USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 844 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: C 13 ASN : amide:sc= -0.0469 K(o=-0.047,f=-1.5!) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: C 11 SER OG : rot 180:sc= 0 USER MOD Set 2.2: C 21 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 11 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 174:sc=-0.000883 (180deg=-0.0268) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -163:sc= -0.0472 (180deg=-0.298) USER MOD Single : A 13 ASN : amide:sc= -0.0868 X(o=-0.087,f=-0.22) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.899 X(o=-0.9,f=-0.44) USER MOD Single : A 29 GLN : amide:sc= -0.0964 K(o=-0.096,f=-1.9!) USER MOD Single : A 35 ASN : amide:sc= -0.0434 K(o=-0.043,f=-1.7) USER MOD Single : A 38 LYS NZ :NH3+ -167:sc= -0.0337 (180deg=-0.213) USER MOD Single : A 43 HIS : no HE2:sc= -0.963 X(o=-0.96,f=-1.1) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0.974 K(o=0.97,f=0) USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ -165:sc= -0.0208 (180deg=-0.218) USER MOD Single : C 26 SER OG : rot 180:sc=-0.00205 USER MOD Single : C 28 GLN : amide:sc= -0.847 X(o=-0.85,f=-0.49) USER MOD Single : C 29 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : C 35 ASN : amide:sc= -0.0288 K(o=-0.029,f=-1.8) USER MOD Single : C 38 LYS NZ :NH3+ -168:sc=-0.00591 (180deg=-0.203) USER MOD Single : C 43 HIS : no HE2:sc= -1.29 K(o=-1.3,f=-2) USER MOD Single : C 48 TYR OH : rot 180:sc= 0 USER MOD Single : C 49 GLN : amide:sc= 0.906 K(o=0.91,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.922 3.032 -1.769 1.00 0.00 N ATOM 2 CA MET A 1 -11.889 2.458 -0.882 1.00 0.00 C ATOM 3 C MET A 1 -11.921 0.941 -0.918 1.00 0.00 C ATOM 4 O MET A 1 -12.987 0.353 -0.776 1.00 0.00 O ATOM 5 CB MET A 1 -12.099 2.905 0.566 1.00 0.00 C ATOM 6 CG MET A 1 -11.078 2.247 1.498 1.00 0.00 C ATOM 7 SD MET A 1 -9.404 2.906 1.358 1.00 0.00 S ATOM 8 CE MET A 1 -9.660 4.362 2.395 1.00 0.00 C ATOM 0 H1 MET A 1 -12.879 4.070 -1.726 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.754 2.719 -2.746 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.862 2.712 -1.460 1.00 0.00 H new ATOM 0 HA MET A 1 -10.925 2.816 -1.244 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.011 3.989 0.632 1.00 0.00 H new ATOM 0 HB3 MET A 1 -13.108 2.647 0.887 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.416 2.364 2.528 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.052 1.177 1.291 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.710 4.877 2.541 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.367 5.035 1.909 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.058 4.055 3.362 1.00 0.00 H new ATOM 20 N LEU A 2 -10.762 0.309 -1.098 1.00 0.00 N ATOM 21 CA LEU A 2 -10.632 -1.133 -1.033 1.00 0.00 C ATOM 22 C LEU A 2 -9.521 -1.430 -0.029 1.00 0.00 C ATOM 23 O LEU A 2 -8.343 -1.176 -0.304 1.00 0.00 O ATOM 24 CB LEU A 2 -10.350 -1.665 -2.444 1.00 0.00 C ATOM 25 CG LEU A 2 -10.404 -3.196 -2.594 1.00 0.00 C ATOM 26 CD1 LEU A 2 -8.984 -3.740 -2.650 1.00 0.00 C ATOM 27 CD2 LEU A 2 -11.147 -3.921 -1.474 1.00 0.00 C ATOM 0 H LEU A 2 -9.886 0.793 -1.294 1.00 0.00 H new ATOM 0 HA LEU A 2 -11.539 -1.634 -0.694 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -11.072 -1.224 -3.132 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -9.363 -1.321 -2.753 1.00 0.00 H new ATOM 0 HG LEU A 2 -10.961 -3.384 -3.512 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -9.014 -4.824 -2.756 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -8.461 -3.306 -3.503 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -8.458 -3.480 -1.731 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -11.134 -4.994 -1.664 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -10.659 -3.715 -0.521 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -12.179 -3.572 -1.436 1.00 0.00 H new ATOM 39 N ILE A 3 -9.896 -1.962 1.137 1.00 0.00 N ATOM 40 CA ILE A 3 -8.962 -2.289 2.202 1.00 0.00 C ATOM 41 C ILE A 3 -8.387 -3.676 1.957 1.00 0.00 C ATOM 42 O ILE A 3 -9.077 -4.560 1.453 1.00 0.00 O ATOM 43 CB ILE A 3 -9.647 -2.272 3.583 1.00 0.00 C ATOM 44 CG1 ILE A 3 -10.087 -0.863 3.991 1.00 0.00 C ATOM 45 CG2 ILE A 3 -8.642 -2.735 4.643 1.00 0.00 C ATOM 46 CD1 ILE A 3 -11.481 -0.524 3.481 1.00 0.00 C ATOM 0 H ILE A 3 -10.867 -2.177 1.364 1.00 0.00 H new ATOM 0 HA ILE A 3 -8.173 -1.537 2.200 1.00 0.00 H new ATOM 0 HB ILE A 3 -10.519 -2.923 3.516 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -10.070 -0.779 5.078 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -9.374 -0.135 3.604 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -9.118 -2.726 5.624 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -8.308 -3.746 4.411 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -7.784 -2.062 4.650 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -11.748 0.485 3.796 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -11.494 -0.580 2.393 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -12.200 -1.234 3.889 1.00 0.00 H new ATOM 58 N LEU A 4 -7.116 -3.849 2.324 1.00 0.00 N ATOM 59 CA LEU A 4 -6.428 -5.126 2.287 1.00 0.00 C ATOM 60 C LEU A 4 -5.492 -5.179 3.487 1.00 0.00 C ATOM 61 O LEU A 4 -4.790 -4.209 3.770 1.00 0.00 O ATOM 62 CB LEU A 4 -5.610 -5.242 0.996 1.00 0.00 C ATOM 63 CG LEU A 4 -6.471 -5.284 -0.271 1.00 0.00 C ATOM 64 CD1 LEU A 4 -5.558 -5.262 -1.496 1.00 0.00 C ATOM 65 CD2 LEU A 4 -7.331 -6.549 -0.318 1.00 0.00 C ATOM 0 H LEU A 4 -6.530 -3.085 2.661 1.00 0.00 H new ATOM 0 HA LEU A 4 -7.146 -5.946 2.318 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -4.925 -4.397 0.932 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.000 -6.144 1.041 1.00 0.00 H new ATOM 0 HG LEU A 4 -7.131 -4.417 -0.265 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -6.164 -5.292 -2.402 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -4.961 -4.350 -1.488 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -4.897 -6.129 -1.473 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -7.930 -6.548 -1.229 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.686 -7.428 -0.308 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -7.990 -6.573 0.550 1.00 0.00 H new ATOM 77 N THR A 5 -5.474 -6.307 4.198 1.00 0.00 N ATOM 78 CA THR A 5 -4.518 -6.503 5.278 1.00 0.00 C ATOM 79 C THR A 5 -3.309 -7.222 4.707 1.00 0.00 C ATOM 80 O THR A 5 -3.443 -8.077 3.834 1.00 0.00 O ATOM 81 CB THR A 5 -5.117 -7.320 6.425 1.00 0.00 C ATOM 82 OG1 THR A 5 -5.639 -8.537 5.943 1.00 0.00 O ATOM 83 CG2 THR A 5 -6.230 -6.544 7.116 1.00 0.00 C ATOM 0 H THR A 5 -6.108 -7.091 4.044 1.00 0.00 H new ATOM 0 HA THR A 5 -4.238 -5.533 5.688 1.00 0.00 H new ATOM 0 HB THR A 5 -4.320 -7.522 7.141 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.017 -9.049 6.688 1.00 0.00 H new ATOM 0 HG21 THR A 5 -6.642 -7.143 7.928 1.00 0.00 H new ATOM 0 HG22 THR A 5 -5.829 -5.614 7.519 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.017 -6.318 6.397 1.00 0.00 H new ATOM 91 N ARG A 6 -2.121 -6.873 5.196 1.00 0.00 N ATOM 92 CA ARG A 6 -0.902 -7.486 4.701 1.00 0.00 C ATOM 93 C ARG A 6 0.119 -7.608 5.825 1.00 0.00 C ATOM 94 O ARG A 6 0.394 -6.624 6.511 1.00 0.00 O ATOM 95 CB ARG A 6 -0.393 -6.610 3.550 1.00 0.00 C ATOM 96 CG ARG A 6 0.574 -7.342 2.615 1.00 0.00 C ATOM 97 CD ARG A 6 -0.138 -8.126 1.504 1.00 0.00 C ATOM 98 NE ARG A 6 -0.988 -9.212 2.008 1.00 0.00 N ATOM 99 CZ ARG A 6 -1.404 -10.240 1.263 1.00 0.00 C ATOM 100 NH1 ARG A 6 -1.068 -10.334 -0.021 1.00 0.00 N ATOM 101 NH2 ARG A 6 -2.166 -11.186 1.802 1.00 0.00 N ATOM 0 H ARG A 6 -1.982 -6.176 5.927 1.00 0.00 H new ATOM 0 HA ARG A 6 -1.082 -8.498 4.337 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -1.244 -6.250 2.972 1.00 0.00 H new ATOM 0 HB3 ARG A 6 0.105 -5.733 3.963 1.00 0.00 H new ATOM 0 HG2 ARG A 6 1.251 -6.617 2.163 1.00 0.00 H new ATOM 0 HG3 ARG A 6 1.186 -8.028 3.200 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -0.749 -7.439 0.919 1.00 0.00 H new ATOM 0 HD3 ARG A 6 0.609 -8.543 0.828 1.00 0.00 H new ATOM 0 HE ARG A 6 -1.278 -9.180 2.985 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -0.485 -9.615 -0.450 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -1.393 -11.125 -0.577 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -2.433 -11.127 2.785 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -2.484 -11.971 1.233 1.00 0.00 H new ATOM 115 N LYS A 7 0.684 -8.806 6.006 1.00 0.00 N ATOM 116 CA LYS A 7 1.740 -9.027 6.985 1.00 0.00 C ATOM 117 C LYS A 7 3.045 -8.509 6.389 1.00 0.00 C ATOM 118 O LYS A 7 3.236 -8.601 5.176 1.00 0.00 O ATOM 119 CB LYS A 7 1.846 -10.521 7.304 1.00 0.00 C ATOM 120 CG LYS A 7 1.914 -10.828 8.803 1.00 0.00 C ATOM 121 CD LYS A 7 0.598 -10.508 9.514 1.00 0.00 C ATOM 122 CE LYS A 7 0.624 -10.977 10.969 1.00 0.00 C ATOM 123 NZ LYS A 7 0.721 -12.443 11.070 1.00 0.00 N ATOM 0 H LYS A 7 0.421 -9.640 5.480 1.00 0.00 H new ATOM 0 HA LYS A 7 1.523 -8.500 7.914 1.00 0.00 H new ATOM 0 HB2 LYS A 7 0.987 -11.037 6.875 1.00 0.00 H new ATOM 0 HB3 LYS A 7 2.735 -10.925 6.819 1.00 0.00 H new ATOM 0 HG2 LYS A 7 2.157 -11.881 8.947 1.00 0.00 H new ATOM 0 HG3 LYS A 7 2.720 -10.250 9.255 1.00 0.00 H new ATOM 0 HD2 LYS A 7 0.415 -9.434 9.479 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -0.228 -10.989 8.989 1.00 0.00 H new ATOM 0 HE2 LYS A 7 1.470 -10.521 11.483 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -0.279 -10.637 11.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 0.450 -12.744 12.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 0.083 -12.882 10.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 1.699 -12.740 10.877 1.00 0.00 H new ATOM 137 N VAL A 8 3.941 -7.972 7.219 1.00 0.00 N ATOM 138 CA VAL A 8 5.214 -7.470 6.714 1.00 0.00 C ATOM 139 C VAL A 8 5.939 -8.589 5.966 1.00 0.00 C ATOM 140 O VAL A 8 6.180 -9.659 6.520 1.00 0.00 O ATOM 141 CB VAL A 8 6.066 -6.862 7.835 1.00 0.00 C ATOM 142 CG1 VAL A 8 5.320 -5.697 8.481 1.00 0.00 C ATOM 143 CG2 VAL A 8 6.431 -7.852 8.941 1.00 0.00 C ATOM 0 H VAL A 8 3.810 -7.876 8.226 1.00 0.00 H new ATOM 0 HA VAL A 8 5.026 -6.658 6.012 1.00 0.00 H new ATOM 0 HB VAL A 8 6.991 -6.539 7.357 1.00 0.00 H new ATOM 0 HG11 VAL A 8 5.931 -5.270 9.276 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.117 -4.934 7.730 1.00 0.00 H new ATOM 0 HG13 VAL A 8 4.379 -6.054 8.899 1.00 0.00 H new ATOM 0 HG21 VAL A 8 7.034 -7.348 9.696 1.00 0.00 H new ATOM 0 HG22 VAL A 8 5.520 -8.236 9.400 1.00 0.00 H new ATOM 0 HG23 VAL A 8 7.000 -8.679 8.516 1.00 0.00 H new ATOM 153 N GLY A 9 6.283 -8.338 4.701 1.00 0.00 N ATOM 154 CA GLY A 9 6.988 -9.309 3.871 1.00 0.00 C ATOM 155 C GLY A 9 6.190 -9.752 2.644 1.00 0.00 C ATOM 156 O GLY A 9 6.728 -10.472 1.806 1.00 0.00 O ATOM 0 H GLY A 9 6.080 -7.458 4.227 1.00 0.00 H new ATOM 0 HA2 GLY A 9 7.934 -8.877 3.544 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.229 -10.184 4.474 1.00 0.00 H new ATOM 160 N GLU A 10 4.920 -9.344 2.517 1.00 0.00 N ATOM 161 CA GLU A 10 4.079 -9.747 1.395 1.00 0.00 C ATOM 162 C GLU A 10 3.833 -8.581 0.428 1.00 0.00 C ATOM 163 O GLU A 10 4.403 -7.505 0.609 1.00 0.00 O ATOM 164 CB GLU A 10 2.767 -10.340 1.919 1.00 0.00 C ATOM 165 CG GLU A 10 3.009 -11.584 2.770 1.00 0.00 C ATOM 166 CD GLU A 10 3.693 -12.698 1.975 1.00 0.00 C ATOM 167 OE1 GLU A 10 3.246 -12.959 0.834 1.00 0.00 O ATOM 168 OE2 GLU A 10 4.657 -13.284 2.510 1.00 0.00 O ATOM 0 H GLU A 10 4.455 -8.730 3.186 1.00 0.00 H new ATOM 0 HA GLU A 10 4.601 -10.516 0.825 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.240 -9.591 2.511 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.121 -10.594 1.078 1.00 0.00 H new ATOM 0 HG2 GLU A 10 3.626 -11.321 3.630 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.058 -11.948 3.159 1.00 0.00 H new ATOM 175 N SER A 11 2.987 -8.782 -0.591 1.00 0.00 N ATOM 176 CA SER A 11 2.815 -7.802 -1.661 1.00 0.00 C ATOM 177 C SER A 11 1.362 -7.651 -2.113 1.00 0.00 C ATOM 178 O SER A 11 0.489 -8.435 -1.738 1.00 0.00 O ATOM 179 CB SER A 11 3.676 -8.218 -2.861 1.00 0.00 C ATOM 180 OG SER A 11 5.026 -8.348 -2.466 1.00 0.00 O ATOM 0 H SER A 11 2.412 -9.618 -0.693 1.00 0.00 H new ATOM 0 HA SER A 11 3.126 -6.835 -1.265 1.00 0.00 H new ATOM 0 HB2 SER A 11 3.315 -9.163 -3.268 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.591 -7.476 -3.655 1.00 0.00 H new ATOM 0 HG SER A 11 5.568 -8.615 -3.237 1.00 0.00 H new ATOM 186 N ILE A 12 1.121 -6.621 -2.937 1.00 0.00 N ATOM 187 CA ILE A 12 -0.181 -6.240 -3.482 1.00 0.00 C ATOM 188 C ILE A 12 0.054 -5.716 -4.907 1.00 0.00 C ATOM 189 O ILE A 12 1.193 -5.425 -5.267 1.00 0.00 O ATOM 190 CB ILE A 12 -0.828 -5.182 -2.564 1.00 0.00 C ATOM 191 CG1 ILE A 12 -1.018 -5.763 -1.153 1.00 0.00 C ATOM 192 CG2 ILE A 12 -2.174 -4.686 -3.102 1.00 0.00 C ATOM 193 CD1 ILE A 12 -1.684 -4.786 -0.183 1.00 0.00 C ATOM 0 H ILE A 12 1.868 -6.004 -3.254 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.869 -7.084 -3.526 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.154 -4.326 -2.531 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -1.622 -6.668 -1.218 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -0.047 -6.056 -0.754 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.587 -3.943 -2.420 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -2.030 -4.236 -4.084 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -2.864 -5.526 -3.186 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -1.789 -5.258 0.794 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.070 -3.890 -0.090 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -2.669 -4.513 -0.561 1.00 0.00 H new ATOM 205 N ASN A 13 -0.995 -5.594 -5.726 1.00 0.00 N ATOM 206 CA ASN A 13 -0.874 -5.203 -7.127 1.00 0.00 C ATOM 207 C ASN A 13 -1.941 -4.187 -7.523 1.00 0.00 C ATOM 208 O ASN A 13 -3.023 -4.133 -6.936 1.00 0.00 O ATOM 209 CB ASN A 13 -1.002 -6.447 -8.009 1.00 0.00 C ATOM 210 CG ASN A 13 0.344 -7.119 -8.230 1.00 0.00 C ATOM 211 OD1 ASN A 13 0.928 -7.011 -9.305 1.00 0.00 O ATOM 212 ND2 ASN A 13 0.846 -7.815 -7.216 1.00 0.00 N ATOM 0 H ASN A 13 -1.956 -5.766 -5.430 1.00 0.00 H new ATOM 0 HA ASN A 13 0.101 -4.736 -7.267 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.690 -7.154 -7.544 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.432 -6.169 -8.971 1.00 0.00 H new ATOM 0 HD21 ASN A 13 1.747 -8.283 -7.315 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.331 -7.881 -6.338 1.00 0.00 H new ATOM 219 N ILE A 14 -1.618 -3.378 -8.536 1.00 0.00 N ATOM 220 CA ILE A 14 -2.503 -2.350 -9.077 1.00 0.00 C ATOM 221 C ILE A 14 -2.319 -2.292 -10.589 1.00 0.00 C ATOM 222 O ILE A 14 -1.196 -2.381 -11.090 1.00 0.00 O ATOM 223 CB ILE A 14 -2.189 -0.988 -8.436 1.00 0.00 C ATOM 224 CG1 ILE A 14 -2.292 -1.062 -6.909 1.00 0.00 C ATOM 225 CG2 ILE A 14 -3.165 0.064 -8.977 1.00 0.00 C ATOM 226 CD1 ILE A 14 -1.956 0.265 -6.237 1.00 0.00 C ATOM 0 H ILE A 14 -0.716 -3.423 -9.010 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.540 -2.595 -8.849 1.00 0.00 H new ATOM 0 HB ILE A 14 -1.167 -0.709 -8.692 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -3.302 -1.361 -6.630 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.617 -1.834 -6.539 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -2.945 1.031 -8.525 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -3.058 0.137 -10.059 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.186 -0.227 -8.732 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.044 0.158 -5.156 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -0.936 0.553 -6.491 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -2.647 1.033 -6.583 1.00 0.00 H new ATOM 238 N GLY A 15 -3.426 -2.146 -11.321 1.00 0.00 N ATOM 239 CA GLY A 15 -3.395 -2.116 -12.770 1.00 0.00 C ATOM 240 C GLY A 15 -2.701 -3.365 -13.307 1.00 0.00 C ATOM 241 O GLY A 15 -2.907 -4.465 -12.801 1.00 0.00 O ATOM 0 H GLY A 15 -4.359 -2.047 -10.921 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -4.410 -2.058 -13.162 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -2.870 -1.224 -13.112 1.00 0.00 H new ATOM 245 N ASP A 16 -1.879 -3.180 -14.341 1.00 0.00 N ATOM 246 CA ASP A 16 -1.095 -4.249 -14.941 1.00 0.00 C ATOM 247 C ASP A 16 0.368 -3.819 -15.076 1.00 0.00 C ATOM 248 O ASP A 16 1.157 -4.498 -15.729 1.00 0.00 O ATOM 249 CB ASP A 16 -1.695 -4.625 -16.299 1.00 0.00 C ATOM 250 CG ASP A 16 -3.101 -5.198 -16.150 1.00 0.00 C ATOM 251 OD1 ASP A 16 -3.201 -6.401 -15.825 1.00 0.00 O ATOM 252 OD2 ASP A 16 -4.063 -4.422 -16.364 1.00 0.00 O ATOM 0 H ASP A 16 -1.741 -2.273 -14.787 1.00 0.00 H new ATOM 0 HA ASP A 16 -1.124 -5.129 -14.298 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.726 -3.744 -16.941 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.054 -5.356 -16.792 1.00 0.00 H new ATOM 257 N ASP A 17 0.731 -2.688 -14.458 1.00 0.00 N ATOM 258 CA ASP A 17 2.072 -2.128 -14.538 1.00 0.00 C ATOM 259 C ASP A 17 2.552 -1.610 -13.179 1.00 0.00 C ATOM 260 O ASP A 17 3.603 -0.974 -13.114 1.00 0.00 O ATOM 261 CB ASP A 17 2.110 -1.001 -15.574 1.00 0.00 C ATOM 262 CG ASP A 17 1.698 -1.488 -16.961 1.00 0.00 C ATOM 263 OD1 ASP A 17 2.563 -2.083 -17.641 1.00 0.00 O ATOM 264 OD2 ASP A 17 0.523 -1.258 -17.327 1.00 0.00 O ATOM 0 H ASP A 17 0.092 -2.137 -13.885 1.00 0.00 H new ATOM 0 HA ASP A 17 2.747 -2.926 -14.846 1.00 0.00 H new ATOM 0 HB2 ASP A 17 1.445 -0.196 -15.260 1.00 0.00 H new ATOM 0 HB3 ASP A 17 3.116 -0.584 -15.620 1.00 0.00 H new ATOM 269 N ILE A 18 1.811 -1.860 -12.090 1.00 0.00 N ATOM 270 CA ILE A 18 2.222 -1.394 -10.772 1.00 0.00 C ATOM 271 C ILE A 18 2.111 -2.519 -9.746 1.00 0.00 C ATOM 272 O ILE A 18 1.212 -3.356 -9.820 1.00 0.00 O ATOM 273 CB ILE A 18 1.379 -0.183 -10.336 1.00 0.00 C ATOM 274 CG1 ILE A 18 1.465 0.987 -11.326 1.00 0.00 C ATOM 275 CG2 ILE A 18 1.864 0.315 -8.967 1.00 0.00 C ATOM 276 CD1 ILE A 18 0.354 0.904 -12.374 1.00 0.00 C ATOM 0 H ILE A 18 0.933 -2.378 -12.102 1.00 0.00 H new ATOM 0 HA ILE A 18 3.265 -1.082 -10.831 1.00 0.00 H new ATOM 0 HB ILE A 18 0.343 -0.520 -10.295 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.390 1.931 -10.786 1.00 0.00 H new ATOM 0 HG13 ILE A 18 2.437 0.979 -11.820 1.00 0.00 H new ATOM 0 HG21 ILE A 18 1.266 1.173 -8.659 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.759 -0.483 -8.232 1.00 0.00 H new ATOM 0 HG23 ILE A 18 2.911 0.609 -9.037 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.439 1.745 -13.062 1.00 0.00 H new ATOM 0 HD12 ILE A 18 0.446 -0.030 -12.929 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.616 0.937 -11.879 1.00 0.00 H new ATOM 288 N THR A 19 3.041 -2.524 -8.789 1.00 0.00 N ATOM 289 CA THR A 19 3.083 -3.495 -7.703 1.00 0.00 C ATOM 290 C THR A 19 3.442 -2.758 -6.416 1.00 0.00 C ATOM 291 O THR A 19 4.073 -1.703 -6.461 1.00 0.00 O ATOM 292 CB THR A 19 4.118 -4.577 -8.022 1.00 0.00 C ATOM 293 OG1 THR A 19 3.856 -5.132 -9.291 1.00 0.00 O ATOM 294 CG2 THR A 19 4.100 -5.708 -6.992 1.00 0.00 C ATOM 0 H THR A 19 3.797 -1.840 -8.750 1.00 0.00 H new ATOM 0 HA THR A 19 2.115 -3.981 -7.582 1.00 0.00 H new ATOM 0 HB THR A 19 5.097 -4.099 -8.001 1.00 0.00 H new ATOM 0 HG1 THR A 19 4.522 -5.822 -9.490 1.00 0.00 H new ATOM 0 HG21 THR A 19 4.850 -6.454 -7.257 1.00 0.00 H new ATOM 0 HG22 THR A 19 4.323 -5.304 -6.004 1.00 0.00 H new ATOM 0 HG23 THR A 19 3.114 -6.173 -6.980 1.00 0.00 H new ATOM 302 N ILE A 20 3.038 -3.316 -5.273 1.00 0.00 N ATOM 303 CA ILE A 20 3.235 -2.711 -3.965 1.00 0.00 C ATOM 304 C ILE A 20 3.760 -3.781 -3.018 1.00 0.00 C ATOM 305 O ILE A 20 3.437 -4.958 -3.170 1.00 0.00 O ATOM 306 CB ILE A 20 1.892 -2.164 -3.452 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.235 -1.184 -4.435 1.00 0.00 C ATOM 308 CG2 ILE A 20 2.063 -1.489 -2.088 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.018 0.118 -4.600 1.00 0.00 C ATOM 0 H ILE A 20 2.558 -4.215 -5.235 1.00 0.00 H new ATOM 0 HA ILE A 20 3.949 -1.890 -4.026 1.00 0.00 H new ATOM 0 HB ILE A 20 1.230 -3.024 -3.353 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.136 -1.666 -5.407 1.00 0.00 H new ATOM 0 HG13 ILE A 20 0.227 -0.953 -4.089 1.00 0.00 H new ATOM 0 HG21 ILE A 20 1.100 -1.110 -1.746 1.00 0.00 H new ATOM 0 HG22 ILE A 20 2.444 -2.214 -1.369 1.00 0.00 H new ATOM 0 HG23 ILE A 20 2.767 -0.662 -2.177 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.501 0.766 -5.307 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.095 0.621 -3.636 1.00 0.00 H new ATOM 0 HD13 ILE A 20 3.017 -0.103 -4.975 1.00 0.00 H new ATOM 321 N THR A 21 4.574 -3.382 -2.039 1.00 0.00 N ATOM 322 CA THR A 21 5.165 -4.310 -1.088 1.00 0.00 C ATOM 323 C THR A 21 5.205 -3.670 0.295 1.00 0.00 C ATOM 324 O THR A 21 5.418 -2.467 0.414 1.00 0.00 O ATOM 325 CB THR A 21 6.586 -4.661 -1.543 1.00 0.00 C ATOM 326 OG1 THR A 21 6.583 -5.093 -2.887 1.00 0.00 O ATOM 327 CG2 THR A 21 7.173 -5.785 -0.689 1.00 0.00 C ATOM 0 H THR A 21 4.838 -2.408 -1.888 1.00 0.00 H new ATOM 0 HA THR A 21 4.565 -5.219 -1.040 1.00 0.00 H new ATOM 0 HB THR A 21 7.191 -3.760 -1.436 1.00 0.00 H new ATOM 0 HG1 THR A 21 7.498 -5.312 -3.162 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.182 -6.014 -1.033 1.00 0.00 H new ATOM 0 HG22 THR A 21 7.208 -5.469 0.354 1.00 0.00 H new ATOM 0 HG23 THR A 21 6.548 -6.674 -0.778 1.00 0.00 H new ATOM 335 N ILE A 22 5.004 -4.475 1.339 1.00 0.00 N ATOM 336 CA ILE A 22 5.062 -4.000 2.712 1.00 0.00 C ATOM 337 C ILE A 22 6.398 -4.432 3.302 1.00 0.00 C ATOM 338 O ILE A 22 6.538 -5.515 3.866 1.00 0.00 O ATOM 339 CB ILE A 22 3.834 -4.472 3.512 1.00 0.00 C ATOM 340 CG1 ILE A 22 3.960 -4.154 5.004 1.00 0.00 C ATOM 341 CG2 ILE A 22 3.571 -5.970 3.362 1.00 0.00 C ATOM 342 CD1 ILE A 22 4.217 -2.670 5.248 1.00 0.00 C ATOM 0 H ILE A 22 4.798 -5.470 1.252 1.00 0.00 H new ATOM 0 HA ILE A 22 5.015 -2.912 2.756 1.00 0.00 H new ATOM 0 HB ILE A 22 2.995 -3.920 3.089 1.00 0.00 H new ATOM 0 HG12 ILE A 22 3.047 -4.454 5.518 1.00 0.00 H new ATOM 0 HG13 ILE A 22 4.774 -4.739 5.433 1.00 0.00 H new ATOM 0 HG21 ILE A 22 2.694 -6.246 3.947 1.00 0.00 H new ATOM 0 HG22 ILE A 22 3.395 -6.205 2.312 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.436 -6.529 3.719 1.00 0.00 H new ATOM 0 HD11 ILE A 22 4.300 -2.486 6.319 1.00 0.00 H new ATOM 0 HD12 ILE A 22 5.144 -2.376 4.756 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.390 -2.086 4.843 1.00 0.00 H new ATOM 354 N LEU A 23 7.397 -3.558 3.159 1.00 0.00 N ATOM 355 CA LEU A 23 8.762 -3.856 3.558 1.00 0.00 C ATOM 356 C LEU A 23 8.865 -4.033 5.071 1.00 0.00 C ATOM 357 O LEU A 23 9.704 -4.796 5.543 1.00 0.00 O ATOM 358 CB LEU A 23 9.677 -2.723 3.089 1.00 0.00 C ATOM 359 CG LEU A 23 9.484 -2.386 1.607 1.00 0.00 C ATOM 360 CD1 LEU A 23 10.408 -1.241 1.220 1.00 0.00 C ATOM 361 CD2 LEU A 23 9.799 -3.583 0.715 1.00 0.00 C ATOM 0 H LEU A 23 7.276 -2.626 2.763 1.00 0.00 H new ATOM 0 HA LEU A 23 9.071 -4.793 3.095 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.484 -1.833 3.688 1.00 0.00 H new ATOM 0 HB3 LEU A 23 10.716 -3.005 3.262 1.00 0.00 H new ATOM 0 HG LEU A 23 8.440 -2.106 1.464 1.00 0.00 H new ATOM 0 HD11 LEU A 23 10.270 -1.002 0.165 1.00 0.00 H new ATOM 0 HD12 LEU A 23 10.174 -0.364 1.824 1.00 0.00 H new ATOM 0 HD13 LEU A 23 11.443 -1.535 1.393 1.00 0.00 H new ATOM 0 HD21 LEU A 23 9.651 -3.307 -0.329 1.00 0.00 H new ATOM 0 HD22 LEU A 23 10.835 -3.887 0.867 1.00 0.00 H new ATOM 0 HD23 LEU A 23 9.137 -4.410 0.969 1.00 0.00 H new ATOM 373 N GLY A 24 8.018 -3.332 5.833 1.00 0.00 N ATOM 374 CA GLY A 24 7.971 -3.512 7.277 1.00 0.00 C ATOM 375 C GLY A 24 7.407 -2.284 7.978 1.00 0.00 C ATOM 376 O GLY A 24 6.851 -1.397 7.331 1.00 0.00 O ATOM 0 H GLY A 24 7.362 -2.640 5.471 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.358 -4.381 7.516 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.974 -3.716 7.651 1.00 0.00 H new ATOM 380 N VAL A 25 7.552 -2.231 9.302 1.00 0.00 N ATOM 381 CA VAL A 25 7.083 -1.097 10.087 1.00 0.00 C ATOM 382 C VAL A 25 8.231 -0.496 10.889 1.00 0.00 C ATOM 383 O VAL A 25 9.301 -1.089 11.013 1.00 0.00 O ATOM 384 CB VAL A 25 5.899 -1.483 10.988 1.00 0.00 C ATOM 385 CG1 VAL A 25 4.832 -2.242 10.191 1.00 0.00 C ATOM 386 CG2 VAL A 25 6.360 -2.326 12.176 1.00 0.00 C ATOM 0 H VAL A 25 7.994 -2.967 9.853 1.00 0.00 H new ATOM 0 HA VAL A 25 6.717 -0.335 9.399 1.00 0.00 H new ATOM 0 HB VAL A 25 5.463 -0.560 11.369 1.00 0.00 H new ATOM 0 HG11 VAL A 25 4.004 -2.505 10.850 1.00 0.00 H new ATOM 0 HG12 VAL A 25 4.465 -1.611 9.381 1.00 0.00 H new ATOM 0 HG13 VAL A 25 5.267 -3.151 9.775 1.00 0.00 H new ATOM 0 HG21 VAL A 25 5.500 -2.583 12.795 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.832 -3.239 11.813 1.00 0.00 H new ATOM 0 HG23 VAL A 25 7.077 -1.758 12.769 1.00 0.00 H new ATOM 396 N SER A 26 7.987 0.694 11.432 1.00 0.00 N ATOM 397 CA SER A 26 8.958 1.491 12.166 1.00 0.00 C ATOM 398 C SER A 26 8.215 2.234 13.268 1.00 0.00 C ATOM 399 O SER A 26 8.198 3.463 13.308 1.00 0.00 O ATOM 400 CB SER A 26 9.654 2.449 11.199 1.00 0.00 C ATOM 401 OG SER A 26 10.627 1.755 10.450 1.00 0.00 O ATOM 0 H SER A 26 7.073 1.143 11.369 1.00 0.00 H new ATOM 0 HA SER A 26 9.728 0.868 12.621 1.00 0.00 H new ATOM 0 HB2 SER A 26 8.921 2.900 10.530 1.00 0.00 H new ATOM 0 HB3 SER A 26 10.122 3.262 11.754 1.00 0.00 H new ATOM 0 HG SER A 26 11.067 2.375 9.832 1.00 0.00 H new ATOM 407 N GLY A 27 7.593 1.474 14.171 1.00 0.00 N ATOM 408 CA GLY A 27 6.725 2.042 15.181 1.00 0.00 C ATOM 409 C GLY A 27 5.363 2.258 14.545 1.00 0.00 C ATOM 410 O GLY A 27 4.690 1.298 14.175 1.00 0.00 O ATOM 0 H GLY A 27 7.681 0.459 14.216 1.00 0.00 H new ATOM 0 HA2 GLY A 27 6.646 1.373 16.038 1.00 0.00 H new ATOM 0 HA3 GLY A 27 7.130 2.985 15.548 1.00 0.00 H new ATOM 414 N GLN A 28 4.965 3.524 14.421 1.00 0.00 N ATOM 415 CA GLN A 28 3.733 3.874 13.737 1.00 0.00 C ATOM 416 C GLN A 28 4.048 4.211 12.288 1.00 0.00 C ATOM 417 O GLN A 28 3.137 4.492 11.513 1.00 0.00 O ATOM 418 CB GLN A 28 3.035 5.026 14.461 1.00 0.00 C ATOM 419 CG GLN A 28 2.044 4.473 15.488 1.00 0.00 C ATOM 420 CD GLN A 28 2.661 3.349 16.320 1.00 0.00 C ATOM 421 OE1 GLN A 28 3.343 3.598 17.307 1.00 0.00 O ATOM 422 NE2 GLN A 28 2.416 2.102 15.919 1.00 0.00 N ATOM 0 H GLN A 28 5.484 4.322 14.788 1.00 0.00 H new ATOM 0 HA GLN A 28 3.044 3.030 13.747 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.773 5.655 14.958 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.512 5.656 13.741 1.00 0.00 H new ATOM 0 HG2 GLN A 28 1.717 5.277 16.148 1.00 0.00 H new ATOM 0 HG3 GLN A 28 1.157 4.101 14.975 1.00 0.00 H new ATOM 0 HE21 GLN A 28 1.843 1.936 15.092 1.00 0.00 H new ATOM 0 HE22 GLN A 28 2.801 1.314 16.439 1.00 0.00 H new ATOM 431 N GLN A 29 5.331 4.188 11.916 1.00 0.00 N ATOM 432 CA GLN A 29 5.705 4.319 10.524 1.00 0.00 C ATOM 433 C GLN A 29 5.573 2.969 9.836 1.00 0.00 C ATOM 434 O GLN A 29 5.547 1.923 10.483 1.00 0.00 O ATOM 435 CB GLN A 29 7.151 4.785 10.384 1.00 0.00 C ATOM 436 CG GLN A 29 7.265 6.304 10.402 1.00 0.00 C ATOM 437 CD GLN A 29 8.555 6.758 9.736 1.00 0.00 C ATOM 438 OE1 GLN A 29 9.379 5.948 9.326 1.00 0.00 O ATOM 439 NE2 GLN A 29 8.729 8.067 9.624 1.00 0.00 N ATOM 0 H GLN A 29 6.114 4.080 12.560 1.00 0.00 H new ATOM 0 HA GLN A 29 5.045 5.056 10.066 1.00 0.00 H new ATOM 0 HB2 GLN A 29 7.747 4.367 11.195 1.00 0.00 H new ATOM 0 HB3 GLN A 29 7.567 4.401 9.453 1.00 0.00 H new ATOM 0 HG2 GLN A 29 6.411 6.743 9.887 1.00 0.00 H new ATOM 0 HG3 GLN A 29 7.236 6.663 11.431 1.00 0.00 H new ATOM 0 HE21 GLN A 29 8.019 8.708 9.978 1.00 0.00 H new ATOM 0 HE22 GLN A 29 9.573 8.433 9.184 1.00 0.00 H new ATOM 448 N VAL A 30 5.492 3.006 8.509 1.00 0.00 N ATOM 449 CA VAL A 30 5.431 1.817 7.688 1.00 0.00 C ATOM 450 C VAL A 30 6.312 2.044 6.472 1.00 0.00 C ATOM 451 O VAL A 30 6.111 3.013 5.743 1.00 0.00 O ATOM 452 CB VAL A 30 3.979 1.566 7.274 1.00 0.00 C ATOM 453 CG1 VAL A 30 3.893 0.280 6.463 1.00 0.00 C ATOM 454 CG2 VAL A 30 3.068 1.410 8.494 1.00 0.00 C ATOM 0 H VAL A 30 5.467 3.875 7.975 1.00 0.00 H new ATOM 0 HA VAL A 30 5.785 0.942 8.233 1.00 0.00 H new ATOM 0 HB VAL A 30 3.653 2.425 6.687 1.00 0.00 H new ATOM 0 HG11 VAL A 30 2.858 0.103 6.169 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.513 0.370 5.571 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.246 -0.556 7.067 1.00 0.00 H new ATOM 0 HG21 VAL A 30 2.044 1.233 8.164 1.00 0.00 H new ATOM 0 HG22 VAL A 30 3.406 0.566 9.095 1.00 0.00 H new ATOM 0 HG23 VAL A 30 3.104 2.320 9.093 1.00 0.00 H new ATOM 464 N ARG A 31 7.285 1.151 6.253 1.00 0.00 N ATOM 465 CA ARG A 31 8.073 1.170 5.032 1.00 0.00 C ATOM 466 C ARG A 31 7.276 0.453 3.959 1.00 0.00 C ATOM 467 O ARG A 31 7.009 -0.744 4.077 1.00 0.00 O ATOM 468 CB ARG A 31 9.419 0.466 5.202 1.00 0.00 C ATOM 469 CG ARG A 31 10.477 1.382 5.800 1.00 0.00 C ATOM 470 CD ARG A 31 11.871 0.902 5.382 1.00 0.00 C ATOM 471 NE ARG A 31 12.163 -0.457 5.847 1.00 0.00 N ATOM 472 CZ ARG A 31 13.238 -1.153 5.457 1.00 0.00 C ATOM 473 NH1 ARG A 31 14.129 -0.622 4.622 1.00 0.00 N ATOM 474 NH2 ARG A 31 13.427 -2.388 5.907 1.00 0.00 N ATOM 0 H ARG A 31 7.539 0.412 6.908 1.00 0.00 H new ATOM 0 HA ARG A 31 8.278 2.207 4.765 1.00 0.00 H new ATOM 0 HB2 ARG A 31 9.292 -0.406 5.843 1.00 0.00 H new ATOM 0 HB3 ARG A 31 9.762 0.102 4.233 1.00 0.00 H new ATOM 0 HG2 ARG A 31 10.318 2.406 5.463 1.00 0.00 H new ATOM 0 HG3 ARG A 31 10.395 1.388 6.887 1.00 0.00 H new ATOM 0 HD2 ARG A 31 11.952 0.935 4.296 1.00 0.00 H new ATOM 0 HD3 ARG A 31 12.621 1.587 5.779 1.00 0.00 H new ATOM 0 HE ARG A 31 11.514 -0.895 6.501 1.00 0.00 H new ATOM 0 HH11 ARG A 31 13.997 0.327 4.271 1.00 0.00 H new ATOM 0 HH12 ARG A 31 14.943 -1.164 4.333 1.00 0.00 H new ATOM 0 HH21 ARG A 31 12.753 -2.805 6.549 1.00 0.00 H new ATOM 0 HH22 ARG A 31 14.246 -2.919 5.610 1.00 0.00 H new ATOM 488 N ILE A 32 6.913 1.200 2.922 1.00 0.00 N ATOM 489 CA ILE A 32 6.148 0.684 1.808 1.00 0.00 C ATOM 490 C ILE A 32 6.995 0.831 0.557 1.00 0.00 C ATOM 491 O ILE A 32 7.625 1.866 0.349 1.00 0.00 O ATOM 492 CB ILE A 32 4.827 1.456 1.672 1.00 0.00 C ATOM 493 CG1 ILE A 32 4.149 1.609 3.043 1.00 0.00 C ATOM 494 CG2 ILE A 32 3.915 0.723 0.685 1.00 0.00 C ATOM 495 CD1 ILE A 32 2.778 2.275 2.950 1.00 0.00 C ATOM 0 H ILE A 32 7.147 2.189 2.837 1.00 0.00 H new ATOM 0 HA ILE A 32 5.899 -0.366 1.965 1.00 0.00 H new ATOM 0 HB ILE A 32 5.028 2.457 1.291 1.00 0.00 H new ATOM 0 HG12 ILE A 32 4.041 0.626 3.502 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.791 2.198 3.698 1.00 0.00 H new ATOM 0 HG21 ILE A 32 2.976 1.267 0.585 1.00 0.00 H new ATOM 0 HG22 ILE A 32 4.405 0.662 -0.287 1.00 0.00 H new ATOM 0 HG23 ILE A 32 3.714 -0.283 1.053 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.345 2.357 3.947 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.885 3.270 2.518 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.123 1.674 2.319 1.00 0.00 H new ATOM 507 N GLY A 33 7.011 -0.207 -0.280 1.00 0.00 N ATOM 508 CA GLY A 33 7.768 -0.211 -1.517 1.00 0.00 C ATOM 509 C GLY A 33 6.791 -0.180 -2.679 1.00 0.00 C ATOM 510 O GLY A 33 5.686 -0.713 -2.576 1.00 0.00 O ATOM 0 H GLY A 33 6.494 -1.070 -0.111 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.432 0.652 -1.557 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.396 -1.100 -1.574 1.00 0.00 H new ATOM 514 N ILE A 34 7.195 0.441 -3.785 1.00 0.00 N ATOM 515 CA ILE A 34 6.364 0.529 -4.971 1.00 0.00 C ATOM 516 C ILE A 34 7.229 0.196 -6.176 1.00 0.00 C ATOM 517 O ILE A 34 8.414 0.525 -6.206 1.00 0.00 O ATOM 518 CB ILE A 34 5.749 1.931 -5.074 1.00 0.00 C ATOM 519 CG1 ILE A 34 4.967 2.241 -3.792 1.00 0.00 C ATOM 520 CG2 ILE A 34 4.851 2.003 -6.312 1.00 0.00 C ATOM 521 CD1 ILE A 34 4.375 3.646 -3.786 1.00 0.00 C ATOM 0 H ILE A 34 8.104 0.894 -3.879 1.00 0.00 H new ATOM 0 HA ILE A 34 5.537 -0.179 -4.924 1.00 0.00 H new ATOM 0 HB ILE A 34 6.533 2.680 -5.181 1.00 0.00 H new ATOM 0 HG12 ILE A 34 4.164 1.513 -3.677 1.00 0.00 H new ATOM 0 HG13 ILE A 34 5.627 2.126 -2.932 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.413 2.998 -6.387 1.00 0.00 H new ATOM 0 HG22 ILE A 34 5.444 1.799 -7.204 1.00 0.00 H new ATOM 0 HG23 ILE A 34 4.056 1.262 -6.228 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.833 3.808 -2.854 1.00 0.00 H new ATOM 0 HD12 ILE A 34 5.177 4.379 -3.872 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.691 3.756 -4.628 1.00 0.00 H new ATOM 533 N ASN A 35 6.639 -0.459 -7.171 1.00 0.00 N ATOM 534 CA ASN A 35 7.352 -0.872 -8.361 1.00 0.00 C ATOM 535 C ASN A 35 6.486 -0.565 -9.577 1.00 0.00 C ATOM 536 O ASN A 35 5.524 -1.276 -9.863 1.00 0.00 O ATOM 537 CB ASN A 35 7.698 -2.357 -8.245 1.00 0.00 C ATOM 538 CG ASN A 35 8.649 -2.819 -9.343 1.00 0.00 C ATOM 539 OD1 ASN A 35 9.026 -2.050 -10.221 1.00 0.00 O ATOM 540 ND2 ASN A 35 9.046 -4.087 -9.293 1.00 0.00 N ATOM 0 H ASN A 35 5.652 -0.716 -7.169 1.00 0.00 H new ATOM 0 HA ASN A 35 8.290 -0.328 -8.474 1.00 0.00 H new ATOM 0 HB2 ASN A 35 8.151 -2.547 -7.272 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.782 -2.946 -8.290 1.00 0.00 H new ATOM 0 HD21 ASN A 35 9.685 -4.449 -10.000 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.711 -4.697 -8.547 1.00 0.00 H new ATOM 547 N ALA A 36 6.849 0.505 -10.279 1.00 0.00 N ATOM 548 CA ALA A 36 6.130 0.980 -11.445 1.00 0.00 C ATOM 549 C ALA A 36 7.138 1.540 -12.451 1.00 0.00 C ATOM 550 O ALA A 36 8.232 1.944 -12.055 1.00 0.00 O ATOM 551 CB ALA A 36 5.158 2.069 -10.987 1.00 0.00 C ATOM 0 H ALA A 36 7.665 1.071 -10.045 1.00 0.00 H new ATOM 0 HA ALA A 36 5.573 0.175 -11.924 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.602 2.445 -11.846 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.462 1.653 -10.259 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.716 2.886 -10.530 1.00 0.00 H new ATOM 557 N PRO A 37 6.796 1.577 -13.744 1.00 0.00 N ATOM 558 CA PRO A 37 7.656 2.152 -14.763 1.00 0.00 C ATOM 559 C PRO A 37 7.687 3.668 -14.632 1.00 0.00 C ATOM 560 O PRO A 37 6.727 4.278 -14.164 1.00 0.00 O ATOM 561 CB PRO A 37 7.015 1.737 -16.087 1.00 0.00 C ATOM 562 CG PRO A 37 5.531 1.605 -15.741 1.00 0.00 C ATOM 563 CD PRO A 37 5.566 1.064 -14.314 1.00 0.00 C ATOM 0 HA PRO A 37 8.688 1.810 -14.681 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.181 2.483 -16.864 1.00 0.00 H new ATOM 0 HB3 PRO A 37 7.426 0.797 -16.455 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.015 2.563 -15.798 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.016 0.925 -16.419 1.00 0.00 H new ATOM 0 HD2 PRO A 37 4.699 1.398 -13.745 1.00 0.00 H new ATOM 0 HD3 PRO A 37 5.552 -0.026 -14.305 1.00 0.00 H new ATOM 571 N LYS A 38 8.790 4.296 -15.053 1.00 0.00 N ATOM 572 CA LYS A 38 8.891 5.752 -15.061 1.00 0.00 C ATOM 573 C LYS A 38 7.897 6.353 -16.062 1.00 0.00 C ATOM 574 O LYS A 38 7.772 7.571 -16.157 1.00 0.00 O ATOM 575 CB LYS A 38 10.332 6.176 -15.367 1.00 0.00 C ATOM 576 CG LYS A 38 11.307 5.737 -14.266 1.00 0.00 C ATOM 577 CD LYS A 38 11.062 6.465 -12.935 1.00 0.00 C ATOM 578 CE LYS A 38 11.341 7.966 -13.029 1.00 0.00 C ATOM 579 NZ LYS A 38 12.745 8.240 -13.392 1.00 0.00 N ATOM 0 H LYS A 38 9.623 3.815 -15.392 1.00 0.00 H new ATOM 0 HA LYS A 38 8.632 6.135 -14.074 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.642 5.745 -16.319 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.375 7.259 -15.479 1.00 0.00 H new ATOM 0 HG2 LYS A 38 11.214 4.662 -14.111 1.00 0.00 H new ATOM 0 HG3 LYS A 38 12.329 5.924 -14.595 1.00 0.00 H new ATOM 0 HD2 LYS A 38 10.029 6.309 -12.624 1.00 0.00 H new ATOM 0 HD3 LYS A 38 11.696 6.028 -12.164 1.00 0.00 H new ATOM 0 HE2 LYS A 38 10.680 8.413 -13.771 1.00 0.00 H new ATOM 0 HE3 LYS A 38 11.114 8.439 -12.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 12.955 9.246 -13.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 13.375 7.658 -12.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 12.896 8.009 -14.395 1.00 0.00 H new ATOM 593 N ASP A 39 7.192 5.494 -16.806 1.00 0.00 N ATOM 594 CA ASP A 39 6.096 5.877 -17.684 1.00 0.00 C ATOM 595 C ASP A 39 4.890 6.371 -16.885 1.00 0.00 C ATOM 596 O ASP A 39 3.941 6.895 -17.466 1.00 0.00 O ATOM 597 CB ASP A 39 5.703 4.669 -18.533 1.00 0.00 C ATOM 598 CG ASP A 39 6.793 4.329 -19.546 1.00 0.00 C ATOM 599 OD1 ASP A 39 6.845 5.013 -20.592 1.00 0.00 O ATOM 600 OD2 ASP A 39 7.570 3.390 -19.262 1.00 0.00 O ATOM 0 H ASP A 39 7.377 4.491 -16.810 1.00 0.00 H new ATOM 0 HA ASP A 39 6.425 6.696 -18.323 1.00 0.00 H new ATOM 0 HB2 ASP A 39 5.523 3.810 -17.887 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.769 4.877 -19.055 1.00 0.00 H new ATOM 605 N VAL A 40 4.922 6.208 -15.557 1.00 0.00 N ATOM 606 CA VAL A 40 3.874 6.679 -14.662 1.00 0.00 C ATOM 607 C VAL A 40 4.511 7.279 -13.412 1.00 0.00 C ATOM 608 O VAL A 40 5.674 7.004 -13.109 1.00 0.00 O ATOM 609 CB VAL A 40 2.903 5.548 -14.291 1.00 0.00 C ATOM 610 CG1 VAL A 40 2.317 4.892 -15.539 1.00 0.00 C ATOM 611 CG2 VAL A 40 3.570 4.465 -13.443 1.00 0.00 C ATOM 0 H VAL A 40 5.688 5.739 -15.074 1.00 0.00 H new ATOM 0 HA VAL A 40 3.293 7.445 -15.175 1.00 0.00 H new ATOM 0 HB VAL A 40 2.109 6.014 -13.707 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.634 4.095 -15.245 1.00 0.00 H new ATOM 0 HG12 VAL A 40 1.776 5.637 -16.122 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.123 4.474 -16.143 1.00 0.00 H new ATOM 0 HG21 VAL A 40 2.843 3.688 -13.207 1.00 0.00 H new ATOM 0 HG22 VAL A 40 4.400 4.028 -13.998 1.00 0.00 H new ATOM 0 HG23 VAL A 40 3.944 4.905 -12.519 1.00 0.00 H new ATOM 621 N ALA A 41 3.751 8.098 -12.687 1.00 0.00 N ATOM 622 CA ALA A 41 4.270 8.809 -11.530 1.00 0.00 C ATOM 623 C ALA A 41 3.839 8.154 -10.220 1.00 0.00 C ATOM 624 O ALA A 41 2.838 7.439 -10.170 1.00 0.00 O ATOM 625 CB ALA A 41 3.784 10.258 -11.584 1.00 0.00 C ATOM 0 H ALA A 41 2.768 8.283 -12.886 1.00 0.00 H new ATOM 0 HA ALA A 41 5.359 8.776 -11.561 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.167 10.803 -10.721 1.00 0.00 H new ATOM 0 HB2 ALA A 41 4.144 10.729 -12.499 1.00 0.00 H new ATOM 0 HB3 ALA A 41 2.694 10.277 -11.571 1.00 0.00 H new ATOM 631 N VAL A 42 4.601 8.400 -9.154 1.00 0.00 N ATOM 632 CA VAL A 42 4.271 7.942 -7.810 1.00 0.00 C ATOM 633 C VAL A 42 4.910 8.888 -6.797 1.00 0.00 C ATOM 634 O VAL A 42 6.071 9.259 -6.950 1.00 0.00 O ATOM 635 CB VAL A 42 4.735 6.491 -7.624 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.171 6.282 -8.089 1.00 0.00 C ATOM 637 CG2 VAL A 42 4.665 6.048 -6.167 1.00 0.00 C ATOM 0 H VAL A 42 5.472 8.928 -9.203 1.00 0.00 H new ATOM 0 HA VAL A 42 3.192 7.955 -7.654 1.00 0.00 H new ATOM 0 HB VAL A 42 4.053 5.897 -8.232 1.00 0.00 H new ATOM 0 HG11 VAL A 42 6.455 5.240 -7.938 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.250 6.530 -9.148 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.837 6.926 -7.515 1.00 0.00 H new ATOM 0 HG21 VAL A 42 5.003 5.015 -6.084 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.305 6.689 -5.561 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.637 6.123 -5.813 1.00 0.00 H new ATOM 647 N HIS A 43 4.157 9.283 -5.764 1.00 0.00 N ATOM 648 CA HIS A 43 4.633 10.230 -4.761 1.00 0.00 C ATOM 649 C HIS A 43 3.869 10.090 -3.453 1.00 0.00 C ATOM 650 O HIS A 43 2.835 9.428 -3.394 1.00 0.00 O ATOM 651 CB HIS A 43 4.403 11.662 -5.245 1.00 0.00 C ATOM 652 CG HIS A 43 4.988 11.991 -6.585 1.00 0.00 C ATOM 653 ND1 HIS A 43 6.309 12.386 -6.818 1.00 0.00 N ATOM 654 CD2 HIS A 43 4.311 11.954 -7.770 1.00 0.00 C ATOM 655 CE1 HIS A 43 6.391 12.570 -8.145 1.00 0.00 C ATOM 656 NE2 HIS A 43 5.212 12.324 -8.740 1.00 0.00 N ATOM 0 H HIS A 43 3.205 8.954 -5.604 1.00 0.00 H new ATOM 0 HA HIS A 43 5.691 10.019 -4.605 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.329 11.847 -5.281 1.00 0.00 H new ATOM 0 HB3 HIS A 43 4.820 12.348 -4.507 1.00 0.00 H new ATOM 0 HD1 HIS A 43 7.050 12.508 -6.128 1.00 0.00 H new ATOM 0 HD2 HIS A 43 3.275 11.687 -7.916 1.00 0.00 H new ATOM 0 HE1 HIS A 43 7.287 12.875 -8.666 1.00 0.00 H new ATOM 664 N ARG A 44 4.389 10.726 -2.396 1.00 0.00 N ATOM 665 CA ARG A 44 3.663 10.882 -1.147 1.00 0.00 C ATOM 666 C ARG A 44 2.491 11.825 -1.403 1.00 0.00 C ATOM 667 O ARG A 44 2.562 12.645 -2.312 1.00 0.00 O ATOM 668 CB ARG A 44 4.619 11.473 -0.109 1.00 0.00 C ATOM 669 CG ARG A 44 5.693 10.460 0.284 1.00 0.00 C ATOM 670 CD ARG A 44 7.053 11.125 0.496 1.00 0.00 C ATOM 671 NE ARG A 44 6.999 12.234 1.458 1.00 0.00 N ATOM 672 CZ ARG A 44 7.782 13.314 1.371 1.00 0.00 C ATOM 673 NH1 ARG A 44 8.667 13.436 0.388 1.00 0.00 N ATOM 674 NH2 ARG A 44 7.680 14.287 2.271 1.00 0.00 N ATOM 0 H ARG A 44 5.320 11.142 -2.390 1.00 0.00 H new ATOM 0 HA ARG A 44 3.284 9.929 -0.776 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.090 12.370 -0.512 1.00 0.00 H new ATOM 0 HB3 ARG A 44 4.059 11.777 0.775 1.00 0.00 H new ATOM 0 HG2 ARG A 44 5.392 9.949 1.198 1.00 0.00 H new ATOM 0 HG3 ARG A 44 5.777 9.700 -0.493 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.766 10.379 0.847 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.424 11.496 -0.459 1.00 0.00 H new ATOM 0 HE ARG A 44 6.333 12.177 2.228 1.00 0.00 H new ATOM 0 HH11 ARG A 44 8.756 12.700 -0.313 1.00 0.00 H new ATOM 0 HH12 ARG A 44 9.258 14.266 0.334 1.00 0.00 H new ATOM 0 HH21 ARG A 44 7.003 14.211 3.030 1.00 0.00 H new ATOM 0 HH22 ARG A 44 8.279 15.110 2.202 1.00 0.00 H new ATOM 688 N GLU A 45 1.414 11.731 -0.621 1.00 0.00 N ATOM 689 CA GLU A 45 0.254 12.601 -0.811 1.00 0.00 C ATOM 690 C GLU A 45 0.617 14.064 -0.527 1.00 0.00 C ATOM 691 O GLU A 45 -0.040 14.974 -1.027 1.00 0.00 O ATOM 692 CB GLU A 45 -0.887 12.086 0.075 1.00 0.00 C ATOM 693 CG GLU A 45 -2.194 12.860 -0.118 1.00 0.00 C ATOM 694 CD GLU A 45 -2.336 14.066 0.812 1.00 0.00 C ATOM 695 OE1 GLU A 45 -1.406 14.325 1.607 1.00 0.00 O ATOM 696 OE2 GLU A 45 -3.397 14.727 0.720 1.00 0.00 O ATOM 0 H GLU A 45 1.322 11.065 0.146 1.00 0.00 H new ATOM 0 HA GLU A 45 -0.078 12.574 -1.849 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -1.060 11.032 -0.142 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.585 12.150 1.120 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.256 13.200 -1.152 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -3.034 12.185 0.046 1.00 0.00 H new ATOM 703 N GLU A 46 1.660 14.291 0.274 1.00 0.00 N ATOM 704 CA GLU A 46 2.137 15.631 0.590 1.00 0.00 C ATOM 705 C GLU A 46 3.044 16.184 -0.511 1.00 0.00 C ATOM 706 O GLU A 46 3.466 17.339 -0.443 1.00 0.00 O ATOM 707 CB GLU A 46 2.877 15.591 1.933 1.00 0.00 C ATOM 708 CG GLU A 46 4.162 14.769 1.830 1.00 0.00 C ATOM 709 CD GLU A 46 4.719 14.413 3.208 1.00 0.00 C ATOM 710 OE1 GLU A 46 4.809 15.331 4.054 1.00 0.00 O ATOM 711 OE2 GLU A 46 5.058 13.224 3.402 1.00 0.00 O ATOM 0 H GLU A 46 2.196 13.547 0.721 1.00 0.00 H new ATOM 0 HA GLU A 46 1.280 16.301 0.660 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.116 16.606 2.250 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.228 15.162 2.697 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.965 13.855 1.270 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.909 15.331 1.270 1.00 0.00 H new ATOM 718 N ILE A 47 3.343 15.367 -1.528 1.00 0.00 N ATOM 719 CA ILE A 47 4.201 15.741 -2.647 1.00 0.00 C ATOM 720 C ILE A 47 3.412 15.704 -3.952 1.00 0.00 C ATOM 721 O ILE A 47 3.650 16.523 -4.833 1.00 0.00 O ATOM 722 CB ILE A 47 5.393 14.784 -2.705 1.00 0.00 C ATOM 723 CG1 ILE A 47 6.325 14.980 -1.506 1.00 0.00 C ATOM 724 CG2 ILE A 47 6.178 14.968 -4.002 1.00 0.00 C ATOM 725 CD1 ILE A 47 6.842 16.416 -1.367 1.00 0.00 C ATOM 0 H ILE A 47 2.987 14.413 -1.593 1.00 0.00 H new ATOM 0 HA ILE A 47 4.567 16.758 -2.505 1.00 0.00 H new ATOM 0 HB ILE A 47 4.995 13.770 -2.672 1.00 0.00 H new ATOM 0 HG12 ILE A 47 5.796 14.702 -0.594 1.00 0.00 H new ATOM 0 HG13 ILE A 47 7.174 14.303 -1.601 1.00 0.00 H new ATOM 0 HG21 ILE A 47 7.020 14.276 -4.019 1.00 0.00 H new ATOM 0 HG22 ILE A 47 5.527 14.768 -4.853 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.548 15.992 -4.061 1.00 0.00 H new ATOM 0 HD11 ILE A 47 7.496 16.485 -0.498 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.399 16.691 -2.263 1.00 0.00 H new ATOM 0 HD13 ILE A 47 5.999 17.096 -1.241 1.00 0.00 H new ATOM 737 N TYR A 48 2.475 14.765 -4.088 1.00 0.00 N ATOM 738 CA TYR A 48 1.663 14.652 -5.286 1.00 0.00 C ATOM 739 C TYR A 48 0.932 15.959 -5.581 1.00 0.00 C ATOM 740 O TYR A 48 0.781 16.340 -6.741 1.00 0.00 O ATOM 741 CB TYR A 48 0.661 13.518 -5.099 1.00 0.00 C ATOM 742 CG TYR A 48 -0.438 13.531 -6.132 1.00 0.00 C ATOM 743 CD1 TYR A 48 -0.125 13.473 -7.499 1.00 0.00 C ATOM 744 CD2 TYR A 48 -1.775 13.615 -5.719 1.00 0.00 C ATOM 745 CE1 TYR A 48 -1.148 13.522 -8.454 1.00 0.00 C ATOM 746 CE2 TYR A 48 -2.801 13.655 -6.666 1.00 0.00 C ATOM 747 CZ TYR A 48 -2.495 13.607 -8.041 1.00 0.00 C ATOM 748 OH TYR A 48 -3.493 13.648 -8.967 1.00 0.00 O ATOM 0 H TYR A 48 2.263 14.069 -3.373 1.00 0.00 H new ATOM 0 HA TYR A 48 2.312 14.438 -6.135 1.00 0.00 H new ATOM 0 HB2 TYR A 48 1.186 12.564 -5.146 1.00 0.00 H new ATOM 0 HB3 TYR A 48 0.220 13.590 -4.105 1.00 0.00 H new ATOM 0 HD1 TYR A 48 0.905 13.391 -7.814 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -2.012 13.649 -4.666 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -0.906 13.495 -9.506 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -3.830 13.723 -6.344 1.00 0.00 H new ATOM 0 HH TYR A 48 -4.359 13.705 -8.512 1.00 0.00 H new ATOM 758 N GLN A 49 0.479 16.654 -4.532 1.00 0.00 N ATOM 759 CA GLN A 49 -0.233 17.912 -4.694 1.00 0.00 C ATOM 760 C GLN A 49 0.686 18.982 -5.286 1.00 0.00 C ATOM 761 O GLN A 49 0.203 19.968 -5.845 1.00 0.00 O ATOM 762 CB GLN A 49 -0.761 18.377 -3.335 1.00 0.00 C ATOM 763 CG GLN A 49 -1.752 17.374 -2.748 1.00 0.00 C ATOM 764 CD GLN A 49 -2.219 17.833 -1.373 1.00 0.00 C ATOM 765 OE1 GLN A 49 -2.983 18.788 -1.249 1.00 0.00 O ATOM 766 NE2 GLN A 49 -1.764 17.151 -0.328 1.00 0.00 N ATOM 0 H GLN A 49 0.597 16.360 -3.562 1.00 0.00 H new ATOM 0 HA GLN A 49 -1.067 17.757 -5.379 1.00 0.00 H new ATOM 0 HB2 GLN A 49 0.073 18.512 -2.646 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -1.245 19.348 -3.444 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -2.609 17.267 -3.413 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -1.284 16.393 -2.671 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -1.131 16.364 -0.469 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -2.048 17.415 0.616 1.00 0.00 H new ATOM 775 N ARG A 50 2.005 18.796 -5.169 1.00 0.00 N ATOM 776 CA ARG A 50 2.977 19.767 -5.644 1.00 0.00 C ATOM 777 C ARG A 50 3.304 19.538 -7.117 1.00 0.00 C ATOM 778 O ARG A 50 3.510 20.504 -7.846 1.00 0.00 O ATOM 779 CB ARG A 50 4.235 19.661 -4.782 1.00 0.00 C ATOM 780 CG ARG A 50 5.266 20.702 -5.206 1.00 0.00 C ATOM 781 CD ARG A 50 6.482 20.598 -4.289 1.00 0.00 C ATOM 782 NE ARG A 50 6.179 21.056 -2.928 1.00 0.00 N ATOM 783 CZ ARG A 50 6.164 22.335 -2.547 1.00 0.00 C ATOM 784 NH1 ARG A 50 6.426 23.310 -3.417 1.00 0.00 N ATOM 785 NH2 ARG A 50 5.887 22.645 -1.284 1.00 0.00 N ATOM 0 H ARG A 50 2.421 17.968 -4.742 1.00 0.00 H new ATOM 0 HA ARG A 50 2.560 20.771 -5.560 1.00 0.00 H new ATOM 0 HB2 ARG A 50 3.976 19.804 -3.733 1.00 0.00 H new ATOM 0 HB3 ARG A 50 4.661 18.662 -4.872 1.00 0.00 H new ATOM 0 HG2 ARG A 50 5.561 20.539 -6.243 1.00 0.00 H new ATOM 0 HG3 ARG A 50 4.836 21.702 -5.150 1.00 0.00 H new ATOM 0 HD2 ARG A 50 6.825 19.564 -4.257 1.00 0.00 H new ATOM 0 HD3 ARG A 50 7.298 21.192 -4.699 1.00 0.00 H new ATOM 0 HE ARG A 50 5.965 20.348 -2.225 1.00 0.00 H new ATOM 0 HH11 ARG A 50 6.641 23.083 -4.388 1.00 0.00 H new ATOM 0 HH12 ARG A 50 6.411 24.283 -3.112 1.00 0.00 H new ATOM 0 HH21 ARG A 50 5.687 21.906 -0.610 1.00 0.00 H new ATOM 0 HH22 ARG A 50 5.875 23.621 -0.989 1.00 0.00 H new ATOM 799 N ILE A 51 3.353 18.279 -7.563 1.00 0.00 N ATOM 800 CA ILE A 51 3.569 17.983 -8.974 1.00 0.00 C ATOM 801 C ILE A 51 2.380 18.510 -9.791 1.00 0.00 C ATOM 802 O ILE A 51 2.477 18.669 -11.004 1.00 0.00 O ATOM 803 CB ILE A 51 3.842 16.483 -9.197 1.00 0.00 C ATOM 804 CG1 ILE A 51 5.237 16.091 -8.690 1.00 0.00 C ATOM 805 CG2 ILE A 51 3.827 16.137 -10.688 1.00 0.00 C ATOM 806 CD1 ILE A 51 5.326 16.028 -7.172 1.00 0.00 C ATOM 0 H ILE A 51 3.246 17.457 -6.969 1.00 0.00 H new ATOM 0 HA ILE A 51 4.464 18.497 -9.324 1.00 0.00 H new ATOM 0 HB ILE A 51 3.060 15.950 -8.656 1.00 0.00 H new ATOM 0 HG12 ILE A 51 5.508 15.120 -9.104 1.00 0.00 H new ATOM 0 HG13 ILE A 51 5.967 16.810 -9.061 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.022 15.072 -10.816 1.00 0.00 H new ATOM 0 HG22 ILE A 51 2.851 16.380 -11.108 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.597 16.712 -11.203 1.00 0.00 H new ATOM 0 HD11 ILE A 51 6.337 15.746 -6.878 1.00 0.00 H new ATOM 0 HD12 ILE A 51 5.086 17.005 -6.753 1.00 0.00 H new ATOM 0 HD13 ILE A 51 4.619 15.288 -6.796 1.00 0.00 H new ATOM 1635 N MET C 1 11.980 0.115 -7.752 1.00 0.00 N ATOM 1636 CA MET C 1 11.520 0.173 -6.353 1.00 0.00 C ATOM 1637 C MET C 1 11.667 1.580 -5.802 1.00 0.00 C ATOM 1638 O MET C 1 12.758 2.134 -5.826 1.00 0.00 O ATOM 1639 CB MET C 1 12.329 -0.769 -5.461 1.00 0.00 C ATOM 1640 CG MET C 1 11.965 -0.591 -3.988 1.00 0.00 C ATOM 1641 SD MET C 1 10.298 -1.121 -3.545 1.00 0.00 S ATOM 1642 CE MET C 1 10.659 -2.880 -3.367 1.00 0.00 C ATOM 0 H1 MET C 1 11.872 -0.854 -8.113 1.00 0.00 H new ATOM 0 H2 MET C 1 11.412 0.765 -8.332 1.00 0.00 H new ATOM 0 H3 MET C 1 12.981 0.393 -7.800 1.00 0.00 H new ATOM 0 HA MET C 1 10.473 -0.130 -6.350 1.00 0.00 H new ATOM 0 HB2 MET C 1 12.147 -1.801 -5.760 1.00 0.00 H new ATOM 0 HB3 MET C 1 13.393 -0.579 -5.600 1.00 0.00 H new ATOM 0 HG2 MET C 1 12.680 -1.148 -3.383 1.00 0.00 H new ATOM 0 HG3 MET C 1 12.077 0.461 -3.726 1.00 0.00 H new ATOM 0 HE1 MET C 1 9.749 -3.412 -3.090 1.00 0.00 H new ATOM 0 HE2 MET C 1 11.035 -3.272 -4.312 1.00 0.00 H new ATOM 0 HE3 MET C 1 11.412 -3.020 -2.591 1.00 0.00 H new ATOM 1654 N LEU C 2 10.569 2.153 -5.307 1.00 0.00 N ATOM 1655 CA LEU C 2 10.575 3.458 -4.672 1.00 0.00 C ATOM 1656 C LEU C 2 9.971 3.277 -3.281 1.00 0.00 C ATOM 1657 O LEU C 2 8.765 3.073 -3.150 1.00 0.00 O ATOM 1658 CB LEU C 2 9.797 4.435 -5.562 1.00 0.00 C ATOM 1659 CG LEU C 2 9.858 5.914 -5.146 1.00 0.00 C ATOM 1660 CD1 LEU C 2 8.575 6.303 -4.428 1.00 0.00 C ATOM 1661 CD2 LEU C 2 11.016 6.273 -4.218 1.00 0.00 C ATOM 0 H LEU C 2 9.648 1.716 -5.339 1.00 0.00 H new ATOM 0 HA LEU C 2 11.574 3.877 -4.554 1.00 0.00 H new ATOM 0 HB2 LEU C 2 10.174 4.348 -6.581 1.00 0.00 H new ATOM 0 HB3 LEU C 2 8.752 4.126 -5.582 1.00 0.00 H new ATOM 0 HG LEU C 2 10.002 6.457 -6.080 1.00 0.00 H new ATOM 0 HD11 LEU C 2 8.625 7.352 -4.136 1.00 0.00 H new ATOM 0 HD12 LEU C 2 7.725 6.152 -5.094 1.00 0.00 H new ATOM 0 HD13 LEU C 2 8.454 5.684 -3.539 1.00 0.00 H new ATOM 0 HD21 LEU C 2 10.976 7.336 -3.980 1.00 0.00 H new ATOM 0 HD22 LEU C 2 10.939 5.692 -3.299 1.00 0.00 H new ATOM 0 HD23 LEU C 2 11.961 6.047 -4.712 1.00 0.00 H new ATOM 1673 N ILE C 3 10.813 3.353 -2.245 1.00 0.00 N ATOM 1674 CA ILE C 3 10.386 3.217 -0.860 1.00 0.00 C ATOM 1675 C ILE C 3 9.876 4.557 -0.356 1.00 0.00 C ATOM 1676 O ILE C 3 10.363 5.612 -0.762 1.00 0.00 O ATOM 1677 CB ILE C 3 11.545 2.764 0.048 1.00 0.00 C ATOM 1678 CG1 ILE C 3 11.996 1.337 -0.266 1.00 0.00 C ATOM 1679 CG2 ILE C 3 11.088 2.776 1.510 1.00 0.00 C ATOM 1680 CD1 ILE C 3 13.075 1.309 -1.338 1.00 0.00 C ATOM 0 H ILE C 3 11.815 3.512 -2.351 1.00 0.00 H new ATOM 0 HA ILE C 3 9.600 2.463 -0.826 1.00 0.00 H new ATOM 0 HB ILE C 3 12.371 3.454 -0.126 1.00 0.00 H new ATOM 0 HG12 ILE C 3 12.373 0.867 0.642 1.00 0.00 H new ATOM 0 HG13 ILE C 3 11.140 0.749 -0.597 1.00 0.00 H new ATOM 0 HG21 ILE C 3 11.909 2.455 2.151 1.00 0.00 H new ATOM 0 HG22 ILE C 3 10.784 3.785 1.788 1.00 0.00 H new ATOM 0 HG23 ILE C 3 10.245 2.096 1.633 1.00 0.00 H new ATOM 0 HD11 ILE C 3 13.368 0.277 -1.532 1.00 0.00 H new ATOM 0 HD12 ILE C 3 12.689 1.755 -2.254 1.00 0.00 H new ATOM 0 HD13 ILE C 3 13.942 1.874 -0.996 1.00 0.00 H new ATOM 1692 N LEU C 4 8.888 4.500 0.535 1.00 0.00 N ATOM 1693 CA LEU C 4 8.344 5.648 1.229 1.00 0.00 C ATOM 1694 C LEU C 4 8.091 5.243 2.675 1.00 0.00 C ATOM 1695 O LEU C 4 7.947 4.057 2.970 1.00 0.00 O ATOM 1696 CB LEU C 4 7.036 6.091 0.563 1.00 0.00 C ATOM 1697 CG LEU C 4 7.226 6.566 -0.886 1.00 0.00 C ATOM 1698 CD1 LEU C 4 5.862 6.878 -1.495 1.00 0.00 C ATOM 1699 CD2 LEU C 4 8.079 7.829 -0.952 1.00 0.00 C ATOM 0 H LEU C 4 8.436 3.624 0.796 1.00 0.00 H new ATOM 0 HA LEU C 4 9.042 6.484 1.190 1.00 0.00 H new ATOM 0 HB2 LEU C 4 6.329 5.261 0.577 1.00 0.00 H new ATOM 0 HB3 LEU C 4 6.593 6.897 1.148 1.00 0.00 H new ATOM 0 HG LEU C 4 7.730 5.771 -1.436 1.00 0.00 H new ATOM 0 HD11 LEU C 4 5.991 7.216 -2.523 1.00 0.00 H new ATOM 0 HD12 LEU C 4 5.244 5.980 -1.483 1.00 0.00 H new ATOM 0 HD13 LEU C 4 5.375 7.662 -0.914 1.00 0.00 H new ATOM 0 HD21 LEU C 4 8.193 8.137 -1.991 1.00 0.00 H new ATOM 0 HD22 LEU C 4 7.593 8.626 -0.389 1.00 0.00 H new ATOM 0 HD23 LEU C 4 9.061 7.628 -0.523 1.00 0.00 H new ATOM 1711 N THR C 5 8.028 6.223 3.577 1.00 0.00 N ATOM 1712 CA THR C 5 7.681 5.977 4.968 1.00 0.00 C ATOM 1713 C THR C 5 6.414 6.758 5.259 1.00 0.00 C ATOM 1714 O THR C 5 6.263 7.900 4.813 1.00 0.00 O ATOM 1715 CB THR C 5 8.809 6.382 5.922 1.00 0.00 C ATOM 1716 OG1 THR C 5 9.171 7.728 5.720 1.00 0.00 O ATOM 1717 CG2 THR C 5 10.042 5.509 5.713 1.00 0.00 C ATOM 0 H THR C 5 8.216 7.202 3.361 1.00 0.00 H new ATOM 0 HA THR C 5 7.524 4.910 5.127 1.00 0.00 H new ATOM 0 HB THR C 5 8.439 6.248 6.938 1.00 0.00 H new ATOM 0 HG1 THR C 5 9.891 7.969 6.339 1.00 0.00 H new ATOM 0 HG21 THR C 5 10.828 5.818 6.403 1.00 0.00 H new ATOM 0 HG22 THR C 5 9.785 4.466 5.899 1.00 0.00 H new ATOM 0 HG23 THR C 5 10.396 5.618 4.688 1.00 0.00 H new ATOM 1725 N ARG C 6 5.494 6.154 6.012 1.00 0.00 N ATOM 1726 CA ARG C 6 4.211 6.780 6.263 1.00 0.00 C ATOM 1727 C ARG C 6 3.704 6.424 7.654 1.00 0.00 C ATOM 1728 O ARG C 6 3.674 5.247 8.012 1.00 0.00 O ATOM 1729 CB ARG C 6 3.254 6.271 5.177 1.00 0.00 C ATOM 1730 CG ARG C 6 2.001 7.127 4.995 1.00 0.00 C ATOM 1731 CD ARG C 6 2.295 8.447 4.276 1.00 0.00 C ATOM 1732 NE ARG C 6 2.862 9.462 5.169 1.00 0.00 N ATOM 1733 CZ ARG C 6 3.510 10.552 4.753 1.00 0.00 C ATOM 1734 NH1 ARG C 6 3.685 10.796 3.460 1.00 0.00 N ATOM 1735 NH2 ARG C 6 3.990 11.419 5.636 1.00 0.00 N ATOM 0 H ARG C 6 5.618 5.242 6.451 1.00 0.00 H new ATOM 0 HA ARG C 6 4.289 7.867 6.228 1.00 0.00 H new ATOM 0 HB2 ARG C 6 3.790 6.225 4.229 1.00 0.00 H new ATOM 0 HB3 ARG C 6 2.952 5.253 5.422 1.00 0.00 H new ATOM 0 HG2 ARG C 6 1.259 6.565 4.428 1.00 0.00 H new ATOM 0 HG3 ARG C 6 1.563 7.338 5.971 1.00 0.00 H new ATOM 0 HD2 ARG C 6 2.988 8.263 3.455 1.00 0.00 H new ATOM 0 HD3 ARG C 6 1.374 8.829 3.836 1.00 0.00 H new ATOM 0 HE ARG C 6 2.754 9.326 6.174 1.00 0.00 H new ATOM 0 HH11 ARG C 6 3.321 10.145 2.764 1.00 0.00 H new ATOM 0 HH12 ARG C 6 4.183 11.635 3.162 1.00 0.00 H new ATOM 0 HH21 ARG C 6 3.864 11.253 6.634 1.00 0.00 H new ATOM 0 HH22 ARG C 6 4.485 12.251 5.316 1.00 0.00 H new ATOM 1749 N LYS C 7 3.308 7.430 8.441 1.00 0.00 N ATOM 1750 CA LYS C 7 2.735 7.194 9.759 1.00 0.00 C ATOM 1751 C LYS C 7 1.279 6.778 9.574 1.00 0.00 C ATOM 1752 O LYS C 7 0.632 7.208 8.617 1.00 0.00 O ATOM 1753 CB LYS C 7 2.830 8.474 10.597 1.00 0.00 C ATOM 1754 CG LYS C 7 3.387 8.248 12.009 1.00 0.00 C ATOM 1755 CD LYS C 7 4.831 7.740 12.009 1.00 0.00 C ATOM 1756 CE LYS C 7 5.351 7.605 13.439 1.00 0.00 C ATOM 1757 NZ LYS C 7 5.497 8.919 14.090 1.00 0.00 N ATOM 0 H LYS C 7 3.376 8.414 8.183 1.00 0.00 H new ATOM 0 HA LYS C 7 3.278 6.406 10.281 1.00 0.00 H new ATOM 0 HB2 LYS C 7 3.464 9.192 10.077 1.00 0.00 H new ATOM 0 HB3 LYS C 7 1.839 8.921 10.674 1.00 0.00 H new ATOM 0 HG2 LYS C 7 3.337 9.183 12.567 1.00 0.00 H new ATOM 0 HG3 LYS C 7 2.755 7.530 12.532 1.00 0.00 H new ATOM 0 HD2 LYS C 7 4.883 6.775 11.504 1.00 0.00 H new ATOM 0 HD3 LYS C 7 5.465 8.428 11.449 1.00 0.00 H new ATOM 0 HE2 LYS C 7 4.667 6.985 14.019 1.00 0.00 H new ATOM 0 HE3 LYS C 7 6.314 7.094 13.430 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 6.080 8.820 14.946 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 5.956 9.582 13.434 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 4.558 9.284 14.350 1.00 0.00 H new ATOM 1771 N VAL C 8 0.749 5.945 10.473 1.00 0.00 N ATOM 1772 CA VAL C 8 -0.643 5.528 10.367 1.00 0.00 C ATOM 1773 C VAL C 8 -1.545 6.762 10.364 1.00 0.00 C ATOM 1774 O VAL C 8 -1.404 7.636 11.220 1.00 0.00 O ATOM 1775 CB VAL C 8 -1.022 4.540 11.479 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -0.152 3.286 11.375 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -0.869 5.113 12.887 1.00 0.00 C ATOM 0 H VAL C 8 1.255 5.554 11.267 1.00 0.00 H new ATOM 0 HA VAL C 8 -0.783 4.996 9.426 1.00 0.00 H new ATOM 0 HB VAL C 8 -2.077 4.311 11.330 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -0.424 2.588 12.166 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -0.308 2.814 10.405 1.00 0.00 H new ATOM 0 HG13 VAL C 8 0.897 3.562 11.480 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -1.155 4.358 13.620 1.00 0.00 H new ATOM 0 HG22 VAL C 8 0.169 5.403 13.051 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -1.512 5.987 12.996 1.00 0.00 H new ATOM 1787 N GLY C 9 -2.472 6.838 9.405 1.00 0.00 N ATOM 1788 CA GLY C 9 -3.393 7.960 9.286 1.00 0.00 C ATOM 1789 C GLY C 9 -3.036 8.908 8.135 1.00 0.00 C ATOM 1790 O GLY C 9 -3.738 9.896 7.928 1.00 0.00 O ATOM 0 H GLY C 9 -2.601 6.121 8.691 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -4.403 7.579 9.136 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -3.399 8.519 10.222 1.00 0.00 H new ATOM 1794 N GLU C 10 -1.963 8.623 7.387 1.00 0.00 N ATOM 1795 CA GLU C 10 -1.536 9.457 6.270 1.00 0.00 C ATOM 1796 C GLU C 10 -1.745 8.735 4.936 1.00 0.00 C ATOM 1797 O GLU C 10 -2.283 7.625 4.913 1.00 0.00 O ATOM 1798 CB GLU C 10 -0.070 9.866 6.464 1.00 0.00 C ATOM 1799 CG GLU C 10 0.145 10.617 7.777 1.00 0.00 C ATOM 1800 CD GLU C 10 1.601 11.038 7.942 1.00 0.00 C ATOM 1801 OE1 GLU C 10 2.486 10.160 7.783 1.00 0.00 O ATOM 1802 OE2 GLU C 10 1.827 12.234 8.226 1.00 0.00 O ATOM 0 H GLU C 10 -1.371 7.807 7.543 1.00 0.00 H new ATOM 0 HA GLU C 10 -2.147 10.359 6.245 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.560 8.977 6.448 1.00 0.00 H new ATOM 0 HB3 GLU C 10 0.244 10.495 5.631 1.00 0.00 H new ATOM 0 HG2 GLU C 10 -0.496 11.498 7.804 1.00 0.00 H new ATOM 0 HG3 GLU C 10 -0.150 9.983 8.613 1.00 0.00 H new ATOM 1809 N SER C 11 -1.329 9.348 3.817 1.00 0.00 N ATOM 1810 CA SER C 11 -1.630 8.825 2.489 1.00 0.00 C ATOM 1811 C SER C 11 -0.469 8.956 1.498 1.00 0.00 C ATOM 1812 O SER C 11 0.529 9.626 1.759 1.00 0.00 O ATOM 1813 CB SER C 11 -2.854 9.559 1.935 1.00 0.00 C ATOM 1814 OG SER C 11 -3.959 9.412 2.803 1.00 0.00 O ATOM 0 H SER C 11 -0.782 10.209 3.813 1.00 0.00 H new ATOM 0 HA SER C 11 -1.820 7.758 2.603 1.00 0.00 H new ATOM 0 HB2 SER C 11 -2.623 10.617 1.808 1.00 0.00 H new ATOM 0 HB3 SER C 11 -3.105 9.167 0.949 1.00 0.00 H new ATOM 0 HG SER C 11 -4.731 9.889 2.433 1.00 0.00 H new ATOM 1820 N ILE C 12 -0.631 8.299 0.343 1.00 0.00 N ATOM 1821 CA ILE C 12 0.337 8.226 -0.751 1.00 0.00 C ATOM 1822 C ILE C 12 -0.455 8.247 -2.068 1.00 0.00 C ATOM 1823 O ILE C 12 -1.666 8.039 -2.055 1.00 0.00 O ATOM 1824 CB ILE C 12 1.184 6.950 -0.580 1.00 0.00 C ATOM 1825 CG1 ILE C 12 1.983 7.018 0.730 1.00 0.00 C ATOM 1826 CG2 ILE C 12 2.153 6.739 -1.748 1.00 0.00 C ATOM 1827 CD1 ILE C 12 2.837 5.771 0.965 1.00 0.00 C ATOM 0 H ILE C 12 -1.484 7.779 0.139 1.00 0.00 H new ATOM 0 HA ILE C 12 1.029 9.068 -0.753 1.00 0.00 H new ATOM 0 HB ILE C 12 0.493 6.108 -0.557 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.627 7.897 0.713 1.00 0.00 H new ATOM 0 HG13 ILE C 12 1.294 7.144 1.565 1.00 0.00 H new ATOM 0 HG21 ILE C 12 2.728 5.828 -1.583 1.00 0.00 H new ATOM 0 HG22 ILE C 12 1.589 6.649 -2.677 1.00 0.00 H new ATOM 0 HG23 ILE C 12 2.832 7.589 -1.816 1.00 0.00 H new ATOM 0 HD11 ILE C 12 3.380 5.874 1.905 1.00 0.00 H new ATOM 0 HD12 ILE C 12 2.193 4.893 1.012 1.00 0.00 H new ATOM 0 HD13 ILE C 12 3.547 5.657 0.146 1.00 0.00 H new ATOM 1839 N ASN C 13 0.200 8.488 -3.208 1.00 0.00 N ATOM 1840 CA ASN C 13 -0.478 8.594 -4.500 1.00 0.00 C ATOM 1841 C ASN C 13 0.293 7.900 -5.620 1.00 0.00 C ATOM 1842 O ASN C 13 1.512 7.754 -5.559 1.00 0.00 O ATOM 1843 CB ASN C 13 -0.661 10.071 -4.847 1.00 0.00 C ATOM 1844 CG ASN C 13 -1.894 10.644 -4.171 1.00 0.00 C ATOM 1845 OD1 ASN C 13 -1.796 11.339 -3.164 1.00 0.00 O ATOM 1846 ND2 ASN C 13 -3.068 10.353 -4.723 1.00 0.00 N ATOM 0 H ASN C 13 1.211 8.614 -3.259 1.00 0.00 H new ATOM 0 HA ASN C 13 -1.443 8.094 -4.412 1.00 0.00 H new ATOM 0 HB2 ASN C 13 0.221 10.632 -4.538 1.00 0.00 H new ATOM 0 HB3 ASN C 13 -0.749 10.186 -5.927 1.00 0.00 H new ATOM 0 HD21 ASN C 13 -3.929 10.711 -4.309 1.00 0.00 H new ATOM 0 HD22 ASN C 13 -3.108 9.772 -5.560 1.00 0.00 H new ATOM 1853 N ILE C 14 -0.450 7.476 -6.651 1.00 0.00 N ATOM 1854 CA ILE C 14 0.092 6.791 -7.819 1.00 0.00 C ATOM 1855 C ILE C 14 -0.671 7.252 -9.060 1.00 0.00 C ATOM 1856 O ILE C 14 -1.882 7.483 -9.004 1.00 0.00 O ATOM 1857 CB ILE C 14 -0.040 5.271 -7.632 1.00 0.00 C ATOM 1858 CG1 ILE C 14 0.674 4.819 -6.348 1.00 0.00 C ATOM 1859 CG2 ILE C 14 0.544 4.539 -8.844 1.00 0.00 C ATOM 1860 CD1 ILE C 14 0.551 3.314 -6.115 1.00 0.00 C ATOM 0 H ILE C 14 -1.461 7.604 -6.692 1.00 0.00 H new ATOM 0 HA ILE C 14 1.148 7.031 -7.941 1.00 0.00 H new ATOM 0 HB ILE C 14 -1.098 5.025 -7.544 1.00 0.00 H new ATOM 0 HG12 ILE C 14 1.728 5.090 -6.406 1.00 0.00 H new ATOM 0 HG13 ILE C 14 0.254 5.352 -5.495 1.00 0.00 H new ATOM 0 HG21 ILE C 14 0.445 3.463 -8.701 1.00 0.00 H new ATOM 0 HG22 ILE C 14 0.005 4.837 -9.743 1.00 0.00 H new ATOM 0 HG23 ILE C 14 1.598 4.796 -8.951 1.00 0.00 H new ATOM 0 HD11 ILE C 14 1.072 3.044 -5.196 1.00 0.00 H new ATOM 0 HD12 ILE C 14 -0.501 3.044 -6.028 1.00 0.00 H new ATOM 0 HD13 ILE C 14 0.995 2.778 -6.954 1.00 0.00 H new ATOM 1872 N GLY C 15 0.038 7.388 -10.183 1.00 0.00 N ATOM 1873 CA GLY C 15 -0.560 7.835 -11.430 1.00 0.00 C ATOM 1874 C GLY C 15 -1.245 9.184 -11.245 1.00 0.00 C ATOM 1875 O GLY C 15 -0.736 10.060 -10.546 1.00 0.00 O ATOM 0 H GLY C 15 1.037 7.191 -10.247 1.00 0.00 H new ATOM 0 HA2 GLY C 15 0.208 7.914 -12.200 1.00 0.00 H new ATOM 0 HA3 GLY C 15 -1.284 7.098 -11.777 1.00 0.00 H new ATOM 1879 N ASP C 16 -2.405 9.335 -11.884 1.00 0.00 N ATOM 1880 CA ASP C 16 -3.222 10.539 -11.799 1.00 0.00 C ATOM 1881 C ASP C 16 -4.666 10.160 -11.460 1.00 0.00 C ATOM 1882 O ASP C 16 -5.562 11.000 -11.526 1.00 0.00 O ATOM 1883 CB ASP C 16 -3.143 11.304 -13.119 1.00 0.00 C ATOM 1884 CG ASP C 16 -1.719 11.750 -13.432 1.00 0.00 C ATOM 1885 OD1 ASP C 16 -1.330 12.827 -12.923 1.00 0.00 O ATOM 1886 OD2 ASP C 16 -1.030 11.016 -14.174 1.00 0.00 O ATOM 0 H ASP C 16 -2.806 8.613 -12.482 1.00 0.00 H new ATOM 0 HA ASP C 16 -2.848 11.187 -11.006 1.00 0.00 H new ATOM 0 HB2 ASP C 16 -3.512 10.673 -13.927 1.00 0.00 H new ATOM 0 HB3 ASP C 16 -3.795 12.176 -13.073 1.00 0.00 H new ATOM 1891 N ASP C 17 -4.883 8.889 -11.102 1.00 0.00 N ATOM 1892 CA ASP C 17 -6.207 8.350 -10.821 1.00 0.00 C ATOM 1893 C ASP C 17 -6.191 7.365 -9.650 1.00 0.00 C ATOM 1894 O ASP C 17 -7.200 6.697 -9.415 1.00 0.00 O ATOM 1895 CB ASP C 17 -6.757 7.667 -12.078 1.00 0.00 C ATOM 1896 CG ASP C 17 -6.899 8.650 -13.239 1.00 0.00 C ATOM 1897 OD1 ASP C 17 -7.910 9.386 -13.251 1.00 0.00 O ATOM 1898 OD2 ASP C 17 -5.995 8.653 -14.107 1.00 0.00 O ATOM 0 H ASP C 17 -4.134 8.204 -11.000 1.00 0.00 H new ATOM 0 HA ASP C 17 -6.853 9.180 -10.535 1.00 0.00 H new ATOM 0 HB2 ASP C 17 -6.094 6.853 -12.370 1.00 0.00 H new ATOM 0 HB3 ASP C 17 -7.728 7.223 -11.856 1.00 0.00 H new ATOM 1903 N ILE C 18 -5.080 7.254 -8.908 1.00 0.00 N ATOM 1904 CA ILE C 18 -5.014 6.328 -7.784 1.00 0.00 C ATOM 1905 C ILE C 18 -4.462 7.022 -6.543 1.00 0.00 C ATOM 1906 O ILE C 18 -3.622 7.920 -6.623 1.00 0.00 O ATOM 1907 CB ILE C 18 -4.159 5.099 -8.145 1.00 0.00 C ATOM 1908 CG1 ILE C 18 -4.689 4.362 -9.381 1.00 0.00 C ATOM 1909 CG2 ILE C 18 -4.149 4.111 -6.976 1.00 0.00 C ATOM 1910 CD1 ILE C 18 -4.040 4.873 -10.667 1.00 0.00 C ATOM 0 H ILE C 18 -4.227 7.790 -9.068 1.00 0.00 H new ATOM 0 HA ILE C 18 -6.026 5.989 -7.561 1.00 0.00 H new ATOM 0 HB ILE C 18 -3.156 5.467 -8.361 1.00 0.00 H new ATOM 0 HG12 ILE C 18 -4.498 3.294 -9.277 1.00 0.00 H new ATOM 0 HG13 ILE C 18 -5.770 4.488 -9.444 1.00 0.00 H new ATOM 0 HG21 ILE C 18 -3.543 3.244 -7.238 1.00 0.00 H new ATOM 0 HG22 ILE C 18 -3.729 4.595 -6.094 1.00 0.00 H new ATOM 0 HG23 ILE C 18 -5.168 3.790 -6.762 1.00 0.00 H new ATOM 0 HD11 ILE C 18 -4.442 4.326 -11.520 1.00 0.00 H new ATOM 0 HD12 ILE C 18 -4.253 5.936 -10.785 1.00 0.00 H new ATOM 0 HD13 ILE C 18 -2.962 4.723 -10.615 1.00 0.00 H new ATOM 1922 N THR C 19 -4.958 6.589 -5.381 1.00 0.00 N ATOM 1923 CA THR C 19 -4.525 7.068 -4.080 1.00 0.00 C ATOM 1924 C THR C 19 -4.394 5.870 -3.151 1.00 0.00 C ATOM 1925 O THR C 19 -5.053 4.850 -3.353 1.00 0.00 O ATOM 1926 CB THR C 19 -5.547 8.078 -3.541 1.00 0.00 C ATOM 1927 OG1 THR C 19 -5.756 9.109 -4.480 1.00 0.00 O ATOM 1928 CG2 THR C 19 -5.092 8.713 -2.227 1.00 0.00 C ATOM 0 H THR C 19 -5.688 5.879 -5.325 1.00 0.00 H new ATOM 0 HA THR C 19 -3.561 7.572 -4.152 1.00 0.00 H new ATOM 0 HB THR C 19 -6.469 7.525 -3.363 1.00 0.00 H new ATOM 0 HG1 THR C 19 -6.411 9.746 -4.126 1.00 0.00 H new ATOM 0 HG21 THR C 19 -5.847 9.421 -1.884 1.00 0.00 H new ATOM 0 HG22 THR C 19 -4.955 7.936 -1.475 1.00 0.00 H new ATOM 0 HG23 THR C 19 -4.149 9.236 -2.383 1.00 0.00 H new ATOM 1936 N ILE C 20 -3.544 5.987 -2.132 1.00 0.00 N ATOM 1937 CA ILE C 20 -3.236 4.912 -1.201 1.00 0.00 C ATOM 1938 C ILE C 20 -3.277 5.492 0.208 1.00 0.00 C ATOM 1939 O ILE C 20 -2.969 6.669 0.397 1.00 0.00 O ATOM 1940 CB ILE C 20 -1.837 4.358 -1.512 1.00 0.00 C ATOM 1941 CG1 ILE C 20 -1.691 3.885 -2.966 1.00 0.00 C ATOM 1942 CG2 ILE C 20 -1.476 3.222 -0.550 1.00 0.00 C ATOM 1943 CD1 ILE C 20 -2.539 2.656 -3.280 1.00 0.00 C ATOM 0 H ILE C 20 -3.042 6.851 -1.930 1.00 0.00 H new ATOM 0 HA ILE C 20 -3.956 4.099 -1.289 1.00 0.00 H new ATOM 0 HB ILE C 20 -1.141 5.185 -1.373 1.00 0.00 H new ATOM 0 HG12 ILE C 20 -1.974 4.696 -3.637 1.00 0.00 H new ATOM 0 HG13 ILE C 20 -0.644 3.658 -3.165 1.00 0.00 H new ATOM 0 HG21 ILE C 20 -0.482 2.845 -0.789 1.00 0.00 H new ATOM 0 HG22 ILE C 20 -1.486 3.595 0.474 1.00 0.00 H new ATOM 0 HG23 ILE C 20 -2.203 2.416 -0.650 1.00 0.00 H new ATOM 0 HD11 ILE C 20 -2.393 2.370 -4.322 1.00 0.00 H new ATOM 0 HD12 ILE C 20 -2.240 1.832 -2.632 1.00 0.00 H new ATOM 0 HD13 ILE C 20 -3.591 2.887 -3.111 1.00 0.00 H new ATOM 1955 N THR C 21 -3.650 4.679 1.196 1.00 0.00 N ATOM 1956 CA THR C 21 -3.767 5.139 2.574 1.00 0.00 C ATOM 1957 C THR C 21 -3.268 4.057 3.521 1.00 0.00 C ATOM 1958 O THR C 21 -3.359 2.867 3.212 1.00 0.00 O ATOM 1959 CB THR C 21 -5.234 5.474 2.872 1.00 0.00 C ATOM 1960 OG1 THR C 21 -5.757 6.310 1.862 1.00 0.00 O ATOM 1961 CG2 THR C 21 -5.386 6.196 4.209 1.00 0.00 C ATOM 0 H THR C 21 -3.877 3.693 1.063 1.00 0.00 H new ATOM 0 HA THR C 21 -3.160 6.033 2.717 1.00 0.00 H new ATOM 0 HB THR C 21 -5.777 4.529 2.910 1.00 0.00 H new ATOM 0 HG1 THR C 21 -6.694 6.517 2.061 1.00 0.00 H new ATOM 0 HG21 THR C 21 -6.439 6.417 4.386 1.00 0.00 H new ATOM 0 HG22 THR C 21 -5.009 5.561 5.010 1.00 0.00 H new ATOM 0 HG23 THR C 21 -4.819 7.127 4.187 1.00 0.00 H new ATOM 1969 N ILE C 22 -2.748 4.469 4.677 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.275 3.561 5.710 1.00 0.00 C ATOM 1971 C ILE C 22 -3.215 3.677 6.906 1.00 0.00 C ATOM 1972 O ILE C 22 -2.996 4.470 7.823 1.00 0.00 O ATOM 1973 CB ILE C 22 -0.795 3.820 6.027 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -0.315 3.031 7.246 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -0.492 5.299 6.271 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -0.592 1.538 7.099 1.00 0.00 C ATOM 0 H ILE C 22 -2.644 5.454 4.921 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.302 2.524 5.376 1.00 0.00 H new ATOM 0 HB ILE C 22 -0.260 3.485 5.138 1.00 0.00 H new ATOM 0 HG12 ILE C 22 0.754 3.190 7.384 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -0.812 3.407 8.141 1.00 0.00 H new ATOM 0 HG21 ILE C 22 0.569 5.422 6.490 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -0.748 5.874 5.381 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -1.081 5.657 7.116 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -0.236 1.013 7.985 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -1.664 1.376 6.987 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -0.074 1.157 6.219 1.00 0.00 H new ATOM 1988 N LEU C 23 -4.280 2.871 6.889 1.00 0.00 N ATOM 1989 CA LEU C 23 -5.327 2.923 7.898 1.00 0.00 C ATOM 1990 C LEU C 23 -4.781 2.570 9.279 1.00 0.00 C ATOM 1991 O LEU C 23 -5.285 3.074 10.284 1.00 0.00 O ATOM 1992 CB LEU C 23 -6.452 1.959 7.512 1.00 0.00 C ATOM 1993 CG LEU C 23 -6.935 2.147 6.067 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -8.069 1.168 5.777 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -7.450 3.561 5.819 1.00 0.00 C ATOM 0 H LEU C 23 -4.436 2.164 6.171 1.00 0.00 H new ATOM 0 HA LEU C 23 -5.716 3.940 7.944 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -6.105 0.934 7.643 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -7.293 2.100 8.191 1.00 0.00 H new ATOM 0 HG LEU C 23 -6.083 1.966 5.412 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -8.412 1.302 4.751 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -7.711 0.147 5.910 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -8.895 1.355 6.463 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -7.782 3.651 4.785 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -8.286 3.766 6.488 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -6.651 4.278 6.007 1.00 0.00 H new ATOM 2007 N GLY C 24 -3.756 1.709 9.341 1.00 0.00 N ATOM 2008 CA GLY C 24 -3.111 1.393 10.608 1.00 0.00 C ATOM 2009 C GLY C 24 -2.401 0.046 10.593 1.00 0.00 C ATOM 2010 O GLY C 24 -2.226 -0.557 9.536 1.00 0.00 O ATOM 0 H GLY C 24 -3.364 1.226 8.533 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -2.390 2.175 10.848 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -3.859 1.395 11.401 1.00 0.00 H new ATOM 2014 N VAL C 25 -1.991 -0.425 11.778 1.00 0.00 N ATOM 2015 CA VAL C 25 -1.352 -1.732 11.928 1.00 0.00 C ATOM 2016 C VAL C 25 -1.975 -2.469 13.111 1.00 0.00 C ATOM 2017 O VAL C 25 -2.613 -1.860 13.974 1.00 0.00 O ATOM 2018 CB VAL C 25 0.171 -1.601 12.117 1.00 0.00 C ATOM 2019 CG1 VAL C 25 0.776 -0.627 11.105 1.00 0.00 C ATOM 2020 CG2 VAL C 25 0.514 -1.138 13.533 1.00 0.00 C ATOM 0 H VAL C 25 -2.094 0.089 12.653 1.00 0.00 H new ATOM 0 HA VAL C 25 -1.517 -2.302 11.014 1.00 0.00 H new ATOM 0 HB VAL C 25 0.598 -2.590 11.953 1.00 0.00 H new ATOM 0 HG11 VAL C 25 1.852 -0.557 11.265 1.00 0.00 H new ATOM 0 HG12 VAL C 25 0.582 -0.986 10.094 1.00 0.00 H new ATOM 0 HG13 VAL C 25 0.326 0.357 11.233 1.00 0.00 H new ATOM 0 HG21 VAL C 25 1.596 -1.055 13.637 1.00 0.00 H new ATOM 0 HG22 VAL C 25 0.056 -0.167 13.719 1.00 0.00 H new ATOM 0 HG23 VAL C 25 0.135 -1.862 14.254 1.00 0.00 H new ATOM 2030 N SER C 26 -1.778 -3.786 13.150 1.00 0.00 N ATOM 2031 CA SER C 26 -2.244 -4.638 14.232 1.00 0.00 C ATOM 2032 C SER C 26 -1.319 -5.846 14.282 1.00 0.00 C ATOM 2033 O SER C 26 -1.482 -6.799 13.518 1.00 0.00 O ATOM 2034 CB SER C 26 -3.703 -5.041 14.008 1.00 0.00 C ATOM 2035 OG SER C 26 -3.871 -5.605 12.726 1.00 0.00 O ATOM 0 H SER C 26 -1.282 -4.294 12.418 1.00 0.00 H new ATOM 0 HA SER C 26 -2.216 -4.114 15.187 1.00 0.00 H new ATOM 0 HB2 SER C 26 -4.009 -5.758 14.770 1.00 0.00 H new ATOM 0 HB3 SER C 26 -4.347 -4.168 14.115 1.00 0.00 H new ATOM 0 HG SER C 26 -4.809 -5.858 12.601 1.00 0.00 H new ATOM 2041 N GLY C 27 -0.342 -5.811 15.185 1.00 0.00 N ATOM 2042 CA GLY C 27 0.704 -6.815 15.183 1.00 0.00 C ATOM 2043 C GLY C 27 1.605 -6.567 13.983 1.00 0.00 C ATOM 2044 O GLY C 27 2.132 -5.467 13.819 1.00 0.00 O ATOM 0 H GLY C 27 -0.258 -5.105 15.917 1.00 0.00 H new ATOM 0 HA2 GLY C 27 1.280 -6.764 16.107 1.00 0.00 H new ATOM 0 HA3 GLY C 27 0.271 -7.814 15.132 1.00 0.00 H new ATOM 2048 N GLN C 28 1.789 -7.591 13.149 1.00 0.00 N ATOM 2049 CA GLN C 28 2.615 -7.489 11.957 1.00 0.00 C ATOM 2050 C GLN C 28 1.735 -7.261 10.735 1.00 0.00 C ATOM 2051 O GLN C 28 2.241 -7.177 9.618 1.00 0.00 O ATOM 2052 CB GLN C 28 3.484 -8.744 11.824 1.00 0.00 C ATOM 2053 CG GLN C 28 4.832 -8.533 12.514 1.00 0.00 C ATOM 2054 CD GLN C 28 4.691 -7.813 13.852 1.00 0.00 C ATOM 2055 OE1 GLN C 28 4.383 -8.425 14.870 1.00 0.00 O ATOM 2056 NE2 GLN C 28 4.914 -6.496 13.850 1.00 0.00 N ATOM 0 H GLN C 28 1.368 -8.510 13.285 1.00 0.00 H new ATOM 0 HA GLN C 28 3.285 -6.633 12.037 1.00 0.00 H new ATOM 0 HB2 GLN C 28 2.971 -9.598 12.267 1.00 0.00 H new ATOM 0 HB3 GLN C 28 3.640 -8.977 10.771 1.00 0.00 H new ATOM 0 HG2 GLN C 28 5.312 -9.499 12.672 1.00 0.00 H new ATOM 0 HG3 GLN C 28 5.486 -7.956 11.860 1.00 0.00 H new ATOM 0 HE21 GLN C 28 5.168 -6.023 12.983 1.00 0.00 H new ATOM 0 HE22 GLN C 28 4.830 -5.963 14.716 1.00 0.00 H new ATOM 2065 N GLN C 29 0.420 -7.163 10.941 1.00 0.00 N ATOM 2066 CA GLN C 29 -0.495 -6.811 9.879 1.00 0.00 C ATOM 2067 C GLN C 29 -0.469 -5.306 9.660 1.00 0.00 C ATOM 2068 O GLN C 29 -0.044 -4.544 10.527 1.00 0.00 O ATOM 2069 CB GLN C 29 -1.926 -7.196 10.233 1.00 0.00 C ATOM 2070 CG GLN C 29 -2.193 -8.685 10.078 1.00 0.00 C ATOM 2071 CD GLN C 29 -3.693 -8.915 10.152 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -4.342 -9.133 9.136 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -4.251 -8.866 11.357 1.00 0.00 N ATOM 0 H GLN C 29 -0.027 -7.326 11.843 1.00 0.00 H new ATOM 0 HA GLN C 29 -0.181 -7.347 8.984 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -2.133 -6.900 11.261 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -2.615 -6.640 9.597 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -1.801 -9.043 9.126 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -1.685 -9.245 10.863 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -3.675 -8.682 12.179 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -5.255 -9.013 11.460 1.00 0.00 H new ATOM 2082 N VAL C 30 -0.936 -4.895 8.484 1.00 0.00 N ATOM 2083 CA VAL C 30 -1.055 -3.498 8.127 1.00 0.00 C ATOM 2084 C VAL C 30 -2.353 -3.335 7.351 1.00 0.00 C ATOM 2085 O VAL C 30 -2.497 -3.920 6.281 1.00 0.00 O ATOM 2086 CB VAL C 30 0.147 -3.083 7.269 1.00 0.00 C ATOM 2087 CG1 VAL C 30 0.064 -1.596 6.952 1.00 0.00 C ATOM 2088 CG2 VAL C 30 1.465 -3.344 7.999 1.00 0.00 C ATOM 0 H VAL C 30 -1.243 -5.534 7.751 1.00 0.00 H new ATOM 0 HA VAL C 30 -1.068 -2.864 9.014 1.00 0.00 H new ATOM 0 HB VAL C 30 0.121 -3.674 6.354 1.00 0.00 H new ATOM 0 HG11 VAL C 30 0.920 -1.306 6.342 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -0.857 -1.391 6.406 1.00 0.00 H new ATOM 0 HG13 VAL C 30 0.070 -1.025 7.881 1.00 0.00 H new ATOM 0 HG21 VAL C 30 2.298 -3.040 7.366 1.00 0.00 H new ATOM 0 HG22 VAL C 30 1.487 -2.772 8.927 1.00 0.00 H new ATOM 0 HG23 VAL C 30 1.551 -4.407 8.226 1.00 0.00 H new ATOM 2098 N ARG C 31 -3.298 -2.552 7.880 1.00 0.00 N ATOM 2099 CA ARG C 31 -4.493 -2.207 7.125 1.00 0.00 C ATOM 2100 C ARG C 31 -4.104 -1.128 6.137 1.00 0.00 C ATOM 2101 O ARG C 31 -3.798 0.003 6.530 1.00 0.00 O ATOM 2102 CB ARG C 31 -5.626 -1.680 8.013 1.00 0.00 C ATOM 2103 CG ARG C 31 -6.434 -2.801 8.659 1.00 0.00 C ATOM 2104 CD ARG C 31 -7.833 -2.281 8.998 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.803 -1.166 9.950 1.00 0.00 N ATOM 2106 CZ ARG C 31 -8.878 -0.431 10.256 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -10.062 -0.698 9.709 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -8.775 0.573 11.118 1.00 0.00 N ATOM 0 H ARG C 31 -3.255 -2.152 8.817 1.00 0.00 H new ATOM 0 HA ARG C 31 -4.865 -3.107 6.636 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -5.206 -1.044 8.792 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.291 -1.056 7.416 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -6.503 -3.652 7.982 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -5.935 -3.152 9.562 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -8.329 -1.959 8.082 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -8.428 -3.094 9.414 1.00 0.00 H new ATOM 0 HE ARG C 31 -6.917 -0.939 10.402 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -10.156 -1.470 9.049 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -10.875 -0.131 9.950 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -7.875 0.785 11.548 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -9.596 1.132 11.350 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.122 -1.498 4.857 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.819 -0.598 3.763 1.00 0.00 C ATOM 2124 C ILE C 32 -5.123 -0.327 3.025 1.00 0.00 C ATOM 2125 O ILE C 32 -5.968 -1.213 2.923 1.00 0.00 O ATOM 2126 CB ILE C 32 -2.779 -1.238 2.831 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -1.616 -1.822 3.647 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -2.274 -0.192 1.830 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -0.504 -2.391 2.767 1.00 0.00 C ATOM 0 H ILE C 32 -4.351 -2.445 4.555 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.396 0.338 4.129 1.00 0.00 H new ATOM 0 HB ILE C 32 -3.244 -2.055 2.280 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -1.203 -1.045 4.290 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -1.995 -2.608 4.300 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -1.536 -0.647 1.169 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.111 0.179 1.238 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -1.815 0.637 2.370 1.00 0.00 H new ATOM 0 HD11 ILE C 32 0.291 -2.790 3.397 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -0.906 -3.189 2.143 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -0.102 -1.601 2.132 1.00 0.00 H new ATOM 2141 N GLY C 33 -5.284 0.889 2.509 1.00 0.00 N ATOM 2142 CA GLY C 33 -6.469 1.270 1.765 1.00 0.00 C ATOM 2143 C GLY C 33 -6.054 1.766 0.395 1.00 0.00 C ATOM 2144 O GLY C 33 -4.957 2.298 0.232 1.00 0.00 O ATOM 0 H GLY C 33 -4.593 1.634 2.598 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -7.143 0.419 1.669 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -7.014 2.049 2.298 1.00 0.00 H new ATOM 2148 N ILE C 34 -6.929 1.591 -0.594 1.00 0.00 N ATOM 2149 CA ILE C 34 -6.654 2.012 -1.954 1.00 0.00 C ATOM 2150 C ILE C 34 -7.904 2.671 -2.510 1.00 0.00 C ATOM 2151 O ILE C 34 -9.020 2.261 -2.188 1.00 0.00 O ATOM 2152 CB ILE C 34 -6.234 0.796 -2.794 1.00 0.00 C ATOM 2153 CG1 ILE C 34 -5.019 0.116 -2.149 1.00 0.00 C ATOM 2154 CG2 ILE C 34 -5.922 1.250 -4.225 1.00 0.00 C ATOM 2155 CD1 ILE C 34 -4.608 -1.160 -2.881 1.00 0.00 C ATOM 0 H ILE C 34 -7.843 1.155 -0.469 1.00 0.00 H new ATOM 0 HA ILE C 34 -5.834 2.730 -1.982 1.00 0.00 H new ATOM 0 HB ILE C 34 -7.047 0.071 -2.832 1.00 0.00 H new ATOM 0 HG12 ILE C 34 -4.180 0.812 -2.139 1.00 0.00 H new ATOM 0 HG13 ILE C 34 -5.248 -0.122 -1.110 1.00 0.00 H new ATOM 0 HG21 ILE C 34 -5.624 0.389 -4.823 1.00 0.00 H new ATOM 0 HG22 ILE C 34 -6.809 1.706 -4.664 1.00 0.00 H new ATOM 0 HG23 ILE C 34 -5.111 1.978 -4.207 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -3.744 -1.602 -2.385 1.00 0.00 H new ATOM 0 HD12 ILE C 34 -5.436 -1.869 -2.869 1.00 0.00 H new ATOM 0 HD13 ILE C 34 -4.351 -0.921 -3.913 1.00 0.00 H new ATOM 2167 N ASN C 35 -7.714 3.688 -3.348 1.00 0.00 N ATOM 2168 CA ASN C 35 -8.817 4.428 -3.923 1.00 0.00 C ATOM 2169 C ASN C 35 -8.530 4.665 -5.398 1.00 0.00 C ATOM 2170 O ASN C 35 -7.717 5.515 -5.763 1.00 0.00 O ATOM 2171 CB ASN C 35 -9.012 5.732 -3.146 1.00 0.00 C ATOM 2172 CG ASN C 35 -10.307 6.442 -3.520 1.00 0.00 C ATOM 2173 OD1 ASN C 35 -11.044 5.996 -4.396 1.00 0.00 O ATOM 2174 ND2 ASN C 35 -10.592 7.557 -2.853 1.00 0.00 N ATOM 0 H ASN C 35 -6.793 4.015 -3.641 1.00 0.00 H new ATOM 0 HA ASN C 35 -9.748 3.866 -3.850 1.00 0.00 H new ATOM 0 HB2 ASN C 35 -9.013 5.518 -2.077 1.00 0.00 H new ATOM 0 HB3 ASN C 35 -8.169 6.395 -3.337 1.00 0.00 H new ATOM 0 HD21 ASN C 35 -11.447 8.072 -3.063 1.00 0.00 H new ATOM 0 HD22 ASN C 35 -9.956 7.897 -2.132 1.00 0.00 H new ATOM 2181 N ALA C 36 -9.213 3.894 -6.242 1.00 0.00 N ATOM 2182 CA ALA C 36 -9.056 3.947 -7.682 1.00 0.00 C ATOM 2183 C ALA C 36 -10.413 3.712 -8.338 1.00 0.00 C ATOM 2184 O ALA C 36 -11.284 3.087 -7.732 1.00 0.00 O ATOM 2185 CB ALA C 36 -8.056 2.861 -8.089 1.00 0.00 C ATOM 0 H ALA C 36 -9.900 3.206 -5.933 1.00 0.00 H new ATOM 0 HA ALA C 36 -8.683 4.919 -8.004 1.00 0.00 H new ATOM 0 HB1 ALA C 36 -7.919 2.879 -9.170 1.00 0.00 H new ATOM 0 HB2 ALA C 36 -7.100 3.045 -7.599 1.00 0.00 H new ATOM 0 HB3 ALA C 36 -8.436 1.885 -7.788 1.00 0.00 H new ATOM 2191 N PRO C 37 -10.616 4.202 -9.566 1.00 0.00 N ATOM 2192 CA PRO C 37 -11.839 3.971 -10.311 1.00 0.00 C ATOM 2193 C PRO C 37 -11.926 2.509 -10.741 1.00 0.00 C ATOM 2194 O PRO C 37 -10.903 1.857 -10.942 1.00 0.00 O ATOM 2195 CB PRO C 37 -11.743 4.894 -11.529 1.00 0.00 C ATOM 2196 CG PRO C 37 -10.240 5.065 -11.738 1.00 0.00 C ATOM 2197 CD PRO C 37 -9.680 5.011 -10.322 1.00 0.00 C ATOM 0 HA PRO C 37 -12.731 4.177 -9.719 1.00 0.00 H new ATOM 0 HB2 PRO C 37 -12.221 4.453 -12.404 1.00 0.00 H new ATOM 0 HB3 PRO C 37 -12.233 5.850 -11.346 1.00 0.00 H new ATOM 0 HG2 PRO C 37 -9.828 4.273 -12.364 1.00 0.00 H new ATOM 0 HG3 PRO C 37 -10.007 6.011 -12.227 1.00 0.00 H new ATOM 0 HD2 PRO C 37 -8.683 4.571 -10.311 1.00 0.00 H new ATOM 0 HD3 PRO C 37 -9.592 6.011 -9.896 1.00 0.00 H new ATOM 2205 N LYS C 38 -13.148 1.986 -10.885 1.00 0.00 N ATOM 2206 CA LYS C 38 -13.354 0.634 -11.387 1.00 0.00 C ATOM 2207 C LYS C 38 -12.888 0.522 -12.839 1.00 0.00 C ATOM 2208 O LYS C 38 -12.932 -0.557 -13.423 1.00 0.00 O ATOM 2209 CB LYS C 38 -14.827 0.237 -11.237 1.00 0.00 C ATOM 2210 CG LYS C 38 -15.261 0.169 -9.762 1.00 0.00 C ATOM 2211 CD LYS C 38 -14.563 -0.959 -8.996 1.00 0.00 C ATOM 2212 CE LYS C 38 -14.939 -2.346 -9.519 1.00 0.00 C ATOM 2213 NZ LYS C 38 -16.389 -2.602 -9.387 1.00 0.00 N ATOM 0 H LYS C 38 -14.009 2.485 -10.659 1.00 0.00 H new ATOM 0 HA LYS C 38 -12.755 -0.059 -10.797 1.00 0.00 H new ATOM 0 HB2 LYS C 38 -15.452 0.957 -11.765 1.00 0.00 H new ATOM 0 HB3 LYS C 38 -14.990 -0.732 -11.708 1.00 0.00 H new ATOM 0 HG2 LYS C 38 -15.043 1.121 -9.278 1.00 0.00 H new ATOM 0 HG3 LYS C 38 -16.340 0.025 -9.711 1.00 0.00 H new ATOM 0 HD2 LYS C 38 -13.483 -0.828 -9.068 1.00 0.00 H new ATOM 0 HD3 LYS C 38 -14.823 -0.891 -7.940 1.00 0.00 H new ATOM 0 HE2 LYS C 38 -14.647 -2.432 -10.566 1.00 0.00 H new ATOM 0 HE3 LYS C 38 -14.383 -3.106 -8.970 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 -16.580 -3.610 -9.557 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 -16.701 -2.347 -8.428 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 -16.907 -2.029 -10.083 1.00 0.00 H new ATOM 2227 N ASP C 39 -12.436 1.639 -13.419 1.00 0.00 N ATOM 2228 CA ASP C 39 -11.817 1.687 -14.734 1.00 0.00 C ATOM 2229 C ASP C 39 -10.456 0.978 -14.725 1.00 0.00 C ATOM 2230 O ASP C 39 -9.879 0.729 -15.781 1.00 0.00 O ATOM 2231 CB ASP C 39 -11.637 3.158 -15.112 1.00 0.00 C ATOM 2232 CG ASP C 39 -11.238 3.322 -16.578 1.00 0.00 C ATOM 2233 OD1 ASP C 39 -12.025 2.884 -17.446 1.00 0.00 O ATOM 2234 OD2 ASP C 39 -10.146 3.886 -16.821 1.00 0.00 O ATOM 0 H ASP C 39 -12.495 2.553 -12.970 1.00 0.00 H new ATOM 0 HA ASP C 39 -12.450 1.176 -15.459 1.00 0.00 H new ATOM 0 HB2 ASP C 39 -12.566 3.698 -14.925 1.00 0.00 H new ATOM 0 HB3 ASP C 39 -10.874 3.606 -14.475 1.00 0.00 H new ATOM 2239 N VAL C 40 -9.948 0.651 -13.528 1.00 0.00 N ATOM 2240 CA VAL C 40 -8.676 -0.037 -13.350 1.00 0.00 C ATOM 2241 C VAL C 40 -8.815 -1.091 -12.255 1.00 0.00 C ATOM 2242 O VAL C 40 -9.737 -1.022 -11.442 1.00 0.00 O ATOM 2243 CB VAL C 40 -7.552 0.957 -13.019 1.00 0.00 C ATOM 2244 CG1 VAL C 40 -7.454 2.052 -14.081 1.00 0.00 C ATOM 2245 CG2 VAL C 40 -7.759 1.634 -11.662 1.00 0.00 C ATOM 0 H VAL C 40 -10.421 0.863 -12.649 1.00 0.00 H new ATOM 0 HA VAL C 40 -8.408 -0.531 -14.284 1.00 0.00 H new ATOM 0 HB VAL C 40 -6.633 0.371 -12.992 1.00 0.00 H new ATOM 0 HG11 VAL C 40 -6.650 2.741 -13.820 1.00 0.00 H new ATOM 0 HG12 VAL C 40 -7.245 1.601 -15.051 1.00 0.00 H new ATOM 0 HG13 VAL C 40 -8.397 2.597 -14.130 1.00 0.00 H new ATOM 0 HG21 VAL C 40 -6.940 2.327 -11.472 1.00 0.00 H new ATOM 0 HG22 VAL C 40 -8.702 2.180 -11.668 1.00 0.00 H new ATOM 0 HG23 VAL C 40 -7.783 0.877 -10.878 1.00 0.00 H new ATOM 2255 N ALA C 41 -7.905 -2.066 -12.229 1.00 0.00 N ATOM 2256 CA ALA C 41 -7.993 -3.169 -11.289 1.00 0.00 C ATOM 2257 C ALA C 41 -7.020 -2.994 -10.123 1.00 0.00 C ATOM 2258 O ALA C 41 -6.010 -2.302 -10.241 1.00 0.00 O ATOM 2259 CB ALA C 41 -7.693 -4.468 -12.038 1.00 0.00 C ATOM 0 H ALA C 41 -7.099 -2.108 -12.853 1.00 0.00 H new ATOM 0 HA ALA C 41 -8.998 -3.197 -10.868 1.00 0.00 H new ATOM 0 HB1 ALA C 41 -7.754 -5.309 -11.347 1.00 0.00 H new ATOM 0 HB2 ALA C 41 -8.420 -4.602 -12.839 1.00 0.00 H new ATOM 0 HB3 ALA C 41 -6.690 -4.420 -12.463 1.00 0.00 H new ATOM 2265 N VAL C 42 -7.329 -3.631 -8.993 1.00 0.00 N ATOM 2266 CA VAL C 42 -6.457 -3.653 -7.824 1.00 0.00 C ATOM 2267 C VAL C 42 -6.734 -4.921 -7.027 1.00 0.00 C ATOM 2268 O VAL C 42 -7.890 -5.248 -6.770 1.00 0.00 O ATOM 2269 CB VAL C 42 -6.684 -2.388 -6.981 1.00 0.00 C ATOM 2270 CG1 VAL C 42 -8.161 -2.089 -6.748 1.00 0.00 C ATOM 2271 CG2 VAL C 42 -6.024 -2.501 -5.611 1.00 0.00 C ATOM 0 H VAL C 42 -8.198 -4.149 -8.865 1.00 0.00 H new ATOM 0 HA VAL C 42 -5.411 -3.659 -8.129 1.00 0.00 H new ATOM 0 HB VAL C 42 -6.237 -1.580 -7.560 1.00 0.00 H new ATOM 0 HG11 VAL C 42 -8.259 -1.185 -6.147 1.00 0.00 H new ATOM 0 HG12 VAL C 42 -8.658 -1.943 -7.707 1.00 0.00 H new ATOM 0 HG13 VAL C 42 -8.623 -2.925 -6.223 1.00 0.00 H new ATOM 0 HG21 VAL C 42 -6.206 -1.588 -5.043 1.00 0.00 H new ATOM 0 HG22 VAL C 42 -6.443 -3.352 -5.074 1.00 0.00 H new ATOM 0 HG23 VAL C 42 -4.950 -2.644 -5.735 1.00 0.00 H new ATOM 2281 N HIS C 43 -5.679 -5.641 -6.635 1.00 0.00 N ATOM 2282 CA HIS C 43 -5.818 -6.914 -5.932 1.00 0.00 C ATOM 2283 C HIS C 43 -4.563 -7.240 -5.142 1.00 0.00 C ATOM 2284 O HIS C 43 -3.522 -6.612 -5.332 1.00 0.00 O ATOM 2285 CB HIS C 43 -6.007 -8.045 -6.952 1.00 0.00 C ATOM 2286 CG HIS C 43 -7.135 -7.838 -7.923 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -8.476 -8.155 -7.687 1.00 0.00 N ATOM 2288 CD2 HIS C 43 -6.999 -7.312 -9.173 1.00 0.00 C ATOM 2289 CE1 HIS C 43 -9.118 -7.805 -8.816 1.00 0.00 C ATOM 2290 NE2 HIS C 43 -8.260 -7.299 -9.718 1.00 0.00 N ATOM 0 H HIS C 43 -4.712 -5.358 -6.796 1.00 0.00 H new ATOM 0 HA HIS C 43 -6.673 -6.828 -5.262 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -5.081 -8.167 -7.514 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -6.177 -8.977 -6.413 1.00 0.00 H new ATOM 0 HD1 HIS C 43 -8.879 -8.562 -6.843 1.00 0.00 H new ATOM 0 HD2 HIS C 43 -6.086 -6.974 -9.640 1.00 0.00 H new ATOM 0 HE1 HIS C 43 -10.180 -7.916 -8.976 1.00 0.00 H new ATOM 2298 N ARG C 44 -4.654 -8.228 -4.246 1.00 0.00 N ATOM 2299 CA ARG C 44 -3.476 -8.775 -3.590 1.00 0.00 C ATOM 2300 C ARG C 44 -2.647 -9.516 -4.631 1.00 0.00 C ATOM 2301 O ARG C 44 -3.156 -9.884 -5.689 1.00 0.00 O ATOM 2302 CB ARG C 44 -3.901 -9.725 -2.473 1.00 0.00 C ATOM 2303 CG ARG C 44 -4.441 -8.933 -1.281 1.00 0.00 C ATOM 2304 CD ARG C 44 -5.092 -9.876 -0.271 1.00 0.00 C ATOM 2305 NE ARG C 44 -6.379 -10.348 -0.782 1.00 0.00 N ATOM 2306 CZ ARG C 44 -6.822 -11.608 -0.746 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -6.072 -12.597 -0.264 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -8.037 -11.877 -1.203 1.00 0.00 N ATOM 0 H ARG C 44 -5.533 -8.661 -3.963 1.00 0.00 H new ATOM 0 HA ARG C 44 -2.882 -7.974 -3.150 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -4.665 -10.410 -2.840 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -3.052 -10.333 -2.160 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -3.630 -8.382 -0.804 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -5.169 -8.197 -1.624 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -4.435 -10.724 -0.078 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -5.236 -9.361 0.679 1.00 0.00 H new ATOM 0 HE ARG C 44 -6.994 -9.652 -1.204 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -5.135 -12.401 0.089 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -6.434 -13.550 -0.248 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -8.619 -11.127 -1.575 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -8.389 -12.834 -1.182 1.00 0.00 H new ATOM 2322 N GLU C 45 -1.367 -9.747 -4.345 1.00 0.00 N ATOM 2323 CA GLU C 45 -0.475 -10.426 -5.277 1.00 0.00 C ATOM 2324 C GLU C 45 -0.901 -11.886 -5.461 1.00 0.00 C ATOM 2325 O GLU C 45 -0.593 -12.497 -6.480 1.00 0.00 O ATOM 2326 CB GLU C 45 0.954 -10.290 -4.742 1.00 0.00 C ATOM 2327 CG GLU C 45 2.010 -10.733 -5.754 1.00 0.00 C ATOM 2328 CD GLU C 45 2.295 -12.238 -5.747 1.00 0.00 C ATOM 2329 OE1 GLU C 45 1.848 -12.927 -4.802 1.00 0.00 O ATOM 2330 OE2 GLU C 45 2.968 -12.691 -6.698 1.00 0.00 O ATOM 0 H GLU C 45 -0.924 -9.471 -3.469 1.00 0.00 H new ATOM 0 HA GLU C 45 -0.524 -9.972 -6.267 1.00 0.00 H new ATOM 0 HB2 GLU C 45 1.136 -9.252 -4.465 1.00 0.00 H new ATOM 0 HB3 GLU C 45 1.055 -10.885 -3.834 1.00 0.00 H new ATOM 0 HG2 GLU C 45 1.685 -10.441 -6.753 1.00 0.00 H new ATOM 0 HG3 GLU C 45 2.938 -10.198 -5.552 1.00 0.00 H new ATOM 2337 N GLU C 46 -1.613 -12.444 -4.476 1.00 0.00 N ATOM 2338 CA GLU C 46 -2.105 -13.816 -4.524 1.00 0.00 C ATOM 2339 C GLU C 46 -3.453 -13.916 -5.246 1.00 0.00 C ATOM 2340 O GLU C 46 -3.954 -15.020 -5.460 1.00 0.00 O ATOM 2341 CB GLU C 46 -2.214 -14.358 -3.095 1.00 0.00 C ATOM 2342 CG GLU C 46 -3.297 -13.623 -2.302 1.00 0.00 C ATOM 2343 CD GLU C 46 -3.255 -13.967 -0.818 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -3.292 -15.176 -0.494 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -3.187 -13.012 -0.013 1.00 0.00 O ATOM 0 H GLU C 46 -1.863 -11.949 -3.620 1.00 0.00 H new ATOM 0 HA GLU C 46 -1.397 -14.418 -5.094 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -2.442 -15.423 -3.124 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -1.254 -14.251 -2.589 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -3.171 -12.548 -2.428 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -4.277 -13.878 -2.705 1.00 0.00 H new ATOM 2352 N ILE C 47 -4.043 -12.773 -5.621 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.318 -12.717 -6.328 1.00 0.00 C ATOM 2354 C ILE C 47 -5.109 -12.160 -7.728 1.00 0.00 C ATOM 2355 O ILE C 47 -5.787 -12.586 -8.660 1.00 0.00 O ATOM 2356 CB ILE C 47 -6.298 -11.857 -5.527 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -6.658 -12.525 -4.193 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -7.569 -11.589 -6.331 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -7.252 -13.928 -4.352 1.00 0.00 C ATOM 0 H ILE C 47 -3.640 -11.854 -5.437 1.00 0.00 H new ATOM 0 HA ILE C 47 -5.736 -13.719 -6.427 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.806 -10.907 -5.318 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -5.763 -12.586 -3.573 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.371 -11.895 -3.661 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -8.250 -10.976 -5.741 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -7.313 -11.064 -7.252 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -8.052 -12.535 -6.575 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.482 -14.339 -3.369 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -8.165 -13.872 -4.945 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.532 -14.573 -4.855 1.00 0.00 H new ATOM 2371 N TYR C 48 -4.180 -11.216 -7.893 1.00 0.00 N ATOM 2372 CA TYR C 48 -3.907 -10.616 -9.190 1.00 0.00 C ATOM 2373 C TYR C 48 -3.583 -11.689 -10.226 1.00 0.00 C ATOM 2374 O TYR C 48 -4.005 -11.587 -11.377 1.00 0.00 O ATOM 2375 CB TYR C 48 -2.739 -9.641 -9.058 1.00 0.00 C ATOM 2376 CG TYR C 48 -2.157 -9.246 -10.392 1.00 0.00 C ATOM 2377 CD1 TYR C 48 -2.989 -8.794 -11.428 1.00 0.00 C ATOM 2378 CD2 TYR C 48 -0.775 -9.345 -10.594 1.00 0.00 C ATOM 2379 CE1 TYR C 48 -2.448 -8.478 -12.683 1.00 0.00 C ATOM 2380 CE2 TYR C 48 -0.224 -9.012 -11.838 1.00 0.00 C ATOM 2381 CZ TYR C 48 -1.054 -8.582 -12.890 1.00 0.00 C ATOM 2382 OH TYR C 48 -0.519 -8.268 -14.103 1.00 0.00 O ATOM 0 H TYR C 48 -3.603 -10.852 -7.135 1.00 0.00 H new ATOM 0 HA TYR C 48 -4.794 -10.080 -9.526 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -3.075 -8.746 -8.534 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -1.959 -10.095 -8.446 1.00 0.00 H new ATOM 0 HD1 TYR C 48 -4.050 -8.689 -11.258 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -0.134 -9.678 -9.791 1.00 0.00 H new ATOM 0 HE1 TYR C 48 -3.094 -8.157 -13.487 1.00 0.00 H new ATOM 0 HE2 TYR C 48 0.843 -9.086 -11.991 1.00 0.00 H new ATOM 0 HH TYR C 48 0.453 -8.393 -14.074 1.00 0.00 H new ATOM 2392 N GLN C 49 -2.835 -12.719 -9.824 1.00 0.00 N ATOM 2393 CA GLN C 49 -2.440 -13.784 -10.735 1.00 0.00 C ATOM 2394 C GLN C 49 -3.650 -14.576 -11.219 1.00 0.00 C ATOM 2395 O GLN C 49 -3.578 -15.241 -12.248 1.00 0.00 O ATOM 2396 CB GLN C 49 -1.476 -14.728 -10.018 1.00 0.00 C ATOM 2397 CG GLN C 49 -0.204 -14.001 -9.586 1.00 0.00 C ATOM 2398 CD GLN C 49 0.728 -14.951 -8.837 1.00 0.00 C ATOM 2399 OE1 GLN C 49 1.255 -15.898 -9.412 1.00 0.00 O ATOM 2400 NE2 GLN C 49 0.932 -14.702 -7.549 1.00 0.00 N ATOM 0 H GLN C 49 -2.492 -12.834 -8.870 1.00 0.00 H new ATOM 0 HA GLN C 49 -1.957 -13.332 -11.601 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -1.967 -15.157 -9.144 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -1.218 -15.557 -10.677 1.00 0.00 H new ATOM 0 HG2 GLN C 49 0.306 -13.597 -10.461 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -0.460 -13.156 -8.948 1.00 0.00 H new ATOM 0 HE21 GLN C 49 0.476 -13.905 -7.105 1.00 0.00 H new ATOM 0 HE22 GLN C 49 1.545 -15.308 -7.003 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.763 -14.510 -10.479 1.00 0.00 N ATOM 2410 CA ARG C 50 -5.956 -15.278 -10.787 1.00 0.00 C ATOM 2411 C ARG C 50 -6.847 -14.555 -11.796 1.00 0.00 C ATOM 2412 O ARG C 50 -7.508 -15.206 -12.605 1.00 0.00 O ATOM 2413 CB ARG C 50 -6.706 -15.544 -9.481 1.00 0.00 C ATOM 2414 CG ARG C 50 -7.877 -16.487 -9.724 1.00 0.00 C ATOM 2415 CD ARG C 50 -8.559 -16.767 -8.388 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.745 -17.644 -7.536 1.00 0.00 N ATOM 2417 CZ ARG C 50 -7.850 -17.709 -6.207 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.737 -16.964 -5.553 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -7.059 -18.529 -5.517 1.00 0.00 N ATOM 0 H ARG C 50 -4.853 -13.920 -9.652 1.00 0.00 H new ATOM 0 HA ARG C 50 -5.669 -16.222 -11.250 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -6.028 -15.978 -8.747 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -7.068 -14.604 -9.064 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -8.584 -16.041 -10.424 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -7.528 -17.417 -10.173 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -8.744 -15.826 -7.870 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -9.530 -17.230 -8.565 1.00 0.00 H new ATOM 0 HE ARG C 50 -7.055 -18.242 -7.990 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -9.350 -16.331 -6.067 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -8.805 -17.026 -4.537 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -6.374 -19.106 -6.004 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -7.138 -18.579 -4.501 1.00 0.00 H new ATOM 2433 N ILE C 51 -6.868 -13.219 -11.761 1.00 0.00 N ATOM 2434 CA ILE C 51 -7.599 -12.439 -12.753 1.00 0.00 C ATOM 2435 C ILE C 51 -6.965 -12.663 -14.131 1.00 0.00 C ATOM 2436 O ILE C 51 -7.587 -12.399 -15.158 1.00 0.00 O ATOM 2437 CB ILE C 51 -7.650 -10.947 -12.372 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -8.578 -10.682 -11.174 1.00 0.00 C ATOM 2439 CG2 ILE C 51 -8.228 -10.104 -13.512 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -8.011 -11.178 -9.850 1.00 0.00 C ATOM 0 H ILE C 51 -6.387 -12.660 -11.056 1.00 0.00 H new ATOM 0 HA ILE C 51 -8.635 -12.777 -12.787 1.00 0.00 H new ATOM 0 HB ILE C 51 -6.619 -10.680 -12.140 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -8.769 -9.611 -11.101 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -9.538 -11.165 -11.354 1.00 0.00 H new ATOM 0 HG21 ILE C 51 -8.251 -9.056 -13.214 1.00 0.00 H new ATOM 0 HG22 ILE C 51 -7.604 -10.215 -14.399 1.00 0.00 H new ATOM 0 HG23 ILE C 51 -9.240 -10.440 -13.736 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -8.716 -10.959 -9.048 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -7.846 -12.254 -9.905 1.00 0.00 H new ATOM 0 HD13 ILE C 51 -7.065 -10.676 -9.649 1.00 0.00 H new