 O ATOM 1583 CB SER A 110 -4.126 3.893 -5.915 1.00 0.00 C ATOM 1584 OG SER A 110 -3.707 2.591 -6.284 1.00 0.00 O ATOM 0 H SER A 110 -6.324 4.056 -3.881 1.00 0.00 H new ATOM 0 HA SER A 110 -3.480 3.480 -3.914 1.00 0.00 H new ATOM 0 HB2 SER A 110 -5.069 4.128 -6.409 1.00 0.00 H new ATOM 0 HB3 SER A 110 -3.395 4.624 -6.259 1.00 0.00 H new ATOM 0 HG SER A 110 -3.870 1.972 -5.542 1.00 0.00 H new ATOM 1590 N VAL A 111 -3.126 6.134 -4.242 1.00 0.00 N ATOM 1591 CA VAL A 111 -2.979 7.542 -3.896 1.00 0.00 C ATOM 1592 C VAL A 111 -2.546 8.367 -5.105 1.00 0.00 C ATOM 1593 O VAL A 111 -1.846 7.875 -5.991 1.00 0.00 O ATOM 1594 CB VAL A 111 -1.985 7.751 -2.722 1.00 0.00 C ATOM 1595 CG1 VAL A 111 -1.957 6.537 -1.804 1.00 0.00 C ATOM 1596 CG2 VAL A 111 -0.582 8.077 -3.221 1.00 0.00 C ATOM 0 H VAL A 111 -2.304 5.715 -4.678 1.00 0.00 H new ATOM 0 HA VAL A 111 -3.960 7.889 -3.570 1.00 0.00 H new ATOM 0 HB VAL A 111 -2.341 8.607 -2.149 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.252 6.712 -0.991 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -2.952 6.369 -1.392 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.647 5.659 -2.371 1.00 0.00 H new ATOM 0 HG21 VAL A 111 0.084 8.216 -2.369 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.215 7.257 -3.838 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.610 8.992 -3.813 1.00 0.00 H new ATOM 1606 N LYS A 112 -2.975 9.622 -5.132 1.00 0.00 N ATOM 1607 CA LYS A 112 -2.647 10.525 -6.227 1.00 0.00 C ATOM 1608 C LYS A 112 -1.514 11.470 -5.840 1.00 0.00 C ATOM 1609 O LYS A 112 -1.272 11.715 -4.658 1.00 0.00 O ATOM 1610 CB LYS A 112 -3.884 11.334 -6.619 1.00 0.00 C ATOM 1611 CG LYS A 112 -3.984 11.613 -8.110 1.00 0.00 C ATOM 1612 CD LYS A 112 -5.429 11.787 -8.548 1.00 0.00 C ATOM 1613 CE LYS A 112 -5.633 11.337 -9.985 1.00 0.00 C ATOM 1614 NZ LYS A 112 -5.446 12.456 -10.950 1.00 0.00 N ATOM 0 H LYS A 112 -3.554 10.039 -4.404 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.317 9.926 -7.076 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -4.776 10.796 -6.298 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -3.873 12.282 -6.081 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -3.419 12.513 -8.352 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -3.530 10.793 -8.666 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -6.081 11.213 -7.890 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -5.717 12.834 -8.449 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -4.931 10.536 -10.218 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.636 10.925 -10.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -5.594 12.107 -11.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -6.132 13.210 -10.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -4.481 12.833 -10.861 1.00 0.00 H new ATOM 1628 N GLU A 113 -0.831 12.009 -6.845 1.00 0.00 N ATOM 1629 CA GLU A 113 0.267 12.940 -6.614 1.00 0.00 C ATOM 1630 C GLU A 113 0.031 14.237 -7.374 1.00 0.00 C ATOM 1631 O GLU A 113 0.161 14.293 -8.596 1.00 0.00 O ATOM 1632 CB GLU A 113 1.604 12.317 -7.025 1.00 0.00 C ATOM 1633 CG GLU A 113 2.425 11.813 -5.850 1.00 0.00 C ATOM 1634 CD GLU A 113 3.916 11.984 -6.064 1.00 0.00 C ATOM 1635 OE1 GLU A 113 4.307 12.905 -6.811 1.00 0.00 O ATOM 1636 OE2 GLU A 113 4.693 11.196 -5.486 1.00 0.00 O ATOM 0 H GLU A 113 -1.019 11.816 -7.829 1.00 0.00 H new ATOM 0 HA GLU A 113 0.307 13.162 -5.548 1.00 0.00 H new ATOM 0 HB2 GLU A 113 1.415 11.489 -7.708 1.00 0.00 H new ATOM 0 HB3 GLU A 113 2.187 13.056 -7.574 1.00 0.00 H new ATOM 0 HG2 GLU A 113 2.128 12.348 -4.948 1.00 0.00 H new ATOM 0 HG3 GLU A 113 2.204 10.759 -5.683 1.00 0.00 H new ATOM 1643 N VAL A 114 -0.333 15.271 -6.632 1.00 0.00 N ATOM 1644 CA VAL A 114 -0.613 16.578 -7.208 1.00 0.00 C ATOM 1645 C VAL A 114 0.444 17.595 -6.792 1.00 0.00 C ATOM 1646 O VAL A 114 1.407 17.255 -6.110 1.00 0.00 O ATOM 1647 CB VAL A 114 -2.007 17.099 -6.795 1.00 0.00 C ATOM 1648 CG1 VAL A 114 -2.573 18.033 -7.854 1.00 0.00 C ATOM 1649 CG2 VAL A 114 -2.968 15.948 -6.543 1.00 0.00 C ATOM 0 H VAL A 114 -0.442 15.229 -5.619 1.00 0.00 H new ATOM 0 HA VAL A 114 -0.593 16.455 -8.291 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.889 17.658 -5.867 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -3.555 18.386 -7.540 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -1.905 18.885 -7.983 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -2.665 17.498 -8.799 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.942 16.344 -6.254 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -3.072 15.356 -7.452 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -2.580 15.319 -5.742 1.00 0.00 H new ATOM 1659 N SER A 115 0.253 18.837 -7.230 1.00 0.00 N ATOM 1660 CA SER A 115 1.165 19.945 -6.945 1.00 0.00 C ATOM 1661 C SER A 115 1.871 19.816 -5.593 1.00 0.00 C ATOM 1662 O SER A 115 1.425 20.374 -4.591 1.00 0.00 O ATOM 1663 CB SER A 115 0.368 21.245 -6.968 1.00 0.00 C ATOM 1664 OG SER A 115 1.113 22.299 -7.551 1.00 0.00 O ATOM 0 H SER A 115 -0.549 19.107 -7.800 1.00 0.00 H new ATOM 0 HA SER A 115 1.942 19.933 -7.709 1.00 0.00 H new ATOM 0 HB2 SER A 115 -0.555 21.097 -7.528 1.00 0.00 H new ATOM 0 HB3 SER A 115 0.084 21.517 -5.951 1.00 0.00 H new ATOM 0 HG SER A 115 0.575 23.118 -7.553 1.00 0.00 H new ATOM 1670 N GLY A 116 2.985 19.093 -5.584 1.00 0.00 N ATOM 1671 CA GLY A 116 3.753 18.919 -4.362 1.00 0.00 C ATOM 1672 C GLY A 116 2.930 18.321 -3.245 1.00 0.00 C ATOM 1673 O GLY A 116 3.214 18.538 -2.068 1.00 0.00 O ATOM 0 H GLY A 116 3.372 18.623 -6.402 1.00 0.00 H new ATOM 0 HA2 GLY A 116 4.610 18.276 -4.563 1.00 0.00 H new ATOM 0 HA3 GLY A 116 4.147 19.884 -4.043 1.00 0.00 H new ATOM 1677 N LYS A 117 1.891 17.587 -3.615 1.00 0.00 N ATOM 1678 CA LYS A 117 1.006 16.978 -2.639 1.00 0.00 C ATOM 1679 C LYS A 117 0.742 15.514 -2.961 1.00 0.00 C ATOM 1680 O LYS A 117 1.068 15.032 -4.046 1.00 0.00 O ATOM 1681 CB LYS A 117 -0.317 17.738 -2.611 1.00 0.00 C ATOM 1682 CG LYS A 117 -0.210 19.144 -2.050 1.00 0.00 C ATOM 1683 CD LYS A 117 -1.462 19.955 -2.350 1.00 0.00 C ATOM 1684 CE LYS A 117 -1.681 20.120 -3.849 1.00 0.00 C ATOM 1685 NZ LYS A 117 -3.050 20.618 -4.162 1.00 0.00 N ATOM 0 H LYS A 117 1.642 17.400 -4.586 1.00 0.00 H new ATOM 0 HA LYS A 117 1.491 17.028 -1.664 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -0.715 17.792 -3.624 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -1.035 17.174 -2.016 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -0.054 19.097 -0.972 1.00 0.00 H new ATOM 0 HG3 LYS A 117 0.660 19.643 -2.477 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -2.329 19.464 -1.908 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -1.380 20.937 -1.884 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -0.942 20.815 -4.249 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -1.521 19.163 -4.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -3.487 20.005 -4.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -3.629 20.607 -3.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -2.991 21.590 -4.527 1.00 0.00 H new ATOM 1699 N VAL A 118 0.133 14.820 -2.009 1.00 0.00 N ATOM 1700 CA VAL A 118 -0.203 13.416 -2.175 1.00 0.00 C ATOM 1701 C VAL A 118 -1.594 13.138 -1.617 1.00 0.00 C ATOM 1702 O VAL A 118 -1.812 13.186 -0.406 1.00 0.00 O ATOM 1703 CB VAL A 118 0.823 12.501 -1.481 1.00 0.00 C ATOM 1704 CG1 VAL A 118 2.211 12.714 -2.068 1.00 0.00 C ATOM 1705 CG2 VAL A 118 0.830 12.742 0.020 1.00 0.00 C ATOM 0 H VAL A 118 -0.139 15.212 -1.108 1.00 0.00 H new ATOM 0 HA VAL A 118 -0.186 13.198 -3.243 1.00 0.00 H new ATOM 0 HB VAL A 118 0.533 11.465 -1.656 1.00 0.00 H new ATOM 0 HG11 VAL A 118 2.923 12.059 -1.566 1.00 0.00 H new ATOM 0 HG12 VAL A 118 2.195 12.483 -3.133 1.00 0.00 H new ATOM 0 HG13 VAL A 118 2.511 13.752 -1.926 1.00 0.00 H new ATOM 0 HG21 VAL A 118 1.562 12.085 0.491 1.00 0.00 H new ATOM 0 HG22 VAL A 118 1.093 13.781 0.221 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -0.159 12.533 0.427 1.00 0.00 H new ATOM 1715 N PHE A 119 -2.535 12.862 -2.509 1.00 0.00 N ATOM 1716 CA PHE A 119 -3.910 12.592 -2.113 1.00 0.00 C ATOM 1717 C PHE A 119 -4.213 11.105 -2.198 1.00 0.00 C ATOM 1718 O PHE A 119 -3.421 10.334 -2.735 1.00 0.00 O ATOM 1719 CB PHE A 119 -4.872 13.393 -2.991 1.00 0.00 C ATOM 1720 CG PHE A 119 -4.549 14.861 -3.019 1.00 0.00 C ATOM 1721 CD1 PHE A 119 -3.404 15.312 -3.650 1.00 0.00 C ATOM 1722 CD2 PHE A 119 -5.382 15.786 -2.410 1.00 0.00 C ATOM 1723 CE1 PHE A 119 -3.091 16.655 -3.675 1.00 0.00 C ATOM 1724 CE2 PHE A 119 -5.075 17.136 -2.432 1.00 0.00 C ATOM 1725 CZ PHE A 119 -3.923 17.571 -3.068 1.00 0.00 C ATOM 0 H PHE A 119 -2.371 12.819 -3.515 1.00 0.00 H new ATOM 0 HA PHE A 119 -4.043 12.901 -1.076 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -4.843 13.000 -4.007 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -5.890 13.256 -2.626 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -2.746 14.603 -4.130 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -6.280 15.450 -1.913 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -2.192 16.990 -4.171 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -5.732 17.848 -1.955 1.00 0.00 H new ATOM 0 HZ PHE A 119 -3.678 18.623 -3.088 1.00 0.00 H new ATOM 1735 N LEU A 120 -5.353 10.702 -1.651 1.00 0.00 N ATOM 1736 CA LEU A 120 -5.738 9.299 -1.655 1.00 0.00 C ATOM 1737 C LEU A 120 -7.111 9.094 -2.293 1.00 0.00 C ATOM 1738 O LEU A 120 -7.877 10.043 -2.479 1.00 0.00 O ATOM 1739 CB LEU A 120 -5.737 8.757 -0.224 1.00 0.00 C ATOM 1740 CG LEU A 120 -4.635 7.748 0.090 1.00 0.00 C ATOM 1741 CD1 LEU A 120 -3.319 8.463 0.357 1.00 0.00 C ATOM 1742 CD2 LEU A 120 -5.026 6.888 1.283 1.00 0.00 C ATOM 0 H LEU A 120 -6.024 11.325 -1.201 1.00 0.00 H new ATOM 0 HA LEU A 120 -5.010 8.752 -2.253 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -5.645 9.597 0.465 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -6.702 8.289 -0.030 1.00 0.00 H new ATOM 0 HG LEU A 120 -4.504 7.098 -0.776 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -2.545 7.729 0.579 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -3.032 9.038 -0.523 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -3.436 9.135 1.207 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -4.230 6.174 1.494 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -5.183 7.524 2.154 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -5.946 6.349 1.057 1.00 0.00 H new ATOM 1754 N GLN A 121 -7.408 7.838 -2.618 1.00 0.00 N ATOM 1755 CA GLN A 121 -8.682 7.475 -3.228 1.00 0.00 C ATOM 1756 C GLN A 121 -9.218 6.190 -2.605 1.00 0.00 C ATOM 1757 O GLN A 121 -8.533 5.167 -2.586 1.00 0.00 O ATOM 1758 CB GLN A 121 -8.518 7.299 -4.739 1.00 0.00 C ATOM 1759 CG GLN A 121 -9.806 6.916 -5.450 1.00 0.00 C ATOM 1760 CD GLN A 121 -9.591 6.609 -6.919 1.00 0.00 C ATOM 1761 OE1 GLN A 121 -8.689 7.155 -7.554 1.00 0.00 O ATOM 1762 NE2 GLN A 121 -10.423 5.730 -7.467 1.00 0.00 N ATOM 0 H GLN A 121 -6.778 7.050 -2.467 1.00 0.00 H new ATOM 0 HA GLN A 121 -9.396 8.278 -3.046 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -8.140 8.228 -5.166 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -7.767 6.532 -4.928 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -10.242 6.045 -4.960 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -10.526 7.729 -5.354 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -11.157 5.302 -6.903 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -10.328 5.483 -8.452 1.00 0.00 H new ATOM 1771 N CYS A 122 -10.438 6.252 -2.084 1.00 0.00 N ATOM 1772 CA CYS A 122 -11.056 5.094 -1.446 1.00 0.00 C ATOM 1773 C CYS A 122 -12.148 4.493 -2.327 1.00 0.00 C ATOM 1774 O CYS A 122 -12.356 4.925 -3.461 1.00 0.00 O ATOM 1775 CB CYS A 122 -11.638 5.500 -0.087 1.00 0.00 C ATOM 1776 SG CYS A 122 -11.689 4.165 1.156 1.00 0.00 S ATOM 0 H CYS A 122 -11.019 7.090 -2.090 1.00 0.00 H new ATOM 0 HA CYS A 122 -10.288 4.334 -1.300 1.00 0.00 H new ATOM 0 HB2 CYS A 122 -11.049 6.326 0.312 1.00 0.00 H new ATOM 0 HB3 CYS A 122 -12.650 5.874 -0.239 1.00 0.00 H new ATOM 1781 N GLN A 123 -12.838 3.487 -1.796 1.00 0.00 N ATOM 1782 CA GLN A 123 -13.904 2.815 -2.522 1.00 0.00 C ATOM 1783 C GLN A 123 -15.268 3.360 -2.108 1.00 0.00 C ATOM 1784 O GLN A 123 -15.582 3.439 -0.920 1.00 0.00 O ATOM 1785 CB GLN A 123 -13.837 1.306 -2.261 1.00 0.00 C ATOM 1786 CG GLN A 123 -14.256 0.903 -0.856 1.00 0.00 C ATOM 1787 CD GLN A 123 -14.230 -0.599 -0.651 1.00 0.00 C ATOM 1788 OE1 GLN A 123 -13.618 -1.098 0.293 1.00 0.00 O ATOM 1789 NE2 GLN A 123 -14.896 -1.328 -1.539 1.00 0.00 N ATOM 0 H GLN A 123 -12.674 3.120 -0.859 1.00 0.00 H new ATOM 0 HA GLN A 123 -13.771 3.002 -3.588 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -14.476 0.794 -2.981 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -12.818 0.962 -2.438 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -13.593 1.377 -0.132 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -15.261 1.276 -0.659 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -15.390 -0.872 -2.306 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -14.914 -2.344 -1.454 1.00 0.00 H new ATOM 1919 N TYR A 132 -15.237 10.040 -0.528 1.00 0.00 N ATOM 1920 CA TYR A 132 -14.142 9.127 -0.220 1.00 0.00 C ATOM 1921 C TYR A 132 -14.119 8.792 1.268 1.00 0.00 C ATOM 1922 O TYR A 132 -14.197 9.681 2.115 1.00 0.00 O ATOM 1923 CB TYR A 132 -12.804 9.743 -0.640 1.00 0.00 C ATOM 1924 CG TYR A 132 -12.552 9.720 -2.135 1.00 0.00 C ATOM 1925 CD1 TYR A 132 -13.597 9.566 -3.041 1.00 0.00 C ATOM 1926 CD2 TYR A 132 -11.265 9.857 -2.640 1.00 0.00 C ATOM 1927 CE1 TYR A 132 -13.365 9.548 -4.403 1.00 0.00 C ATOM 1928 CE2 TYR A 132 -11.026 9.841 -4.001 1.00 0.00 C ATOM 1929 CZ TYR A 132 -12.078 9.686 -4.878 1.00 0.00 C ATOM 1930 OH TYR A 132 -11.843 9.669 -6.233 1.00 0.00 O ATOM 0 HA TYR A 132 -14.299 8.205 -0.779 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -12.767 10.775 -0.292 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -11.997 9.209 -0.138 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -14.607 9.459 -2.673 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -10.437 9.978 -1.957 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -14.188 9.426 -5.092 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -10.019 9.950 -4.376 1.00 0.00 H new ATOM 0 HH TYR A 132 -10.884 9.779 -6.400 1.00 0.00 H new ATOM 1940 N LEU A 133 -14.016 7.504 1.579 1.00 0.00 N ATOM 1941 CA LEU A 133 -13.987 7.054 2.966 1.00 0.00 C ATOM 1942 C LEU A 133 -12.564 7.047 3.517 1.00 0.00 C ATOM 1943 O LEU A 133 -11.670 6.423 2.949 1.00 0.00 O ATOM 1944 CB LEU A 133 -14.595 5.654 3.081 1.00 0.00 C ATOM 1945 CG LEU A 133 -16.043 5.532 2.604 1.00 0.00 C ATOM 1946 CD1 LEU A 133 -16.905 6.628 3.214 1.00 0.00 C ATOM 1947 CD2 LEU A 133 -16.109 5.582 1.085 1.00 0.00 C ATOM 0 H LEU A 133 -13.951 6.754 0.890 1.00 0.00 H new ATOM 0 HA LEU A 133 -14.578 7.754 3.556 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -13.981 4.960 2.507 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -14.545 5.338 4.123 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.433 4.569 2.934 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -17.931 6.523 2.861 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -16.884 6.545 4.301 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -16.518 7.603 2.917 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -17.147 5.494 0.763 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -15.699 6.529 0.734 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -15.529 4.759 0.668 1.00 0.00 H new ATOM 1959 N TRP A 134 -12.363 7.743 4.631 1.00 0.00 N ATOM 1960 CA TRP A 134 -11.051 7.812 5.266 1.00 0.00 C ATOM 1961 C TRP A 134 -11.191 7.835 6.785 1.00 0.00 C ATOM 1962 O TRP A 134 -11.783 8.755 7.348 1.00 0.00 O ATOM 1963 CB TRP A 134 -10.288 9.056 4.784 1.00 0.00 C ATOM 1964 CG TRP A 134 -9.361 9.646 5.803 1.00 0.00 C ATOM 1965 CD1 TRP A 134 -8.165 9.137 6.221 1.00 0.00 C ATOM 1966 CD2 TRP A 134 -9.558 10.861 6.530 1.00 0.00 C ATOM 1967 NE1 TRP A 134 -7.606 9.965 7.164 1.00 0.00 N ATOM 1968 CE2 TRP A 134 -8.443 11.031 7.370 1.00 0.00 C ATOM 1969 CE3 TRP A 134 -10.572 11.823 6.548 1.00 0.00 C ATOM 1970 CZ2 TRP A 134 -8.313 12.125 8.221 1.00 0.00 C ATOM 1971 CZ3 TRP A 134 -10.442 12.909 7.393 1.00 0.00 C ATOM 1972 CH2 TRP A 134 -9.319 13.052 8.219 1.00 0.00 C ATOM 0 H TRP A 134 -13.092 8.268 5.114 1.00 0.00 H new ATOM 0 HA TRP A 134 -10.486 6.924 4.984 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -9.713 8.793 3.896 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -11.009 9.816 4.483 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -7.723 8.219 5.863 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -6.714 9.812 7.634 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -11.440 11.720 5.914 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -7.449 12.238 8.860 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -11.218 13.659 7.417 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -9.246 13.912 8.868 1.00 0.00 H new ATOM 1983 N LYS A 135 -10.631 6.828 7.442 1.00 0.00 N ATOM 1984 CA LYS A 135 -10.684 6.749 8.895 1.00 0.00 C ATOM 1985 C LYS A 135 -9.282 6.550 9.459 1.00 0.00 C ATOM 1986 O LYS A 135 -8.632 5.540 9.193 1.00 0.00 O ATOM 1987 CB LYS A 135 -11.615 5.611 9.331 1.00 0.00 C ATOM 1988 CG LYS A 135 -12.305 5.851 10.665 1.00 0.00 C ATOM 1989 CD LYS A 135 -13.211 4.685 11.042 1.00 0.00 C ATOM 1990 CE LYS A 135 -12.559 3.714 12.023 1.00 0.00 C ATOM 1991 NZ LYS A 135 -11.089 3.925 12.164 1.00 0.00 N ATOM 0 H LYS A 135 -10.136 6.057 6.993 1.00 0.00 H new ATOM 0 HA LYS A 135 -11.083 7.684 9.288 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -12.374 5.462 8.563 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -11.039 4.688 9.393 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -11.555 5.997 11.443 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -12.892 6.768 10.612 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -14.130 5.074 11.481 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -13.493 4.145 10.138 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -13.031 3.822 13.000 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -12.743 2.692 11.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -10.668 3.114 12.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -10.659 4.015 11.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -10.914 4.794 12.708 1.00 0.00 H new ATOM 2005 N LYS A 136 -8.816 7.529 10.229 1.00 0.00 N ATOM 2006 CA LYS A 136 -7.482 7.474 10.818 1.00 0.00 C ATOM 2007 C LYS A 136 -7.522 6.848 12.209 1.00 0.00 C ATOM 2008 O LYS A 136 -8.469 7.056 12.967 1.00 0.00 O ATOM 2009 CB LYS A 136 -6.884 8.881 10.894 1.00 0.00 C ATOM 2010 CG LYS A 136 -5.511 8.937 11.547 1.00 0.00 C ATOM 2011 CD LYS A 136 -5.374 10.148 12.456 1.00 0.00 C ATOM 2012 CE LYS A 136 -5.062 11.407 11.663 1.00 0.00 C ATOM 2013 NZ LYS A 136 -5.077 12.623 12.522 1.00 0.00 N ATOM 0 H LYS A 136 -9.343 8.371 10.460 1.00 0.00 H new ATOM 0 HA LYS A 136 -6.855 6.850 10.182 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -6.812 9.289 9.886 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -7.566 9.525 11.450 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -5.344 8.027 12.124 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -4.741 8.971 10.776 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -6.298 10.290 13.017 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -4.583 9.970 13.184 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -4.084 11.307 11.193 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -5.791 11.520 10.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -4.860 13.459 11.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -6.018 12.734 12.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -4.364 12.527 13.273 1.00 0.00 H new ATOM 2027 N GLY A 137 -6.483 6.087 12.541 1.00 0.00 N ATOM 2028 CA GLY A 137 -6.413 5.443 13.842 1.00 0.00 C ATOM 2029 C GLY A 137 -6.742 6.377 14.996 1.00 0.00 C ATOM 2030 O GLY A 137 -7.142 5.925 16.069 1.00 0.00 O ATOM 0 H GLY A 137 -5.686 5.904 11.931 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -7.103 4.599 13.859 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -5.411 5.039 13.986 1.00 0.00 H new ATOM 2034 N LYS A 138 -6.571 7.680 14.783 1.00 0.00 N ATOM 2035 CA LYS A 138 -6.851 8.665 15.822 1.00 0.00 C ATOM 2036 C LYS A 138 -8.101 9.478 15.493 1.00 0.00 C ATOM 2037 O LYS A 138 -8.768 9.995 16.390 1.00 0.00 O ATOM 2038 CB LYS A 138 -5.653 9.601 16.001 1.00 0.00 C ATOM 2039 CG LYS A 138 -4.677 9.140 17.070 1.00 0.00 C ATOM 2040 CD LYS A 138 -5.306 9.182 18.453 1.00 0.00 C ATOM 2041 CE LYS A 138 -4.869 7.998 19.300 1.00 0.00 C ATOM 2042 NZ LYS A 138 -5.975 7.489 20.157 1.00 0.00 N ATOM 0 H LYS A 138 -6.241 8.076 13.903 1.00 0.00 H new ATOM 0 HA LYS A 138 -7.030 8.127 16.753 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -5.125 9.688 15.051 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -6.015 10.597 16.256 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -4.347 8.125 16.850 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -3.791 9.774 17.053 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -5.028 10.110 18.952 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -6.392 9.183 18.360 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -4.516 7.198 18.650 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -4.029 8.292 19.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -5.636 6.682 20.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -6.295 8.245 20.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -6.767 7.184 19.556 1.00 0.00 H new ATOM 2056 N GLU A 139 -8.413 9.590 14.206 1.00 0.00 N ATOM 2057 CA GLU A 139 -9.581 10.341 13.766 1.00 0.00 C ATOM 2058 C GLU A 139 -10.598 9.410 13.117 1.00 0.00 C ATOM 2059 O GLU A 139 -10.242 8.571 12.290 1.00 0.00 O ATOM 2060 CB GLU A 139 -9.152 11.445 12.789 1.00 0.00 C ATOM 2061 CG GLU A 139 -10.226 11.869 11.790 1.00 0.00 C ATOM 2062 CD GLU A 139 -10.345 13.375 11.667 1.00 0.00 C ATOM 2063 OE1 GLU A 139 -9.297 14.053 11.638 1.00 0.00 O ATOM 2064 OE2 GLU A 139 -11.487 13.877 11.600 1.00 0.00 O ATOM 0 H GLU A 139 -7.872 9.170 13.450 1.00 0.00 H new ATOM 0 HA GLU A 139 -10.053 10.805 14.632 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -8.844 12.319 13.363 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -8.277 11.102 12.237 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -9.995 11.445 10.813 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -11.187 11.456 12.098 1.00 0.00 H new ATOM 2071 N GLU A 140 -11.864 9.561 13.490 1.00 0.00 N ATOM 2072 CA GLU A 140 -12.910 8.723 12.929 1.00 0.00 C ATOM 2073 C GLU A 140 -13.033 8.956 11.422 1.00 0.00 C ATOM 2074 O GLU A 140 -12.089 8.689 10.684 1.00 0.00 O ATOM 2075 CB GLU A 140 -14.245 8.953 13.641 1.00 0.00 C ATOM 2076 CG GLU A 140 -15.297 7.914 13.285 1.00 0.00 C ATOM 2077 CD GLU A 140 -16.580 8.085 14.075 1.00 0.00 C ATOM 2078 OE1 GLU A 140 -17.061 9.232 14.184 1.00 0.00 O ATOM 2079 OE2 GLU A 140 -17.103 7.072 14.585 1.00 0.00 O ATOM 0 H GLU A 140 -12.186 10.249 14.171 1.00 0.00 H new ATOM 0 HA GLU A 140 -12.634 7.681 13.088 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -14.082 8.942 14.719 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -14.620 9.944 13.386 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -15.520 7.979 12.220 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -14.894 6.918 13.466 1.00 0.00 H new ATOM 2086 N LEU A 141 -14.185 9.436 10.949 1.00 0.00 N ATOM 2087 CA LEU A 141 -14.367 9.653 9.523 1.00 0.00 C ATOM 2088 C LEU A 141 -14.458 11.132 9.164 1.00 0.00 C ATOM 2089 O LEU A 141 -14.343 12.011 10.018 1.00 0.00 O ATOM 2090 CB LEU A 141 -15.624 8.927 9.033 1.00 0.00 C ATOM 2091 CG LEU A 141 -15.390 7.517 8.487 1.00 0.00 C ATOM 2092 CD1 LEU A 141 -14.198 7.499 7.541 1.00 0.00 C ATOM 2093 CD2 LEU A 141 -15.177 6.538 9.628 1.00 0.00 C ATOM 0 H LEU A 141 -14.991 9.677 11.526 1.00 0.00 H new ATOM 0 HA LEU A 141 -13.485 9.248 9.026 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -16.334 8.867 9.858 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -16.091 9.529 8.253 1.00 0.00 H new ATOM 0 HG LEU A 141 -16.275 7.213 7.928 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -14.048 6.487 7.164 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -14.386 8.174 6.706 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -13.305 7.823 8.075 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -15.012 5.539 9.224 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -14.308 6.842 10.211 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -16.059 6.529 10.269 1.00 0.00 H new ATOM 2105 N GLY A 142 -14.667 11.377 7.876 1.00 0.00 N ATOM 2106 CA GLY A 142 -14.778 12.726 7.355 1.00 0.00 C ATOM 2107 C GLY A 142 -14.803 12.717 5.840 1.00 0.00 C ATOM 2108 O GLY A 142 -13.806 13.031 5.195 1.00 0.00 O ATOM 0 H GLY A 142 -14.763 10.647 7.170 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -15.686 13.194 7.735 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -13.939 13.326 7.706 1.00 0.00 H new ATOM 2112 N ASN A 143 -15.942 12.324 5.276 1.00 0.00 N ATOM 2113 CA ASN A 143 -16.102 12.229 3.825 1.00 0.00 C ATOM 2114 C ASN A 143 -15.566 13.461 3.099 1.00 0.00 C ATOM 2115 O ASN A 143 -15.761 14.595 3.536 1.00 0.00 O ATOM 2116 CB ASN A 143 -17.575 12.023 3.472 1.00 0.00 C ATOM 2117 CG ASN A 143 -18.485 13.000 4.191 1.00 0.00 C ATOM 2118 OD1 ASN A 143 -18.625 12.952 5.413 1.00 0.00 O ATOM 2119 ND2 ASN A 143 -19.111 13.893 3.433 1.00 0.00 N ATOM 0 H ASN A 143 -16.774 12.064 5.805 1.00 0.00 H new ATOM 0 HA ASN A 143 -15.517 11.372 3.493 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -17.706 12.133 2.396 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -17.867 11.004 3.726 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -19.737 14.575 3.860 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -18.965 13.897 2.423 1.00 0.00 H new ATOM 2126 N MET A 144 -14.894 13.214 1.976 1.00 0.00 N ATOM 2127 CA MET A 144 -14.324 14.281 1.159 1.00 0.00 C ATOM 2128 C MET A 144 -14.189 13.830 -0.293 1.00 0.00 C ATOM 2129 O MET A 144 -13.984 12.647 -0.566 1.00 0.00 O ATOM 2130 CB MET A 144 -12.955 14.699 1.702 1.00 0.00 C ATOM 2131 CG MET A 144 -11.941 13.565 1.743 1.00 0.00 C ATOM 2132 SD MET A 144 -11.570 13.016 3.417 1.00 0.00 S ATOM 2133 CE MET A 144 -12.466 11.466 3.455 1.00 0.00 C ATOM 0 H MET A 144 -14.731 12.276 1.610 1.00 0.00 H new ATOM 0 HA MET A 144 -14.997 15.137 1.201 1.00 0.00 H new ATOM 0 HB2 MET A 144 -12.560 15.506 1.085 1.00 0.00 H new ATOM 0 HB3 MET A 144 -13.080 15.100 2.708 1.00 0.00 H new ATOM 0 HG2 MET A 144 -12.322 12.723 1.166 1.00 0.00 H new ATOM 0 HG3 MET A 144 -11.020 13.891 1.260 1.00 0.00 H new ATOM 0 HE1 MET A 144 -12.580 11.137 4.488 1.00 0.00 H new ATOM 0 HE2 MET A 144 -13.450 11.604 3.007 1.00 0.00 H new ATOM 0 HE3 MET A 144 -11.914 10.713 2.893 1.00 0.00 H new ATOM 2143 N ARG A 145 -14.305 14.775 -1.222 1.00 0.00 N ATOM 2144 CA ARG A 145 -14.194 14.466 -2.646 1.00 0.00 C ATOM 2145 C ARG A 145 -12.870 13.770 -2.947 1.00 0.00 C ATOM 2146 O ARG A 145 -12.829 12.770 -3.664 1.00 0.00 O ATOM 2147 CB ARG A 145 -14.313 15.744 -3.479 1.00 0.00 C ATOM 2148 CG ARG A 145 -15.740 16.077 -3.883 1.00 0.00 C ATOM 2149 CD ARG A 145 -16.384 14.931 -4.647 1.00 0.00 C ATOM 2150 NE ARG A 145 -17.275 15.408 -5.702 1.00 0.00 N ATOM 2151 CZ ARG A 145 -18.417 16.053 -5.473 1.00 0.00 C ATOM 2152 NH1 ARG A 145 -18.809 16.302 -4.230 1.00 0.00 N ATOM 2153 NH2 ARG A 145 -19.168 16.451 -6.490 1.00 0.00 N ATOM 0 H ARG A 145 -14.475 15.759 -1.016 1.00 0.00 H new ATOM 0 HA ARG A 145 -15.009 13.792 -2.912 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -13.901 16.578 -2.910 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -13.705 15.640 -4.378 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -16.329 16.299 -2.993 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -15.744 16.975 -4.500 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -15.606 14.305 -5.085 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -16.945 14.304 -3.954 1.00 0.00 H new ATOM 0 HE ARG A 145 -17.006 15.237 -6.671 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -18.234 15.999 -3.444 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -19.685 16.797 -4.061 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -18.871 16.263 -7.448 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -20.043 16.945 -6.315 1.00 0.00 H new ATOM 2167 N GLN A 146 -11.792 14.303 -2.383 1.00 0.00 N ATOM 2168 CA GLN A 146 -10.462 13.737 -2.573 1.00 0.00 C ATOM 2169 C GLN A 146 -9.763 13.596 -1.228 1.00 0.00 C ATOM 2170 O GLN A 146 -9.762 14.528 -0.424 1.00 0.00 O ATOM 2171 CB GLN A 146 -9.632 14.621 -3.507 1.00 0.00 C ATOM 2172 CG GLN A 146 -9.791 14.270 -4.977 1.00 0.00 C ATOM 2173 CD GLN A 146 -10.696 15.238 -5.713 1.00 0.00 C ATOM 2174 OE1 GLN A 146 -11.310 16.115 -5.106 1.00 0.00 O ATOM 2175 NE2 GLN A 146 -10.784 15.082 -7.029 1.00 0.00 N ATOM 0 H GLN A 146 -11.814 15.131 -1.787 1.00 0.00 H new ATOM 0 HA GLN A 146 -10.563 12.752 -3.028 1.00 0.00 H new ATOM 0 HB2 GLN A 146 -9.918 15.662 -3.358 1.00 0.00 H new ATOM 0 HB3 GLN A 146 -8.580 14.537 -3.234 1.00 0.00 H new ATOM 0 HG2 GLN A 146 -8.810 14.262 -5.453 1.00 0.00 H new ATOM 0 HG3 GLN A 146 -10.196 13.262 -5.064 1.00 0.00 H new ATOM 0 HE21 GLN A 146 -10.257 14.341 -7.491 1.00 0.00 H new ATOM 0 HE22 GLN A 146 -11.379 15.703 -7.578 1.00 0.00 H new ATOM 2184 N LEU A 147 -9.182 12.428 -0.974 1.00 0.00 N ATOM 2185 CA LEU A 147 -8.506 12.194 0.294 1.00 0.00 C ATOM 2186 C LEU A 147 -7.216 13.001 0.398 1.00 0.00 C ATOM 2187 O LEU A 147 -6.209 12.672 -0.228 1.00 0.00 O ATOM 2188 CB LEU A 147 -8.199 10.708 0.484 1.00 0.00 C ATOM 2189 CG LEU A 147 -8.940 10.021 1.637 1.00 0.00 C ATOM 2190 CD1 LEU A 147 -8.371 8.631 1.878 1.00 0.00 C ATOM 2191 CD2 LEU A 147 -8.855 10.855 2.908 1.00 0.00 C ATOM 0 H LEU A 147 -9.166 11.639 -1.621 1.00 0.00 H new ATOM 0 HA LEU A 147 -9.183 12.522 1.083 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -8.439 10.185 -0.441 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -7.127 10.595 0.646 1.00 0.00 H new ATOM 0 HG LEU A 147 -9.990 9.927 1.360 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -8.907 8.156 2.699 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.484 8.030 0.975 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -7.314 8.710 2.132 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -9.388 10.348 3.712 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -7.810 10.984 3.190 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -9.306 11.832 2.733 1.00 0.00 H new ATOM 2203 N ASP A 148 -7.254 14.043 1.214 1.00 0.00 N ATOM 2204 CA ASP A 148 -6.092 14.890 1.437 1.00 0.00 C ATOM 2205 C ASP A 148 -5.839 15.031 2.933 1.00 0.00 C ATOM 2206 O ASP A 148 -6.396 15.911 3.588 1.00 0.00 O ATOM 2207 CB ASP A 148 -6.304 16.268 0.807 1.00 0.00 C ATOM 2208 CG ASP A 148 -4.998 16.998 0.559 1.00 0.00 C ATOM 2209 OD1 ASP A 148 -3.946 16.328 0.504 1.00 0.00 O ATOM 2210 OD2 ASP A 148 -5.029 18.239 0.420 1.00 0.00 O ATOM 0 H ASP A 148 -8.084 14.324 1.737 1.00 0.00 H new ATOM 0 HA ASP A 148 -5.224 14.427 0.968 1.00 0.00 H new ATOM 0 HB2 ASP A 148 -6.838 16.155 -0.136 1.00 0.00 H new ATOM 0 HB3 ASP A 148 -6.935 16.870 1.461 1.00 0.00 H new ATOM 2215 N LEU A 149 -5.002 14.149 3.468 1.00 0.00 N ATOM 2216 CA LEU A 149 -4.682 14.162 4.891 1.00 0.00 C ATOM 2217 C LEU A 149 -3.177 14.304 5.101 1.00 0.00 C ATOM 2218 O LEU A 149 -2.628 13.817 6.089 1.00 0.00 O ATOM 2219 CB LEU A 149 -5.192 12.881 5.576 1.00 0.00 C ATOM 2220 CG LEU A 149 -6.337 12.151 4.855 1.00 0.00 C ATOM 2221 CD1 LEU A 149 -7.455 13.123 4.505 1.00 0.00 C ATOM 2222 CD2 LEU A 149 -5.814 11.452 3.608 1.00 0.00 C ATOM 0 H LEU A 149 -4.532 13.415 2.937 1.00 0.00 H new ATOM 0 HA LEU A 149 -5.181 15.020 5.342 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -4.356 12.190 5.683 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -5.525 13.137 6.582 1.00 0.00 H new ATOM 0 HG LEU A 149 -6.746 11.395 5.525 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -8.256 12.588 3.995 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -7.844 13.575 5.418 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -7.067 13.904 3.851 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -6.635 10.939 3.107 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -5.381 12.189 2.932 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -5.051 10.726 3.891 1.00 0.00 H new ATOM 2234 N GLY A 150 -2.517 14.977 4.162 1.00 0.00 N ATOM 2235 CA GLY A 150 -1.082 15.173 4.259 1.00 0.00 C ATOM 2236 C GLY A 150 -0.477 15.691 2.968 1.00 0.00 C ATOM 2237 O GLY A 150 -1.146 15.740 1.935 1.00 0.00 O ATOM 0 H GLY A 150 -2.951 15.390 3.336 1.00 0.00 H new ATOM 0 HA2 GLY A 150 -0.868 15.876 5.064 1.00 0.00 H new ATOM 0 HA3 GLY A 150 -0.607 14.229 4.526 1.00 0.00 H new ATOM 2241 N ALA A 151 0.793 16.077 3.027 1.00 0.00 N ATOM 2242 CA ALA A 151 1.496 16.593 1.858 1.00 0.00 C ATOM 2243 C ALA A 151 2.577 15.626 1.402 1.00 0.00 C ATOM 2244 O ALA A 151 2.917 14.683 2.109 1.00 0.00 O ATOM 2245 CB ALA A 151 2.108 17.947 2.168 1.00 0.00 C ATOM 0 H ALA A 151 1.358 16.042 3.875 1.00 0.00 H new ATOM 0 HA ALA A 151 0.773 16.705 1.050 1.00 0.00 H new ATOM 0 HB1 ALA A 151 2.630 18.321 1.287 1.00 0.00 H new ATOM 0 HB2 ALA A 151 1.320 18.647 2.447 1.00 0.00 H new ATOM 0 HB3 ALA A 151 2.814 17.847 2.992 1.00 0.00 H new ATOM 2251 N ILE A 152 3.120 15.866 0.217 1.00 0.00 N ATOM 2252 CA ILE A 152 4.164 15.008 -0.319 1.00 0.00 C ATOM 2253 C ILE A 152 5.412 15.052 0.558 1.00 0.00 C ATOM 2254 O ILE A 152 5.996 14.017 0.877 1.00 0.00 O ATOM 2255 CB ILE A 152 4.528 15.400 -1.763 1.00 0.00 C ATOM 2256 CG1 ILE A 152 5.301 14.265 -2.428 1.00 0.00 C ATOM 2257 CG2 ILE A 152 5.331 16.694 -1.798 1.00 0.00 C ATOM 2258 CD1 ILE A 152 5.082 14.183 -3.919 1.00 0.00 C ATOM 0 H ILE A 152 2.856 16.644 -0.388 1.00 0.00 H new ATOM 0 HA ILE A 152 3.773 13.991 -0.326 1.00 0.00 H new ATOM 0 HB ILE A 152 3.605 15.572 -2.317 1.00 0.00 H new ATOM 0 HG12 ILE A 152 6.365 14.396 -2.231 1.00 0.00 H new ATOM 0 HG13 ILE A 152 5.007 13.319 -1.973 1.00 0.00 H new ATOM 0 HG21 ILE A 152 5.573 16.944 -2.831 1.00 0.00 H new ATOM 0 HG22 ILE A 152 4.743 17.499 -1.358 1.00 0.00 H new ATOM 0 HG23 ILE A 152 6.253 16.566 -1.230 1.00 0.00 H new ATOM 0 HD11 ILE A 152 5.661 13.354 -4.327 1.00 0.00 H new ATOM 0 HD12 ILE A 152 4.024 14.021 -4.123 1.00 0.00 H new ATOM 0 HD13 ILE A 152 5.403 15.114 -4.386 1.00 0.00 H new ATOM 2270 N TYR A 153 5.804 16.257 0.955 1.00 0.00 N ATOM 2271 CA TYR A 153 6.970 16.438 1.807 1.00 0.00 C ATOM 2272 C TYR A 153 6.578 16.247 3.267 1.00 0.00 C ATOM 2273 O TYR A 153 7.346 15.713 4.068 1.00 0.00 O ATOM 2274 CB TYR A 153 7.572 17.827 1.590 1.00 0.00 C ATOM 2275 CG TYR A 153 6.667 18.958 2.025 1.00 0.00 C ATOM 2276 CD1 TYR A 153 5.686 19.453 1.175 1.00 0.00 C ATOM 2277 CD2 TYR A 153 6.793 19.530 3.284 1.00 0.00 C ATOM 2278 CE1 TYR A 153 4.857 20.487 1.568 1.00 0.00 C ATOM 2279 CE2 TYR A 153 5.968 20.563 3.685 1.00 0.00 C ATOM 2280 CZ TYR A 153 5.001 21.038 2.824 1.00 0.00 C ATOM 2281 OH TYR A 153 4.178 22.067 3.219 1.00 0.00 O ATOM 0 H TYR A 153 5.330 17.123 0.699 1.00 0.00 H new ATOM 0 HA TYR A 153 7.722 15.693 1.546 1.00 0.00 H new ATOM 0 HB2 TYR A 153 8.512 17.895 2.137 1.00 0.00 H new ATOM 0 HB3 TYR A 153 7.809 17.949 0.533 1.00 0.00 H new ATOM 0 HD1 TYR A 153 5.569 19.023 0.191 1.00 0.00 H new ATOM 0 HD2 TYR A 153 7.549 19.161 3.961 1.00 0.00 H new ATOM 0 HE1 TYR A 153 4.100 20.862 0.895 1.00 0.00 H new ATOM 0 HE2 TYR A 153 6.080 20.996 4.668 1.00 0.00 H new ATOM 0 HH TYR A 153 4.410 22.340 4.131 1.00 0.00 H new ATOM 2291 N ASP A 154 5.360 16.668 3.594 1.00 0.00 N ATOM 2292 CA ASP A 154 4.831 16.529 4.943 1.00 0.00 C ATOM 2293 C ASP A 154 3.796 15.410 4.973 1.00 0.00 C ATOM 2294 O ASP A 154 2.693 15.578 5.494 1.00 0.00 O ATOM 2295 CB ASP A 154 4.203 17.844 5.410 1.00 0.00 C ATOM 2296 CG ASP A 154 4.320 18.040 6.909 1.00 0.00 C ATOM 2297 OD1 ASP A 154 4.345 17.028 7.640 1.00 0.00 O ATOM 2298 OD2 ASP A 154 4.385 19.207 7.352 1.00 0.00 O ATOM 0 H ASP A 154 4.718 17.111 2.937 1.00 0.00 H new ATOM 0 HA ASP A 154 5.648 16.280 5.620 1.00 0.00 H new ATOM 0 HB2 ASP A 154 4.687 18.676 4.899 1.00 0.00 H new ATOM 0 HB3 ASP A 154 3.151 17.863 5.125 1.00 0.00 H new ATOM 2303 N ASP A 155 4.170 14.273 4.387 1.00 0.00 N ATOM 2304 CA ASP A 155 3.302 13.098 4.304 1.00 0.00 C ATOM 2305 C ASP A 155 2.410 12.942 5.532 1.00 0.00 C ATOM 2306 O ASP A 155 2.764 13.367 6.631 1.00 0.00 O ATOM 2307 CB ASP A 155 4.150 11.843 4.110 1.00 0.00 C ATOM 2308 CG ASP A 155 5.050 11.562 5.297 1.00 0.00 C ATOM 2309 OD1 ASP A 155 5.516 12.531 5.933 1.00 0.00 O ATOM 2310 OD2 ASP A 155 5.290 10.372 5.591 1.00 0.00 O ATOM 0 H ASP A 155 5.085 14.140 3.956 1.00 0.00 H new ATOM 0 HA ASP A 155 2.644 13.239 3.447 1.00 0.00 H new ATOM 0 HB2 ASP A 155 3.495 10.988 3.944 1.00 0.00 H new ATOM 0 HB3 ASP A 155 4.760 11.956 3.214 1.00 0.00 H new ATOM 2315 N PRO A 156 1.230 12.323 5.348 1.00 0.00 N ATOM 2316 CA PRO A 156 0.267 12.098 6.424 1.00 0.00 C ATOM 2317 C PRO A 156 0.929 11.608 7.698 1.00 0.00 C ATOM 2318 O PRO A 156 0.514 11.952 8.804 1.00 0.00 O ATOM 2319 CB PRO A 156 -0.685 11.031 5.850 1.00 0.00 C ATOM 2320 CG PRO A 156 -0.115 10.639 4.520 1.00 0.00 C ATOM 2321 CD PRO A 156 0.739 11.788 4.076 1.00 0.00 C ATOM 0 HA PRO A 156 -0.243 13.018 6.711 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -0.752 10.170 6.515 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -1.694 11.428 5.740 1.00 0.00 H new ATOM 0 HG2 PRO A 156 0.474 9.726 4.603 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -0.909 10.442 3.799 1.00 0.00 H new ATOM 0 HD2 PRO A 156 1.554 11.463 3.430 1.00 0.00 H new ATOM 0 HD3 PRO A 156 0.166 12.528 3.518 1.00 0.00 H new ATOM 2329 N ARG A 157 1.965 10.808 7.530 1.00 0.00 N ATOM 2330 CA ARG A 157 2.704 10.265 8.655 1.00 0.00 C ATOM 2331 C ARG A 157 1.765 9.634 9.676 1.00 0.00 C ATOM 2332 O ARG A 157 2.081 9.559 10.863 1.00 0.00 O ATOM 2333 CB ARG A 157 3.543 11.357 9.320 1.00 0.00 C ATOM 2334 CG ARG A 157 4.719 11.820 8.475 1.00 0.00 C ATOM 2335 CD ARG A 157 5.955 12.068 9.325 1.00 0.00 C ATOM 2336 NE ARG A 157 6.914 12.943 8.654 1.00 0.00 N ATOM 2337 CZ ARG A 157 8.198 13.034 8.995 1.00 0.00 C ATOM 2338 NH1 ARG A 157 8.680 12.309 9.997 1.00 0.00 N ATOM 2339 NH2 ARG A 157 9.002 13.854 8.332 1.00 0.00 N ATOM 0 H ARG A 157 2.316 10.518 6.617 1.00 0.00 H new ATOM 0 HA ARG A 157 3.368 9.489 8.275 1.00 0.00 H new ATOM 0 HB2 ARG A 157 2.904 12.213 9.538 1.00 0.00 H new ATOM 0 HB3 ARG A 157 3.916 10.986 10.275 1.00 0.00 H new ATOM 0 HG2 ARG A 157 4.942 11.068 7.718 1.00 0.00 H new ATOM 0 HG3 ARG A 157 4.450 12.735 7.947 1.00 0.00 H new ATOM 0 HD2 ARG A 157 5.659 12.515 10.274 1.00 0.00 H new ATOM 0 HD3 ARG A 157 6.433 11.116 9.556 1.00 0.00 H new ATOM 0 HE ARG A 157 6.581 13.517 7.880 1.00 0.00 H new ATOM 0 HH11 ARG A 157 8.066 11.677 10.511 1.00 0.00 H new ATOM 0 HH12 ARG A 157 9.665 12.384 10.253 1.00 0.00 H new ATOM 0 HH21 ARG A 157 8.637 14.414 7.562 1.00 0.00 H new ATOM 0 HH22 ARG A 157 9.986 13.925 8.592 1.00 0.00 H new ATOM 2353 N GLY A 158 0.607 9.182 9.205 1.00 0.00 N ATOM 2354 CA GLY A 158 -0.356 8.566 10.091 1.00 0.00 C ATOM 2355 C GLY A 158 -1.082 7.407 9.442 1.00 0.00 C ATOM 2356 O GLY A 158 -1.549 7.514 8.308 1.00 0.00 O ATOM 0 H GLY A 158 0.321 9.232 8.227 1.00 0.00 H new ATOM 0 HA2 GLY A 158 0.153 8.215 10.988 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -1.083 9.314 10.409 1.00 0.00 H new ATOM 2360 N THR A 159 -1.177 6.295 10.161 1.00 0.00 N ATOM 2361 CA THR A 159 -1.851 5.111 9.646 1.00 0.00 C ATOM 2362 C THR A 159 -3.350 5.357 9.511 1.00 0.00 C ATOM 2363 O THR A 159 -4.039 5.617 10.500 1.00 0.00 O ATOM 2364 CB THR A 159 -1.599 3.915 10.566 1.00 0.00 C ATOM 2365 OG1 THR A 159 -2.128 2.728 10.003 1.00 0.00 O ATOM 2366 CG2 THR A 159 -2.204 4.080 11.944 1.00 0.00 C ATOM 0 H THR A 159 -0.796 6.189 11.101 1.00 0.00 H new ATOM 0 HA THR A 159 -1.446 4.892 8.658 1.00 0.00 H new ATOM 0 HB THR A 159 -0.516 3.854 10.668 1.00 0.00 H new ATOM 0 HG1 THR A 159 -1.955 1.975 10.606 1.00 0.00 H new ATOM 0 HG21 THR A 159 -1.988 3.196 12.544 1.00 0.00 H new ATOM 0 HG22 THR A 159 -1.777 4.960 12.426 1.00 0.00 H new ATOM 0 HG23 THR A 159 -3.283 4.203 11.855 1.00 0.00 H new ATOM 2374 N TYR A 160 -3.853 5.266 8.283 1.00 0.00 N ATOM 2375 CA TYR A 160 -5.272 5.473 8.032 1.00 0.00 C ATOM 2376 C TYR A 160 -5.935 4.188 7.564 1.00 0.00 C ATOM 2377 O TYR A 160 -5.266 3.204 7.258 1.00 0.00 O ATOM 2378 CB TYR A 160 -5.505 6.567 6.989 1.00 0.00 C ATOM 2379 CG TYR A 160 -4.707 7.831 7.210 1.00 0.00 C ATOM 2380 CD1 TYR A 160 -4.266 8.195 8.475 1.00 0.00 C ATOM 2381 CD2 TYR A 160 -4.404 8.667 6.143 1.00 0.00 C ATOM 2382 CE1 TYR A 160 -3.544 9.357 8.671 1.00 0.00 C ATOM 2383 CE2 TYR A 160 -3.684 9.830 6.330 1.00 0.00 C ATOM 2384 CZ TYR A 160 -3.256 10.171 7.596 1.00 0.00 C ATOM 2385 OH TYR A 160 -2.541 11.331 7.790 1.00 0.00 O ATOM 0 H TYR A 160 -3.301 5.052 7.452 1.00 0.00 H new ATOM 0 HA TYR A 160 -5.718 5.787 8.976 1.00 0.00 H new ATOM 0 HB2 TYR A 160 -5.263 6.168 6.004 1.00 0.00 H new ATOM 0 HB3 TYR A 160 -6.565 6.820 6.979 1.00 0.00 H new ATOM 0 HD1 TYR A 160 -4.491 7.560 9.319 1.00 0.00 H new ATOM 0 HD2 TYR A 160 -4.737 8.403 5.150 1.00 0.00 H new ATOM 0 HE1 TYR A 160 -3.207 9.626 9.661 1.00 0.00 H new ATOM 0 HE2 TYR A 160 -3.457 10.469 5.490 1.00 0.00 H new ATOM 0 HH TYR A 160 -1.933 11.217 8.550 1.00 0.00 H new ATOM 2395 N THR A 161 -7.258 4.215 7.505 1.00 0.00 N ATOM 2396 CA THR A 161 -8.032 3.065 7.067 1.00 0.00 C ATOM 2397 C THR A 161 -8.992 3.478 5.957 1.00 0.00 C ATOM 2398 O THR A 161 -9.613 4.539 6.027 1.00 0.00 O ATOM 2399 CB THR A 161 -8.795 2.465 8.247 1.00 0.00 C ATOM 2400 OG1 THR A 161 -7.940 2.307 9.366 1.00 0.00 O ATOM 2401 CG2 THR A 161 -9.405 1.115 7.945 1.00 0.00 C ATOM 0 H THR A 161 -7.821 5.028 7.757 1.00 0.00 H new ATOM 0 HA THR A 161 -7.355 2.306 6.675 1.00 0.00 H new ATOM 0 HB THR A 161 -9.600 3.169 8.457 1.00 0.00 H new ATOM 0 HG1 THR A 161 -8.446 1.923 10.113 1.00 0.00 H new ATOM 0 HG21 THR A 161 -9.931 0.748 8.826 1.00 0.00 H new ATOM 0 HG22 THR A 161 -10.107 1.210 7.117 1.00 0.00 H new ATOM 0 HG23 THR A 161 -8.617 0.412 7.674 1.00 0.00 H new ATOM 2409 N CYS A 162 -9.098 2.649 4.926 1.00 0.00 N ATOM 2410 CA CYS A 162 -9.971 2.951 3.798 1.00 0.00 C ATOM 2411 C CYS A 162 -10.786 1.724 3.389 1.00 0.00 C ATOM 2412 O CYS A 162 -10.246 0.630 3.221 1.00 0.00 O ATOM 2413 CB CYS A 162 -9.133 3.473 2.625 1.00 0.00 C ATOM 2414 SG CYS A 162 -9.887 3.251 0.980 1.00 0.00 S ATOM 0 H CYS A 162 -8.593 1.766 4.847 1.00 0.00 H new ATOM 0 HA CYS A 162 -10.678 3.724 4.097 1.00 0.00 H new ATOM 0 HB2 CYS A 162 -8.941 4.535 2.780 1.00 0.00 H new ATOM 0 HB3 CYS A 162 -8.167 2.969 2.636 1.00 0.00 H new ATOM 2419 N GLN A 163 -12.091 1.923 3.233 1.00 0.00 N ATOM 2420 CA GLN A 163 -12.999 0.849 2.847 1.00 0.00 C ATOM 2421 C GLN A 163 -14.379 1.409 2.517 1.00 0.00 C ATOM 2422 O GLN A 163 -14.674 2.568 2.808 1.00 0.00 O ATOM 2423 CB GLN A 163 -13.103 -0.196 3.960 1.00 0.00 C ATOM 2424 CG GLN A 163 -13.131 -1.627 3.450 1.00 0.00 C ATOM 2425 CD GLN A 163 -12.777 -2.636 4.525 1.00 0.00 C ATOM 2426 OE1 GLN A 163 -13.485 -2.771 5.523 1.00 0.00 O ATOM 2427 NE2 GLN A 163 -11.675 -3.350 4.326 1.00 0.00 N ATOM 0 H GLN A 163 -12.546 2.826 3.369 1.00 0.00 H new ATOM 0 HA GLN A 163 -12.597 0.366 1.956 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -12.258 -0.077 4.638 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -14.006 -0.008 4.540 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -14.124 -1.850 3.060 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -12.432 -1.727 2.619 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -11.118 -3.205 3.484 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -11.385 -4.044 5.015 1.00 0.00 H new ATOM 2436 N ARG A 164 -15.217 0.582 1.904 1.00 0.00 N ATOM 2437 CA ARG A 164 -16.565 0.996 1.526 1.00 0.00 C ATOM 2438 C ARG A 164 -17.463 1.233 2.744 1.00 0.00 C ATOM 2439 O ARG A 164 -18.610 1.654 2.592 1.00 0.00 O ATOM 2440 CB ARG A 164 -17.203 -0.056 0.616 1.00 0.00 C ATOM 2441 CG ARG A 164 -17.246 -1.446 1.231 1.00 0.00 C ATOM 2442 CD ARG A 164 -18.664 -1.993 1.279 1.00 0.00 C ATOM 2443 NE ARG A 164 -18.852 -2.932 2.383 1.00 0.00 N ATOM 2444 CZ ARG A 164 -18.467 -4.206 2.347 1.00 0.00 C ATOM 2445 NH1 ARG A 164 -17.872 -4.696 1.266 1.00 0.00 N ATOM 2446 NH2 ARG A 164 -18.676 -4.992 3.394 1.00 0.00 N ATOM 0 H ARG A 164 -14.988 -0.381 1.657 1.00 0.00 H new ATOM 0 HA ARG A 164 -16.472 1.942 0.993 1.00 0.00 H new ATOM 0 HB2 ARG A 164 -18.218 0.255 0.371 1.00 0.00 H new ATOM 0 HB3 ARG A 164 -16.648 -0.099 -0.321 1.00 0.00 H new ATOM 0 HG2 ARG A 164 -16.615 -2.120 0.652 1.00 0.00 H new ATOM 0 HG3 ARG A 164 -16.834 -1.411 2.240 1.00 0.00 H new ATOM 0 HD2 ARG A 164 -19.368 -1.167 1.382 1.00 0.00 H new ATOM 0 HD3 ARG A 164 -18.892 -2.491 0.337 1.00 0.00 H new ATOM 0 HE ARG A 164 -19.305 -2.591 3.231 1.00 0.00 H new ATOM 0 HH11 ARG A 164 -17.708 -4.096 0.458 1.00 0.00 H new ATOM 0 HH12 ARG A 164 -17.579 -5.673 1.244 1.00 0.00 H new ATOM 0 HH21 ARG A 164 -19.132 -4.621 4.227 1.00 0.00 H new ATOM 0 HH22 ARG A 164 -18.381 -5.968 3.366 1.00 0.00 H new ATOM 2460 N ASP A 165 -16.956 0.965 3.948 1.00 0.00 N ATOM 2461 CA ASP A 165 -17.750 1.161 5.158 1.00 0.00 C ATOM 2462 C ASP A 165 -17.244 2.356 5.957 1.00 0.00 C ATOM 2463 O ASP A 165 -16.155 2.866 5.704 1.00 0.00 O ATOM 2464 CB ASP A 165 -17.714 -0.096 6.031 1.00 0.00 C ATOM 2465 CG ASP A 165 -17.849 -1.372 5.221 1.00 0.00 C ATOM 2466 OD1 ASP A 165 -16.860 -1.768 4.569 1.00 0.00 O ATOM 2467 OD2 ASP A 165 -18.943 -1.973 5.239 1.00 0.00 O ATOM 0 H ASP A 165 -16.011 0.616 4.109 1.00 0.00 H new ATOM 0 HA ASP A 165 -18.778 1.357 4.854 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -16.777 -0.121 6.588 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -18.519 -0.048 6.764 1.00 0.00 H new ATOM 2472 N GLU A 166 -18.039 2.793 6.930 1.00 0.00 N ATOM 2473 CA GLU A 166 -17.661 3.921 7.772 1.00 0.00 C ATOM 2474 C GLU A 166 -16.451 3.556 8.622 1.00 0.00 C ATOM 2475 O GLU A 166 -15.364 4.102 8.442 1.00 0.00 O ATOM 2476 CB GLU A 166 -18.829 4.336 8.668 1.00 0.00 C ATOM 2477 CG GLU A 166 -18.925 5.837 8.887 1.00 0.00 C ATOM 2478 CD GLU A 166 -19.800 6.198 10.071 1.00 0.00 C ATOM 2479 OE1 GLU A 166 -19.404 5.895 11.216 1.00 0.00 O ATOM 2480 OE2 GLU A 166 -20.882 6.784 9.853 1.00 0.00 O ATOM 0 H GLU A 166 -18.946 2.384 7.153 1.00 0.00 H new ATOM 0 HA GLU A 166 -17.402 4.763 7.130 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -19.760 3.982 8.225 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -18.728 3.842 9.634 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -17.925 6.243 9.042 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -19.324 6.307 7.988 1.00 0.00 H new ATOM 2487 N ASN A 167 -16.645 2.609 9.532 1.00 0.00 N ATOM 2488 CA ASN A 167 -15.573 2.138 10.407 1.00 0.00 C ATOM 2489 C ASN A 167 -14.616 1.223 9.646 1.00 0.00 C ATOM 2490 O ASN A 167 -14.226 0.168 10.146 1.00 0.00 O ATOM 2491 CB ASN A 167 -16.149 1.397 11.609 1.00 0.00 C ATOM 2492 CG ASN A 167 -17.285 2.154 12.269 1.00 0.00 C ATOM 2493 OD1 ASN A 167 -18.268 2.510 11.620 1.00 0.00 O ATOM 2494 ND2 ASN A 167 -17.155 2.403 13.567 1.00 0.00 N ATOM 0 H ASN A 167 -17.542 2.148 9.685 1.00 0.00 H new ATOM 0 HA ASN A 167 -15.020 3.009 10.759 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -16.506 0.418 11.291 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -15.358 1.226 12.339 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -17.888 2.908 14.065 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -16.322 2.089 14.066 1.00 0.00 H new ATOM 2501 N VAL A 168 -14.262 1.645 8.433 1.00 0.00 N ATOM 2502 CA VAL A 168 -13.356 0.912 7.543 1.00 0.00 C ATOM 2503 C VAL A 168 -12.442 -0.062 8.285 1.00 0.00 C ATOM 2504 O VAL A 168 -12.095 0.148 9.447 1.00 0.00 O ATOM 2505 CB VAL A 168 -12.483 1.906 6.769 1.00 0.00 C ATOM 2506 CG1 VAL A 168 -13.305 2.616 5.710 1.00 0.00 C ATOM 2507 CG2 VAL A 168 -11.868 2.908 7.730 1.00 0.00 C ATOM 0 H VAL A 168 -14.601 2.520 8.032 1.00 0.00 H new ATOM 0 HA VAL A 168 -13.985 0.328 6.871 1.00 0.00 H new ATOM 0 HB VAL A 168 -11.681 1.362 6.270 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -12.672 3.319 5.168 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -13.712 1.883 5.013 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -14.123 3.157 6.186 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -11.249 3.612 7.174 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -12.660 3.450 8.246 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -11.253 2.382 8.460 1.00 0.00 H new ATOM 2517 N ASN A 169 -12.065 -1.134 7.599 1.00 0.00 N ATOM 2518 CA ASN A 169 -11.210 -2.156 8.185 1.00 0.00 C ATOM 2519 C ASN A 169 -9.807 -2.150 7.576 1.00 0.00 C ATOM 2520 O ASN A 169 -8.820 -2.377 8.277 1.00 0.00 O ATOM 2521 CB ASN A 169 -11.857 -3.523 7.989 1.00 0.00 C ATOM 2522 CG ASN A 169 -11.322 -4.564 8.953 1.00 0.00 C ATOM 2523 OD1 ASN A 169 -10.236 -5.109 8.756 1.00 0.00 O ATOM 2524 ND2 ASN A 169 -12.086 -4.846 10.002 1.00 0.00 N ATOM 0 H ASN A 169 -12.339 -1.317 6.634 1.00 0.00 H new ATOM 0 HA ASN A 169 -11.102 -1.938 9.248 1.00 0.00 H new ATOM 0 HB2 ASN A 169 -12.935 -3.433 8.119 1.00 0.00 H new ATOM 0 HB3 ASN A 169 -11.686 -3.858 6.966 1.00 0.00 H new ATOM 0 HD21 ASN A 169 -11.779 -5.539 10.685 1.00 0.00 H new ATOM 0 HD22 ASN A 169 -12.979 -4.369 10.125 1.00 0.00 H new ATOM 2531 N SER A 170 -9.720 -1.897 6.274 1.00 0.00 N ATOM 2532 CA SER A 170 -8.432 -1.874 5.586 1.00 0.00 C ATOM 2533 C SER A 170 -7.580 -0.703 6.068 1.00 0.00 C ATOM 2534 O SER A 170 -7.838 0.447 5.716 1.00 0.00 O ATOM 2535 CB SER A 170 -8.642 -1.779 4.072 1.00 0.00 C ATOM 2536 OG SER A 170 -7.942 -2.809 3.395 1.00 0.00 O ATOM 0 H SER A 170 -10.523 -1.705 5.675 1.00 0.00 H new ATOM 0 HA SER A 170 -7.907 -2.801 5.816 1.00 0.00 H new ATOM 0 HB2 SER A 170 -9.706 -1.847 3.844 1.00 0.00 H new ATOM 0 HB3 SER A 170 -8.301 -0.807 3.715 1.00 0.00 H new ATOM 0 HG SER A 170 -8.093 -2.728 2.430 1.00 0.00 H new ATOM 2542 N THR A 171 -6.567 -1.003 6.877 1.00 0.00 N ATOM 2543 CA THR A 171 -5.680 0.028 7.411 1.00 0.00 C ATOM 2544 C THR A 171 -4.473 0.241 6.502 1.00 0.00 C ATOM 2545 O THR A 171 -3.565 -0.588 6.456 1.00 0.00 O ATOM 2546 CB THR A 171 -5.212 -0.352 8.816 1.00 0.00 C ATOM 2547 OG1 THR A 171 -6.262 -0.960 9.547 1.00 0.00 O ATOM 2548 CG2 THR A 171 -4.715 0.829 9.622 1.00 0.00 C ATOM 0 H THR A 171 -6.340 -1.951 7.177 1.00 0.00 H new ATOM 0 HA THR A 171 -6.241 0.961 7.459 1.00 0.00 H new ATOM 0 HB THR A 171 -4.383 -1.043 8.667 1.00 0.00 H new ATOM 0 HG1 THR A 171 -5.942 -1.197 10.442 1.00 0.00 H new ATOM 0 HG21 THR A 171 -4.399 0.489 10.608 1.00 0.00 H new ATOM 0 HG22 THR A 171 -3.871 1.290 9.109 1.00 0.00 H new ATOM 0 HG23 THR A 171 -5.517 1.559 9.730 1.00 0.00 H new ATOM 2556 N LEU A 172 -4.470 1.359 5.778 1.00 0.00 N ATOM 2557 CA LEU A 172 -3.375 1.680 4.870 1.00 0.00 C ATOM 2558 C LEU A 172 -2.312 2.528 5.567 1.00 0.00 C ATOM 2559 O LEU A 172 -2.556 3.681 5.924 1.00 0.00 O ATOM 2560 CB LEU A 172 -3.905 2.412 3.628 1.00 0.00 C ATOM 2561 CG LEU A 172 -2.834 2.980 2.684 1.00 0.00 C ATOM 2562 CD1 LEU A 172 -2.301 4.300 3.217 1.00 0.00 C ATOM 2563 CD2 LEU A 172 -1.700 1.982 2.490 1.00 0.00 C ATOM 0 H LEU A 172 -5.214 2.056 5.804 1.00 0.00 H new ATOM 0 HA LEU A 172 -2.913 0.743 4.558 1.00 0.00 H new ATOM 0 HB2 LEU A 172 -4.533 1.723 3.063 1.00 0.00 H new ATOM 0 HB3 LEU A 172 -4.545 3.231 3.957 1.00 0.00 H new ATOM 0 HG LEU A 172 -3.295 3.161 1.713 1.00 0.00 H new ATOM 0 HD11 LEU A 172 -1.543 4.688 2.536 1.00 0.00 H new ATOM 0 HD12 LEU A 172 -3.118 5.017 3.297 1.00 0.00 H new ATOM 0 HD13 LEU A 172 -1.858 4.143 4.201 1.00 0.00 H new ATOM 0 HD21 LEU A 172 -0.954 2.406 1.818 1.00 0.00 H new ATOM 0 HD22 LEU A 172 -1.239 1.763 3.453 1.00 0.00 H new ATOM 0 HD23 LEU A 172 -2.095 1.062 2.060 1.00 0.00 H new ATOM 2575 N HIS A 173 -1.130 1.947 5.746 1.00 0.00 N ATOM 2576 CA HIS A 173 -0.017 2.642 6.386 1.00 0.00 C ATOM 2577 C HIS A 173 0.807 3.401 5.349 1.00 0.00 C ATOM 2578 O HIS A 173 0.578 3.269 4.147 1.00 0.00 O ATOM 2579 CB HIS A 173 0.873 1.641 7.124 1.00 0.00 C ATOM 2580 CG HIS A 173 1.579 2.222 8.310 1.00 0.00 C ATOM 2581 ND1 HIS A 173 2.858 2.734 8.250 1.00 0.00 N ATOM 2582 CD2 HIS A 173 1.178 2.367 9.595 1.00 0.00 C ATOM 2583 CE1 HIS A 173 3.213 3.169 9.446 1.00 0.00 C ATOM 2584 NE2 HIS A 173 2.211 2.958 10.279 1.00 0.00 N ATOM 0 H HIS A 173 -0.917 0.993 5.456 1.00 0.00 H new ATOM 0 HA HIS A 173 -0.422 3.357 7.102 1.00 0.00 H new ATOM 0 HB2 HIS A 173 0.263 0.799 7.452 1.00 0.00 H new ATOM 0 HB3 HIS A 173 1.614 1.246 6.429 1.00 0.00 H new ATOM 0 HD2 HIS A 173 0.223 2.073 10.005 1.00 0.00 H new ATOM 0 HE1 HIS A 173 4.161 3.620 9.699 1.00 0.00 H new ATOM 0 HE2 HIS A 173 2.205 3.196 11.271 1.00 0.00 H new ATOM 2592 N VAL A 174 1.766 4.196 5.815 1.00 0.00 N ATOM 2593 CA VAL A 174 2.614 4.970 4.913 1.00 0.00 C ATOM 2594 C VAL A 174 3.954 5.317 5.560 1.00 0.00 C ATOM 2595 O VAL A 174 4.065 5.395 6.783 1.00 0.00 O ATOM 2596 CB VAL A 174 1.915 6.270 4.468 1.00 0.00 C ATOM 2597 CG1 VAL A 174 1.646 7.173 5.662 1.00 0.00 C ATOM 2598 CG2 VAL A 174 2.746 6.993 3.419 1.00 0.00 C ATOM 0 H VAL A 174 1.975 4.321 6.806 1.00 0.00 H new ATOM 0 HA VAL A 174 2.796 4.343 4.040 1.00 0.00 H new ATOM 0 HB VAL A 174 0.956 6.007 4.021 1.00 0.00 H new ATOM 0 HG11 VAL A 174 1.152 8.084 5.325 1.00 0.00 H new ATOM 0 HG12 VAL A 174 1.003 6.654 6.373 1.00 0.00 H new ATOM 0 HG13 VAL A 174 2.589 7.429 6.145 1.00 0.00 H new ATOM 0 HG21 VAL A 174 2.236 7.908 3.118 1.00 0.00 H new ATOM 0 HG22 VAL A 174 3.722 7.242 3.836 1.00 0.00 H new ATOM 0 HG23 VAL A 174 2.877 6.348 2.550 1.00 0.00 H new ATOM 2608 N HIS A 175 4.967 5.529 4.724 1.00 0.00 N ATOM 2609 CA HIS A 175 6.303 5.875 5.201 1.00 0.00 C ATOM 2610 C HIS A 175 6.873 7.044 4.402 1.00 0.00 C ATOM 2611 O HIS A 175 7.231 8.078 4.966 1.00 0.00 O ATOM 2612 CB HIS A 175 7.235 4.666 5.096 1.00 0.00 C ATOM 2613 CG HIS A 175 8.470 4.789 5.933 1.00 0.00 C ATOM 2614 ND1 HIS A 175 8.806 3.884 6.918 1.00 0.00 N ATOM 2615 CD2 HIS A 175 9.455 5.719 5.928 1.00 0.00 C ATOM 2616 CE1 HIS A 175 9.943 4.252 7.483 1.00 0.00 C ATOM 2617 NE2 HIS A 175 10.357 5.361 6.900 1.00 0.00 N ATOM 0 H HIS A 175 4.887 5.467 3.709 1.00 0.00 H new ATOM 0 HA HIS A 175 6.226 6.172 6.247 1.00 0.00 H new ATOM 0 HB2 HIS A 175 6.690 3.771 5.396 1.00 0.00 H new ATOM 0 HB3 HIS A 175 7.524 4.530 4.054 1.00 0.00 H new ATOM 0 HD2 HIS A 175 9.519 6.581 5.281 1.00 0.00 H new ATOM 0 HE1 HIS A 175 10.447 3.733 8.285 1.00 0.00 H new ATOM 0 HE2 HIS A 175 11.209 5.870 7.134 1.00 0.00 H new ATOM 2625 N TYR A 176 6.951 6.866 3.084 1.00 0.00 N ATOM 2626 CA TYR A 176 7.469 7.891 2.185 1.00 0.00 C ATOM 2627 C TYR A 176 8.955 8.066 2.351 1.00 0.00 C ATOM 2628 O TYR A 176 9.485 7.992 3.460 1.00 0.00 O ATOM 2629 CB TYR A 176 6.795 9.242 2.425 1.00 0.00 C ATOM 2630 CG TYR A 176 5.618 9.506 1.522 1.00 0.00 C ATOM 2631 CD1 TYR A 176 5.810 9.931 0.215 1.00 0.00 C ATOM 2632 CD2 TYR A 176 4.318 9.330 1.976 1.00 0.00 C ATOM 2633 CE1 TYR A 176 4.733 10.175 -0.618 1.00 0.00 C ATOM 2634 CE2 TYR A 176 3.237 9.571 1.153 1.00 0.00 C ATOM 2635 CZ TYR A 176 3.449 9.993 -0.144 1.00 0.00 C ATOM 2636 OH TYR A 176 2.374 10.231 -0.969 1.00 0.00 O ATOM 0 H TYR A 176 6.658 6.010 2.613 1.00 0.00 H new ATOM 0 HA TYR A 176 7.250 7.551 1.173 1.00 0.00 H new ATOM 0 HB2 TYR A 176 6.463 9.292 3.462 1.00 0.00 H new ATOM 0 HB3 TYR A 176 7.531 10.034 2.287 1.00 0.00 H new ATOM 0 HD1 TYR A 176 6.814 10.073 -0.157 1.00 0.00 H new ATOM 0 HD2 TYR A 176 4.150 8.999 2.990 1.00 0.00 H new ATOM 0 HE1 TYR A 176 4.895 10.506 -1.633 1.00 0.00 H new ATOM 0 HE2 TYR A 176 2.232 9.430 1.521 1.00 0.00 H new ATOM 0 HH TYR A 176 1.568 9.835 -0.578 1.00 0.00 H new ATOM 2646 N ARG A 177 9.622 8.339 1.246 1.00 0.00 N ATOM 2647 CA ARG A 177 11.041 8.569 1.288 1.00 0.00 C ATOM 2648 C ARG A 177 11.551 9.156 -0.026 1.00 0.00 C ATOM 2649 O ARG A 177 12.414 10.033 -0.030 1.00 0.00 O ATOM 2650 CB ARG A 177 11.793 7.281 1.634 1.00 0.00 C ATOM 2651 CG ARG A 177 11.803 6.254 0.512 1.00 0.00 C ATOM 2652 CD ARG A 177 13.030 6.402 -0.374 1.00 0.00 C ATOM 2653 NE ARG A 177 14.264 6.486 0.405 1.00 0.00 N ATOM 2654 CZ ARG A 177 14.803 5.457 1.054 1.00 0.00 C ATOM 2655 NH1 ARG A 177 14.223 4.264 1.020 1.00 0.00 N ATOM 2656 NH2 ARG A 177 15.927 5.621 1.738 1.00 0.00 N ATOM 0 H ARG A 177 9.203 8.405 0.319 1.00 0.00 H new ATOM 0 HA ARG A 177 11.232 9.299 2.074 1.00 0.00 H new ATOM 0 HB2 ARG A 177 12.822 7.531 1.894 1.00 0.00 H new ATOM 0 HB3 ARG A 177 11.340 6.834 2.519 1.00 0.00 H new ATOM 0 HG2 ARG A 177 11.780 5.250 0.937 1.00 0.00 H new ATOM 0 HG3 ARG A 177 10.902 6.366 -0.092 1.00 0.00 H new ATOM 0 HD2 ARG A 177 13.089 5.553 -1.055 1.00 0.00 H new ATOM 0 HD3 ARG A 177 12.928 7.297 -0.988 1.00 0.00 H new ATOM 0 HE ARG A 177 14.740 7.387 0.454 1.00 0.00 H new ATOM 0 HH11 ARG A 177 13.359 4.132 0.494 1.00 0.00 H new ATOM 0 HH12 ARG A 177 14.641 3.479 1.520 1.00 0.00 H new ATOM 0 HH21 ARG A 177 16.378 6.535 1.766 1.00 0.00 H new ATOM 0 HH22 ARG A 177 16.341 4.833 2.236 1.00 0.00 H new