USER MOD reduce.3.24.130724 H: found=0, std=0, add=713, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 712 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl -128:sc= -0.334 (180deg=-1.88) USER MOD Single : A 1 MET N :NH3+ 168:sc= 0.466 (180deg=0.394) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -4.29! C(o=-4.3!,f=-5.6!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 SER OG : rot -81:sc= 0.263 USER MOD Single : A 17 TYR OH : rot -15:sc= -0.708 USER MOD Single : A 22 LYS NZ :NH3+ 159:sc= 0.929 (180deg=0.635) USER MOD Single : A 23 MET CE :methyl -148:sc= -3.15! (180deg=-3.43!) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0.0107 USER MOD Single : A 34 MET CE :methyl 156:sc= -0.447 (180deg=-0.777) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= 1.15 K(o=1.1,f=-5.1!) USER MOD Single : B 101 MET CE :methyl -136:sc= -0.175 (180deg=-1.23) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 105 ASN : amide:sc= -5.53! C(o=-5.5!,f=-8.4!) USER MOD Single : B 113 LYS NZ :NH3+ 164:sc= -0.0225 (180deg=-0.224) USER MOD Single : B 116 SER OG : rot -79:sc= -0.102 USER MOD Single : B 117 TYR OH : rot -15:sc= -0.716 USER MOD Single : B 122 LYS NZ :NH3+ -167:sc= -0.0284 (180deg=-0.233) USER MOD Single : B 123 MET CE :methyl 156:sc= -0.17 (180deg=-0.85) USER MOD Single : B 126 THR OG1 : rot 180:sc= 0 USER MOD Single : B 128 SER OG : rot 180:sc= 0 USER MOD Single : B 134 MET CE :methyl 150:sc= -0.477 (180deg=-0.852) USER MOD Single : B 137 TYR OH : rot 180:sc= 0 USER MOD Single : B 141 ASN : amide:sc= 1.56 K(o=1.6,f=-5.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.900 12.964 12.040 1.00 0.00 N ATOM 2 CA MET A 1 -3.274 11.718 11.511 1.00 0.00 C ATOM 3 C MET A 1 -3.599 10.544 12.434 1.00 0.00 C ATOM 4 O MET A 1 -3.726 10.713 13.647 1.00 0.00 O ATOM 5 CB MET A 1 -1.757 11.889 11.355 1.00 0.00 C ATOM 6 CG MET A 1 -0.990 10.576 11.215 1.00 0.00 C ATOM 7 SD MET A 1 0.768 10.821 10.819 1.00 0.00 S ATOM 8 CE MET A 1 0.655 11.621 9.218 1.00 0.00 C ATOM 0 H1 MET A 1 -3.516 13.787 11.534 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.930 12.921 11.901 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.691 13.053 13.055 1.00 0.00 H new ATOM 0 HA MET A 1 -3.685 11.512 10.523 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.561 12.507 10.479 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.373 12.431 12.219 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.073 10.012 12.144 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.452 9.973 10.434 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.282 11.091 8.501 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.380 11.606 8.876 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.994 12.654 9.303 1.00 0.00 H new ATOM 18 N GLY A 2 -3.746 9.364 11.852 1.00 0.00 N ATOM 19 CA GLY A 2 -3.995 8.176 12.626 1.00 0.00 C ATOM 20 C GLY A 2 -3.027 7.072 12.273 1.00 0.00 C ATOM 21 O GLY A 2 -2.467 7.061 11.177 1.00 0.00 O ATOM 0 H GLY A 2 -3.696 9.212 10.845 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -3.912 8.408 13.688 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -5.016 7.835 12.453 1.00 0.00 H new ATOM 25 N SER A 3 -2.835 6.146 13.200 1.00 0.00 N ATOM 26 CA SER A 3 -1.952 5.007 13.008 1.00 0.00 C ATOM 27 C SER A 3 -2.743 3.714 12.898 1.00 0.00 C ATOM 28 O SER A 3 -3.749 3.547 13.595 1.00 0.00 O ATOM 29 CB SER A 3 -0.932 4.938 14.139 1.00 0.00 C ATOM 30 OG SER A 3 -1.563 5.072 15.414 1.00 0.00 O ATOM 0 H SER A 3 -3.291 6.164 14.112 1.00 0.00 H new ATOM 0 HA SER A 3 -1.415 5.139 12.069 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.398 3.989 14.093 1.00 0.00 H new ATOM 0 HB3 SER A 3 -0.191 5.727 14.012 1.00 0.00 H new ATOM 0 HG SER A 3 -0.886 5.022 16.121 1.00 0.00 H new ATOM 36 N ILE A 4 -2.290 2.835 12.029 1.00 0.00 N ATOM 37 CA ILE A 4 -2.922 1.536 11.821 1.00 0.00 C ATOM 38 C ILE A 4 -1.894 0.438 12.015 1.00 0.00 C ATOM 39 O ILE A 4 -0.677 0.703 11.997 1.00 0.00 O ATOM 40 CB ILE A 4 -3.546 1.422 10.403 1.00 0.00 C ATOM 41 CG1 ILE A 4 -2.468 1.433 9.302 1.00 0.00 C ATOM 42 CG2 ILE A 4 -4.532 2.567 10.189 1.00 0.00 C ATOM 43 CD1 ILE A 4 -2.105 0.056 8.766 1.00 0.00 C ATOM 0 H ILE A 4 -1.471 2.995 11.442 1.00 0.00 H new ATOM 0 HA ILE A 4 -3.726 1.431 12.549 1.00 0.00 H new ATOM 0 HB ILE A 4 -4.069 0.468 10.336 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -2.817 2.051 8.475 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -1.568 1.905 9.696 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.971 2.488 9.194 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.321 2.513 10.939 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -4.009 3.519 10.281 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -1.340 0.155 7.996 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -1.723 -0.562 9.579 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -2.991 -0.413 8.339 1.00 0.00 H new ATOM 55 N ASN A 5 -2.354 -0.795 12.150 1.00 0.00 N ATOM 56 CA ASN A 5 -1.483 -1.963 12.268 1.00 0.00 C ATOM 57 C ASN A 5 -1.552 -2.790 10.990 1.00 0.00 C ATOM 58 O ASN A 5 -2.631 -3.171 10.531 1.00 0.00 O ATOM 59 CB ASN A 5 -1.860 -2.820 13.479 1.00 0.00 C ATOM 60 CG ASN A 5 -0.877 -3.947 13.696 1.00 0.00 C ATOM 61 OD1 ASN A 5 0.103 -3.802 14.437 1.00 0.00 O ATOM 62 ND2 ASN A 5 -1.119 -5.069 13.068 1.00 0.00 N ATOM 0 H ASN A 5 -3.348 -1.020 12.182 1.00 0.00 H new ATOM 0 HA ASN A 5 -0.461 -1.613 12.416 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -1.897 -2.194 14.370 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -2.859 -3.231 13.336 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -0.489 -5.863 13.181 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -1.938 -5.150 12.465 1.00 0.00 H new ATOM 69 N LEU A 6 -0.384 -3.060 10.428 1.00 0.00 N ATOM 70 CA LEU A 6 -0.260 -3.870 9.217 1.00 0.00 C ATOM 71 C LEU A 6 0.523 -5.125 9.587 1.00 0.00 C ATOM 72 O LEU A 6 1.410 -5.037 10.427 1.00 0.00 O ATOM 73 CB LEU A 6 0.453 -3.036 8.130 1.00 0.00 C ATOM 74 CG LEU A 6 0.695 -3.685 6.752 1.00 0.00 C ATOM 75 CD1 LEU A 6 1.912 -4.609 6.787 1.00 0.00 C ATOM 76 CD2 LEU A 6 -0.552 -4.442 6.268 1.00 0.00 C ATOM 0 H LEU A 6 0.507 -2.726 10.795 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.230 -4.165 8.817 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -0.129 -2.128 7.972 1.00 0.00 H new ATOM 0 HB3 LEU A 6 1.420 -2.729 8.528 1.00 0.00 H new ATOM 0 HG LEU A 6 0.899 -2.885 6.040 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.060 -5.053 5.803 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.797 -4.035 7.063 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.748 -5.398 7.521 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -0.351 -4.889 5.294 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -0.802 -5.226 6.983 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -1.389 -3.748 6.183 1.00 0.00 H new ATOM 88 N ARG A 7 0.195 -6.283 9.007 1.00 0.00 N ATOM 89 CA ARG A 7 0.807 -7.536 9.424 1.00 0.00 C ATOM 90 C ARG A 7 1.148 -8.340 8.167 1.00 0.00 C ATOM 91 O ARG A 7 0.282 -8.563 7.312 1.00 0.00 O ATOM 92 CB ARG A 7 -0.133 -8.348 10.327 1.00 0.00 C ATOM 93 CG ARG A 7 -0.488 -7.635 11.631 1.00 0.00 C ATOM 94 CD ARG A 7 -1.051 -8.588 12.675 1.00 0.00 C ATOM 95 NE ARG A 7 -1.594 -7.886 13.844 1.00 0.00 N ATOM 96 CZ ARG A 7 -1.213 -8.100 15.101 1.00 0.00 C ATOM 97 NH1 ARG A 7 -0.251 -8.976 15.362 1.00 0.00 N ATOM 98 NH2 ARG A 7 -1.757 -7.413 16.110 1.00 0.00 N ATOM 0 H ARG A 7 -0.486 -6.373 8.253 1.00 0.00 H new ATOM 0 HA ARG A 7 1.706 -7.321 10.001 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -1.050 -8.567 9.780 1.00 0.00 H new ATOM 0 HB3 ARG A 7 0.336 -9.304 10.560 1.00 0.00 H new ATOM 0 HG2 ARG A 7 0.401 -7.147 12.030 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -1.217 -6.851 11.427 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -1.836 -9.194 12.223 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -0.266 -9.272 12.998 1.00 0.00 H new ATOM 0 HE ARG A 7 -2.315 -7.183 13.681 1.00 0.00 H new ATOM 0 HH11 ARG A 7 0.196 -9.485 14.599 1.00 0.00 H new ATOM 0 HH12 ARG A 7 0.041 -9.140 16.325 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -2.475 -6.713 15.922 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -1.454 -7.588 17.068 1.00 0.00 H new ATOM 112 N ILE A 8 2.410 -8.765 8.040 1.00 0.00 N ATOM 113 CA ILE A 8 2.855 -9.549 6.885 1.00 0.00 C ATOM 114 C ILE A 8 3.950 -10.515 7.299 1.00 0.00 C ATOM 115 O ILE A 8 4.461 -10.416 8.417 1.00 0.00 O ATOM 116 CB ILE A 8 3.393 -8.682 5.714 1.00 0.00 C ATOM 117 CG1 ILE A 8 4.734 -7.997 6.075 1.00 0.00 C ATOM 118 CG2 ILE A 8 2.349 -7.650 5.273 1.00 0.00 C ATOM 119 CD1 ILE A 8 4.706 -7.142 7.331 1.00 0.00 C ATOM 0 H ILE A 8 3.142 -8.578 8.725 1.00 0.00 H new ATOM 0 HA ILE A 8 1.971 -10.078 6.530 1.00 0.00 H new ATOM 0 HB ILE A 8 3.587 -9.351 4.875 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.496 -8.767 6.196 1.00 0.00 H new ATOM 0 HG13 ILE A 8 5.042 -7.373 5.236 1.00 0.00 H new ATOM 0 HG21 ILE A 8 2.749 -7.055 4.452 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.446 -8.164 4.942 1.00 0.00 H new ATOM 0 HG23 ILE A 8 2.108 -6.996 6.111 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.692 -6.707 7.497 1.00 0.00 H new ATOM 0 HD12 ILE A 8 3.973 -6.344 7.212 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.434 -7.761 8.186 1.00 0.00 H new ATOM 131 N ASP A 9 4.312 -11.432 6.417 1.00 0.00 N ATOM 132 CA ASP A 9 5.411 -12.340 6.716 1.00 0.00 C ATOM 133 C ASP A 9 6.729 -11.573 6.728 1.00 0.00 C ATOM 134 O ASP A 9 6.969 -10.707 5.873 1.00 0.00 O ATOM 135 CB ASP A 9 5.478 -13.490 5.703 1.00 0.00 C ATOM 136 CG ASP A 9 6.342 -14.642 6.203 1.00 0.00 C ATOM 137 OD1 ASP A 9 7.527 -14.402 6.500 1.00 0.00 O ATOM 138 OD2 ASP A 9 5.838 -15.777 6.312 1.00 0.00 O ATOM 0 H ASP A 9 3.873 -11.568 5.506 1.00 0.00 H new ATOM 0 HA ASP A 9 5.235 -12.772 7.701 1.00 0.00 H new ATOM 0 HB2 ASP A 9 4.471 -13.854 5.500 1.00 0.00 H new ATOM 0 HB3 ASP A 9 5.879 -13.119 4.760 1.00 0.00 H new ATOM 143 N ASP A 10 7.575 -11.875 7.697 1.00 0.00 N ATOM 144 CA ASP A 10 8.825 -11.166 7.898 1.00 0.00 C ATOM 145 C ASP A 10 9.746 -11.294 6.688 1.00 0.00 C ATOM 146 O ASP A 10 10.603 -10.429 6.464 1.00 0.00 O ATOM 147 CB ASP A 10 9.518 -11.665 9.151 1.00 0.00 C ATOM 148 CG ASP A 10 9.679 -13.170 9.189 1.00 0.00 C ATOM 149 OD1 ASP A 10 8.690 -13.871 9.519 1.00 0.00 O ATOM 150 OD2 ASP A 10 10.792 -13.674 8.914 1.00 0.00 O ATOM 0 H ASP A 10 7.412 -12.624 8.370 1.00 0.00 H new ATOM 0 HA ASP A 10 8.591 -10.108 8.021 1.00 0.00 H new ATOM 0 HB2 ASP A 10 10.501 -11.200 9.224 1.00 0.00 H new ATOM 0 HB3 ASP A 10 8.949 -11.346 10.024 1.00 0.00 H new ATOM 155 N GLU A 11 9.588 -12.384 5.926 1.00 0.00 N ATOM 156 CA GLU A 11 10.401 -12.597 4.745 1.00 0.00 C ATOM 157 C GLU A 11 10.109 -11.524 3.697 1.00 0.00 C ATOM 158 O GLU A 11 11.002 -11.023 3.016 1.00 0.00 O ATOM 159 CB GLU A 11 10.190 -14.017 4.150 1.00 0.00 C ATOM 160 CG GLU A 11 8.776 -14.302 3.607 1.00 0.00 C ATOM 161 CD GLU A 11 8.540 -13.802 2.183 1.00 0.00 C ATOM 162 OE1 GLU A 11 9.507 -13.728 1.399 1.00 0.00 O ATOM 163 OE2 GLU A 11 7.381 -13.493 1.830 1.00 0.00 O ATOM 0 H GLU A 11 8.908 -13.121 6.113 1.00 0.00 H new ATOM 0 HA GLU A 11 11.446 -12.521 5.044 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.907 -14.165 3.343 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.420 -14.753 4.920 1.00 0.00 H new ATOM 0 HG2 GLU A 11 8.597 -15.377 3.637 1.00 0.00 H new ATOM 0 HG3 GLU A 11 8.044 -13.838 4.269 1.00 0.00 H new ATOM 170 N LEU A 12 8.836 -11.136 3.594 1.00 0.00 N ATOM 171 CA LEU A 12 8.436 -10.138 2.614 1.00 0.00 C ATOM 172 C LEU A 12 8.813 -8.768 3.134 1.00 0.00 C ATOM 173 O LEU A 12 9.388 -7.952 2.418 1.00 0.00 O ATOM 174 CB LEU A 12 6.928 -10.230 2.392 1.00 0.00 C ATOM 175 CG LEU A 12 6.345 -9.235 1.384 1.00 0.00 C ATOM 176 CD1 LEU A 12 6.966 -9.452 0.003 1.00 0.00 C ATOM 177 CD2 LEU A 12 4.821 -9.369 1.328 1.00 0.00 C ATOM 0 H LEU A 12 8.076 -11.496 4.172 1.00 0.00 H new ATOM 0 HA LEU A 12 8.941 -10.311 1.664 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.689 -11.240 2.058 1.00 0.00 H new ATOM 0 HB3 LEU A 12 6.428 -10.084 3.350 1.00 0.00 H new ATOM 0 HG LEU A 12 6.586 -8.222 1.708 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.542 -8.738 -0.703 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.045 -9.307 0.062 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.754 -10.466 -0.336 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.419 -8.656 0.608 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.556 -10.381 1.023 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.401 -9.165 2.313 1.00 0.00 H new ATOM 189 N LYS A 13 8.493 -8.565 4.407 1.00 0.00 N ATOM 190 CA LYS A 13 8.785 -7.317 5.114 1.00 0.00 C ATOM 191 C LYS A 13 10.245 -6.917 4.899 1.00 0.00 C ATOM 192 O LYS A 13 10.551 -5.769 4.621 1.00 0.00 O ATOM 193 CB LYS A 13 8.467 -7.496 6.615 1.00 0.00 C ATOM 194 CG LYS A 13 8.705 -6.275 7.491 1.00 0.00 C ATOM 195 CD LYS A 13 10.131 -6.210 8.047 1.00 0.00 C ATOM 196 CE LYS A 13 10.269 -5.076 9.033 1.00 0.00 C ATOM 197 NZ LYS A 13 11.670 -4.947 9.526 1.00 0.00 N ATOM 0 H LYS A 13 8.022 -9.263 4.983 1.00 0.00 H new ATOM 0 HA LYS A 13 8.161 -6.515 4.719 1.00 0.00 H new ATOM 0 HB2 LYS A 13 7.423 -7.793 6.713 1.00 0.00 H new ATOM 0 HB3 LYS A 13 9.070 -8.319 6.999 1.00 0.00 H new ATOM 0 HG2 LYS A 13 8.505 -5.374 6.912 1.00 0.00 H new ATOM 0 HG3 LYS A 13 7.997 -6.285 8.320 1.00 0.00 H new ATOM 0 HD2 LYS A 13 10.380 -7.153 8.533 1.00 0.00 H new ATOM 0 HD3 LYS A 13 10.839 -6.076 7.230 1.00 0.00 H new ATOM 0 HE2 LYS A 13 9.961 -4.143 8.561 1.00 0.00 H new ATOM 0 HE3 LYS A 13 9.599 -5.243 9.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 11.729 -4.158 10.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 11.955 -5.829 9.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 12.305 -4.763 8.723 1.00 0.00 H new ATOM 211 N ALA A 14 11.152 -7.893 5.029 1.00 0.00 N ATOM 212 CA ALA A 14 12.573 -7.631 4.876 1.00 0.00 C ATOM 213 C ALA A 14 12.904 -7.062 3.494 1.00 0.00 C ATOM 214 O ALA A 14 13.585 -6.052 3.369 1.00 0.00 O ATOM 215 CB ALA A 14 13.361 -8.905 5.126 1.00 0.00 C ATOM 0 H ALA A 14 10.921 -8.864 5.239 1.00 0.00 H new ATOM 0 HA ALA A 14 12.855 -6.878 5.612 1.00 0.00 H new ATOM 0 HB1 ALA A 14 14.426 -8.703 5.010 1.00 0.00 H new ATOM 0 HB2 ALA A 14 13.167 -9.260 6.138 1.00 0.00 H new ATOM 0 HB3 ALA A 14 13.056 -9.668 4.409 1.00 0.00 H new ATOM 221 N ARG A 15 12.396 -7.712 2.447 1.00 0.00 N ATOM 222 CA ARG A 15 12.708 -7.287 1.065 1.00 0.00 C ATOM 223 C ARG A 15 12.076 -5.926 0.765 1.00 0.00 C ATOM 224 O ARG A 15 12.738 -5.039 0.226 1.00 0.00 O ATOM 225 CB ARG A 15 12.211 -8.324 0.047 1.00 0.00 C ATOM 226 CG ARG A 15 13.119 -9.538 -0.108 1.00 0.00 C ATOM 227 CD ARG A 15 13.234 -10.355 1.166 1.00 0.00 C ATOM 228 NE ARG A 15 13.936 -11.609 0.928 1.00 0.00 N ATOM 229 CZ ARG A 15 13.378 -12.811 1.035 1.00 0.00 C ATOM 230 NH1 ARG A 15 12.107 -12.924 1.381 1.00 0.00 N ATOM 231 NH2 ARG A 15 14.085 -13.890 0.796 1.00 0.00 N ATOM 0 H ARG A 15 11.778 -8.520 2.516 1.00 0.00 H new ATOM 0 HA ARG A 15 13.791 -7.203 0.979 1.00 0.00 H new ATOM 0 HB2 ARG A 15 11.219 -8.663 0.346 1.00 0.00 H new ATOM 0 HB3 ARG A 15 12.103 -7.840 -0.924 1.00 0.00 H new ATOM 0 HG2 ARG A 15 12.736 -10.172 -0.907 1.00 0.00 H new ATOM 0 HG3 ARG A 15 14.112 -9.207 -0.412 1.00 0.00 H new ATOM 0 HD2 ARG A 15 13.763 -9.778 1.924 1.00 0.00 H new ATOM 0 HD3 ARG A 15 12.239 -10.562 1.559 1.00 0.00 H new ATOM 0 HE ARG A 15 14.920 -11.562 0.662 1.00 0.00 H new ATOM 0 HH11 ARG A 15 11.553 -12.088 1.566 1.00 0.00 H new ATOM 0 HH12 ARG A 15 11.681 -13.847 1.463 1.00 0.00 H new ATOM 0 HH21 ARG A 15 15.066 -13.808 0.527 1.00 0.00 H new ATOM 0 HH22 ARG A 15 13.654 -14.811 0.879 1.00 0.00 H new ATOM 245 N SER A 16 10.804 -5.774 1.111 1.00 0.00 N ATOM 246 CA SER A 16 10.070 -4.551 0.811 1.00 0.00 C ATOM 247 C SER A 16 10.700 -3.337 1.476 1.00 0.00 C ATOM 248 O SER A 16 11.062 -2.353 0.812 1.00 0.00 O ATOM 249 CB SER A 16 8.635 -4.716 1.289 1.00 0.00 C ATOM 250 OG SER A 16 8.588 -5.121 2.640 1.00 0.00 O ATOM 0 H SER A 16 10.258 -6.483 1.600 1.00 0.00 H new ATOM 0 HA SER A 16 10.098 -4.383 -0.266 1.00 0.00 H new ATOM 0 HB2 SER A 16 8.099 -3.774 1.171 1.00 0.00 H new ATOM 0 HB3 SER A 16 8.125 -5.453 0.668 1.00 0.00 H new ATOM 0 HG SER A 16 8.727 -6.089 2.696 1.00 0.00 H new ATOM 256 N TYR A 17 10.858 -3.423 2.793 1.00 0.00 N ATOM 257 CA TYR A 17 11.405 -2.320 3.578 1.00 0.00 C ATOM 258 C TYR A 17 12.828 -2.000 3.153 1.00 0.00 C ATOM 259 O TYR A 17 13.201 -0.828 3.057 1.00 0.00 O ATOM 260 CB TYR A 17 11.350 -2.646 5.072 1.00 0.00 C ATOM 261 CG TYR A 17 9.951 -2.465 5.657 1.00 0.00 C ATOM 262 CD1 TYR A 17 8.921 -3.332 5.296 1.00 0.00 C ATOM 263 CD2 TYR A 17 9.672 -1.445 6.541 1.00 0.00 C ATOM 264 CE1 TYR A 17 7.656 -3.168 5.808 1.00 0.00 C ATOM 265 CE2 TYR A 17 8.406 -1.267 7.064 1.00 0.00 C ATOM 266 CZ TYR A 17 7.390 -2.140 6.685 1.00 0.00 C ATOM 267 OH TYR A 17 6.114 -1.959 7.184 1.00 0.00 O ATOM 0 H TYR A 17 10.614 -4.248 3.341 1.00 0.00 H new ATOM 0 HA TYR A 17 10.792 -1.438 3.393 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.676 -3.674 5.229 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.050 -2.004 5.607 1.00 0.00 H new ATOM 0 HD1 TYR A 17 9.119 -4.140 4.608 1.00 0.00 H new ATOM 0 HD2 TYR A 17 10.462 -0.769 6.832 1.00 0.00 H new ATOM 0 HE1 TYR A 17 6.867 -3.848 5.521 1.00 0.00 H new ATOM 0 HE2 TYR A 17 8.207 -0.463 7.757 1.00 0.00 H new ATOM 0 HH TYR A 17 5.477 -2.475 6.648 1.00 0.00 H new ATOM 277 N ALA A 18 13.604 -3.039 2.868 1.00 0.00 N ATOM 278 CA ALA A 18 14.972 -2.871 2.392 1.00 0.00 C ATOM 279 C ALA A 18 15.004 -2.081 1.090 1.00 0.00 C ATOM 280 O ALA A 18 15.842 -1.183 0.906 1.00 0.00 O ATOM 281 CB ALA A 18 15.656 -4.217 2.208 1.00 0.00 C ATOM 0 H ALA A 18 13.308 -4.011 2.959 1.00 0.00 H new ATOM 0 HA ALA A 18 15.518 -2.309 3.150 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.675 -4.062 1.852 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.681 -4.746 3.161 1.00 0.00 H new ATOM 0 HB3 ALA A 18 15.103 -4.809 1.479 1.00 0.00 H new ATOM 287 N ALA A 19 14.077 -2.402 0.202 1.00 0.00 N ATOM 288 CA ALA A 19 13.999 -1.763 -1.109 1.00 0.00 C ATOM 289 C ALA A 19 13.719 -0.257 -0.994 1.00 0.00 C ATOM 290 O ALA A 19 14.375 0.552 -1.652 1.00 0.00 O ATOM 291 CB ALA A 19 12.937 -2.469 -1.947 1.00 0.00 C ATOM 0 H ALA A 19 13.359 -3.108 0.365 1.00 0.00 H new ATOM 0 HA ALA A 19 14.965 -1.857 -1.605 1.00 0.00 H new ATOM 0 HB1 ALA A 19 12.874 -1.997 -2.927 1.00 0.00 H new ATOM 0 HB2 ALA A 19 13.206 -3.518 -2.067 1.00 0.00 H new ATOM 0 HB3 ALA A 19 11.971 -2.397 -1.447 1.00 0.00 H new ATOM 297 N LEU A 20 12.748 0.103 -0.154 1.00 0.00 N ATOM 298 CA LEU A 20 12.322 1.492 -0.055 1.00 0.00 C ATOM 299 C LEU A 20 13.358 2.342 0.684 1.00 0.00 C ATOM 300 O LEU A 20 13.625 3.468 0.283 1.00 0.00 O ATOM 301 CB LEU A 20 10.914 1.591 0.591 1.00 0.00 C ATOM 302 CG LEU A 20 10.719 0.889 1.944 1.00 0.00 C ATOM 303 CD1 LEU A 20 11.187 1.769 3.105 1.00 0.00 C ATOM 304 CD2 LEU A 20 9.264 0.473 2.136 1.00 0.00 C ATOM 0 H LEU A 20 12.249 -0.542 0.459 1.00 0.00 H new ATOM 0 HA LEU A 20 12.246 1.898 -1.064 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.673 2.646 0.718 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.189 1.181 -0.112 1.00 0.00 H new ATOM 0 HG LEU A 20 11.336 -0.010 1.939 1.00 0.00 H new ATOM 0 HD11 LEU A 20 11.034 1.241 4.046 1.00 0.00 H new ATOM 0 HD12 LEU A 20 12.246 1.997 2.985 1.00 0.00 H new ATOM 0 HD13 LEU A 20 10.614 2.697 3.112 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.151 -0.022 3.101 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.626 1.356 2.104 1.00 0.00 H new ATOM 0 HD23 LEU A 20 8.974 -0.213 1.340 1.00 0.00 H new ATOM 316 N GLU A 21 13.976 1.790 1.735 1.00 0.00 N ATOM 317 CA GLU A 21 15.018 2.518 2.467 1.00 0.00 C ATOM 318 C GLU A 21 16.255 2.676 1.605 1.00 0.00 C ATOM 319 O GLU A 21 17.045 3.599 1.768 1.00 0.00 O ATOM 320 CB GLU A 21 15.348 1.828 3.785 1.00 0.00 C ATOM 321 CG GLU A 21 15.858 0.406 3.633 1.00 0.00 C ATOM 322 CD GLU A 21 16.326 -0.206 4.941 1.00 0.00 C ATOM 323 OE1 GLU A 21 15.486 -0.713 5.709 1.00 0.00 O ATOM 324 OE2 GLU A 21 17.532 -0.169 5.215 1.00 0.00 O ATOM 0 H GLU A 21 13.777 0.856 2.093 1.00 0.00 H new ATOM 0 HA GLU A 21 14.639 3.512 2.705 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.099 2.417 4.312 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.455 1.817 4.410 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.066 -0.214 3.212 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.682 0.397 2.920 1.00 0.00 H new ATOM 331 N LYS A 22 16.407 1.748 0.662 1.00 0.00 N ATOM 332 CA LYS A 22 17.486 1.763 -0.303 1.00 0.00 C ATOM 333 C LYS A 22 17.303 2.943 -1.256 1.00 0.00 C ATOM 334 O LYS A 22 18.230 3.716 -1.513 1.00 0.00 O ATOM 335 CB LYS A 22 17.491 0.430 -1.068 1.00 0.00 C ATOM 336 CG LYS A 22 18.393 0.362 -2.283 1.00 0.00 C ATOM 337 CD LYS A 22 18.190 -0.969 -3.004 1.00 0.00 C ATOM 338 CE LYS A 22 19.023 -1.086 -4.277 1.00 0.00 C ATOM 339 NZ LYS A 22 18.855 -2.405 -4.915 1.00 0.00 N ATOM 0 H LYS A 22 15.772 0.958 0.552 1.00 0.00 H new ATOM 0 HA LYS A 22 18.444 1.880 0.203 1.00 0.00 H new ATOM 0 HB2 LYS A 22 17.785 -0.361 -0.378 1.00 0.00 H new ATOM 0 HB3 LYS A 22 16.471 0.213 -1.385 1.00 0.00 H new ATOM 0 HG2 LYS A 22 18.172 1.189 -2.958 1.00 0.00 H new ATOM 0 HG3 LYS A 22 19.435 0.467 -1.980 1.00 0.00 H new ATOM 0 HD2 LYS A 22 18.449 -1.785 -2.330 1.00 0.00 H new ATOM 0 HD3 LYS A 22 17.135 -1.084 -3.254 1.00 0.00 H new ATOM 0 HE2 LYS A 22 18.732 -0.303 -4.977 1.00 0.00 H new ATOM 0 HE3 LYS A 22 20.075 -0.927 -4.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 19.125 -2.343 -5.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 19.461 -3.102 -4.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 17.861 -2.702 -4.842 1.00 0.00 H new ATOM 353 N MET A 23 16.082 3.045 -1.776 1.00 0.00 N ATOM 354 CA MET A 23 15.682 4.177 -2.623 1.00 0.00 C ATOM 355 C MET A 23 15.746 5.493 -1.842 1.00 0.00 C ATOM 356 O MET A 23 15.782 6.563 -2.433 1.00 0.00 O ATOM 357 CB MET A 23 14.279 3.983 -3.174 1.00 0.00 C ATOM 358 CG MET A 23 14.130 2.764 -4.078 1.00 0.00 C ATOM 359 SD MET A 23 12.620 2.833 -5.075 1.00 0.00 S ATOM 360 CE MET A 23 11.405 3.044 -3.783 1.00 0.00 C ATOM 0 H MET A 23 15.345 2.355 -1.627 1.00 0.00 H new ATOM 0 HA MET A 23 16.383 4.222 -3.456 1.00 0.00 H new ATOM 0 HB2 MET A 23 13.582 3.892 -2.341 1.00 0.00 H new ATOM 0 HB3 MET A 23 13.993 4.874 -3.733 1.00 0.00 H new ATOM 0 HG2 MET A 23 14.996 2.694 -4.737 1.00 0.00 H new ATOM 0 HG3 MET A 23 14.120 1.861 -3.468 1.00 0.00 H new ATOM 0 HE1 MET A 23 10.473 2.562 -4.078 1.00 0.00 H new ATOM 0 HE2 MET A 23 11.772 2.592 -2.861 1.00 0.00 H new ATOM 0 HE3 MET A 23 11.228 4.107 -3.620 1.00 0.00 H new ATOM 370 N GLY A 24 15.761 5.376 -0.514 1.00 0.00 N ATOM 371 CA GLY A 24 15.830 6.542 0.341 1.00 0.00 C ATOM 372 C GLY A 24 14.453 7.090 0.677 1.00 0.00 C ATOM 373 O GLY A 24 14.287 8.289 0.926 1.00 0.00 O ATOM 0 H GLY A 24 15.726 4.486 -0.017 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.351 6.284 1.263 1.00 0.00 H new ATOM 0 HA3 GLY A 24 16.417 7.317 -0.151 1.00 0.00 H new ATOM 377 N VAL A 25 13.468 6.191 0.696 1.00 0.00 N ATOM 378 CA VAL A 25 12.083 6.546 0.990 1.00 0.00 C ATOM 379 C VAL A 25 11.698 6.031 2.381 1.00 0.00 C ATOM 380 O VAL A 25 12.137 4.950 2.800 1.00 0.00 O ATOM 381 CB VAL A 25 11.114 5.938 -0.062 1.00 0.00 C ATOM 382 CG1 VAL A 25 9.683 6.407 0.183 1.00 0.00 C ATOM 383 CG2 VAL A 25 11.568 6.270 -1.484 1.00 0.00 C ATOM 0 H VAL A 25 13.610 5.199 0.508 1.00 0.00 H new ATOM 0 HA VAL A 25 12.000 7.632 0.957 1.00 0.00 H new ATOM 0 HB VAL A 25 11.135 4.854 0.047 1.00 0.00 H new ATOM 0 HG11 VAL A 25 9.023 5.968 -0.566 1.00 0.00 H new ATOM 0 HG12 VAL A 25 9.363 6.094 1.177 1.00 0.00 H new ATOM 0 HG13 VAL A 25 9.639 7.494 0.113 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.872 5.832 -2.200 1.00 0.00 H new ATOM 0 HG22 VAL A 25 11.591 7.352 -1.615 1.00 0.00 H new ATOM 0 HG23 VAL A 25 12.565 5.863 -1.652 1.00 0.00 H new ATOM 393 N THR A 26 10.902 6.819 3.097 1.00 0.00 N ATOM 394 CA THR A 26 10.391 6.420 4.393 1.00 0.00 C ATOM 395 C THR A 26 9.289 5.360 4.204 1.00 0.00 C ATOM 396 O THR A 26 8.447 5.502 3.326 1.00 0.00 O ATOM 397 CB THR A 26 9.796 7.646 5.117 1.00 0.00 C ATOM 398 OG1 THR A 26 10.787 8.674 5.236 1.00 0.00 O ATOM 399 CG2 THR A 26 9.276 7.272 6.503 1.00 0.00 C ATOM 0 H THR A 26 10.598 7.744 2.794 1.00 0.00 H new ATOM 0 HA THR A 26 11.204 6.005 4.988 1.00 0.00 H new ATOM 0 HB THR A 26 8.958 8.012 4.524 1.00 0.00 H new ATOM 0 HG1 THR A 26 10.401 9.449 5.695 1.00 0.00 H new ATOM 0 HG21 THR A 26 8.863 8.157 6.988 1.00 0.00 H new ATOM 0 HG22 THR A 26 8.498 6.514 6.408 1.00 0.00 H new ATOM 0 HG23 THR A 26 10.095 6.878 7.105 1.00 0.00 H new ATOM 407 N PRO A 27 9.297 4.286 5.022 1.00 0.00 N ATOM 408 CA PRO A 27 8.258 3.242 4.956 1.00 0.00 C ATOM 409 C PRO A 27 6.852 3.832 5.008 1.00 0.00 C ATOM 410 O PRO A 27 6.009 3.524 4.190 1.00 0.00 O ATOM 411 CB PRO A 27 8.541 2.359 6.205 1.00 0.00 C ATOM 412 CG PRO A 27 9.486 3.162 7.046 1.00 0.00 C ATOM 413 CD PRO A 27 10.290 3.983 6.066 1.00 0.00 C ATOM 0 HA PRO A 27 8.295 2.683 4.021 1.00 0.00 H new ATOM 0 HB2 PRO A 27 7.622 2.137 6.747 1.00 0.00 H new ATOM 0 HB3 PRO A 27 8.981 1.403 5.920 1.00 0.00 H new ATOM 0 HG2 PRO A 27 8.946 3.801 7.744 1.00 0.00 H new ATOM 0 HG3 PRO A 27 10.131 2.515 7.640 1.00 0.00 H new ATOM 0 HD2 PRO A 27 10.688 4.889 6.524 1.00 0.00 H new ATOM 0 HD3 PRO A 27 11.140 3.427 5.670 1.00 0.00 H new ATOM 421 N SER A 28 6.656 4.749 5.969 1.00 0.00 N ATOM 422 CA SER A 28 5.379 5.436 6.125 1.00 0.00 C ATOM 423 C SER A 28 4.947 6.129 4.848 1.00 0.00 C ATOM 424 O SER A 28 3.750 6.228 4.553 1.00 0.00 O ATOM 425 CB SER A 28 5.506 6.442 7.267 1.00 0.00 C ATOM 426 OG SER A 28 6.101 5.851 8.407 1.00 0.00 O ATOM 0 H SER A 28 7.368 5.026 6.645 1.00 0.00 H new ATOM 0 HA SER A 28 4.609 4.699 6.355 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.105 7.292 6.941 1.00 0.00 H new ATOM 0 HB3 SER A 28 4.520 6.827 7.527 1.00 0.00 H new ATOM 0 HG SER A 28 6.172 6.518 9.122 1.00 0.00 H new ATOM 432 N GLU A 29 5.923 6.592 4.054 1.00 0.00 N ATOM 433 CA GLU A 29 5.646 7.301 2.829 1.00 0.00 C ATOM 434 C GLU A 29 5.249 6.343 1.714 1.00 0.00 C ATOM 435 O GLU A 29 4.265 6.575 1.034 1.00 0.00 O ATOM 436 CB GLU A 29 6.865 8.135 2.398 1.00 0.00 C ATOM 437 CG GLU A 29 7.206 9.286 3.328 1.00 0.00 C ATOM 438 CD GLU A 29 6.062 10.282 3.468 1.00 0.00 C ATOM 439 OE1 GLU A 29 5.803 11.020 2.505 1.00 0.00 O ATOM 440 OE2 GLU A 29 5.441 10.335 4.552 1.00 0.00 O ATOM 0 H GLU A 29 6.917 6.479 4.255 1.00 0.00 H new ATOM 0 HA GLU A 29 4.808 7.971 3.018 1.00 0.00 H new ATOM 0 HB2 GLU A 29 7.731 7.477 2.324 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.681 8.534 1.400 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.462 8.891 4.311 1.00 0.00 H new ATOM 0 HG3 GLU A 29 8.089 9.803 2.953 1.00 0.00 H new ATOM 447 N ALA A 30 6.012 5.261 1.537 1.00 0.00 N ATOM 448 CA ALA A 30 5.701 4.266 0.512 1.00 0.00 C ATOM 449 C ALA A 30 4.289 3.696 0.674 1.00 0.00 C ATOM 450 O ALA A 30 3.576 3.465 -0.303 1.00 0.00 O ATOM 451 CB ALA A 30 6.743 3.149 0.501 1.00 0.00 C ATOM 0 H ALA A 30 6.845 5.054 2.088 1.00 0.00 H new ATOM 0 HA ALA A 30 5.734 4.775 -0.451 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.489 2.422 -0.270 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.726 3.571 0.292 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.759 2.656 1.473 1.00 0.00 H new ATOM 457 N LEU A 31 3.892 3.484 1.925 1.00 0.00 N ATOM 458 CA LEU A 31 2.552 2.983 2.207 1.00 0.00 C ATOM 459 C LEU A 31 1.524 4.095 2.020 1.00 0.00 C ATOM 460 O LEU A 31 0.406 3.856 1.565 1.00 0.00 O ATOM 461 CB LEU A 31 2.483 2.402 3.627 1.00 0.00 C ATOM 462 CG LEU A 31 3.432 1.225 3.927 1.00 0.00 C ATOM 463 CD1 LEU A 31 3.291 0.758 5.359 1.00 0.00 C ATOM 464 CD2 LEU A 31 3.165 0.079 2.949 1.00 0.00 C ATOM 0 H LEU A 31 4.470 3.649 2.749 1.00 0.00 H new ATOM 0 HA LEU A 31 2.321 2.182 1.505 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.695 3.203 4.336 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.460 2.074 3.814 1.00 0.00 H new ATOM 0 HG LEU A 31 4.459 1.567 3.796 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.973 -0.073 5.540 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.532 1.579 6.035 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.266 0.431 5.536 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.839 -0.750 3.167 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.133 -0.256 3.054 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.333 0.425 1.929 1.00 0.00 H new ATOM 476 N ARG A 32 1.918 5.318 2.358 1.00 0.00 N ATOM 477 CA ARG A 32 1.051 6.500 2.222 1.00 0.00 C ATOM 478 C ARG A 32 0.629 6.689 0.766 1.00 0.00 C ATOM 479 O ARG A 32 -0.550 6.867 0.481 1.00 0.00 O ATOM 480 CB ARG A 32 1.769 7.743 2.785 1.00 0.00 C ATOM 481 CG ARG A 32 1.135 9.104 2.447 1.00 0.00 C ATOM 482 CD ARG A 32 1.676 9.679 1.156 1.00 0.00 C ATOM 483 NE ARG A 32 1.199 11.070 0.932 1.00 0.00 N ATOM 484 CZ ARG A 32 1.742 11.896 0.050 1.00 0.00 C ATOM 485 NH1 ARG A 32 2.746 11.506 -0.724 1.00 0.00 N ATOM 486 NH2 ARG A 32 1.288 13.135 -0.069 1.00 0.00 N ATOM 0 H ARG A 32 2.843 5.526 2.734 1.00 0.00 H new ATOM 0 HA ARG A 32 0.140 6.351 2.802 1.00 0.00 H new ATOM 0 HB2 ARG A 32 1.819 7.648 3.870 1.00 0.00 H new ATOM 0 HB3 ARG A 32 2.795 7.742 2.417 1.00 0.00 H new ATOM 0 HG2 ARG A 32 0.054 8.990 2.368 1.00 0.00 H new ATOM 0 HG3 ARG A 32 1.323 9.803 3.262 1.00 0.00 H new ATOM 0 HD2 ARG A 32 2.766 9.667 1.181 1.00 0.00 H new ATOM 0 HD3 ARG A 32 1.369 9.050 0.320 1.00 0.00 H new ATOM 0 HE ARG A 32 0.412 11.406 1.487 1.00 0.00 H new ATOM 0 HH11 ARG A 32 3.112 10.557 -0.645 1.00 0.00 H new ATOM 0 HH12 ARG A 32 3.152 12.155 -1.398 1.00 0.00 H new ATOM 0 HH21 ARG A 32 0.519 13.455 0.519 1.00 0.00 H new ATOM 0 HH22 ARG A 32 1.708 13.769 -0.749 1.00 0.00 H new ATOM 500 N LEU A 33 1.600 6.638 -0.150 1.00 0.00 N ATOM 501 CA LEU A 33 1.318 6.807 -1.566 1.00 0.00 C ATOM 502 C LEU A 33 0.486 5.653 -2.095 1.00 0.00 C ATOM 503 O LEU A 33 -0.287 5.804 -3.049 1.00 0.00 O ATOM 504 CB LEU A 33 2.593 6.958 -2.386 1.00 0.00 C ATOM 505 CG LEU A 33 3.660 5.875 -2.162 1.00 0.00 C ATOM 506 CD1 LEU A 33 3.673 4.853 -3.304 1.00 0.00 C ATOM 507 CD2 LEU A 33 5.020 6.526 -1.984 1.00 0.00 C ATOM 0 H LEU A 33 2.584 6.481 0.069 1.00 0.00 H new ATOM 0 HA LEU A 33 0.746 7.729 -1.670 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.325 6.965 -3.443 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.034 7.929 -2.162 1.00 0.00 H new ATOM 0 HG LEU A 33 3.413 5.327 -1.253 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.440 4.102 -3.112 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.699 4.368 -3.370 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.890 5.361 -4.244 1.00 0.00 H new ATOM 0 HD21 LEU A 33 5.774 5.755 -1.825 1.00 0.00 H new ATOM 0 HD22 LEU A 33 5.269 7.099 -2.877 1.00 0.00 H new ATOM 0 HD23 LEU A 33 4.995 7.192 -1.121 1.00 0.00 H new ATOM 519 N MET A 34 0.633 4.486 -1.467 1.00 0.00 N ATOM 520 CA MET A 34 -0.161 3.316 -1.813 1.00 0.00 C ATOM 521 C MET A 34 -1.629 3.605 -1.523 1.00 0.00 C ATOM 522 O MET A 34 -2.499 3.343 -2.353 1.00 0.00 O ATOM 523 CB MET A 34 0.307 2.055 -1.068 1.00 0.00 C ATOM 524 CG MET A 34 -0.694 0.907 -1.103 1.00 0.00 C ATOM 525 SD MET A 34 -2.060 1.147 0.062 1.00 0.00 S ATOM 526 CE MET A 34 -3.108 -0.245 -0.363 1.00 0.00 C ATOM 0 H MET A 34 1.300 4.330 -0.712 1.00 0.00 H new ATOM 0 HA MET A 34 -0.029 3.114 -2.876 1.00 0.00 H new ATOM 0 HB2 MET A 34 1.248 1.717 -1.503 1.00 0.00 H new ATOM 0 HB3 MET A 34 0.511 2.314 -0.029 1.00 0.00 H new ATOM 0 HG2 MET A 34 -1.094 0.808 -2.112 1.00 0.00 H new ATOM 0 HG3 MET A 34 -0.181 -0.026 -0.870 1.00 0.00 H new ATOM 0 HE1 MET A 34 -3.739 -0.499 0.489 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.736 0.019 -1.214 1.00 0.00 H new ATOM 0 HE3 MET A 34 -2.487 -1.102 -0.623 1.00 0.00 H new ATOM 536 N LEU A 35 -1.888 4.193 -0.358 1.00 0.00 N ATOM 537 CA LEU A 35 -3.248 4.493 0.072 1.00 0.00 C ATOM 538 C LEU A 35 -3.869 5.474 -0.897 1.00 0.00 C ATOM 539 O LEU A 35 -5.084 5.464 -1.135 1.00 0.00 O ATOM 540 CB LEU A 35 -3.267 5.026 1.511 1.00 0.00 C ATOM 541 CG LEU A 35 -2.808 4.027 2.596 1.00 0.00 C ATOM 542 CD1 LEU A 35 -2.855 4.665 3.985 1.00 0.00 C ATOM 543 CD2 LEU A 35 -3.652 2.755 2.555 1.00 0.00 C ATOM 0 H LEU A 35 -1.168 4.472 0.308 1.00 0.00 H new ATOM 0 HA LEU A 35 -3.839 3.577 0.070 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -2.629 5.909 1.561 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.280 5.351 1.746 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.773 3.756 2.386 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.527 3.940 4.730 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -2.196 5.533 4.009 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -3.875 4.977 4.208 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.310 2.067 3.328 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.698 3.007 2.730 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.551 2.283 1.578 1.00 0.00 H new ATOM 555 N GLU A 36 -3.032 6.337 -1.460 1.00 0.00 N ATOM 556 CA GLU A 36 -3.489 7.319 -2.431 1.00 0.00 C ATOM 557 C GLU A 36 -3.977 6.623 -3.708 1.00 0.00 C ATOM 558 O GLU A 36 -5.065 6.908 -4.192 1.00 0.00 O ATOM 559 CB GLU A 36 -2.381 8.323 -2.757 1.00 0.00 C ATOM 560 CG GLU A 36 -1.745 8.954 -1.521 1.00 0.00 C ATOM 561 CD GLU A 36 -0.875 10.157 -1.853 1.00 0.00 C ATOM 562 OE1 GLU A 36 0.301 9.962 -2.203 1.00 0.00 O ATOM 563 OE2 GLU A 36 -1.388 11.299 -1.775 1.00 0.00 O ATOM 0 H GLU A 36 -2.033 6.375 -1.259 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.323 7.867 -1.993 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -1.607 7.821 -3.338 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.791 9.112 -3.387 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.531 9.260 -0.830 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -1.141 8.206 -1.007 1.00 0.00 H new ATOM 570 N TYR A 37 -3.176 5.684 -4.241 1.00 0.00 N ATOM 571 CA TYR A 37 -3.508 5.072 -5.528 1.00 0.00 C ATOM 572 C TYR A 37 -4.727 4.160 -5.421 1.00 0.00 C ATOM 573 O TYR A 37 -5.468 4.021 -6.371 1.00 0.00 O ATOM 574 CB TYR A 37 -2.292 4.328 -6.125 1.00 0.00 C ATOM 575 CG TYR A 37 -2.075 2.868 -5.697 1.00 0.00 C ATOM 576 CD1 TYR A 37 -2.957 1.854 -6.074 1.00 0.00 C ATOM 577 CD2 TYR A 37 -0.979 2.500 -4.929 1.00 0.00 C ATOM 578 CE1 TYR A 37 -2.762 0.558 -5.682 1.00 0.00 C ATOM 579 CE2 TYR A 37 -0.768 1.178 -4.559 1.00 0.00 C ATOM 580 CZ TYR A 37 -1.673 0.223 -4.940 1.00 0.00 C ATOM 581 OH TYR A 37 -1.481 -1.104 -4.561 1.00 0.00 O ATOM 0 H TYR A 37 -2.317 5.343 -3.810 1.00 0.00 H new ATOM 0 HA TYR A 37 -3.770 5.877 -6.214 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -2.384 4.350 -7.211 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -1.394 4.891 -5.869 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -3.811 2.098 -6.688 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -0.276 3.257 -4.613 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -3.476 -0.202 -5.963 1.00 0.00 H new ATOM 0 HE2 TYR A 37 0.100 0.906 -3.977 1.00 0.00 H new ATOM 0 HH TYR A 37 -0.657 -1.178 -4.036 1.00 0.00 H new ATOM 591 N ILE A 38 -4.907 3.492 -4.277 1.00 0.00 N ATOM 592 CA ILE A 38 -6.059 2.625 -4.088 1.00 0.00 C ATOM 593 C ILE A 38 -7.351 3.434 -4.026 1.00 0.00 C ATOM 594 O ILE A 38 -8.359 3.060 -4.606 1.00 0.00 O ATOM 595 CB ILE A 38 -5.931 1.705 -2.829 1.00 0.00 C ATOM 596 CG1 ILE A 38 -7.266 1.042 -2.457 1.00 0.00 C ATOM 597 CG2 ILE A 38 -5.368 2.470 -1.625 1.00 0.00 C ATOM 598 CD1 ILE A 38 -7.807 0.104 -3.511 1.00 0.00 C ATOM 0 H ILE A 38 -4.273 3.538 -3.479 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.092 1.970 -4.958 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.228 0.916 -3.097 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.137 0.489 -1.526 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -8.005 1.821 -2.266 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.294 1.798 -0.770 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -4.379 2.857 -1.870 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -6.031 3.299 -1.378 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.751 -0.321 -3.170 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -7.971 0.654 -4.438 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.090 -0.698 -3.687 1.00 0.00 H new ATOM 610 N ALA A 39 -7.305 4.575 -3.326 1.00 0.00 N ATOM 611 CA ALA A 39 -8.452 5.447 -3.215 1.00 0.00 C ATOM 612 C ALA A 39 -8.831 6.040 -4.570 1.00 0.00 C ATOM 613 O ALA A 39 -10.000 6.215 -4.898 1.00 0.00 O ATOM 614 CB ALA A 39 -8.180 6.553 -2.208 1.00 0.00 C ATOM 0 H ALA A 39 -6.477 4.905 -2.831 1.00 0.00 H new ATOM 0 HA ALA A 39 -9.294 4.851 -2.864 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -9.053 7.202 -2.135 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -7.972 6.114 -1.232 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.320 7.138 -2.533 1.00 0.00 H new ATOM 620 N ASP A 40 -7.808 6.369 -5.354 1.00 0.00 N ATOM 621 CA ASP A 40 -8.004 7.004 -6.652 1.00 0.00 C ATOM 622 C ASP A 40 -8.439 6.012 -7.724 1.00 0.00 C ATOM 623 O ASP A 40 -9.284 6.324 -8.564 1.00 0.00 O ATOM 624 CB ASP A 40 -6.690 7.693 -7.082 1.00 0.00 C ATOM 625 CG ASP A 40 -6.819 8.389 -8.437 1.00 0.00 C ATOM 626 OD1 ASP A 40 -7.422 9.484 -8.499 1.00 0.00 O ATOM 627 OD2 ASP A 40 -6.304 7.846 -9.431 1.00 0.00 O ATOM 0 H ASP A 40 -6.831 6.205 -5.111 1.00 0.00 H new ATOM 0 HA ASP A 40 -8.804 7.737 -6.547 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -6.401 8.423 -6.326 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -5.892 6.952 -7.131 1.00 0.00 H new ATOM 632 N ASN A 41 -7.875 4.818 -7.693 1.00 0.00 N ATOM 633 CA ASN A 41 -8.035 3.840 -8.783 1.00 0.00 C ATOM 634 C ASN A 41 -9.070 2.769 -8.451 1.00 0.00 C ATOM 635 O ASN A 41 -9.738 2.274 -9.367 1.00 0.00 O ATOM 636 CB ASN A 41 -6.686 3.190 -9.131 1.00 0.00 C ATOM 637 CG ASN A 41 -5.734 4.181 -9.810 1.00 0.00 C ATOM 638 OD1 ASN A 41 -5.709 4.302 -11.018 1.00 0.00 O ATOM 639 ND2 ASN A 41 -4.942 4.886 -9.035 1.00 0.00 N ATOM 0 H ASN A 41 -7.294 4.489 -6.922 1.00 0.00 H new ATOM 0 HA ASN A 41 -8.401 4.387 -9.652 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -6.223 2.806 -8.222 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -6.853 2.337 -9.789 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -4.288 5.552 -9.445 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -4.981 4.767 -8.023 1.00 0.00 H new ATOM 646 N GLU A 42 -9.209 2.418 -7.172 1.00 0.00 N ATOM 647 CA GLU A 42 -10.159 1.382 -6.747 1.00 0.00 C ATOM 648 C GLU A 42 -10.029 0.092 -7.571 1.00 0.00 C ATOM 649 O GLU A 42 -11.037 -0.507 -7.963 1.00 0.00 O ATOM 650 CB GLU A 42 -11.603 1.925 -6.831 1.00 0.00 C ATOM 651 CG GLU A 42 -11.886 3.075 -5.874 1.00 0.00 C ATOM 652 CD GLU A 42 -13.310 3.595 -5.988 1.00 0.00 C ATOM 653 OE1 GLU A 42 -14.254 2.784 -5.878 1.00 0.00 O ATOM 654 OE2 GLU A 42 -13.492 4.815 -6.191 1.00 0.00 O ATOM 0 H GLU A 42 -8.676 2.835 -6.409 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.921 1.127 -5.714 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.797 2.258 -7.851 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.299 1.112 -6.623 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -11.705 2.744 -4.851 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -11.189 3.889 -6.074 1.00 0.00 H new ATOM 661 N ARG A 43 -8.795 -0.366 -7.791 1.00 0.00 N ATOM 662 CA ARG A 43 -8.564 -1.556 -8.635 1.00 0.00 C ATOM 663 C ARG A 43 -7.299 -2.295 -8.251 1.00 0.00 C ATOM 664 O ARG A 43 -7.234 -3.525 -8.380 1.00 0.00 O ATOM 665 CB ARG A 43 -8.523 -1.153 -10.106 1.00 0.00 C ATOM 666 CG ARG A 43 -7.518 -0.053 -10.426 1.00 0.00 C ATOM 667 CD ARG A 43 -7.522 0.305 -11.911 1.00 0.00 C ATOM 668 NE ARG A 43 -6.733 1.514 -12.184 1.00 0.00 N ATOM 669 CZ ARG A 43 -5.508 1.516 -12.714 1.00 0.00 C ATOM 670 NH1 ARG A 43 -4.919 0.360 -13.026 1.00 0.00 N ATOM 671 NH2 ARG A 43 -4.893 2.663 -12.936 1.00 0.00 N ATOM 0 H ARG A 43 -7.949 0.055 -7.407 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.395 -2.241 -8.471 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -8.285 -2.032 -10.705 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.516 -0.821 -10.408 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -7.751 0.834 -9.838 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -6.519 -0.377 -10.133 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -7.120 -0.529 -12.487 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -8.548 0.458 -12.245 1.00 0.00 H new ATOM 0 HE ARG A 43 -7.151 2.415 -11.952 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -5.405 -0.521 -12.859 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -3.983 0.358 -13.431 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -5.354 3.542 -12.703 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -3.957 2.670 -13.341 1.00 0.00 H new ATOM 685 N LEU A 44 -6.269 -1.578 -7.794 1.00 0.00 N ATOM 686 CA LEU A 44 -4.975 -2.165 -7.434 1.00 0.00 C ATOM 687 C LEU A 44 -4.242 -2.668 -8.691 1.00 0.00 C ATOM 688 O LEU A 44 -4.867 -2.903 -9.719 1.00 0.00 O ATOM 689 CB LEU A 44 -5.146 -3.324 -6.434 1.00 0.00 C ATOM 690 CG LEU A 44 -5.716 -2.935 -5.052 1.00 0.00 C ATOM 691 CD1 LEU A 44 -6.029 -4.175 -4.215 1.00 0.00 C ATOM 692 CD2 LEU A 44 -4.743 -2.022 -4.307 1.00 0.00 C ATOM 0 H LEU A 44 -6.309 -0.567 -7.662 1.00 0.00 H new ATOM 0 HA LEU A 44 -4.380 -1.385 -6.959 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.802 -4.071 -6.880 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -4.176 -3.799 -6.286 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.648 -2.393 -5.215 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.429 -3.870 -3.248 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -6.765 -4.788 -4.735 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -5.117 -4.752 -4.065 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -5.162 -1.759 -3.336 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.795 -2.540 -4.165 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.577 -1.115 -4.888 1.00 0.00 H new ATOM 812 N MET B 101 5.172 -13.948 11.230 1.00 0.00 N ATOM 813 CA MET B 101 4.610 -12.656 10.769 1.00 0.00 C ATOM 814 C MET B 101 4.890 -11.562 11.782 1.00 0.00 C ATOM 815 O MET B 101 4.957 -11.817 12.991 1.00 0.00 O ATOM 816 CB MET B 101 3.103 -12.796 10.517 1.00 0.00 C ATOM 817 CG MET B 101 2.360 -11.466 10.424 1.00 0.00 C ATOM 818 SD MET B 101 0.617 -11.687 9.996 1.00 0.00 S ATOM 819 CE MET B 101 0.758 -12.395 8.345 1.00 0.00 C ATOM 0 HA MET B 101 5.092 -12.378 9.832 1.00 0.00 H new ATOM 0 HB2 MET B 101 2.950 -13.351 9.591 1.00 0.00 H new ATOM 0 HB3 MET B 101 2.665 -13.389 11.320 1.00 0.00 H new ATOM 0 HG2 MET B 101 2.435 -10.942 11.377 1.00 0.00 H new ATOM 0 HG3 MET B 101 2.839 -10.835 9.675 1.00 0.00 H new ATOM 0 HE1 MET B 101 0.036 -11.918 7.682 1.00 0.00 H new ATOM 0 HE2 MET B 101 1.766 -12.230 7.963 1.00 0.00 H new ATOM 0 HE3 MET B 101 0.558 -13.466 8.390 1.00 0.00 H new ATOM 829 N GLY B 102 5.055 -10.332 11.293 1.00 0.00 N ATOM 830 CA GLY B 102 5.282 -9.200 12.168 1.00 0.00 C ATOM 831 C GLY B 102 4.320 -8.069 11.854 1.00 0.00 C ATOM 832 O GLY B 102 3.783 -7.982 10.749 1.00 0.00 O ATOM 0 H GLY B 102 5.034 -10.103 10.299 1.00 0.00 H new ATOM 0 HA2 GLY B 102 5.160 -9.508 13.206 1.00 0.00 H new ATOM 0 HA3 GLY B 102 6.309 -8.850 12.058 1.00 0.00 H new ATOM 836 N SER B 103 4.104 -7.218 12.855 1.00 0.00 N ATOM 837 CA SER B 103 3.219 -6.071 12.701 1.00 0.00 C ATOM 838 C SER B 103 4.022 -4.770 12.723 1.00 0.00 C ATOM 839 O SER B 103 5.000 -4.655 13.476 1.00 0.00 O ATOM 840 CB SER B 103 2.155 -6.063 13.790 1.00 0.00 C ATOM 841 OG SER B 103 2.744 -6.283 15.086 1.00 0.00 O ATOM 0 H SER B 103 4.530 -7.303 13.778 1.00 0.00 H new ATOM 0 HA SER B 103 2.718 -6.151 11.736 1.00 0.00 H new ATOM 0 HB2 SER B 103 1.629 -5.109 13.783 1.00 0.00 H new ATOM 0 HB3 SER B 103 1.415 -6.837 13.586 1.00 0.00 H new ATOM 0 HG SER B 103 2.043 -6.272 15.770 1.00 0.00 H new ATOM 847 N ILE B 104 3.607 -3.828 11.904 1.00 0.00 N ATOM 848 CA ILE B 104 4.251 -2.516 11.838 1.00 0.00 C ATOM 849 C ILE B 104 3.215 -1.436 12.048 1.00 0.00 C ATOM 850 O ILE B 104 2.003 -1.686 11.972 1.00 0.00 O ATOM 851 CB ILE B 104 4.951 -2.291 10.456 1.00 0.00 C ATOM 852 CG1 ILE B 104 3.914 -2.198 9.313 1.00 0.00 C ATOM 853 CG2 ILE B 104 5.945 -3.425 10.165 1.00 0.00 C ATOM 854 CD1 ILE B 104 3.555 -0.774 8.895 1.00 0.00 C ATOM 0 H ILE B 104 2.820 -3.940 11.265 1.00 0.00 H new ATOM 0 HA ILE B 104 5.010 -2.473 12.619 1.00 0.00 H new ATOM 0 HB ILE B 104 5.492 -1.346 10.509 1.00 0.00 H new ATOM 0 HG12 ILE B 104 4.301 -2.731 8.445 1.00 0.00 H new ATOM 0 HG13 ILE B 104 3.004 -2.712 9.623 1.00 0.00 H new ATOM 0 HG21 ILE B 104 6.422 -3.252 9.200 1.00 0.00 H new ATOM 0 HG22 ILE B 104 6.705 -3.452 10.946 1.00 0.00 H new ATOM 0 HG23 ILE B 104 5.414 -4.377 10.142 1.00 0.00 H new ATOM 0 HD11 ILE B 104 2.822 -0.805 8.089 1.00 0.00 H new ATOM 0 HD12 ILE B 104 3.135 -0.240 9.747 1.00 0.00 H new ATOM 0 HD13 ILE B 104 4.452 -0.259 8.550 1.00 0.00 H new ATOM 866 N ASN B 105 3.683 -0.213 12.320 1.00 0.00 N ATOM 867 CA ASN B 105 2.805 0.934 12.479 1.00 0.00 C ATOM 868 C ASN B 105 2.919 1.868 11.268 1.00 0.00 C ATOM 869 O ASN B 105 4.023 2.269 10.878 1.00 0.00 O ATOM 870 CB ASN B 105 3.145 1.700 13.774 1.00 0.00 C ATOM 871 CG ASN B 105 2.632 3.139 13.804 1.00 0.00 C ATOM 872 OD1 ASN B 105 3.257 4.013 14.408 1.00 0.00 O ATOM 873 ND2 ASN B 105 1.495 3.388 13.193 1.00 0.00 N ATOM 0 H ASN B 105 4.674 0.001 12.434 1.00 0.00 H new ATOM 0 HA ASN B 105 1.779 0.573 12.547 1.00 0.00 H new ATOM 0 HB2 ASN B 105 2.727 1.159 14.623 1.00 0.00 H new ATOM 0 HB3 ASN B 105 4.227 1.709 13.904 1.00 0.00 H new ATOM 0 HD21 ASN B 105 1.103 4.329 13.209 1.00 0.00 H new ATOM 0 HD22 ASN B 105 1.005 2.640 12.703 1.00 0.00 H new ATOM 880 N LEU B 106 1.784 2.168 10.671 1.00 0.00 N ATOM 881 CA LEU B 106 1.709 3.073 9.525 1.00 0.00 C ATOM 882 C LEU B 106 0.914 4.302 9.976 1.00 0.00 C ATOM 883 O LEU B 106 -0.009 4.155 10.768 1.00 0.00 O ATOM 884 CB LEU B 106 1.055 2.334 8.351 1.00 0.00 C ATOM 885 CG LEU B 106 0.928 3.091 7.016 1.00 0.00 C ATOM 886 CD1 LEU B 106 -0.280 4.008 7.002 1.00 0.00 C ATOM 887 CD2 LEU B 106 2.202 3.877 6.705 1.00 0.00 C ATOM 0 H LEU B 106 0.881 1.794 10.962 1.00 0.00 H new ATOM 0 HA LEU B 106 2.690 3.400 9.182 1.00 0.00 H new ATOM 0 HB2 LEU B 106 1.625 1.423 8.168 1.00 0.00 H new ATOM 0 HB3 LEU B 106 0.056 2.028 8.661 1.00 0.00 H new ATOM 0 HG LEU B 106 0.786 2.343 6.236 1.00 0.00 H new ATOM 0 HD11 LEU B 106 -0.334 4.524 6.043 1.00 0.00 H new ATOM 0 HD12 LEU B 106 -1.185 3.419 7.149 1.00 0.00 H new ATOM 0 HD13 LEU B 106 -0.190 4.741 7.804 1.00 0.00 H new ATOM 0 HD21 LEU B 106 2.084 4.401 5.757 1.00 0.00 H new ATOM 0 HD22 LEU B 106 2.386 4.600 7.499 1.00 0.00 H new ATOM 0 HD23 LEU B 106 3.046 3.190 6.637 1.00 0.00 H new ATOM 899 N ARG B 107 1.272 5.498 9.498 1.00 0.00 N ATOM 900 CA ARG B 107 0.649 6.721 9.982 1.00 0.00 C ATOM 901 C ARG B 107 0.356 7.615 8.778 1.00 0.00 C ATOM 902 O ARG B 107 1.263 7.910 7.985 1.00 0.00 O ATOM 903 CB ARG B 107 1.547 7.453 10.964 1.00 0.00 C ATOM 904 CG ARG B 107 1.889 6.651 12.212 1.00 0.00 C ATOM 905 CD ARG B 107 2.353 7.554 13.355 1.00 0.00 C ATOM 906 NE ARG B 107 2.902 6.786 14.469 1.00 0.00 N ATOM 907 CZ ARG B 107 2.921 7.218 15.742 1.00 0.00 C ATOM 908 NH1 ARG B 107 2.342 8.376 16.056 1.00 0.00 N ATOM 909 NH2 ARG B 107 3.511 6.495 16.674 1.00 0.00 N ATOM 0 H ARG B 107 1.985 5.639 8.782 1.00 0.00 H new ATOM 0 HA ARG B 107 -0.271 6.469 10.509 1.00 0.00 H new ATOM 0 HB2 ARG B 107 2.472 7.729 10.458 1.00 0.00 H new ATOM 0 HB3 ARG B 107 1.059 8.381 11.264 1.00 0.00 H new ATOM 0 HG2 ARG B 107 1.015 6.082 12.530 1.00 0.00 H new ATOM 0 HG3 ARG B 107 2.672 5.929 11.978 1.00 0.00 H new ATOM 0 HD2 ARG B 107 3.108 8.248 12.986 1.00 0.00 H new ATOM 0 HD3 ARG B 107 1.514 8.154 13.707 1.00 0.00 H new ATOM 0 HE ARG B 107 3.295 5.866 14.269 1.00 0.00 H new ATOM 0 HH11 ARG B 107 1.886 8.931 15.332 1.00 0.00 H new ATOM 0 HH12 ARG B 107 2.354 8.707 17.021 1.00 0.00 H new ATOM 0 HH21 ARG B 107 3.952 5.609 16.429 1.00 0.00 H new ATOM 0 HH22 ARG B 107 3.526 6.822 17.640 1.00 0.00 H new ATOM 923 N ILE B 108 -0.886 8.066 8.620 1.00 0.00 N ATOM 924 CA ILE B 108 -1.274 8.947 7.507 1.00 0.00 C ATOM 925 C ILE B 108 -2.397 9.882 7.947 1.00 0.00 C ATOM 926 O ILE B 108 -2.958 9.697 9.031 1.00 0.00 O ATOM 927 CB ILE B 108 -1.780 8.150 6.252 1.00 0.00 C ATOM 928 CG1 ILE B 108 -3.107 7.428 6.528 1.00 0.00 C ATOM 929 CG2 ILE B 108 -0.713 7.184 5.746 1.00 0.00 C ATOM 930 CD1 ILE B 108 -3.083 6.446 7.688 1.00 0.00 C ATOM 0 H ILE B 108 -1.652 7.836 9.253 1.00 0.00 H new ATOM 0 HA ILE B 108 -0.378 9.503 7.230 1.00 0.00 H new ATOM 0 HB ILE B 108 -1.972 8.877 5.463 1.00 0.00 H new ATOM 0 HG12 ILE B 108 -3.875 8.176 6.723 1.00 0.00 H new ATOM 0 HG13 ILE B 108 -3.405 6.893 5.626 1.00 0.00 H new ATOM 0 HG21 ILE B 108 -1.092 6.646 4.877 1.00 0.00 H new ATOM 0 HG22 ILE B 108 0.180 7.743 5.466 1.00 0.00 H new ATOM 0 HG23 ILE B 108 -0.464 6.472 6.533 1.00 0.00 H new ATOM 0 HD11 ILE B 108 -4.067 5.990 7.799 1.00 0.00 H new ATOM 0 HD12 ILE B 108 -2.344 5.669 7.492 1.00 0.00 H new ATOM 0 HD13 ILE B 108 -2.821 6.973 8.606 1.00 0.00 H new ATOM 942 N ASP B 109 -2.727 10.864 7.126 1.00 0.00 N ATOM 943 CA ASP B 109 -3.825 11.748 7.447 1.00 0.00 C ATOM 944 C ASP B 109 -5.143 10.981 7.361 1.00 0.00 C ATOM 945 O ASP B 109 -5.350 10.183 6.435 1.00 0.00 O ATOM 946 CB ASP B 109 -3.846 12.978 6.518 1.00 0.00 C ATOM 947 CG ASP B 109 -4.678 14.129 7.080 1.00 0.00 C ATOM 948 OD1 ASP B 109 -5.825 13.894 7.510 1.00 0.00 O ATOM 949 OD2 ASP B 109 -4.192 15.270 7.113 1.00 0.00 O ATOM 0 H ASP B 109 -2.255 11.065 6.244 1.00 0.00 H new ATOM 0 HA ASP B 109 -3.690 12.113 8.465 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -2.825 13.321 6.353 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -4.246 12.687 5.546 1.00 0.00 H new ATOM 954 N ASP B 110 -6.035 11.227 8.301 1.00 0.00 N ATOM 955 CA ASP B 110 -7.291 10.501 8.403 1.00 0.00 C ATOM 956 C ASP B 110 -8.149 10.731 7.165 1.00 0.00 C ATOM 957 O ASP B 110 -8.999 9.895 6.830 1.00 0.00 O ATOM 958 CB ASP B 110 -8.058 10.922 9.658 1.00 0.00 C ATOM 959 CG ASP B 110 -7.228 10.835 10.922 1.00 0.00 C ATOM 960 OD1 ASP B 110 -6.389 11.718 11.174 1.00 0.00 O ATOM 961 OD2 ASP B 110 -7.408 9.863 11.694 1.00 0.00 O ATOM 0 H ASP B 110 -5.910 11.939 9.020 1.00 0.00 H new ATOM 0 HA ASP B 110 -7.060 9.438 8.475 1.00 0.00 H new ATOM 0 HB2 ASP B 110 -8.412 11.945 9.533 1.00 0.00 H new ATOM 0 HB3 ASP B 110 -8.940 10.290 9.766 1.00 0.00 H new ATOM 966 N GLU B 111 -7.956 11.856 6.487 1.00 0.00 N ATOM 967 CA GLU B 111 -8.719 12.183 5.285 1.00 0.00 C ATOM 968 C GLU B 111 -8.386 11.187 4.174 1.00 0.00 C ATOM 969 O GLU B 111 -9.270 10.753 3.433 1.00 0.00 O ATOM 970 CB GLU B 111 -8.482 13.630 4.828 1.00 0.00 C ATOM 971 CG GLU B 111 -7.048 14.038 4.585 1.00 0.00 C ATOM 972 CD GLU B 111 -6.492 13.640 3.224 1.00 0.00 C ATOM 973 OE1 GLU B 111 -7.284 13.599 2.254 1.00 0.00 O ATOM 974 OE2 GLU B 111 -5.281 13.370 3.124 1.00 0.00 O ATOM 0 H GLU B 111 -7.271 12.564 6.751 1.00 0.00 H new ATOM 0 HA GLU B 111 -9.780 12.104 5.524 1.00 0.00 H new ATOM 0 HB2 GLU B 111 -9.043 13.792 3.907 1.00 0.00 H new ATOM 0 HB3 GLU B 111 -8.903 14.298 5.580 1.00 0.00 H new ATOM 0 HG2 GLU B 111 -6.970 15.120 4.691 1.00 0.00 H new ATOM 0 HG3 GLU B 111 -6.423 13.596 5.361 1.00 0.00 H new ATOM 981 N LEU B 112 -7.123 10.794 4.096 1.00 0.00 N ATOM 982 CA LEU B 112 -6.664 9.884 3.069 1.00 0.00 C ATOM 983 C LEU B 112 -7.074 8.470 3.468 1.00 0.00 C ATOM 984 O LEU B 112 -7.630 7.717 2.682 1.00 0.00 O ATOM 985 CB LEU B 112 -5.141 9.966 2.918 1.00 0.00 C ATOM 986 CG LEU B 112 -4.532 9.024 1.872 1.00 0.00 C ATOM 987 CD1 LEU B 112 -5.050 9.375 0.477 1.00 0.00 C ATOM 988 CD2 LEU B 112 -3.000 9.089 1.921 1.00 0.00 C ATOM 0 H LEU B 112 -6.394 11.098 4.742 1.00 0.00 H new ATOM 0 HA LEU B 112 -7.111 10.152 2.112 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -4.873 10.990 2.659 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -4.685 9.752 3.885 1.00 0.00 H new ATOM 0 HG LEU B 112 -4.835 8.002 2.101 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -4.610 8.699 -0.256 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -6.135 9.276 0.456 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -4.775 10.401 0.234 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -2.583 8.415 1.173 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -2.672 10.108 1.714 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -2.655 8.791 2.911 1.00 0.00 H new ATOM 1000 N LYS B 113 -6.799 8.165 4.735 1.00 0.00 N ATOM 1001 CA LYS B 113 -7.149 6.871 5.320 1.00 0.00 C ATOM 1002 C LYS B 113 -8.600 6.497 5.024 1.00 0.00 C ATOM 1003 O LYS B 113 -8.894 5.368 4.647 1.00 0.00 O ATOM 1004 CB LYS B 113 -6.897 6.931 6.841 1.00 0.00 C ATOM 1005 CG LYS B 113 -7.267 5.675 7.639 1.00 0.00 C ATOM 1006 CD LYS B 113 -8.747 5.651 8.039 1.00 0.00 C ATOM 1007 CE LYS B 113 -9.036 4.522 9.023 1.00 0.00 C ATOM 1008 NZ LYS B 113 -8.412 4.777 10.351 1.00 0.00 N ATOM 0 H LYS B 113 -6.331 8.801 5.381 1.00 0.00 H new ATOM 0 HA LYS B 113 -6.525 6.097 4.873 1.00 0.00 H new ATOM 0 HB2 LYS B 113 -5.840 7.142 7.005 1.00 0.00 H new ATOM 0 HB3 LYS B 113 -7.457 7.773 7.248 1.00 0.00 H new ATOM 0 HG2 LYS B 113 -7.040 4.790 7.044 1.00 0.00 H new ATOM 0 HG3 LYS B 113 -6.650 5.623 8.536 1.00 0.00 H new ATOM 0 HD2 LYS B 113 -9.020 6.606 8.487 1.00 0.00 H new ATOM 0 HD3 LYS B 113 -9.365 5.528 7.149 1.00 0.00 H new ATOM 0 HE2 LYS B 113 -10.114 4.410 9.143 1.00 0.00 H new ATOM 0 HE3 LYS B 113 -8.661 3.582 8.619 1.00 0.00 H new ATOM 0 HZ1 LYS B 113 -8.840 4.150 11.062 1.00 0.00 H new ATOM 0 HZ2 LYS B 113 -7.390 4.592 10.296 1.00 0.00 H new ATOM 0 HZ3 LYS B 113 -8.570 5.768 10.624 1.00 0.00 H new ATOM 1022 N ALA B 114 -9.498 7.457 5.187 1.00 0.00 N ATOM 1023 CA ALA B 114 -10.922 7.231 4.936 1.00 0.00 C ATOM 1024 C ALA B 114 -11.179 6.773 3.507 1.00 0.00 C ATOM 1025 O ALA B 114 -11.863 5.774 3.284 1.00 0.00 O ATOM 1026 CB ALA B 114 -11.714 8.506 5.249 1.00 0.00 C ATOM 0 H ALA B 114 -9.270 8.403 5.492 1.00 0.00 H new ATOM 0 HA ALA B 114 -11.258 6.430 5.594 1.00 0.00 H new ATOM 0 HB1 ALA B 114 -12.773 8.332 5.060 1.00 0.00 H new ATOM 0 HB2 ALA B 114 -11.571 8.775 6.296 1.00 0.00 H new ATOM 0 HB3 ALA B 114 -11.361 9.319 4.614 1.00 0.00 H new ATOM 1032 N ARG B 115 -10.635 7.487 2.533 1.00 0.00 N ATOM 1033 CA ARG B 115 -10.869 7.174 1.117 1.00 0.00 C ATOM 1034 C ARG B 115 -10.237 5.836 0.730 1.00 0.00 C ATOM 1035 O ARG B 115 -10.882 4.987 0.114 1.00 0.00 O ATOM 1036 CB ARG B 115 -10.359 8.297 0.205 1.00 0.00 C ATOM 1037 CG ARG B 115 -11.272 9.527 0.140 1.00 0.00 C ATOM 1038 CD ARG B 115 -11.352 10.254 1.477 1.00 0.00 C ATOM 1039 NE ARG B 115 -12.387 11.290 1.478 1.00 0.00 N ATOM 1040 CZ ARG B 115 -12.377 12.337 2.293 1.00 0.00 C ATOM 1041 NH1 ARG B 115 -11.358 12.554 3.137 1.00 0.00 N ATOM 1042 NH2 ARG B 115 -13.373 13.233 2.241 1.00 0.00 N ATOM 0 H ARG B 115 -10.026 8.290 2.690 1.00 0.00 H new ATOM 0 HA ARG B 115 -11.947 7.090 0.978 1.00 0.00 H new ATOM 0 HB2 ARG B 115 -9.374 8.609 0.551 1.00 0.00 H new ATOM 0 HB3 ARG B 115 -10.232 7.901 -0.802 1.00 0.00 H new ATOM 0 HG2 ARG B 115 -10.902 10.212 -0.623 1.00 0.00 H new ATOM 0 HG3 ARG B 115 -12.272 9.220 -0.165 1.00 0.00 H new ATOM 0 HD2 ARG B 115 -11.559 9.534 2.269 1.00 0.00 H new ATOM 0 HD3 ARG B 115 -10.386 10.706 1.702 1.00 0.00 H new ATOM 0 HE ARG B 115 -13.158 11.202 0.816 1.00 0.00 H new ATOM 0 HH11 ARG B 115 -10.569 11.908 3.161 1.00 0.00 H new ATOM 0 HH12 ARG B 115 -11.371 13.366 3.755 1.00 0.00 H new ATOM 0 HH21 ARG B 115 -14.136 13.109 1.576 1.00 0.00 H new ATOM 0 HH22 ARG B 115 -13.367 14.039 2.867 1.00 0.00 H new ATOM 1056 N SER B 116 -8.989 5.652 1.106 1.00 0.00 N ATOM 1057 CA SER B 116 -8.224 4.458 0.776 1.00 0.00 C ATOM 1058 C SER B 116 -8.905 3.196 1.311 1.00 0.00 C ATOM 1059 O SER B 116 -9.213 2.273 0.555 1.00 0.00 O ATOM 1060 CB SER B 116 -6.818 4.578 1.357 1.00 0.00 C ATOM 1061 OG SER B 116 -6.307 5.873 1.145 1.00 0.00 O ATOM 0 H SER B 116 -8.467 6.333 1.657 1.00 0.00 H new ATOM 0 HA SER B 116 -8.168 4.374 -0.309 1.00 0.00 H new ATOM 0 HB2 SER B 116 -6.839 4.359 2.425 1.00 0.00 H new ATOM 0 HB3 SER B 116 -6.162 3.841 0.893 1.00 0.00 H new ATOM 0 HG SER B 116 -5.987 5.951 0.222 1.00 0.00 H new ATOM 1067 N TYR B 117 -9.128 3.170 2.626 1.00 0.00 N ATOM 1068 CA TYR B 117 -9.704 2.019 3.294 1.00 0.00 C ATOM 1069 C TYR B 117 -11.106 1.735 2.787 1.00 0.00 C ATOM 1070 O TYR B 117 -11.476 0.574 2.595 1.00 0.00 O ATOM 1071 CB TYR B 117 -9.686 2.212 4.817 1.00 0.00 C ATOM 1072 CG TYR B 117 -8.306 2.021 5.426 1.00 0.00 C ATOM 1073 CD1 TYR B 117 -7.270 2.900 5.143 1.00 0.00 C ATOM 1074 CD2 TYR B 117 -8.035 0.928 6.260 1.00 0.00 C ATOM 1075 CE1 TYR B 117 -6.003 2.723 5.670 1.00 0.00 C ATOM 1076 CE2 TYR B 117 -6.770 0.750 6.784 1.00 0.00 C ATOM 1077 CZ TYR B 117 -5.760 1.638 6.494 1.00 0.00 C ATOM 1078 OH TYR B 117 -4.508 1.458 7.017 1.00 0.00 O ATOM 0 H TYR B 117 -8.912 3.948 3.250 1.00 0.00 H new ATOM 0 HA TYR B 117 -9.092 1.148 3.059 1.00 0.00 H new ATOM 0 HB2 TYR B 117 -10.046 3.213 5.055 1.00 0.00 H new ATOM 0 HB3 TYR B 117 -10.379 1.507 5.275 1.00 0.00 H new ATOM 0 HD1 TYR B 117 -7.457 3.743 4.495 1.00 0.00 H new ATOM 0 HD2 TYR B 117 -8.818 0.222 6.494 1.00 0.00 H new ATOM 0 HE1 TYR B 117 -5.213 3.423 5.441 1.00 0.00 H new ATOM 0 HE2 TYR B 117 -6.572 -0.094 7.428 1.00 0.00 H new ATOM 0 HH TYR B 117 -3.867 2.020 6.533 1.00 0.00 H new ATOM 1088 N ALA B 118 -11.860 2.791 2.548 1.00 0.00 N ATOM 1089 CA ALA B 118 -13.210 2.664 2.016 1.00 0.00 C ATOM 1090 C ALA B 118 -13.198 1.975 0.662 1.00 0.00 C ATOM 1091 O ALA B 118 -14.025 1.113 0.360 1.00 0.00 O ATOM 1092 CB ALA B 118 -13.885 4.031 1.903 1.00 0.00 C ATOM 0 H ALA B 118 -11.562 3.752 2.714 1.00 0.00 H new ATOM 0 HA ALA B 118 -13.782 2.051 2.712 1.00 0.00 H new ATOM 0 HB1 ALA B 118 -14.892 3.908 1.503 1.00 0.00 H new ATOM 0 HB2 ALA B 118 -13.940 4.492 2.889 1.00 0.00 H new ATOM 0 HB3 ALA B 118 -13.305 4.669 1.236 1.00 0.00 H new ATOM 1098 N ALA B 119 -12.235 2.371 -0.171 1.00 0.00 N ATOM 1099 CA ALA B 119 -12.089 1.835 -1.519 1.00 0.00 C ATOM 1100 C ALA B 119 -11.810 0.334 -1.512 1.00 0.00 C ATOM 1101 O ALA B 119 -12.431 -0.423 -2.259 1.00 0.00 O ATOM 1102 CB ALA B 119 -10.991 2.585 -2.265 1.00 0.00 C ATOM 0 H ALA B 119 -11.536 3.072 0.073 1.00 0.00 H new ATOM 0 HA ALA B 119 -13.036 1.981 -2.038 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -10.890 2.177 -3.271 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -11.250 3.642 -2.327 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -10.047 2.473 -1.732 1.00 0.00 H new ATOM 1108 N LEU B 120 -10.882 -0.096 -0.658 1.00 0.00 N ATOM 1109 CA LEU B 120 -10.472 -1.494 -0.645 1.00 0.00 C ATOM 1110 C LEU B 120 -11.540 -2.388 -0.020 1.00 0.00 C ATOM 1111 O LEU B 120 -11.779 -3.486 -0.516 1.00 0.00 O ATOM 1112 CB LEU B 120 -9.090 -1.647 0.040 1.00 0.00 C ATOM 1113 CG LEU B 120 -8.968 -1.107 1.478 1.00 0.00 C ATOM 1114 CD1 LEU B 120 -9.476 -2.132 2.494 1.00 0.00 C ATOM 1115 CD2 LEU B 120 -7.521 -0.703 1.778 1.00 0.00 C ATOM 0 H LEU B 120 -10.407 0.496 0.024 1.00 0.00 H new ATOM 0 HA LEU B 120 -10.363 -1.831 -1.676 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -8.831 -2.706 0.051 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -8.346 -1.143 -0.577 1.00 0.00 H new ATOM 0 HG LEU B 120 -9.594 -0.219 1.564 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -9.379 -1.726 3.501 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -10.524 -2.355 2.293 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -8.888 -3.046 2.413 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -7.453 -0.324 2.798 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -6.871 -1.571 1.670 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -7.208 0.074 1.080 1.00 0.00 H new ATOM 1127 N GLU B 121 -12.207 -1.916 1.025 1.00 0.00 N ATOM 1128 CA GLU B 121 -13.267 -2.701 1.654 1.00 0.00 C ATOM 1129 C GLU B 121 -14.480 -2.773 0.737 1.00 0.00 C ATOM 1130 O GLU B 121 -15.278 -3.703 0.796 1.00 0.00 O ATOM 1131 CB GLU B 121 -13.666 -2.096 3.018 1.00 0.00 C ATOM 1132 CG GLU B 121 -14.189 -0.663 2.936 1.00 0.00 C ATOM 1133 CD GLU B 121 -14.755 -0.158 4.258 1.00 0.00 C ATOM 1134 OE1 GLU B 121 -13.992 0.396 5.079 1.00 0.00 O ATOM 1135 OE2 GLU B 121 -15.969 -0.298 4.466 1.00 0.00 O ATOM 0 H GLU B 121 -12.038 -1.005 1.452 1.00 0.00 H new ATOM 0 HA GLU B 121 -12.890 -3.709 1.825 1.00 0.00 H new ATOM 0 HB2 GLU B 121 -14.431 -2.725 3.472 1.00 0.00 H new ATOM 0 HB3 GLU B 121 -12.801 -2.118 3.680 1.00 0.00 H new ATOM 0 HG2 GLU B 121 -13.380 -0.005 2.618 1.00 0.00 H new ATOM 0 HG3 GLU B 121 -14.964 -0.608 2.171 1.00 0.00 H new ATOM 1142 N LYS B 122 -14.577 -1.797 -0.137 1.00 0.00 N ATOM 1143 CA LYS B 122 -15.618 -1.738 -1.130 1.00 0.00 C ATOM 1144 C LYS B 122 -15.403 -2.824 -2.171 1.00 0.00 C ATOM 1145 O LYS B 122 -16.313 -3.597 -2.515 1.00 0.00 O ATOM 1146 CB LYS B 122 -15.608 -0.356 -1.793 1.00 0.00 C ATOM 1147 CG LYS B 122 -16.654 -0.153 -2.856 1.00 0.00 C ATOM 1148 CD LYS B 122 -16.497 1.215 -3.501 1.00 0.00 C ATOM 1149 CE LYS B 122 -17.526 1.439 -4.582 1.00 0.00 C ATOM 1150 NZ LYS B 122 -17.396 0.451 -5.695 1.00 0.00 N ATOM 0 H LYS B 122 -13.925 -1.013 -0.176 1.00 0.00 H new ATOM 0 HA LYS B 122 -16.585 -1.900 -0.655 1.00 0.00 H new ATOM 0 HB2 LYS B 122 -15.744 0.402 -1.021 1.00 0.00 H new ATOM 0 HB3 LYS B 122 -14.626 -0.188 -2.234 1.00 0.00 H new ATOM 0 HG2 LYS B 122 -16.567 -0.931 -3.614 1.00 0.00 H new ATOM 0 HG3 LYS B 122 -17.648 -0.244 -2.419 1.00 0.00 H new ATOM 0 HD2 LYS B 122 -16.592 1.990 -2.740 1.00 0.00 H new ATOM 0 HD3 LYS B 122 -15.497 1.306 -3.925 1.00 0.00 H new ATOM 0 HE2 LYS B 122 -18.525 1.370 -4.151 1.00 0.00 H new ATOM 0 HE3 LYS B 122 -17.420 2.448 -4.980 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 -17.963 0.767 -6.507 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 -16.398 0.376 -5.978 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 -17.736 -0.478 -5.376 1.00 0.00 H new ATOM 1164 N MET B 123 -14.161 -2.903 -2.648 1.00 0.00 N ATOM 1165 CA MET B 123 -13.731 -3.961 -3.561 1.00 0.00 C ATOM 1166 C MET B 123 -13.821 -5.334 -2.890 1.00 0.00 C ATOM 1167 O MET B 123 -13.831 -6.376 -3.558 1.00 0.00 O ATOM 1168 CB MET B 123 -12.287 -3.703 -4.017 1.00 0.00 C ATOM 1169 CG MET B 123 -12.099 -2.399 -4.768 1.00 0.00 C ATOM 1170 SD MET B 123 -10.378 -1.892 -4.882 1.00 0.00 S ATOM 1171 CE MET B 123 -9.604 -3.395 -5.477 1.00 0.00 C ATOM 0 H MET B 123 -13.426 -2.236 -2.413 1.00 0.00 H new ATOM 0 HA MET B 123 -14.394 -3.955 -4.426 1.00 0.00 H new ATOM 0 HB2 MET B 123 -11.636 -3.704 -3.143 1.00 0.00 H new ATOM 0 HB3 MET B 123 -11.966 -4.527 -4.655 1.00 0.00 H new ATOM 0 HG2 MET B 123 -12.508 -2.503 -5.773 1.00 0.00 H new ATOM 0 HG3 MET B 123 -12.670 -1.615 -4.271 1.00 0.00 H new ATOM 0 HE1 MET B 123 -8.675 -3.147 -5.990 1.00 0.00 H new ATOM 0 HE2 MET B 123 -9.389 -4.052 -4.634 1.00 0.00 H new ATOM 0 HE3 MET B 123 -10.277 -3.901 -6.169 1.00 0.00 H new ATOM 1181 N GLY B 124 -13.901 -5.322 -1.554 1.00 0.00 N ATOM 1182 CA GLY B 124 -14.002 -6.557 -0.795 1.00 0.00 C ATOM 1183 C GLY B 124 -12.635 -7.114 -0.448 1.00 0.00 C ATOM 1184 O GLY B 124 -12.476 -8.330 -0.290 1.00 0.00 O ATOM 0 H GLY B 124 -13.897 -4.474 -0.987 1.00 0.00 H new ATOM 0 HA2 GLY B 124 -14.565 -6.377 0.121 1.00 0.00 H new ATOM 0 HA3 GLY B 124 -14.560 -7.294 -1.372 1.00 0.00 H new ATOM 1188 N VAL B 125 -11.652 -6.228 -0.322 1.00 0.00 N ATOM 1189 CA VAL B 125 -10.285 -6.610 0.017 1.00 0.00 C ATOM 1190 C VAL B 125 -9.963 -6.210 1.455 1.00 0.00 C ATOM 1191 O VAL B 125 -10.416 -5.175 1.934 1.00 0.00 O ATOM 1192 CB VAL B 125 -9.275 -5.928 -0.950 1.00 0.00 C ATOM 1193 CG1 VAL B 125 -7.854 -6.427 -0.691 1.00 0.00 C ATOM 1194 CG2 VAL B 125 -9.683 -6.163 -2.408 1.00 0.00 C ATOM 0 H VAL B 125 -11.781 -5.225 -0.452 1.00 0.00 H new ATOM 0 HA VAL B 125 -10.199 -7.692 -0.082 1.00 0.00 H new ATOM 0 HB VAL B 125 -9.292 -4.854 -0.762 1.00 0.00 H new ATOM 0 HG11 VAL B 125 -7.165 -5.937 -1.379 1.00 0.00 H new ATOM 0 HG12 VAL B 125 -7.568 -6.196 0.335 1.00 0.00 H new ATOM 0 HG13 VAL B 125 -7.813 -7.505 -0.844 1.00 0.00 H new ATOM 0 HG21 VAL B 125 -8.965 -5.679 -3.069 1.00 0.00 H new ATOM 0 HG22 VAL B 125 -9.700 -7.233 -2.613 1.00 0.00 H new ATOM 0 HG23 VAL B 125 -10.675 -5.744 -2.580 1.00 0.00 H new ATOM 1204 N THR B 126 -9.206 -7.057 2.144 1.00 0.00 N ATOM 1205 CA THR B 126 -8.743 -6.753 3.487 1.00 0.00 C ATOM 1206 C THR B 126 -7.634 -5.697 3.434 1.00 0.00 C ATOM 1207 O THR B 126 -6.757 -5.770 2.575 1.00 0.00 O ATOM 1208 CB THR B 126 -8.214 -8.047 4.152 1.00 0.00 C ATOM 1209 OG1 THR B 126 -9.247 -9.043 4.179 1.00 0.00 O ATOM 1210 CG2 THR B 126 -7.710 -7.786 5.566 1.00 0.00 C ATOM 0 H THR B 126 -8.900 -7.963 1.790 1.00 0.00 H new ATOM 0 HA THR B 126 -9.572 -6.358 4.075 1.00 0.00 H new ATOM 0 HB THR B 126 -7.374 -8.407 3.558 1.00 0.00 H new ATOM 0 HG1 THR B 126 -8.904 -9.859 4.600 1.00 0.00 H new ATOM 0 HG21 THR B 126 -7.347 -8.717 6.000 1.00 0.00 H new ATOM 0 HG22 THR B 126 -6.898 -7.059 5.535 1.00 0.00 H new ATOM 0 HG23 THR B 126 -8.524 -7.394 6.176 1.00 0.00 H new ATOM 1218 N PRO B 127 -7.674 -4.679 4.327 1.00 0.00 N ATOM 1219 CA PRO B 127 -6.633 -3.645 4.385 1.00 0.00 C ATOM 1220 C PRO B 127 -5.230 -4.249 4.448 1.00 0.00 C ATOM 1221 O PRO B 127 -4.351 -3.869 3.696 1.00 0.00 O ATOM 1222 CB PRO B 127 -6.964 -2.849 5.665 1.00 0.00 C ATOM 1223 CG PRO B 127 -7.950 -3.689 6.408 1.00 0.00 C ATOM 1224 CD PRO B 127 -8.713 -4.454 5.351 1.00 0.00 C ATOM 0 HA PRO B 127 -6.627 -3.019 3.493 1.00 0.00 H new ATOM 0 HB2 PRO B 127 -6.069 -2.673 6.261 1.00 0.00 H new ATOM 0 HB3 PRO B 127 -7.383 -1.872 5.423 1.00 0.00 H new ATOM 0 HG2 PRO B 127 -7.446 -4.368 7.096 1.00 0.00 H new ATOM 0 HG3 PRO B 127 -8.621 -3.070 7.005 1.00 0.00 H new ATOM 0 HD2 PRO B 127 -9.116 -5.391 5.736 1.00 0.00 H new ATOM 0 HD3 PRO B 127 -9.554 -3.882 4.960 1.00 0.00 H new ATOM 1232 N SER B 128 -5.078 -5.239 5.332 1.00 0.00 N ATOM 1233 CA SER B 128 -3.811 -5.925 5.502 1.00 0.00 C ATOM 1234 C SER B 128 -3.320 -6.534 4.194 1.00 0.00 C ATOM 1235 O SER B 128 -2.115 -6.624 3.943 1.00 0.00 O ATOM 1236 CB SER B 128 -3.971 -7.011 6.580 1.00 0.00 C ATOM 1237 OG SER B 128 -4.552 -6.469 7.748 1.00 0.00 O ATOM 0 H SER B 128 -5.824 -5.578 5.939 1.00 0.00 H new ATOM 0 HA SER B 128 -3.060 -5.200 5.817 1.00 0.00 H new ATOM 0 HB2 SER B 128 -4.594 -7.820 6.199 1.00 0.00 H new ATOM 0 HB3 SER B 128 -2.998 -7.442 6.817 1.00 0.00 H new ATOM 0 HG SER B 128 -4.648 -7.173 8.423 1.00 0.00 H new ATOM 1243 N GLU B 129 -4.252 -6.918 3.318 1.00 0.00 N ATOM 1244 CA GLU B 129 -3.924 -7.539 2.057 1.00 0.00 C ATOM 1245 C GLU B 129 -3.480 -6.504 1.040 1.00 0.00 C ATOM 1246 O GLU B 129 -2.473 -6.692 0.383 1.00 0.00 O ATOM 1247 CB GLU B 129 -5.111 -8.341 1.532 1.00 0.00 C ATOM 1248 CG GLU B 129 -5.465 -9.515 2.428 1.00 0.00 C ATOM 1249 CD GLU B 129 -4.357 -10.547 2.511 1.00 0.00 C ATOM 1250 OE1 GLU B 129 -4.250 -11.380 1.586 1.00 0.00 O ATOM 1251 OE2 GLU B 129 -3.581 -10.530 3.482 1.00 0.00 O ATOM 0 H GLU B 129 -5.253 -6.802 3.475 1.00 0.00 H new ATOM 0 HA GLU B 129 -3.092 -8.224 2.221 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -5.976 -7.685 1.441 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -4.883 -8.708 0.531 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -5.688 -9.147 3.429 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -6.371 -9.991 2.054 1.00 0.00 H new ATOM 1258 N ALA B 130 -4.227 -5.403 0.916 1.00 0.00 N ATOM 1259 CA ALA B 130 -3.864 -4.345 -0.029 1.00 0.00 C ATOM 1260 C ALA B 130 -2.474 -3.785 0.254 1.00 0.00 C ATOM 1261 O ALA B 130 -1.731 -3.468 -0.664 1.00 0.00 O ATOM 1262 CB ALA B 130 -4.910 -3.239 -0.007 1.00 0.00 C ATOM 0 H ALA B 130 -5.076 -5.223 1.451 1.00 0.00 H new ATOM 0 HA ALA B 130 -3.836 -4.783 -1.027 1.00 0.00 H new ATOM 0 HB1 ALA B 130 -4.629 -2.458 -0.714 1.00 0.00 H new ATOM 0 HB2 ALA B 130 -5.880 -3.650 -0.287 1.00 0.00 H new ATOM 0 HB3 ALA B 130 -4.971 -2.816 0.996 1.00 0.00 H new ATOM 1268 N LEU B 131 -2.144 -3.654 1.528 1.00 0.00 N ATOM 1269 CA LEU B 131 -0.806 -3.193 1.911 1.00 0.00 C ATOM 1270 C LEU B 131 0.224 -4.301 1.678 1.00 0.00 C ATOM 1271 O LEU B 131 1.366 -4.024 1.302 1.00 0.00 O ATOM 1272 CB LEU B 131 -0.778 -2.711 3.376 1.00 0.00 C ATOM 1273 CG LEU B 131 -1.334 -1.319 3.657 1.00 0.00 C ATOM 1274 CD1 LEU B 131 -0.594 -0.265 2.820 1.00 0.00 C ATOM 1275 CD2 LEU B 131 -2.845 -1.249 3.407 1.00 0.00 C ATOM 0 H LEU B 131 -2.768 -3.855 2.309 1.00 0.00 H new ATOM 0 HA LEU B 131 -0.546 -2.342 1.282 1.00 0.00 H new ATOM 0 HB2 LEU B 131 -1.336 -3.427 3.979 1.00 0.00 H new ATOM 0 HB3 LEU B 131 0.255 -2.740 3.722 1.00 0.00 H new ATOM 0 HG LEU B 131 -1.169 -1.105 4.713 1.00 0.00 H new ATOM 0 HD11 LEU B 131 -1.004 0.722 3.033 1.00 0.00 H new ATOM 0 HD12 LEU B 131 0.467 -0.280 3.071 1.00 0.00 H new ATOM 0 HD13 LEU B 131 -0.719 -0.489 1.760 1.00 0.00 H new ATOM 0 HD21 LEU B 131 -3.202 -0.241 3.618 1.00 0.00 H new ATOM 0 HD22 LEU B 131 -3.053 -1.497 2.366 1.00 0.00 H new ATOM 0 HD23 LEU B 131 -3.355 -1.959 4.058 1.00 0.00 H new ATOM 1287 N ARG B 132 -0.197 -5.542 1.906 1.00 0.00 N ATOM 1288 CA ARG B 132 0.684 -6.704 1.722 1.00 0.00 C ATOM 1289 C ARG B 132 1.176 -6.799 0.272 1.00 0.00 C ATOM 1290 O ARG B 132 2.369 -6.973 0.029 1.00 0.00 O ATOM 1291 CB ARG B 132 -0.032 -7.997 2.163 1.00 0.00 C ATOM 1292 CG ARG B 132 0.773 -9.289 1.928 1.00 0.00 C ATOM 1293 CD ARG B 132 0.488 -9.921 0.572 1.00 0.00 C ATOM 1294 NE ARG B 132 -0.907 -10.344 0.452 1.00 0.00 N ATOM 1295 CZ ARG B 132 -1.552 -10.566 -0.704 1.00 0.00 C ATOM 1296 NH1 ARG B 132 -0.946 -10.368 -1.867 1.00 0.00 N ATOM 1297 NH2 ARG B 132 -2.812 -10.993 -0.699 1.00 0.00 N ATOM 0 H ARG B 132 -1.140 -5.774 2.218 1.00 0.00 H new ATOM 0 HA ARG B 132 1.563 -6.574 2.354 1.00 0.00 H new ATOM 0 HB2 ARG B 132 -0.270 -7.921 3.224 1.00 0.00 H new ATOM 0 HB3 ARG B 132 -0.979 -8.072 1.629 1.00 0.00 H new ATOM 0 HG2 ARG B 132 1.838 -9.068 2.005 1.00 0.00 H new ATOM 0 HG3 ARG B 132 0.539 -10.006 2.715 1.00 0.00 H new ATOM 0 HD2 ARG B 132 0.720 -9.207 -0.218 1.00 0.00 H new ATOM 0 HD3 ARG B 132 1.142 -10.781 0.427 1.00 0.00 H new ATOM 0 HE ARG B 132 -1.432 -10.481 1.316 1.00 0.00 H new ATOM 0 HH11 ARG B 132 0.021 -10.044 -1.890 1.00 0.00 H new ATOM 0 HH12 ARG B 132 -1.447 -10.540 -2.739 1.00 0.00 H new ATOM 0 HH21 ARG B 132 -3.293 -11.153 0.186 1.00 0.00 H new ATOM 0 HH22 ARG B 132 -3.297 -11.160 -1.580 1.00 0.00 H new ATOM 1311 N LEU B 133 0.237 -6.665 -0.680 1.00 0.00 N ATOM 1312 CA LEU B 133 0.580 -6.723 -2.097 1.00 0.00 C ATOM 1313 C LEU B 133 1.440 -5.540 -2.497 1.00 0.00 C ATOM 1314 O LEU B 133 2.252 -5.620 -3.427 1.00 0.00 O ATOM 1315 CB LEU B 133 -0.679 -6.823 -2.954 1.00 0.00 C ATOM 1316 CG LEU B 133 -1.685 -5.672 -2.848 1.00 0.00 C ATOM 1317 CD1 LEU B 133 -1.367 -4.532 -3.817 1.00 0.00 C ATOM 1318 CD2 LEU B 133 -3.080 -6.218 -3.092 1.00 0.00 C ATOM 0 H LEU B 133 -0.754 -6.517 -0.489 1.00 0.00 H new ATOM 0 HA LEU B 133 1.168 -7.624 -2.271 1.00 0.00 H new ATOM 0 HB2 LEU B 133 -0.373 -6.911 -3.997 1.00 0.00 H new ATOM 0 HB3 LEU B 133 -1.194 -7.748 -2.694 1.00 0.00 H new ATOM 0 HG LEU B 133 -1.622 -5.248 -1.846 1.00 0.00 H new ATOM 0 HD11 LEU B 133 -2.108 -3.741 -3.704 1.00 0.00 H new ATOM 0 HD12 LEU B 133 -0.376 -4.135 -3.599 1.00 0.00 H new ATOM 0 HD13 LEU B 133 -1.390 -4.907 -4.840 1.00 0.00 H new ATOM 0 HD21 LEU B 133 -3.806 -5.408 -3.019 1.00 0.00 H new ATOM 0 HD22 LEU B 133 -3.129 -6.660 -4.087 1.00 0.00 H new ATOM 0 HD23 LEU B 133 -3.309 -6.978 -2.345 1.00 0.00 H new ATOM 1330 N MET B 134 1.260 -4.423 -1.784 1.00 0.00 N ATOM 1331 CA MET B 134 2.080 -3.252 -2.002 1.00 0.00 C ATOM 1332 C MET B 134 3.532 -3.570 -1.676 1.00 0.00 C ATOM 1333 O MET B 134 4.441 -3.226 -2.445 1.00 0.00 O ATOM 1334 CB MET B 134 1.578 -2.046 -1.201 1.00 0.00 C ATOM 1335 CG MET B 134 2.586 -0.898 -1.101 1.00 0.00 C ATOM 1336 SD MET B 134 3.926 -1.222 0.077 1.00 0.00 S ATOM 1337 CE MET B 134 4.970 0.198 -0.236 1.00 0.00 C ATOM 0 H MET B 134 0.553 -4.316 -1.056 1.00 0.00 H new ATOM 0 HA MET B 134 2.009 -2.977 -3.054 1.00 0.00 H new ATOM 0 HB2 MET B 134 0.663 -1.673 -1.662 1.00 0.00 H new ATOM 0 HB3 MET B 134 1.317 -2.375 -0.195 1.00 0.00 H new ATOM 0 HG2 MET B 134 3.014 -0.713 -2.086 1.00 0.00 H new ATOM 0 HG3 MET B 134 2.063 0.011 -0.805 1.00 0.00 H new ATOM 0 HE1 MET B 134 5.505 0.464 0.676 1.00 0.00 H new ATOM 0 HE2 MET B 134 5.687 -0.044 -1.020 1.00 0.00 H new ATOM 0 HE3 MET B 134 4.354 1.039 -0.554 1.00 0.00 H new ATOM 1347 N LEU B 135 3.737 -4.248 -0.539 1.00 0.00 N ATOM 1348 CA LEU B 135 5.082 -4.571 -0.083 1.00 0.00 C ATOM 1349 C LEU B 135 5.740 -5.496 -1.100 1.00 0.00 C ATOM 1350 O LEU B 135 6.958 -5.475 -1.288 1.00 0.00 O ATOM 1351 CB LEU B 135 5.045 -5.221 1.300 1.00 0.00 C ATOM 1352 CG LEU B 135 4.554 -4.313 2.451 1.00 0.00 C ATOM 1353 CD1 LEU B 135 4.558 -5.068 3.774 1.00 0.00 C ATOM 1354 CD2 LEU B 135 5.439 -3.057 2.534 1.00 0.00 C ATOM 0 H LEU B 135 2.991 -4.578 0.073 1.00 0.00 H new ATOM 0 HA LEU B 135 5.666 -3.654 0.003 1.00 0.00 H new ATOM 0 HB2 LEU B 135 4.400 -6.098 1.252 1.00 0.00 H new ATOM 0 HB3 LEU B 135 6.047 -5.575 1.542 1.00 0.00 H new ATOM 0 HG LEU B 135 3.528 -4.007 2.247 1.00 0.00 H new ATOM 0 HD11 LEU B 135 4.209 -4.410 4.570 1.00 0.00 H new ATOM 0 HD12 LEU B 135 3.897 -5.932 3.702 1.00 0.00 H new ATOM 0 HD13 LEU B 135 5.571 -5.403 3.999 1.00 0.00 H new ATOM 0 HD21 LEU B 135 5.090 -2.419 3.346 1.00 0.00 H new ATOM 0 HD22 LEU B 135 6.472 -3.351 2.722 1.00 0.00 H new ATOM 0 HD23 LEU B 135 5.383 -2.510 1.593 1.00 0.00 H new ATOM 1366 N GLU B 136 4.936 -6.300 -1.764 1.00 0.00 N ATOM 1367 CA GLU B 136 5.416 -7.207 -2.799 1.00 0.00 C ATOM 1368 C GLU B 136 5.957 -6.414 -3.985 1.00 0.00 C ATOM 1369 O GLU B 136 7.074 -6.660 -4.452 1.00 0.00 O ATOM 1370 CB GLU B 136 4.326 -8.170 -3.235 1.00 0.00 C ATOM 1371 CG GLU B 136 3.644 -8.875 -2.072 1.00 0.00 C ATOM 1372 CD GLU B 136 2.820 -10.078 -2.512 1.00 0.00 C ATOM 1373 OE1 GLU B 136 3.395 -11.157 -2.753 1.00 0.00 O ATOM 1374 OE2 GLU B 136 1.588 -9.952 -2.628 1.00 0.00 O ATOM 0 H GLU B 136 3.930 -6.347 -1.605 1.00 0.00 H new ATOM 0 HA GLU B 136 6.229 -7.803 -2.383 1.00 0.00 H new ATOM 0 HB2 GLU B 136 3.577 -7.624 -3.809 1.00 0.00 H new ATOM 0 HB3 GLU B 136 4.757 -8.917 -3.902 1.00 0.00 H new ATOM 0 HG2 GLU B 136 4.400 -9.200 -1.357 1.00 0.00 H new ATOM 0 HG3 GLU B 136 2.997 -8.168 -1.553 1.00 0.00 H new ATOM 1381 N TYR B 137 5.174 -5.433 -4.480 1.00 0.00 N ATOM 1382 CA TYR B 137 5.552 -4.720 -5.704 1.00 0.00 C ATOM 1383 C TYR B 137 6.770 -3.825 -5.473 1.00 0.00 C ATOM 1384 O TYR B 137 7.563 -3.617 -6.384 1.00 0.00 O ATOM 1385 CB TYR B 137 4.359 -3.934 -6.303 1.00 0.00 C ATOM 1386 CG TYR B 137 4.137 -2.520 -5.766 1.00 0.00 C ATOM 1387 CD1 TYR B 137 5.016 -1.486 -6.047 1.00 0.00 C ATOM 1388 CD2 TYR B 137 3.013 -2.221 -5.005 1.00 0.00 C ATOM 1389 CE1 TYR B 137 4.798 -0.218 -5.577 1.00 0.00 C ATOM 1390 CE2 TYR B 137 2.793 -0.946 -4.526 1.00 0.00 C ATOM 1391 CZ TYR B 137 3.692 0.045 -4.809 1.00 0.00 C ATOM 1392 OH TYR B 137 3.471 1.328 -4.332 1.00 0.00 O ATOM 0 H TYR B 137 4.297 -5.126 -4.058 1.00 0.00 H new ATOM 0 HA TYR B 137 5.837 -5.468 -6.443 1.00 0.00 H new ATOM 0 HB2 TYR B 137 4.499 -3.871 -7.382 1.00 0.00 H new ATOM 0 HB3 TYR B 137 3.450 -4.511 -6.132 1.00 0.00 H new ATOM 0 HD1 TYR B 137 5.891 -1.684 -6.649 1.00 0.00 H new ATOM 0 HD2 TYR B 137 2.299 -3.001 -4.785 1.00 0.00 H new ATOM 0 HE1 TYR B 137 5.495 0.573 -5.810 1.00 0.00 H new ATOM 0 HE2 TYR B 137 1.917 -0.732 -3.932 1.00 0.00 H new ATOM 0 HH TYR B 137 2.644 1.344 -3.807 1.00 0.00 H new ATOM 1402 N ILE B 138 6.898 -3.267 -4.269 1.00 0.00 N ATOM 1403 CA ILE B 138 8.060 -2.401 -3.982 1.00 0.00 C ATOM 1404 C ILE B 138 9.347 -3.229 -3.905 1.00 0.00 C ATOM 1405 O ILE B 138 10.379 -2.815 -4.429 1.00 0.00 O ATOM 1406 CB ILE B 138 7.883 -1.575 -2.647 1.00 0.00 C ATOM 1407 CG1 ILE B 138 9.211 -0.963 -2.169 1.00 0.00 C ATOM 1408 CG2 ILE B 138 7.258 -2.427 -1.559 1.00 0.00 C ATOM 1409 CD1 ILE B 138 9.855 -0.008 -3.152 1.00 0.00 C ATOM 0 H ILE B 138 6.242 -3.387 -3.497 1.00 0.00 H new ATOM 0 HA ILE B 138 8.129 -1.691 -4.806 1.00 0.00 H new ATOM 0 HB ILE B 138 7.206 -0.750 -2.867 1.00 0.00 H new ATOM 0 HG12 ILE B 138 9.036 -0.435 -1.231 1.00 0.00 H new ATOM 0 HG13 ILE B 138 9.912 -1.770 -1.955 1.00 0.00 H new ATOM 0 HG21 ILE B 138 7.147 -1.834 -0.651 1.00 0.00 H new ATOM 0 HG22 ILE B 138 6.278 -2.775 -1.887 1.00 0.00 H new ATOM 0 HG23 ILE B 138 7.898 -3.285 -1.356 1.00 0.00 H new ATOM 0 HD11 ILE B 138 10.785 0.374 -2.732 1.00 0.00 H new ATOM 0 HD12 ILE B 138 10.066 -0.533 -4.084 1.00 0.00 H new ATOM 0 HD13 ILE B 138 9.178 0.823 -3.349 1.00 0.00 H new ATOM 1421 N ALA B 139 9.270 -4.416 -3.304 1.00 0.00 N ATOM 1422 CA ALA B 139 10.426 -5.301 -3.215 1.00 0.00 C ATOM 1423 C ALA B 139 10.852 -5.795 -4.584 1.00 0.00 C ATOM 1424 O ALA B 139 12.033 -5.950 -4.874 1.00 0.00 O ATOM 1425 CB ALA B 139 10.097 -6.477 -2.311 1.00 0.00 C ATOM 0 H ALA B 139 8.422 -4.784 -2.874 1.00 0.00 H new ATOM 0 HA ALA B 139 11.258 -4.737 -2.793 1.00 0.00 H new ATOM 0 HB1 ALA B 139 10.961 -7.138 -2.245 1.00 0.00 H new ATOM 0 HB2 ALA B 139 9.843 -6.111 -1.316 1.00 0.00 H new ATOM 0 HB3 ALA B 139 9.250 -7.027 -2.723 1.00 0.00 H new ATOM 1431 N ASP B 140 9.866 -6.050 -5.439 1.00 0.00 N ATOM 1432 CA ASP B 140 10.117 -6.591 -6.764 1.00 0.00 C ATOM 1433 C ASP B 140 10.590 -5.524 -7.751 1.00 0.00 C ATOM 1434 O ASP B 140 11.467 -5.783 -8.581 1.00 0.00 O ATOM 1435 CB ASP B 140 8.831 -7.233 -7.307 1.00 0.00 C ATOM 1436 CG ASP B 140 9.002 -7.830 -8.702 1.00 0.00 C ATOM 1437 OD1 ASP B 140 9.607 -8.916 -8.822 1.00 0.00 O ATOM 1438 OD2 ASP B 140 8.513 -7.218 -9.675 1.00 0.00 O ATOM 0 H ASP B 140 8.880 -5.888 -5.232 1.00 0.00 H new ATOM 0 HA ASP B 140 10.911 -7.331 -6.665 1.00 0.00 H new ATOM 0 HB2 ASP B 140 8.505 -8.015 -6.621 1.00 0.00 H new ATOM 0 HB3 ASP B 140 8.041 -6.483 -7.334 1.00 0.00 H new ATOM 1443 N ASN B 141 10.007 -4.330 -7.660 1.00 0.00 N ATOM 1444 CA ASN B 141 10.234 -3.281 -8.665 1.00 0.00 C ATOM 1445 C ASN B 141 11.261 -2.248 -8.208 1.00 0.00 C ATOM 1446 O ASN B 141 11.970 -1.673 -9.039 1.00 0.00 O ATOM 1447 CB ASN B 141 8.903 -2.577 -8.983 1.00 0.00 C ATOM 1448 CG ASN B 141 7.961 -3.421 -9.820 1.00 0.00 C ATOM 1449 OD1 ASN B 141 7.946 -3.327 -11.052 1.00 0.00 O ATOM 1450 ND2 ASN B 141 7.148 -4.244 -9.164 1.00 0.00 N ATOM 0 H ASN B 141 9.376 -4.061 -6.906 1.00 0.00 H new ATOM 0 HA ASN B 141 10.632 -3.764 -9.557 1.00 0.00 H new ATOM 0 HB2 ASN B 141 8.408 -2.312 -8.049 1.00 0.00 H new ATOM 0 HB3 ASN B 141 9.110 -1.645 -9.510 1.00 0.00 H new ATOM 0 HD21 ASN B 141 6.485 -4.823 -9.679 1.00 0.00 H new ATOM 0 HD22 ASN B 141 7.188 -4.296 -8.146 1.00 0.00 H new ATOM 1457 N GLU B 142 11.327 -2.001 -6.891 1.00 0.00 N ATOM 1458 CA GLU B 142 12.256 -1.026 -6.328 1.00 0.00 C ATOM 1459 C GLU B 142 12.144 0.336 -7.034 1.00 0.00 C ATOM 1460 O GLU B 142 13.158 0.915 -7.434 1.00 0.00 O ATOM 1461 CB GLU B 142 13.704 -1.548 -6.418 1.00 0.00 C ATOM 1462 CG GLU B 142 13.948 -2.869 -5.697 1.00 0.00 C ATOM 1463 CD GLU B 142 15.406 -3.317 -5.768 1.00 0.00 C ATOM 1464 OE1 GLU B 142 15.866 -3.678 -6.882 1.00 0.00 O ATOM 1465 OE2 GLU B 142 16.093 -3.299 -4.729 1.00 0.00 O ATOM 0 H GLU B 142 10.743 -2.469 -6.198 1.00 0.00 H new ATOM 0 HA GLU B 142 11.989 -0.886 -5.280 1.00 0.00 H new ATOM 0 HB2 GLU B 142 13.968 -1.668 -7.469 1.00 0.00 H new ATOM 0 HB3 GLU B 142 14.374 -0.794 -6.005 1.00 0.00 H new ATOM 0 HG2 GLU B 142 13.653 -2.768 -4.652 1.00 0.00 H new ATOM 0 HG3 GLU B 142 13.313 -3.640 -6.134 1.00 0.00 H new ATOM 1472 N ARG B 143 10.933 0.847 -7.185 1.00 0.00 N ATOM 1473 CA ARG B 143 10.737 2.126 -7.862 1.00 0.00 C ATOM 1474 C ARG B 143 9.508 2.880 -7.325 1.00 0.00 C ATOM 1475 O ARG B 143 9.556 4.090 -7.179 1.00 0.00 O ATOM 1476 CB ARG B 143 10.626 1.935 -9.374 1.00 0.00 C ATOM 1477 CG ARG B 143 9.568 0.918 -9.794 1.00 0.00 C ATOM 1478 CD ARG B 143 9.503 0.739 -11.302 1.00 0.00 C ATOM 1479 NE ARG B 143 8.626 -0.381 -11.669 1.00 0.00 N ATOM 1480 CZ ARG B 143 8.202 -0.645 -12.904 1.00 0.00 C ATOM 1481 NH1 ARG B 143 8.531 0.153 -13.927 1.00 0.00 N ATOM 1482 NH2 ARG B 143 7.454 -1.712 -13.126 1.00 0.00 N ATOM 0 H ARG B 143 10.076 0.404 -6.853 1.00 0.00 H new ATOM 0 HA ARG B 143 11.616 2.735 -7.651 1.00 0.00 H new ATOM 0 HB2 ARG B 143 10.396 2.895 -9.836 1.00 0.00 H new ATOM 0 HB3 ARG B 143 11.594 1.619 -9.762 1.00 0.00 H new ATOM 0 HG2 ARG B 143 9.785 -0.042 -9.326 1.00 0.00 H new ATOM 0 HG3 ARG B 143 8.593 1.239 -9.427 1.00 0.00 H new ATOM 0 HD2 ARG B 143 9.138 1.656 -11.764 1.00 0.00 H new ATOM 0 HD3 ARG B 143 10.505 0.562 -11.693 1.00 0.00 H new ATOM 0 HE ARG B 143 8.319 -1.004 -10.922 1.00 0.00 H new ATOM 0 HH11 ARG B 143 9.113 0.975 -13.766 1.00 0.00 H new ATOM 0 HH12 ARG B 143 8.200 -0.061 -14.868 1.00 0.00 H new ATOM 0 HH21 ARG B 143 7.204 -2.329 -12.353 1.00 0.00 H new ATOM 0 HH22 ARG B 143 7.127 -1.918 -14.070 1.00 0.00 H new ATOM 1496 N LEU B 144 8.426 2.149 -7.046 1.00 0.00 N ATOM 1497 CA LEU B 144 7.149 2.753 -6.635 1.00 0.00 C ATOM 1498 C LEU B 144 6.535 3.547 -7.792 1.00 0.00 C ATOM 1499 O LEU B 144 7.247 4.149 -8.586 1.00 0.00 O ATOM 1500 CB LEU B 144 7.310 3.659 -5.399 1.00 0.00 C ATOM 1501 CG LEU B 144 7.705 2.946 -4.085 1.00 0.00 C ATOM 1502 CD1 LEU B 144 7.918 3.945 -2.953 1.00 0.00 C ATOM 1503 CD2 LEU B 144 6.650 1.932 -3.703 1.00 0.00 C ATOM 0 H LEU B 144 8.406 1.130 -7.097 1.00 0.00 H new ATOM 0 HA LEU B 144 6.479 1.938 -6.362 1.00 0.00 H new ATOM 0 HB2 LEU B 144 8.065 4.413 -5.621 1.00 0.00 H new ATOM 0 HB3 LEU B 144 6.371 4.187 -5.235 1.00 0.00 H new ATOM 0 HG LEU B 144 8.649 2.428 -4.254 1.00 0.00 H new ATOM 0 HD11 LEU B 144 8.194 3.411 -2.044 1.00 0.00 H new ATOM 0 HD12 LEU B 144 8.715 4.637 -3.224 1.00 0.00 H new ATOM 0 HD13 LEU B 144 6.997 4.502 -2.781 1.00 0.00 H new ATOM 0 HD21 LEU B 144 6.940 1.437 -2.776 1.00 0.00 H new ATOM 0 HD22 LEU B 144 5.694 2.437 -3.561 1.00 0.00 H new ATOM 0 HD23 LEU B 144 6.554 1.190 -4.496 1.00 0.00 H new