USER MOD reduce.3.24.130724 H: found=0, std=0, add=721, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 720 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 64 SER OG : rot -30:sc= -0.243 USER MOD Set 1.2: A 65 SER OG : rot 84:sc= 0.0244 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -133:sc= 0.0464 (180deg=-0.244) USER MOD Single : A 4 THR OG1 : rot 16:sc= 0.796! USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.133 USER MOD Single : A 9 GLN : amide:sc= -0.141 K(o=-0.14,f=-2.2!) USER MOD Single : A 13 SER OG : rot 91:sc= 1.23 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 180:sc= -1.04 USER MOD Single : A 37 GLN : amide:sc= -10.3! C(o=-10!,f=-11!) USER MOD Single : A 39 GLN : amide:sc= -0.182 X(o=-0.18,f=-0.26) USER MOD Single : A 40 TYR OH : rot 156:sc=0.000828 USER MOD Single : A 41 CYS SG : rot 83:sc= -0.422 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 MET CE :methyl -113:sc= -7.22! (180deg=-9.3!) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= -0.0596 USER MOD Single : A 53 SER OG : rot -80:sc= -0.353 USER MOD Single : A 60 TYR OH : rot 170:sc= 0.00072 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 148:sc= 0.604 (180deg=0.134) USER MOD Single : B 15 THR OG1 : rot 180:sc= 0 USER MOD Single : B 22 GLN : amide:sc= -0.504 X(o=-0.5,f=-0.015) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.505 -1.846 -0.119 1.00 0.00 N ATOM 2 CA MET A 1 -2.390 -2.073 1.060 1.00 0.00 C ATOM 3 C MET A 1 -2.708 -3.563 1.205 1.00 0.00 C ATOM 4 O MET A 1 -2.399 -4.360 0.341 1.00 0.00 O ATOM 5 CB MET A 1 -3.661 -1.279 0.759 1.00 0.00 C ATOM 6 CG MET A 1 -3.335 0.216 0.729 1.00 0.00 C ATOM 7 SD MET A 1 -4.644 1.137 1.574 1.00 0.00 S ATOM 8 CE MET A 1 -3.589 1.965 2.788 1.00 0.00 C ATOM 0 H1 MET A 1 -0.720 -1.219 0.152 1.00 0.00 H new ATOM 0 H2 MET A 1 -1.124 -2.756 -0.447 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.053 -1.404 -0.884 1.00 0.00 H new ATOM 0 HA MET A 1 -1.924 -1.757 1.993 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.078 -1.590 -0.199 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.417 -1.482 1.517 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.376 0.400 1.213 1.00 0.00 H new ATOM 0 HG3 MET A 1 -3.242 0.558 -0.302 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.201 2.600 3.429 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.079 1.218 3.397 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.850 2.577 2.271 1.00 0.00 H new ATOM 18 N ALA A 2 -3.324 -3.946 2.289 1.00 0.00 N ATOM 19 CA ALA A 2 -3.661 -5.386 2.487 1.00 0.00 C ATOM 20 C ALA A 2 -4.682 -5.537 3.618 1.00 0.00 C ATOM 21 O ALA A 2 -5.495 -4.666 3.855 1.00 0.00 O ATOM 22 CB ALA A 2 -2.337 -6.053 2.865 1.00 0.00 C ATOM 0 H ALA A 2 -3.609 -3.325 3.047 1.00 0.00 H new ATOM 0 HA ALA A 2 -4.103 -5.835 1.598 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -2.500 -7.118 3.028 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.617 -5.915 2.058 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.950 -5.601 3.778 1.00 0.00 H new ATOM 28 N ASP A 3 -4.646 -6.637 4.318 1.00 0.00 N ATOM 29 CA ASP A 3 -5.613 -6.844 5.434 1.00 0.00 C ATOM 30 C ASP A 3 -5.153 -7.999 6.325 1.00 0.00 C ATOM 31 O ASP A 3 -4.925 -9.100 5.864 1.00 0.00 O ATOM 32 CB ASP A 3 -6.938 -7.186 4.752 1.00 0.00 C ATOM 33 CG ASP A 3 -6.702 -8.253 3.682 1.00 0.00 C ATOM 34 OD1 ASP A 3 -6.399 -7.882 2.561 1.00 0.00 O ATOM 35 OD2 ASP A 3 -6.829 -9.424 4.002 1.00 0.00 O ATOM 0 H ASP A 3 -3.989 -7.402 4.166 1.00 0.00 H new ATOM 0 HA ASP A 3 -5.699 -5.966 6.074 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -7.655 -7.547 5.489 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -7.368 -6.292 4.300 1.00 0.00 H new ATOM 40 N THR A 4 -5.013 -7.757 7.600 1.00 0.00 N ATOM 41 CA THR A 4 -4.567 -8.844 8.519 1.00 0.00 C ATOM 42 C THR A 4 -3.417 -9.629 7.884 1.00 0.00 C ATOM 43 O THR A 4 -3.589 -10.746 7.434 1.00 0.00 O ATOM 44 CB THR A 4 -5.794 -9.738 8.701 1.00 0.00 C ATOM 45 OG1 THR A 4 -6.086 -10.391 7.474 1.00 0.00 O ATOM 46 CG2 THR A 4 -6.991 -8.886 9.125 1.00 0.00 C ATOM 0 H THR A 4 -5.188 -6.856 8.045 1.00 0.00 H new ATOM 0 HA THR A 4 -4.202 -8.459 9.471 1.00 0.00 H new ATOM 0 HB THR A 4 -5.591 -10.482 9.471 1.00 0.00 H new ATOM 0 HG1 THR A 4 -5.312 -10.325 6.876 1.00 0.00 H new ATOM 0 HG21 THR A 4 -7.865 -9.525 9.254 1.00 0.00 H new ATOM 0 HG22 THR A 4 -6.766 -8.385 10.066 1.00 0.00 H new ATOM 0 HG23 THR A 4 -7.197 -8.140 8.357 1.00 0.00 H new ATOM 54 N ASP A 5 -2.246 -9.056 7.843 1.00 0.00 N ATOM 55 CA ASP A 5 -1.086 -9.770 7.236 1.00 0.00 C ATOM 56 C ASP A 5 0.064 -9.865 8.242 1.00 0.00 C ATOM 57 O ASP A 5 0.350 -10.920 8.772 1.00 0.00 O ATOM 58 CB ASP A 5 -0.680 -8.914 6.036 1.00 0.00 C ATOM 59 CG ASP A 5 -1.593 -9.229 4.850 1.00 0.00 C ATOM 60 OD1 ASP A 5 -2.700 -8.717 4.827 1.00 0.00 O ATOM 61 OD2 ASP A 5 -1.169 -9.976 3.982 1.00 0.00 O ATOM 0 H ASP A 5 -2.041 -8.124 8.203 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.336 -10.790 6.944 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -0.749 -7.856 6.291 1.00 0.00 H new ATOM 0 HB3 ASP A 5 0.359 -9.111 5.771 1.00 0.00 H new ATOM 66 N THR A 6 0.724 -8.772 8.509 1.00 0.00 N ATOM 67 CA THR A 6 1.856 -8.799 9.480 1.00 0.00 C ATOM 68 C THR A 6 3.007 -9.645 8.927 1.00 0.00 C ATOM 69 O THR A 6 4.090 -9.151 8.682 1.00 0.00 O ATOM 70 CB THR A 6 1.280 -9.436 10.746 1.00 0.00 C ATOM 71 OG1 THR A 6 -0.032 -8.938 10.968 1.00 0.00 O ATOM 72 CG2 THR A 6 2.168 -9.091 11.942 1.00 0.00 C ATOM 0 H THR A 6 0.529 -7.860 8.097 1.00 0.00 H new ATOM 0 HA THR A 6 2.258 -7.804 9.673 1.00 0.00 H new ATOM 0 HB THR A 6 1.243 -10.519 10.625 1.00 0.00 H new ATOM 0 HG1 THR A 6 -0.404 -9.346 11.778 1.00 0.00 H new ATOM 0 HG21 THR A 6 1.757 -9.545 12.843 1.00 0.00 H new ATOM 0 HG22 THR A 6 3.174 -9.473 11.770 1.00 0.00 H new ATOM 0 HG23 THR A 6 2.207 -8.009 12.066 1.00 0.00 H new ATOM 80 N ALA A 7 2.782 -10.914 8.727 1.00 0.00 N ATOM 81 CA ALA A 7 3.864 -11.787 8.185 1.00 0.00 C ATOM 82 C ALA A 7 4.185 -11.382 6.746 1.00 0.00 C ATOM 83 O ALA A 7 5.332 -11.254 6.366 1.00 0.00 O ATOM 84 CB ALA A 7 3.296 -13.205 8.233 1.00 0.00 C ATOM 0 H ALA A 7 1.897 -11.385 8.915 1.00 0.00 H new ATOM 0 HA ALA A 7 4.789 -11.706 8.755 1.00 0.00 H new ATOM 0 HB1 ALA A 7 4.036 -13.907 7.849 1.00 0.00 H new ATOM 0 HB2 ALA A 7 3.051 -13.464 9.263 1.00 0.00 H new ATOM 0 HB3 ALA A 7 2.395 -13.257 7.621 1.00 0.00 H new ATOM 90 N GLU A 8 3.178 -11.174 5.944 1.00 0.00 N ATOM 91 CA GLU A 8 3.419 -10.770 4.530 1.00 0.00 C ATOM 92 C GLU A 8 4.255 -9.488 4.490 1.00 0.00 C ATOM 93 O GLU A 8 5.095 -9.309 3.631 1.00 0.00 O ATOM 94 CB GLU A 8 2.029 -10.524 3.943 1.00 0.00 C ATOM 95 CG GLU A 8 2.072 -10.728 2.427 1.00 0.00 C ATOM 96 CD GLU A 8 1.101 -9.755 1.754 1.00 0.00 C ATOM 97 OE1 GLU A 8 -0.093 -9.996 1.825 1.00 0.00 O ATOM 98 OE2 GLU A 8 1.568 -8.786 1.180 1.00 0.00 O ATOM 0 H GLU A 8 2.197 -11.266 6.207 1.00 0.00 H new ATOM 0 HA GLU A 8 3.966 -11.528 3.969 1.00 0.00 H new ATOM 0 HB2 GLU A 8 1.307 -11.206 4.392 1.00 0.00 H new ATOM 0 HB3 GLU A 8 1.698 -9.512 4.175 1.00 0.00 H new ATOM 0 HG2 GLU A 8 3.084 -10.564 2.056 1.00 0.00 H new ATOM 0 HG3 GLU A 8 1.804 -11.755 2.180 1.00 0.00 H new ATOM 105 N GLN A 9 4.027 -8.594 5.413 1.00 0.00 N ATOM 106 CA GLN A 9 4.805 -7.322 5.428 1.00 0.00 C ATOM 107 C GLN A 9 6.297 -7.617 5.613 1.00 0.00 C ATOM 108 O GLN A 9 7.134 -7.097 4.904 1.00 0.00 O ATOM 109 CB GLN A 9 4.260 -6.537 6.623 1.00 0.00 C ATOM 110 CG GLN A 9 3.708 -5.194 6.143 1.00 0.00 C ATOM 111 CD GLN A 9 2.788 -4.607 7.216 1.00 0.00 C ATOM 112 OE1 GLN A 9 2.276 -5.325 8.052 1.00 0.00 O ATOM 113 NE2 GLN A 9 2.556 -3.322 7.228 1.00 0.00 N ATOM 0 H GLN A 9 3.336 -8.689 6.157 1.00 0.00 H new ATOM 0 HA GLN A 9 4.705 -6.765 4.496 1.00 0.00 H new ATOM 0 HB2 GLN A 9 3.475 -7.108 7.119 1.00 0.00 H new ATOM 0 HB3 GLN A 9 5.050 -6.376 7.357 1.00 0.00 H new ATOM 0 HG2 GLN A 9 4.527 -4.506 5.935 1.00 0.00 H new ATOM 0 HG3 GLN A 9 3.159 -5.327 5.211 1.00 0.00 H new ATOM 0 HE21 GLN A 9 2.986 -2.720 6.526 1.00 0.00 H new ATOM 0 HE22 GLN A 9 1.945 -2.921 7.939 1.00 0.00 H new ATOM 122 N VAL A 10 6.636 -8.453 6.557 1.00 0.00 N ATOM 123 CA VAL A 10 8.074 -8.781 6.778 1.00 0.00 C ATOM 124 C VAL A 10 8.678 -9.362 5.497 1.00 0.00 C ATOM 125 O VAL A 10 9.787 -9.040 5.120 1.00 0.00 O ATOM 126 CB VAL A 10 8.077 -9.823 7.896 1.00 0.00 C ATOM 127 CG1 VAL A 10 9.460 -10.471 7.987 1.00 0.00 C ATOM 128 CG2 VAL A 10 7.747 -9.141 9.225 1.00 0.00 C ATOM 0 H VAL A 10 5.981 -8.922 7.183 1.00 0.00 H new ATOM 0 HA VAL A 10 8.665 -7.904 7.042 1.00 0.00 H new ATOM 0 HB VAL A 10 7.331 -10.588 7.682 1.00 0.00 H new ATOM 0 HG11 VAL A 10 9.462 -11.214 8.784 1.00 0.00 H new ATOM 0 HG12 VAL A 10 9.698 -10.955 7.040 1.00 0.00 H new ATOM 0 HG13 VAL A 10 10.207 -9.706 8.202 1.00 0.00 H new ATOM 0 HG21 VAL A 10 7.748 -9.882 10.024 1.00 0.00 H new ATOM 0 HG22 VAL A 10 8.495 -8.377 9.437 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.762 -8.678 9.162 1.00 0.00 H new ATOM 138 N ILE A 11 7.951 -10.209 4.822 1.00 0.00 N ATOM 139 CA ILE A 11 8.473 -10.805 3.561 1.00 0.00 C ATOM 140 C ILE A 11 8.690 -9.701 2.527 1.00 0.00 C ATOM 141 O ILE A 11 9.732 -9.613 1.908 1.00 0.00 O ATOM 142 CB ILE A 11 7.386 -11.774 3.098 1.00 0.00 C ATOM 143 CG1 ILE A 11 7.317 -12.959 4.064 1.00 0.00 C ATOM 144 CG2 ILE A 11 7.717 -12.282 1.694 1.00 0.00 C ATOM 145 CD1 ILE A 11 5.908 -13.553 4.046 1.00 0.00 C ATOM 0 H ILE A 11 7.016 -10.515 5.090 1.00 0.00 H new ATOM 0 HA ILE A 11 9.428 -11.312 3.699 1.00 0.00 H new ATOM 0 HB ILE A 11 6.425 -11.260 3.080 1.00 0.00 H new ATOM 0 HG12 ILE A 11 8.046 -13.717 3.778 1.00 0.00 H new ATOM 0 HG13 ILE A 11 7.573 -12.635 5.073 1.00 0.00 H new ATOM 0 HG21 ILE A 11 6.941 -12.973 1.365 1.00 0.00 H new ATOM 0 HG22 ILE A 11 7.768 -11.439 1.005 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.678 -12.796 1.710 1.00 0.00 H new ATOM 0 HD11 ILE A 11 5.860 -14.397 4.734 1.00 0.00 H new ATOM 0 HD12 ILE A 11 5.189 -12.793 4.353 1.00 0.00 H new ATOM 0 HD13 ILE A 11 5.669 -13.893 3.038 1.00 0.00 H new ATOM 157 N ALA A 12 7.720 -8.845 2.349 1.00 0.00 N ATOM 158 CA ALA A 12 7.888 -7.736 1.369 1.00 0.00 C ATOM 159 C ALA A 12 9.119 -6.923 1.756 1.00 0.00 C ATOM 160 O ALA A 12 9.891 -6.503 0.917 1.00 0.00 O ATOM 161 CB ALA A 12 6.619 -6.894 1.495 1.00 0.00 C ATOM 0 H ALA A 12 6.824 -8.866 2.837 1.00 0.00 H new ATOM 0 HA ALA A 12 8.028 -8.085 0.346 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.669 -6.055 0.801 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.750 -7.508 1.259 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.532 -6.518 2.514 1.00 0.00 H new ATOM 167 N SER A 13 9.321 -6.721 3.029 1.00 0.00 N ATOM 168 CA SER A 13 10.518 -5.961 3.476 1.00 0.00 C ATOM 169 C SER A 13 11.767 -6.779 3.153 1.00 0.00 C ATOM 170 O SER A 13 12.771 -6.257 2.712 1.00 0.00 O ATOM 171 CB SER A 13 10.351 -5.801 4.986 1.00 0.00 C ATOM 172 OG SER A 13 9.040 -5.329 5.266 1.00 0.00 O ATOM 0 H SER A 13 8.709 -7.049 3.776 1.00 0.00 H new ATOM 0 HA SER A 13 10.618 -4.992 2.986 1.00 0.00 H new ATOM 0 HB2 SER A 13 10.521 -6.755 5.485 1.00 0.00 H new ATOM 0 HB3 SER A 13 11.092 -5.102 5.373 1.00 0.00 H new ATOM 0 HG SER A 13 8.440 -6.092 5.402 1.00 0.00 H new ATOM 178 N PHE A 14 11.702 -8.069 3.358 1.00 0.00 N ATOM 179 CA PHE A 14 12.878 -8.931 3.048 1.00 0.00 C ATOM 180 C PHE A 14 13.097 -8.972 1.535 1.00 0.00 C ATOM 181 O PHE A 14 14.212 -8.904 1.058 1.00 0.00 O ATOM 182 CB PHE A 14 12.508 -10.317 3.579 1.00 0.00 C ATOM 183 CG PHE A 14 12.999 -10.458 5.001 1.00 0.00 C ATOM 184 CD1 PHE A 14 14.367 -10.368 5.281 1.00 0.00 C ATOM 185 CD2 PHE A 14 12.085 -10.678 6.040 1.00 0.00 C ATOM 186 CE1 PHE A 14 14.823 -10.497 6.598 1.00 0.00 C ATOM 187 CE2 PHE A 14 12.541 -10.807 7.358 1.00 0.00 C ATOM 188 CZ PHE A 14 13.910 -10.717 7.636 1.00 0.00 C ATOM 0 H PHE A 14 10.887 -8.560 3.726 1.00 0.00 H new ATOM 0 HA PHE A 14 13.800 -8.563 3.499 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.428 -10.457 3.540 1.00 0.00 H new ATOM 0 HB3 PHE A 14 12.952 -11.089 2.951 1.00 0.00 H new ATOM 0 HD1 PHE A 14 15.072 -10.199 4.480 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.029 -10.748 5.825 1.00 0.00 H new ATOM 0 HE1 PHE A 14 15.879 -10.427 6.813 1.00 0.00 H new ATOM 0 HE2 PHE A 14 11.837 -10.976 8.159 1.00 0.00 H new ATOM 0 HZ PHE A 14 14.262 -10.817 8.652 1.00 0.00 H new ATOM 198 N ARG A 15 12.039 -9.070 0.777 1.00 0.00 N ATOM 199 CA ARG A 15 12.189 -9.100 -0.704 1.00 0.00 C ATOM 200 C ARG A 15 13.016 -7.895 -1.157 1.00 0.00 C ATOM 201 O ARG A 15 13.908 -8.012 -1.974 1.00 0.00 O ATOM 202 CB ARG A 15 10.763 -9.010 -1.251 1.00 0.00 C ATOM 203 CG ARG A 15 10.577 -10.042 -2.364 1.00 0.00 C ATOM 204 CD ARG A 15 9.109 -10.065 -2.800 1.00 0.00 C ATOM 205 NE ARG A 15 8.812 -11.498 -3.073 1.00 0.00 N ATOM 206 CZ ARG A 15 9.323 -12.086 -4.122 1.00 0.00 C ATOM 207 NH1 ARG A 15 10.091 -11.419 -4.940 1.00 0.00 N ATOM 208 NH2 ARG A 15 9.062 -13.343 -4.353 1.00 0.00 N ATOM 0 H ARG A 15 11.080 -9.130 1.119 1.00 0.00 H new ATOM 0 HA ARG A 15 12.698 -9.997 -1.057 1.00 0.00 H new ATOM 0 HB2 ARG A 15 10.044 -9.188 -0.452 1.00 0.00 H new ATOM 0 HB3 ARG A 15 10.572 -8.008 -1.634 1.00 0.00 H new ATOM 0 HG2 ARG A 15 11.216 -9.796 -3.213 1.00 0.00 H new ATOM 0 HG3 ARG A 15 10.879 -11.029 -2.013 1.00 0.00 H new ATOM 0 HD2 ARG A 15 8.459 -9.669 -2.020 1.00 0.00 H new ATOM 0 HD3 ARG A 15 8.951 -9.453 -3.688 1.00 0.00 H new ATOM 0 HE ARG A 15 8.208 -12.022 -2.440 1.00 0.00 H new ATOM 0 HH11 ARG A 15 10.294 -10.436 -4.761 1.00 0.00 H new ATOM 0 HH12 ARG A 15 10.488 -11.881 -5.758 1.00 0.00 H new ATOM 0 HH21 ARG A 15 8.460 -13.864 -3.715 1.00 0.00 H new ATOM 0 HH22 ARG A 15 9.460 -13.804 -5.171 1.00 0.00 H new ATOM 222 N ILE A 16 12.730 -6.740 -0.621 1.00 0.00 N ATOM 223 CA ILE A 16 13.506 -5.528 -1.010 1.00 0.00 C ATOM 224 C ILE A 16 14.988 -5.731 -0.682 1.00 0.00 C ATOM 225 O ILE A 16 15.858 -5.407 -1.466 1.00 0.00 O ATOM 226 CB ILE A 16 12.921 -4.394 -0.168 1.00 0.00 C ATOM 227 CG1 ILE A 16 11.522 -4.047 -0.680 1.00 0.00 C ATOM 228 CG2 ILE A 16 13.822 -3.162 -0.275 1.00 0.00 C ATOM 229 CD1 ILE A 16 10.739 -3.331 0.421 1.00 0.00 C ATOM 0 H ILE A 16 11.994 -6.583 0.068 1.00 0.00 H new ATOM 0 HA ILE A 16 13.439 -5.316 -2.077 1.00 0.00 H new ATOM 0 HB ILE A 16 12.859 -4.710 0.873 1.00 0.00 H new ATOM 0 HG12 ILE A 16 11.593 -3.411 -1.562 1.00 0.00 H new ATOM 0 HG13 ILE A 16 10.998 -4.954 -0.982 1.00 0.00 H new ATOM 0 HG21 ILE A 16 13.405 -2.353 0.325 1.00 0.00 H new ATOM 0 HG22 ILE A 16 14.819 -3.408 0.090 1.00 0.00 H new ATOM 0 HG23 ILE A 16 13.884 -2.846 -1.316 1.00 0.00 H new ATOM 0 HD11 ILE A 16 9.742 -3.084 0.056 1.00 0.00 H new ATOM 0 HD12 ILE A 16 10.656 -3.983 1.291 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.260 -2.416 0.702 1.00 0.00 H new ATOM 241 N LEU A 17 15.281 -6.268 0.474 1.00 0.00 N ATOM 242 CA LEU A 17 16.707 -6.496 0.850 1.00 0.00 C ATOM 243 C LEU A 17 17.335 -7.529 -0.087 1.00 0.00 C ATOM 244 O LEU A 17 18.461 -7.386 -0.521 1.00 0.00 O ATOM 245 CB LEU A 17 16.664 -7.040 2.280 1.00 0.00 C ATOM 246 CG LEU A 17 15.883 -6.077 3.175 1.00 0.00 C ATOM 247 CD1 LEU A 17 15.953 -6.559 4.624 1.00 0.00 C ATOM 248 CD2 LEU A 17 16.491 -4.677 3.073 1.00 0.00 C ATOM 0 H LEU A 17 14.596 -6.558 1.172 1.00 0.00 H new ATOM 0 HA LEU A 17 17.301 -5.585 0.778 1.00 0.00 H new ATOM 0 HB2 LEU A 17 16.195 -8.024 2.291 1.00 0.00 H new ATOM 0 HB3 LEU A 17 17.677 -7.166 2.662 1.00 0.00 H new ATOM 0 HG LEU A 17 14.842 -6.044 2.852 1.00 0.00 H new ATOM 0 HD11 LEU A 17 15.397 -5.873 5.263 1.00 0.00 H new ATOM 0 HD12 LEU A 17 15.519 -7.556 4.697 1.00 0.00 H new ATOM 0 HD13 LEU A 17 16.994 -6.592 4.947 1.00 0.00 H new ATOM 0 HD21 LEU A 17 15.934 -3.991 3.711 1.00 0.00 H new ATOM 0 HD22 LEU A 17 17.532 -4.708 3.395 1.00 0.00 H new ATOM 0 HD23 LEU A 17 16.441 -4.333 2.040 1.00 0.00 H new ATOM 260 N ALA A 18 16.613 -8.569 -0.398 1.00 0.00 N ATOM 261 CA ALA A 18 17.162 -9.617 -1.304 1.00 0.00 C ATOM 262 C ALA A 18 16.968 -9.210 -2.768 1.00 0.00 C ATOM 263 O ALA A 18 17.111 -10.013 -3.669 1.00 0.00 O ATOM 264 CB ALA A 18 16.358 -10.875 -0.982 1.00 0.00 C ATOM 0 H ALA A 18 15.665 -8.739 -0.063 1.00 0.00 H new ATOM 0 HA ALA A 18 18.232 -9.769 -1.161 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.702 -11.697 -1.609 1.00 0.00 H new ATOM 0 HB2 ALA A 18 16.496 -11.137 0.067 1.00 0.00 H new ATOM 0 HB3 ALA A 18 15.301 -10.690 -1.174 1.00 0.00 H new ATOM 270 N SER A 19 16.646 -7.969 -3.012 1.00 0.00 N ATOM 271 CA SER A 19 16.445 -7.512 -4.417 1.00 0.00 C ATOM 272 C SER A 19 15.356 -8.344 -5.100 1.00 0.00 C ATOM 273 O SER A 19 15.627 -9.138 -5.979 1.00 0.00 O ATOM 274 CB SER A 19 17.793 -7.730 -5.099 1.00 0.00 C ATOM 275 OG SER A 19 18.206 -6.520 -5.722 1.00 0.00 O ATOM 0 H SER A 19 16.513 -7.252 -2.299 1.00 0.00 H new ATOM 0 HA SER A 19 16.124 -6.472 -4.469 1.00 0.00 H new ATOM 0 HB2 SER A 19 18.536 -8.048 -4.368 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.714 -8.525 -5.840 1.00 0.00 H new ATOM 0 HG SER A 19 19.072 -6.656 -6.159 1.00 0.00 H new ATOM 281 N ASP A 20 14.126 -8.163 -4.705 1.00 0.00 N ATOM 282 CA ASP A 20 13.019 -8.939 -5.334 1.00 0.00 C ATOM 283 C ASP A 20 13.406 -10.414 -5.467 1.00 0.00 C ATOM 284 O ASP A 20 13.360 -10.983 -6.540 1.00 0.00 O ATOM 285 CB ASP A 20 12.831 -8.309 -6.715 1.00 0.00 C ATOM 286 CG ASP A 20 11.503 -8.777 -7.312 1.00 0.00 C ATOM 287 OD1 ASP A 20 11.502 -9.805 -7.970 1.00 0.00 O ATOM 288 OD2 ASP A 20 10.510 -8.100 -7.102 1.00 0.00 O ATOM 0 H ASP A 20 13.839 -7.512 -3.974 1.00 0.00 H new ATOM 0 HA ASP A 20 12.106 -8.906 -4.740 1.00 0.00 H new ATOM 0 HB2 ASP A 20 12.843 -7.222 -6.635 1.00 0.00 H new ATOM 0 HB3 ASP A 20 13.656 -8.590 -7.370 1.00 0.00 H new ATOM 293 N LYS A 21 13.783 -11.041 -4.386 1.00 0.00 N ATOM 294 CA LYS A 21 14.169 -12.479 -4.455 1.00 0.00 C ATOM 295 C LYS A 21 13.498 -13.253 -3.320 1.00 0.00 C ATOM 296 O LYS A 21 13.376 -12.760 -2.216 1.00 0.00 O ATOM 297 CB LYS A 21 15.690 -12.493 -4.300 1.00 0.00 C ATOM 298 CG LYS A 21 16.340 -12.093 -5.626 1.00 0.00 C ATOM 299 CD LYS A 21 17.565 -12.973 -5.883 1.00 0.00 C ATOM 300 CE LYS A 21 18.700 -12.115 -6.445 1.00 0.00 C ATOM 301 NZ LYS A 21 18.575 -12.233 -7.924 1.00 0.00 N ATOM 0 H LYS A 21 13.840 -10.620 -3.459 1.00 0.00 H new ATOM 0 HA LYS A 21 13.858 -12.950 -5.388 1.00 0.00 H new ATOM 0 HB2 LYS A 21 15.993 -11.804 -3.512 1.00 0.00 H new ATOM 0 HB3 LYS A 21 16.027 -13.486 -4.002 1.00 0.00 H new ATOM 0 HG2 LYS A 21 15.624 -12.202 -6.441 1.00 0.00 H new ATOM 0 HG3 LYS A 21 16.633 -11.044 -5.597 1.00 0.00 H new ATOM 0 HD2 LYS A 21 17.882 -13.453 -4.957 1.00 0.00 H new ATOM 0 HD3 LYS A 21 17.314 -13.768 -6.585 1.00 0.00 H new ATOM 0 HE2 LYS A 21 18.608 -11.078 -6.122 1.00 0.00 H new ATOM 0 HE3 LYS A 21 19.671 -12.471 -6.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 19.321 -11.671 -8.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 18.674 -13.230 -8.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 17.643 -11.881 -8.223 1.00 0.00 H new ATOM 315 N PRO A 22 13.084 -14.450 -3.635 1.00 0.00 N ATOM 316 CA PRO A 22 12.418 -15.284 -2.599 1.00 0.00 C ATOM 317 C PRO A 22 13.421 -15.691 -1.516 1.00 0.00 C ATOM 318 O PRO A 22 13.068 -16.311 -0.533 1.00 0.00 O ATOM 319 CB PRO A 22 11.915 -16.512 -3.360 1.00 0.00 C ATOM 320 CG PRO A 22 12.685 -16.527 -4.640 1.00 0.00 C ATOM 321 CD PRO A 22 13.052 -15.104 -4.949 1.00 0.00 C ATOM 0 HA PRO A 22 11.611 -14.755 -2.092 1.00 0.00 H new ATOM 0 HB2 PRO A 22 12.084 -17.425 -2.789 1.00 0.00 H new ATOM 0 HB3 PRO A 22 10.843 -16.447 -3.547 1.00 0.00 H new ATOM 0 HG2 PRO A 22 13.579 -17.144 -4.545 1.00 0.00 H new ATOM 0 HG3 PRO A 22 12.087 -16.954 -5.445 1.00 0.00 H new ATOM 0 HD2 PRO A 22 14.018 -15.041 -5.449 1.00 0.00 H new ATOM 0 HD3 PRO A 22 12.320 -14.638 -5.609 1.00 0.00 H new ATOM 329 N TYR A 23 14.669 -15.349 -1.688 1.00 0.00 N ATOM 330 CA TYR A 23 15.689 -15.722 -0.664 1.00 0.00 C ATOM 331 C TYR A 23 16.664 -14.565 -0.440 1.00 0.00 C ATOM 332 O TYR A 23 16.837 -13.713 -1.289 1.00 0.00 O ATOM 333 CB TYR A 23 16.420 -16.927 -1.255 1.00 0.00 C ATOM 334 CG TYR A 23 17.086 -16.523 -2.549 1.00 0.00 C ATOM 335 CD1 TYR A 23 16.367 -16.569 -3.750 1.00 0.00 C ATOM 336 CD2 TYR A 23 18.421 -16.102 -2.547 1.00 0.00 C ATOM 337 CE1 TYR A 23 16.984 -16.194 -4.949 1.00 0.00 C ATOM 338 CE2 TYR A 23 19.038 -15.727 -3.746 1.00 0.00 C ATOM 339 CZ TYR A 23 18.320 -15.773 -4.948 1.00 0.00 C ATOM 340 OH TYR A 23 18.927 -15.403 -6.130 1.00 0.00 O ATOM 0 H TYR A 23 15.026 -14.829 -2.490 1.00 0.00 H new ATOM 0 HA TYR A 23 15.238 -15.949 0.302 1.00 0.00 H new ATOM 0 HB2 TYR A 23 17.164 -17.297 -0.550 1.00 0.00 H new ATOM 0 HB3 TYR A 23 15.718 -17.741 -1.433 1.00 0.00 H new ATOM 0 HD1 TYR A 23 15.337 -16.894 -3.751 1.00 0.00 H new ATOM 0 HD2 TYR A 23 18.975 -16.067 -1.620 1.00 0.00 H new ATOM 0 HE1 TYR A 23 16.430 -16.229 -5.875 1.00 0.00 H new ATOM 0 HE2 TYR A 23 20.068 -15.402 -3.745 1.00 0.00 H new ATOM 0 HH TYR A 23 19.853 -15.137 -5.953 1.00 0.00 H new ATOM 350 N ILE A 24 17.311 -14.534 0.693 1.00 0.00 N ATOM 351 CA ILE A 24 18.282 -13.438 0.968 1.00 0.00 C ATOM 352 C ILE A 24 19.583 -14.034 1.517 1.00 0.00 C ATOM 353 O ILE A 24 19.567 -14.940 2.326 1.00 0.00 O ATOM 354 CB ILE A 24 17.585 -12.541 2.004 1.00 0.00 C ATOM 355 CG1 ILE A 24 18.133 -11.114 1.897 1.00 0.00 C ATOM 356 CG2 ILE A 24 17.826 -13.075 3.419 1.00 0.00 C ATOM 357 CD1 ILE A 24 19.631 -11.117 2.206 1.00 0.00 C ATOM 0 H ILE A 24 17.209 -15.221 1.440 1.00 0.00 H new ATOM 0 HA ILE A 24 18.551 -12.870 0.078 1.00 0.00 H new ATOM 0 HB ILE A 24 16.513 -12.540 1.805 1.00 0.00 H new ATOM 0 HG12 ILE A 24 17.958 -10.720 0.896 1.00 0.00 H new ATOM 0 HG13 ILE A 24 17.609 -10.459 2.593 1.00 0.00 H new ATOM 0 HG21 ILE A 24 17.326 -12.430 4.141 1.00 0.00 H new ATOM 0 HG22 ILE A 24 17.427 -14.086 3.499 1.00 0.00 H new ATOM 0 HG23 ILE A 24 18.896 -13.090 3.625 1.00 0.00 H new ATOM 0 HD11 ILE A 24 20.020 -10.102 2.130 1.00 0.00 H new ATOM 0 HD12 ILE A 24 19.793 -11.493 3.216 1.00 0.00 H new ATOM 0 HD13 ILE A 24 20.148 -11.758 1.493 1.00 0.00 H new ATOM 369 N LEU A 25 20.708 -13.542 1.078 1.00 0.00 N ATOM 370 CA LEU A 25 22.001 -14.096 1.573 1.00 0.00 C ATOM 371 C LEU A 25 22.365 -13.474 2.923 1.00 0.00 C ATOM 372 O LEU A 25 22.189 -12.292 3.141 1.00 0.00 O ATOM 373 CB LEU A 25 23.040 -13.716 0.509 1.00 0.00 C ATOM 374 CG LEU A 25 22.659 -14.304 -0.861 1.00 0.00 C ATOM 375 CD1 LEU A 25 21.939 -15.647 -0.690 1.00 0.00 C ATOM 376 CD2 LEU A 25 21.741 -13.326 -1.597 1.00 0.00 C ATOM 0 H LEU A 25 20.789 -12.784 0.401 1.00 0.00 H new ATOM 0 HA LEU A 25 21.951 -15.174 1.723 1.00 0.00 H new ATOM 0 HB2 LEU A 25 23.113 -12.631 0.437 1.00 0.00 H new ATOM 0 HB3 LEU A 25 24.023 -14.082 0.807 1.00 0.00 H new ATOM 0 HG LEU A 25 23.570 -14.465 -1.438 1.00 0.00 H new ATOM 0 HD11 LEU A 25 21.678 -16.047 -1.670 1.00 0.00 H new ATOM 0 HD12 LEU A 25 22.595 -16.349 -0.175 1.00 0.00 H new ATOM 0 HD13 LEU A 25 21.032 -15.501 -0.104 1.00 0.00 H new ATOM 0 HD21 LEU A 25 21.470 -13.741 -2.568 1.00 0.00 H new ATOM 0 HD22 LEU A 25 20.838 -13.161 -1.008 1.00 0.00 H new ATOM 0 HD23 LEU A 25 22.259 -12.378 -1.740 1.00 0.00 H new ATOM 388 N ALA A 26 22.873 -14.264 3.829 1.00 0.00 N ATOM 389 CA ALA A 26 23.251 -13.722 5.166 1.00 0.00 C ATOM 390 C ALA A 26 24.215 -12.546 5.005 1.00 0.00 C ATOM 391 O ALA A 26 24.181 -11.593 5.758 1.00 0.00 O ATOM 392 CB ALA A 26 23.938 -14.883 5.885 1.00 0.00 C ATOM 0 H ALA A 26 23.043 -15.262 3.702 1.00 0.00 H new ATOM 0 HA ALA A 26 22.388 -13.353 5.721 1.00 0.00 H new ATOM 0 HB1 ALA A 26 24.247 -14.563 6.880 1.00 0.00 H new ATOM 0 HB2 ALA A 26 23.244 -15.719 5.972 1.00 0.00 H new ATOM 0 HB3 ALA A 26 24.814 -15.196 5.316 1.00 0.00 H new ATOM 398 N GLU A 27 25.076 -12.604 4.025 1.00 0.00 N ATOM 399 CA GLU A 27 26.040 -11.492 3.812 1.00 0.00 C ATOM 400 C GLU A 27 25.284 -10.192 3.522 1.00 0.00 C ATOM 401 O GLU A 27 25.658 -9.129 3.975 1.00 0.00 O ATOM 402 CB GLU A 27 26.860 -11.924 2.600 1.00 0.00 C ATOM 403 CG GLU A 27 27.740 -13.117 2.979 1.00 0.00 C ATOM 404 CD GLU A 27 28.564 -13.551 1.766 1.00 0.00 C ATOM 405 OE1 GLU A 27 28.071 -13.410 0.658 1.00 0.00 O ATOM 406 OE2 GLU A 27 29.674 -14.016 1.964 1.00 0.00 O ATOM 0 H GLU A 27 25.152 -13.376 3.363 1.00 0.00 H new ATOM 0 HA GLU A 27 26.667 -11.303 4.684 1.00 0.00 H new ATOM 0 HB2 GLU A 27 26.198 -12.194 1.777 1.00 0.00 H new ATOM 0 HB3 GLU A 27 27.480 -11.097 2.253 1.00 0.00 H new ATOM 0 HG2 GLU A 27 28.401 -12.847 3.803 1.00 0.00 H new ATOM 0 HG3 GLU A 27 27.120 -13.944 3.325 1.00 0.00 H new ATOM 413 N GLU A 28 24.215 -10.274 2.777 1.00 0.00 N ATOM 414 CA GLU A 28 23.428 -9.049 2.463 1.00 0.00 C ATOM 415 C GLU A 28 22.801 -8.500 3.746 1.00 0.00 C ATOM 416 O GLU A 28 22.770 -7.307 3.975 1.00 0.00 O ATOM 417 CB GLU A 28 22.343 -9.511 1.490 1.00 0.00 C ATOM 418 CG GLU A 28 22.755 -9.156 0.060 1.00 0.00 C ATOM 419 CD GLU A 28 21.588 -9.426 -0.891 1.00 0.00 C ATOM 420 OE1 GLU A 28 20.530 -9.794 -0.409 1.00 0.00 O ATOM 421 OE2 GLU A 28 21.773 -9.262 -2.085 1.00 0.00 O ATOM 0 H GLU A 28 23.853 -11.137 2.372 1.00 0.00 H new ATOM 0 HA GLU A 28 24.041 -8.255 2.035 1.00 0.00 H new ATOM 0 HB2 GLU A 28 22.193 -10.587 1.580 1.00 0.00 H new ATOM 0 HB3 GLU A 28 21.393 -9.035 1.735 1.00 0.00 H new ATOM 0 HG2 GLU A 28 23.048 -8.107 0.005 1.00 0.00 H new ATOM 0 HG3 GLU A 28 23.623 -9.745 -0.236 1.00 0.00 H new ATOM 428 N LEU A 29 22.311 -9.368 4.589 1.00 0.00 N ATOM 429 CA LEU A 29 21.697 -8.901 5.864 1.00 0.00 C ATOM 430 C LEU A 29 22.733 -8.122 6.673 1.00 0.00 C ATOM 431 O LEU A 29 22.415 -7.176 7.365 1.00 0.00 O ATOM 432 CB LEU A 29 21.287 -10.178 6.601 1.00 0.00 C ATOM 433 CG LEU A 29 20.332 -10.992 5.726 1.00 0.00 C ATOM 434 CD1 LEU A 29 19.835 -12.209 6.509 1.00 0.00 C ATOM 435 CD2 LEU A 29 19.138 -10.121 5.328 1.00 0.00 C ATOM 0 H LEU A 29 22.309 -10.378 4.450 1.00 0.00 H new ATOM 0 HA LEU A 29 20.845 -8.240 5.703 1.00 0.00 H new ATOM 0 HB2 LEU A 29 22.170 -10.770 6.842 1.00 0.00 H new ATOM 0 HB3 LEU A 29 20.805 -9.926 7.546 1.00 0.00 H new ATOM 0 HG LEU A 29 20.855 -11.325 4.830 1.00 0.00 H new ATOM 0 HD11 LEU A 29 19.154 -12.789 5.886 1.00 0.00 H new ATOM 0 HD12 LEU A 29 20.684 -12.830 6.794 1.00 0.00 H new ATOM 0 HD13 LEU A 29 19.312 -11.876 7.405 1.00 0.00 H new ATOM 0 HD21 LEU A 29 18.457 -10.700 4.704 1.00 0.00 H new ATOM 0 HD22 LEU A 29 18.615 -9.789 6.225 1.00 0.00 H new ATOM 0 HD23 LEU A 29 19.491 -9.253 4.771 1.00 0.00 H new ATOM 447 N ARG A 30 23.974 -8.514 6.587 1.00 0.00 N ATOM 448 CA ARG A 30 25.040 -7.802 7.341 1.00 0.00 C ATOM 449 C ARG A 30 25.243 -6.399 6.764 1.00 0.00 C ATOM 450 O ARG A 30 25.538 -5.460 7.476 1.00 0.00 O ATOM 451 CB ARG A 30 26.297 -8.647 7.139 1.00 0.00 C ATOM 452 CG ARG A 30 26.131 -9.994 7.841 1.00 0.00 C ATOM 453 CD ARG A 30 27.484 -10.709 7.890 1.00 0.00 C ATOM 454 NE ARG A 30 28.013 -10.438 9.256 1.00 0.00 N ATOM 455 CZ ARG A 30 29.293 -10.535 9.497 1.00 0.00 C ATOM 456 NH1 ARG A 30 30.119 -10.869 8.543 1.00 0.00 N ATOM 457 NH2 ARG A 30 29.749 -10.298 10.697 1.00 0.00 N ATOM 0 H ARG A 30 24.296 -9.301 6.024 1.00 0.00 H new ATOM 0 HA ARG A 30 24.792 -7.683 8.396 1.00 0.00 H new ATOM 0 HB2 ARG A 30 26.476 -8.800 6.075 1.00 0.00 H new ATOM 0 HB3 ARG A 30 27.166 -8.124 7.537 1.00 0.00 H new ATOM 0 HG2 ARG A 30 25.748 -9.846 8.851 1.00 0.00 H new ATOM 0 HG3 ARG A 30 25.402 -10.606 7.310 1.00 0.00 H new ATOM 0 HD2 ARG A 30 27.372 -11.779 7.715 1.00 0.00 H new ATOM 0 HD3 ARG A 30 28.159 -10.330 7.123 1.00 0.00 H new ATOM 0 HE ARG A 30 27.373 -10.176 10.006 1.00 0.00 H new ATOM 0 HH11 ARG A 30 29.766 -11.055 7.605 1.00 0.00 H new ATOM 0 HH12 ARG A 30 31.118 -10.943 8.736 1.00 0.00 H new ATOM 0 HH21 ARG A 30 29.106 -10.038 11.445 1.00 0.00 H new ATOM 0 HH22 ARG A 30 30.748 -10.373 10.887 1.00 0.00 H new ATOM 471 N ARG A 31 25.092 -6.252 5.475 1.00 0.00 N ATOM 472 CA ARG A 31 25.284 -4.910 4.852 1.00 0.00 C ATOM 473 C ARG A 31 23.940 -4.189 4.706 1.00 0.00 C ATOM 474 O ARG A 31 23.866 -2.978 4.771 1.00 0.00 O ATOM 475 CB ARG A 31 25.892 -5.195 3.478 1.00 0.00 C ATOM 476 CG ARG A 31 27.047 -4.225 3.220 1.00 0.00 C ATOM 477 CD ARG A 31 26.654 -3.249 2.109 1.00 0.00 C ATOM 478 NE ARG A 31 27.919 -2.555 1.740 1.00 0.00 N ATOM 479 CZ ARG A 31 28.400 -1.616 2.510 1.00 0.00 C ATOM 480 NH1 ARG A 31 27.772 -1.277 3.604 1.00 0.00 N ATOM 481 NH2 ARG A 31 29.510 -1.012 2.183 1.00 0.00 N ATOM 0 H ARG A 31 24.845 -7.001 4.828 1.00 0.00 H new ATOM 0 HA ARG A 31 25.922 -4.265 5.456 1.00 0.00 H new ATOM 0 HB2 ARG A 31 26.250 -6.224 3.433 1.00 0.00 H new ATOM 0 HB3 ARG A 31 25.133 -5.088 2.703 1.00 0.00 H new ATOM 0 HG2 ARG A 31 27.287 -3.678 4.132 1.00 0.00 H new ATOM 0 HG3 ARG A 31 27.943 -4.777 2.934 1.00 0.00 H new ATOM 0 HD2 ARG A 31 26.228 -3.775 1.254 1.00 0.00 H new ATOM 0 HD3 ARG A 31 25.901 -2.540 2.454 1.00 0.00 H new ATOM 0 HE ARG A 31 28.411 -2.813 0.884 1.00 0.00 H new ATOM 0 HH11 ARG A 31 26.903 -1.746 3.859 1.00 0.00 H new ATOM 0 HH12 ARG A 31 28.151 -0.543 4.203 1.00 0.00 H new ATOM 0 HH21 ARG A 31 30.000 -1.274 1.328 1.00 0.00 H new ATOM 0 HH22 ARG A 31 29.887 -0.278 2.783 1.00 0.00 H new ATOM 495 N GLU A 32 22.877 -4.919 4.505 1.00 0.00 N ATOM 496 CA GLU A 32 21.545 -4.267 4.351 1.00 0.00 C ATOM 497 C GLU A 32 20.931 -3.975 5.723 1.00 0.00 C ATOM 498 O GLU A 32 20.090 -3.109 5.865 1.00 0.00 O ATOM 499 CB GLU A 32 20.692 -5.281 3.589 1.00 0.00 C ATOM 500 CG GLU A 32 21.267 -5.480 2.185 1.00 0.00 C ATOM 501 CD GLU A 32 20.310 -4.882 1.151 1.00 0.00 C ATOM 502 OE1 GLU A 32 19.750 -3.835 1.428 1.00 0.00 O ATOM 503 OE2 GLU A 32 20.153 -5.483 0.100 1.00 0.00 O ATOM 0 H GLU A 32 22.873 -5.937 4.441 1.00 0.00 H new ATOM 0 HA GLU A 32 21.614 -3.314 3.827 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.673 -6.231 4.124 1.00 0.00 H new ATOM 0 HB3 GLU A 32 19.662 -4.930 3.525 1.00 0.00 H new ATOM 0 HG2 GLU A 32 22.244 -5.003 2.110 1.00 0.00 H new ATOM 0 HG3 GLU A 32 21.414 -6.542 1.988 1.00 0.00 H new ATOM 510 N LEU A 33 21.339 -4.690 6.735 1.00 0.00 N ATOM 511 CA LEU A 33 20.773 -4.454 8.091 1.00 0.00 C ATOM 512 C LEU A 33 21.898 -4.298 9.117 1.00 0.00 C ATOM 513 O LEU A 33 22.944 -4.903 8.987 1.00 0.00 O ATOM 514 CB LEU A 33 19.955 -5.707 8.389 1.00 0.00 C ATOM 515 CG LEU A 33 18.470 -5.419 8.157 1.00 0.00 C ATOM 516 CD1 LEU A 33 17.737 -6.728 7.862 1.00 0.00 C ATOM 517 CD2 LEU A 33 17.874 -4.773 9.409 1.00 0.00 C ATOM 0 H LEU A 33 22.041 -5.428 6.680 1.00 0.00 H new ATOM 0 HA LEU A 33 20.173 -3.545 8.138 1.00 0.00 H new ATOM 0 HB2 LEU A 33 20.281 -6.527 7.749 1.00 0.00 H new ATOM 0 HB3 LEU A 33 20.118 -6.023 9.419 1.00 0.00 H new ATOM 0 HG LEU A 33 18.360 -4.741 7.310 1.00 0.00 H new ATOM 0 HD11 LEU A 33 16.679 -6.523 7.697 1.00 0.00 H new ATOM 0 HD12 LEU A 33 18.161 -7.189 6.970 1.00 0.00 H new ATOM 0 HD13 LEU A 33 17.847 -7.406 8.709 1.00 0.00 H new ATOM 0 HD21 LEU A 33 16.816 -4.568 9.244 1.00 0.00 H new ATOM 0 HD22 LEU A 33 17.984 -5.450 10.256 1.00 0.00 H new ATOM 0 HD23 LEU A 33 18.396 -3.840 9.621 1.00 0.00 H new ATOM 529 N PRO A 34 21.640 -3.491 10.109 1.00 0.00 N ATOM 530 CA PRO A 34 22.675 -3.288 11.154 1.00 0.00 C ATOM 531 C PRO A 34 23.251 -4.637 11.593 1.00 0.00 C ATOM 532 O PRO A 34 22.708 -5.677 11.277 1.00 0.00 O ATOM 533 CB PRO A 34 21.931 -2.611 12.312 1.00 0.00 C ATOM 534 CG PRO A 34 20.491 -2.549 11.903 1.00 0.00 C ATOM 535 CD PRO A 34 20.443 -2.708 10.411 1.00 0.00 C ATOM 0 HA PRO A 34 23.514 -2.688 10.802 1.00 0.00 H new ATOM 0 HB2 PRO A 34 22.049 -3.178 13.235 1.00 0.00 H new ATOM 0 HB3 PRO A 34 22.326 -1.612 12.498 1.00 0.00 H new ATOM 0 HG2 PRO A 34 19.918 -3.337 12.392 1.00 0.00 H new ATOM 0 HG3 PRO A 34 20.047 -1.600 12.203 1.00 0.00 H new ATOM 0 HD2 PRO A 34 19.537 -3.222 10.092 1.00 0.00 H new ATOM 0 HD3 PRO A 34 20.457 -1.743 9.904 1.00 0.00 H new ATOM 543 N PRO A 35 24.340 -4.570 12.307 1.00 0.00 N ATOM 544 CA PRO A 35 24.977 -5.832 12.776 1.00 0.00 C ATOM 545 C PRO A 35 24.031 -6.596 13.707 1.00 0.00 C ATOM 546 O PRO A 35 23.991 -7.810 13.704 1.00 0.00 O ATOM 547 CB PRO A 35 26.219 -5.368 13.537 1.00 0.00 C ATOM 548 CG PRO A 35 25.960 -3.935 13.871 1.00 0.00 C ATOM 549 CD PRO A 35 25.070 -3.393 12.790 1.00 0.00 C ATOM 0 HA PRO A 35 25.219 -6.508 11.956 1.00 0.00 H new ATOM 0 HB2 PRO A 35 26.373 -5.961 14.439 1.00 0.00 H new ATOM 0 HB3 PRO A 35 27.117 -5.475 12.928 1.00 0.00 H new ATOM 0 HG2 PRO A 35 25.482 -3.845 14.847 1.00 0.00 H new ATOM 0 HG3 PRO A 35 26.894 -3.375 13.921 1.00 0.00 H new ATOM 0 HD2 PRO A 35 24.391 -2.633 13.176 1.00 0.00 H new ATOM 0 HD3 PRO A 35 25.649 -2.928 11.992 1.00 0.00 H new ATOM 557 N ASP A 36 23.275 -5.896 14.507 1.00 0.00 N ATOM 558 CA ASP A 36 22.338 -6.588 15.439 1.00 0.00 C ATOM 559 C ASP A 36 21.250 -7.326 14.654 1.00 0.00 C ATOM 560 O ASP A 36 20.946 -8.471 14.926 1.00 0.00 O ATOM 561 CB ASP A 36 21.727 -5.473 16.291 1.00 0.00 C ATOM 562 CG ASP A 36 21.184 -4.370 15.381 1.00 0.00 C ATOM 563 OD1 ASP A 36 20.144 -4.583 14.780 1.00 0.00 O ATOM 564 OD2 ASP A 36 21.815 -3.329 15.303 1.00 0.00 O ATOM 0 H ASP A 36 23.265 -4.877 14.556 1.00 0.00 H new ATOM 0 HA ASP A 36 22.845 -7.335 16.050 1.00 0.00 H new ATOM 0 HB2 ASP A 36 20.925 -5.874 16.912 1.00 0.00 H new ATOM 0 HB3 ASP A 36 22.479 -5.064 16.966 1.00 0.00 H new ATOM 569 N GLN A 37 20.660 -6.684 13.683 1.00 0.00 N ATOM 570 CA GLN A 37 19.594 -7.357 12.889 1.00 0.00 C ATOM 571 C GLN A 37 20.201 -8.465 12.023 1.00 0.00 C ATOM 572 O GLN A 37 19.638 -9.533 11.880 1.00 0.00 O ATOM 573 CB GLN A 37 18.999 -6.255 12.013 1.00 0.00 C ATOM 574 CG GLN A 37 17.498 -6.140 12.286 1.00 0.00 C ATOM 575 CD GLN A 37 17.275 -5.555 13.682 1.00 0.00 C ATOM 576 OE1 GLN A 37 16.581 -6.135 14.493 1.00 0.00 O ATOM 577 NE2 GLN A 37 17.839 -4.421 13.999 1.00 0.00 N ATOM 0 H GLN A 37 20.869 -5.725 13.406 1.00 0.00 H new ATOM 0 HA GLN A 37 18.840 -7.826 13.521 1.00 0.00 H new ATOM 0 HB2 GLN A 37 19.491 -5.305 12.221 1.00 0.00 H new ATOM 0 HB3 GLN A 37 19.172 -6.479 10.960 1.00 0.00 H new ATOM 0 HG2 GLN A 37 17.029 -5.504 11.535 1.00 0.00 H new ATOM 0 HG3 GLN A 37 17.028 -7.121 12.212 1.00 0.00 H new ATOM 0 HE21 GLN A 37 18.422 -3.934 13.319 1.00 0.00 H new ATOM 0 HE22 GLN A 37 17.697 -4.023 14.927 1.00 0.00 H new ATOM 586 N ALA A 38 21.346 -8.220 11.447 1.00 0.00 N ATOM 587 CA ALA A 38 21.989 -9.259 10.593 1.00 0.00 C ATOM 588 C ALA A 38 22.234 -10.534 11.406 1.00 0.00 C ATOM 589 O ALA A 38 21.912 -11.625 10.980 1.00 0.00 O ATOM 590 CB ALA A 38 23.316 -8.642 10.153 1.00 0.00 C ATOM 0 H ALA A 38 21.864 -7.345 11.531 1.00 0.00 H new ATOM 0 HA ALA A 38 21.367 -9.539 9.743 1.00 0.00 H new ATOM 0 HB1 ALA A 38 23.852 -9.347 9.518 1.00 0.00 H new ATOM 0 HB2 ALA A 38 23.124 -7.725 9.596 1.00 0.00 H new ATOM 0 HB3 ALA A 38 23.920 -8.413 11.031 1.00 0.00 H new ATOM 596 N GLN A 39 22.799 -10.403 12.576 1.00 0.00 N ATOM 597 CA GLN A 39 23.061 -11.608 13.415 1.00 0.00 C ATOM 598 C GLN A 39 21.741 -12.287 13.789 1.00 0.00 C ATOM 599 O GLN A 39 21.592 -13.487 13.666 1.00 0.00 O ATOM 600 CB GLN A 39 23.763 -11.075 14.665 1.00 0.00 C ATOM 601 CG GLN A 39 24.364 -12.242 15.450 1.00 0.00 C ATOM 602 CD GLN A 39 25.516 -12.856 14.653 1.00 0.00 C ATOM 603 OE1 GLN A 39 26.442 -12.168 14.274 1.00 0.00 O ATOM 604 NE2 GLN A 39 25.496 -14.133 14.379 1.00 0.00 N ATOM 0 H GLN A 39 23.090 -9.516 12.987 1.00 0.00 H new ATOM 0 HA GLN A 39 23.665 -12.351 12.895 1.00 0.00 H new ATOM 0 HB2 GLN A 39 24.546 -10.371 14.383 1.00 0.00 H new ATOM 0 HB3 GLN A 39 23.054 -10.530 15.289 1.00 0.00 H new ATOM 0 HG2 GLN A 39 24.723 -11.895 16.419 1.00 0.00 H new ATOM 0 HG3 GLN A 39 23.600 -12.995 15.644 1.00 0.00 H new ATOM 0 HE21 GLN A 39 24.718 -14.711 14.697 1.00 0.00 H new ATOM 0 HE22 GLN A 39 26.258 -14.552 13.847 1.00 0.00 H new ATOM 613 N TYR A 40 20.782 -11.527 14.242 1.00 0.00 N ATOM 614 CA TYR A 40 19.471 -12.129 14.623 1.00 0.00 C ATOM 615 C TYR A 40 18.769 -12.688 13.381 1.00 0.00 C ATOM 616 O TYR A 40 18.268 -13.794 13.384 1.00 0.00 O ATOM 617 CB TYR A 40 18.666 -10.975 15.220 1.00 0.00 C ATOM 618 CG TYR A 40 17.745 -11.506 16.293 1.00 0.00 C ATOM 619 CD1 TYR A 40 16.783 -12.472 15.974 1.00 0.00 C ATOM 620 CD2 TYR A 40 17.851 -11.031 17.606 1.00 0.00 C ATOM 621 CE1 TYR A 40 15.928 -12.963 16.968 1.00 0.00 C ATOM 622 CE2 TYR A 40 16.997 -11.523 18.599 1.00 0.00 C ATOM 623 CZ TYR A 40 16.035 -12.489 18.281 1.00 0.00 C ATOM 624 OH TYR A 40 15.192 -12.973 19.261 1.00 0.00 O ATOM 0 H TYR A 40 20.848 -10.517 14.365 1.00 0.00 H new ATOM 0 HA TYR A 40 19.581 -12.955 15.326 1.00 0.00 H new ATOM 0 HB2 TYR A 40 19.339 -10.227 15.640 1.00 0.00 H new ATOM 0 HB3 TYR A 40 18.087 -10.480 14.441 1.00 0.00 H new ATOM 0 HD1 TYR A 40 16.701 -12.838 14.961 1.00 0.00 H new ATOM 0 HD2 TYR A 40 18.592 -10.285 17.852 1.00 0.00 H new ATOM 0 HE1 TYR A 40 15.186 -13.708 16.722 1.00 0.00 H new ATOM 0 HE2 TYR A 40 17.080 -11.157 19.612 1.00 0.00 H new ATOM 0 HH TYR A 40 15.615 -12.865 20.139 1.00 0.00 H new ATOM 634 N CYS A 41 18.730 -11.927 12.320 1.00 0.00 N ATOM 635 CA CYS A 41 18.061 -12.413 11.078 1.00 0.00 C ATOM 636 C CYS A 41 18.811 -13.619 10.507 1.00 0.00 C ATOM 637 O CYS A 41 18.217 -14.613 10.135 1.00 0.00 O ATOM 638 CB CYS A 41 18.126 -11.232 10.108 1.00 0.00 C ATOM 639 SG CYS A 41 17.093 -9.881 10.729 1.00 0.00 S ATOM 0 H CYS A 41 19.132 -10.991 12.259 1.00 0.00 H new ATOM 0 HA CYS A 41 17.036 -12.737 11.261 1.00 0.00 H new ATOM 0 HB2 CYS A 41 19.157 -10.895 9.998 1.00 0.00 H new ATOM 0 HB3 CYS A 41 17.784 -11.540 9.120 1.00 0.00 H new ATOM 0 HG CYS A 41 17.761 -9.193 11.607 1.00 0.00 H new ATOM 645 N ILE A 42 20.110 -13.539 10.430 1.00 0.00 N ATOM 646 CA ILE A 42 20.902 -14.678 9.880 1.00 0.00 C ATOM 647 C ILE A 42 20.851 -15.874 10.834 1.00 0.00 C ATOM 648 O ILE A 42 21.238 -16.973 10.489 1.00 0.00 O ATOM 649 CB ILE A 42 22.329 -14.143 9.769 1.00 0.00 C ATOM 650 CG1 ILE A 42 22.379 -13.050 8.699 1.00 0.00 C ATOM 651 CG2 ILE A 42 23.275 -15.280 9.381 1.00 0.00 C ATOM 652 CD1 ILE A 42 23.801 -12.492 8.606 1.00 0.00 C ATOM 0 H ILE A 42 20.660 -12.732 10.725 1.00 0.00 H new ATOM 0 HA ILE A 42 20.516 -15.024 8.921 1.00 0.00 H new ATOM 0 HB ILE A 42 22.637 -13.729 10.729 1.00 0.00 H new ATOM 0 HG12 ILE A 42 22.072 -13.456 7.735 1.00 0.00 H new ATOM 0 HG13 ILE A 42 21.679 -12.252 8.946 1.00 0.00 H new ATOM 0 HG21 ILE A 42 24.292 -14.896 9.302 1.00 0.00 H new ATOM 0 HG22 ILE A 42 23.239 -16.059 10.142 1.00 0.00 H new ATOM 0 HG23 ILE A 42 22.969 -15.696 8.421 1.00 0.00 H new ATOM 0 HD11 ILE A 42 23.837 -11.713 7.844 1.00 0.00 H new ATOM 0 HD12 ILE A 42 24.090 -12.071 9.569 1.00 0.00 H new ATOM 0 HD13 ILE A 42 24.490 -13.294 8.339 1.00 0.00 H new ATOM 664 N LYS A 43 20.381 -15.669 12.032 1.00 0.00 N ATOM 665 CA LYS A 43 20.310 -16.794 13.010 1.00 0.00 C ATOM 666 C LYS A 43 19.040 -17.622 12.784 1.00 0.00 C ATOM 667 O LYS A 43 19.056 -18.833 12.869 1.00 0.00 O ATOM 668 CB LYS A 43 20.273 -16.124 14.384 1.00 0.00 C ATOM 669 CG LYS A 43 20.314 -17.197 15.475 1.00 0.00 C ATOM 670 CD LYS A 43 21.042 -16.648 16.703 1.00 0.00 C ATOM 671 CE LYS A 43 21.713 -17.800 17.456 1.00 0.00 C ATOM 672 NZ LYS A 43 20.626 -18.413 18.269 1.00 0.00 N ATOM 0 H LYS A 43 20.042 -14.771 12.378 1.00 0.00 H new ATOM 0 HA LYS A 43 21.154 -17.477 12.910 1.00 0.00 H new ATOM 0 HB2 LYS A 43 21.120 -15.446 14.493 1.00 0.00 H new ATOM 0 HB3 LYS A 43 19.369 -15.523 14.483 1.00 0.00 H new ATOM 0 HG2 LYS A 43 19.301 -17.497 15.743 1.00 0.00 H new ATOM 0 HG3 LYS A 43 20.823 -18.087 15.105 1.00 0.00 H new ATOM 0 HD2 LYS A 43 21.789 -15.915 16.399 1.00 0.00 H new ATOM 0 HD3 LYS A 43 20.338 -16.133 17.357 1.00 0.00 H new ATOM 0 HE2 LYS A 43 22.146 -18.524 16.766 1.00 0.00 H new ATOM 0 HE3 LYS A 43 22.524 -17.439 18.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 21.009 -19.212 18.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 20.238 -17.702 18.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 19.872 -18.754 17.639 1.00 0.00 H new ATOM 686 N ARG A 44 17.939 -16.978 12.506 1.00 0.00 N ATOM 687 CA ARG A 44 16.671 -17.733 12.284 1.00 0.00 C ATOM 688 C ARG A 44 16.570 -18.199 10.826 1.00 0.00 C ATOM 689 O ARG A 44 16.512 -19.382 10.560 1.00 0.00 O ATOM 690 CB ARG A 44 15.557 -16.741 12.615 1.00 0.00 C ATOM 691 CG ARG A 44 15.329 -16.720 14.129 1.00 0.00 C ATOM 692 CD ARG A 44 13.833 -16.857 14.421 1.00 0.00 C ATOM 693 NE ARG A 44 13.434 -18.141 13.779 1.00 0.00 N ATOM 694 CZ ARG A 44 13.779 -19.279 14.319 1.00 0.00 C ATOM 695 NH1 ARG A 44 14.474 -19.298 15.425 1.00 0.00 N ATOM 696 NH2 ARG A 44 13.430 -20.402 13.751 1.00 0.00 N ATOM 0 H ARG A 44 17.862 -15.964 12.423 1.00 0.00 H new ATOM 0 HA ARG A 44 16.613 -18.630 12.900 1.00 0.00 H new ATOM 0 HB2 ARG A 44 15.825 -15.745 12.263 1.00 0.00 H new ATOM 0 HB3 ARG A 44 14.638 -17.024 12.102 1.00 0.00 H new ATOM 0 HG2 ARG A 44 15.879 -17.534 14.602 1.00 0.00 H new ATOM 0 HG3 ARG A 44 15.709 -15.790 14.552 1.00 0.00 H new ATOM 0 HD2 ARG A 44 13.640 -16.875 15.494 1.00 0.00 H new ATOM 0 HD3 ARG A 44 13.272 -16.018 14.010 1.00 0.00 H new ATOM 0 HE ARG A 44 12.890 -18.131 12.916 1.00 0.00 H new ATOM 0 HH11 ARG A 44 14.749 -18.422 15.870 1.00 0.00 H new ATOM 0 HH12 ARG A 44 14.742 -20.189 15.844 1.00 0.00 H new ATOM 0 HH21 ARG A 44 12.889 -20.390 12.887 1.00 0.00 H new ATOM 0 HH22 ARG A 44 13.699 -21.291 14.172 1.00 0.00 H new ATOM 710 N MET A 45 16.542 -17.276 9.891 1.00 0.00 N ATOM 711 CA MET A 45 16.442 -17.644 8.443 1.00 0.00 C ATOM 712 C MET A 45 17.052 -19.022 8.168 1.00 0.00 C ATOM 713 O MET A 45 18.257 -19.169 8.111 1.00 0.00 O ATOM 714 CB MET A 45 17.246 -16.566 7.717 1.00 0.00 C ATOM 715 CG MET A 45 16.517 -16.169 6.437 1.00 0.00 C ATOM 716 SD MET A 45 17.085 -14.540 5.898 1.00 0.00 S ATOM 717 CE MET A 45 16.178 -13.570 7.126 1.00 0.00 C ATOM 0 H MET A 45 16.585 -16.273 10.073 1.00 0.00 H new ATOM 0 HA MET A 45 15.404 -17.698 8.116 1.00 0.00 H new ATOM 0 HB2 MET A 45 17.374 -15.696 8.361 1.00 0.00 H new ATOM 0 HB3 MET A 45 18.243 -16.937 7.481 1.00 0.00 H new ATOM 0 HG2 MET A 45 16.703 -16.907 5.657 1.00 0.00 H new ATOM 0 HG3 MET A 45 15.441 -16.152 6.610 1.00 0.00 H new ATOM 0 HE1 MET A 45 15.412 -12.976 6.627 1.00 0.00 H new ATOM 0 HE2 MET A 45 15.707 -14.241 7.844 1.00 0.00 H new ATOM 0 HE3 MET A 45 16.868 -12.907 7.648 1.00 0.00 H new ATOM 727 N PRO A 46 16.189 -19.987 8.000 1.00 0.00 N ATOM 728 CA PRO A 46 16.685 -21.360 7.721 1.00 0.00 C ATOM 729 C PRO A 46 17.570 -21.354 6.472 1.00 0.00 C ATOM 730 O PRO A 46 18.070 -20.326 6.061 1.00 0.00 O ATOM 731 CB PRO A 46 15.419 -22.188 7.485 1.00 0.00 C ATOM 732 CG PRO A 46 14.321 -21.196 7.284 1.00 0.00 C ATOM 733 CD PRO A 46 14.724 -19.940 8.002 1.00 0.00 C ATOM 0 HA PRO A 46 17.290 -21.762 8.534 1.00 0.00 H new ATOM 0 HB2 PRO A 46 15.529 -22.832 6.613 1.00 0.00 H new ATOM 0 HB3 PRO A 46 15.210 -22.836 8.336 1.00 0.00 H new ATOM 0 HG2 PRO A 46 14.168 -21.001 6.223 1.00 0.00 H new ATOM 0 HG3 PRO A 46 13.379 -21.579 7.677 1.00 0.00 H new ATOM 0 HD2 PRO A 46 14.352 -19.051 7.492 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.327 -19.915 9.017 1.00 0.00 H new ATOM 741 N ALA A 47 17.770 -22.492 5.864 1.00 0.00 N ATOM 742 CA ALA A 47 18.626 -22.542 4.643 1.00 0.00 C ATOM 743 C ALA A 47 17.757 -22.533 3.382 1.00 0.00 C ATOM 744 O ALA A 47 17.931 -23.341 2.491 1.00 0.00 O ATOM 745 CB ALA A 47 19.393 -23.861 4.751 1.00 0.00 C ATOM 0 H ALA A 47 17.379 -23.387 6.158 1.00 0.00 H new ATOM 0 HA ALA A 47 19.294 -21.683 4.575 1.00 0.00 H new ATOM 0 HB1 ALA A 47 20.048 -23.973 3.887 1.00 0.00 H new ATOM 0 HB2 ALA A 47 19.992 -23.860 5.662 1.00 0.00 H new ATOM 0 HB3 ALA A 47 18.687 -24.691 4.781 1.00 0.00 H new ATOM 751 N TYR A 48 16.827 -21.621 3.297 1.00 0.00 N ATOM 752 CA TYR A 48 15.950 -21.560 2.090 1.00 0.00 C ATOM 753 C TYR A 48 15.377 -22.945 1.777 1.00 0.00 C ATOM 754 O TYR A 48 15.681 -23.919 2.439 1.00 0.00 O ATOM 755 CB TYR A 48 16.868 -21.090 0.961 1.00 0.00 C ATOM 756 CG TYR A 48 16.039 -20.754 -0.256 1.00 0.00 C ATOM 757 CD1 TYR A 48 14.993 -19.831 -0.159 1.00 0.00 C ATOM 758 CD2 TYR A 48 16.320 -21.366 -1.481 1.00 0.00 C ATOM 759 CE1 TYR A 48 14.224 -19.521 -1.288 1.00 0.00 C ATOM 760 CE2 TYR A 48 15.555 -21.057 -2.610 1.00 0.00 C ATOM 761 CZ TYR A 48 14.506 -20.135 -2.515 1.00 0.00 C ATOM 762 OH TYR A 48 13.749 -19.831 -3.629 1.00 0.00 O ATOM 0 H TYR A 48 16.636 -20.916 4.009 1.00 0.00 H new ATOM 0 HA TYR A 48 15.100 -20.893 2.231 1.00 0.00 H new ATOM 0 HB2 TYR A 48 17.436 -20.216 1.280 1.00 0.00 H new ATOM 0 HB3 TYR A 48 17.591 -21.869 0.718 1.00 0.00 H new ATOM 0 HD1 TYR A 48 14.778 -19.357 0.787 1.00 0.00 H new ATOM 0 HD2 TYR A 48 17.129 -22.078 -1.556 1.00 0.00 H new ATOM 0 HE1 TYR A 48 13.415 -18.810 -1.213 1.00 0.00 H new ATOM 0 HE2 TYR A 48 15.774 -21.530 -3.556 1.00 0.00 H new ATOM 0 HH TYR A 48 14.077 -20.343 -4.397 1.00 0.00 H new ATOM 772 N SER A 49 14.549 -23.042 0.773 1.00 0.00 N ATOM 773 CA SER A 49 13.957 -24.364 0.419 1.00 0.00 C ATOM 774 C SER A 49 14.155 -24.648 -1.073 1.00 0.00 C ATOM 775 O SER A 49 14.702 -23.843 -1.800 1.00 0.00 O ATOM 776 CB SER A 49 12.471 -24.237 0.747 1.00 0.00 C ATOM 777 OG SER A 49 12.271 -23.117 1.602 1.00 0.00 O ATOM 0 H SER A 49 14.257 -22.263 0.182 1.00 0.00 H new ATOM 0 HA SER A 49 14.424 -25.184 0.965 1.00 0.00 H new ATOM 0 HB2 SER A 49 11.894 -24.117 -0.170 1.00 0.00 H new ATOM 0 HB3 SER A 49 12.115 -25.146 1.231 1.00 0.00 H new ATOM 0 HG SER A 49 11.318 -23.032 1.813 1.00 0.00 H new ATOM 783 N GLY A 50 13.716 -25.788 -1.534 1.00 0.00 N ATOM 784 CA GLY A 50 13.881 -26.121 -2.977 1.00 0.00 C ATOM 785 C GLY A 50 14.876 -27.274 -3.125 1.00 0.00 C ATOM 786 O GLY A 50 15.261 -27.890 -2.152 1.00 0.00 O ATOM 0 H GLY A 50 13.251 -26.502 -0.974 1.00 0.00 H new ATOM 0 HA2 GLY A 50 12.920 -26.399 -3.409 1.00 0.00 H new ATOM 0 HA3 GLY A 50 14.236 -25.248 -3.524 1.00 0.00 H new ATOM 790 N PRO A 51 15.261 -27.526 -4.348 1.00 0.00 N ATOM 791 CA PRO A 51 16.230 -28.631 -4.586 1.00 0.00 C ATOM 792 C PRO A 51 17.626 -28.223 -4.111 1.00 0.00 C ATOM 793 O PRO A 51 18.016 -28.496 -2.993 1.00 0.00 O ATOM 794 CB PRO A 51 16.216 -28.833 -6.102 1.00 0.00 C ATOM 795 CG PRO A 51 15.615 -27.588 -6.665 1.00 0.00 C ATOM 796 CD PRO A 51 14.710 -27.017 -5.609 1.00 0.00 C ATOM 0 HA PRO A 51 15.968 -29.541 -4.046 1.00 0.00 H new ATOM 0 HB2 PRO A 51 17.224 -28.991 -6.486 1.00 0.00 H new ATOM 0 HB3 PRO A 51 15.630 -29.710 -6.376 1.00 0.00 H new ATOM 0 HG2 PRO A 51 16.392 -26.873 -6.934 1.00 0.00 H new ATOM 0 HG3 PRO A 51 15.055 -27.808 -7.574 1.00 0.00 H new ATOM 0 HD2 PRO A 51 14.709 -25.927 -5.632 1.00 0.00 H new ATOM 0 HD3 PRO A 51 13.679 -27.339 -5.752 1.00 0.00 H new ATOM 804 N GLY A 52 18.383 -27.571 -4.950 1.00 0.00 N ATOM 805 CA GLY A 52 19.753 -27.148 -4.545 1.00 0.00 C ATOM 806 C GLY A 52 19.910 -25.643 -4.768 1.00 0.00 C ATOM 807 O GLY A 52 20.428 -25.206 -5.776 1.00 0.00 O ATOM 0 H GLY A 52 18.112 -27.313 -5.899 1.00 0.00 H new ATOM 0 HA2 GLY A 52 19.925 -27.391 -3.496 1.00 0.00 H new ATOM 0 HA3 GLY A 52 20.499 -27.692 -5.124 1.00 0.00 H new ATOM 811 N SER A 53 19.456 -24.847 -3.837 1.00 0.00 N ATOM 812 CA SER A 53 19.563 -23.377 -3.984 1.00 0.00 C ATOM 813 C SER A 53 21.018 -22.961 -4.221 1.00 0.00 C ATOM 814 O SER A 53 21.834 -23.739 -4.673 1.00 0.00 O ATOM 815 CB SER A 53 19.055 -22.813 -2.659 1.00 0.00 C ATOM 816 OG SER A 53 18.246 -23.787 -2.013 1.00 0.00 O ATOM 0 H SER A 53 19.012 -25.161 -2.974 1.00 0.00 H new ATOM 0 HA SER A 53 18.991 -23.008 -4.836 1.00 0.00 H new ATOM 0 HB2 SER A 53 19.895 -22.540 -2.021 1.00 0.00 H new ATOM 0 HB3 SER A 53 18.480 -21.904 -2.834 1.00 0.00 H new ATOM 0 HG SER A 53 17.349 -23.781 -2.408 1.00 0.00 H new ATOM 822 N VAL A 54 21.348 -21.737 -3.915 1.00 0.00 N ATOM 823 CA VAL A 54 22.749 -21.267 -4.121 1.00 0.00 C ATOM 824 C VAL A 54 23.658 -21.810 -3.015 1.00 0.00 C ATOM 825 O VAL A 54 23.328 -22.777 -2.357 1.00 0.00 O ATOM 826 CB VAL A 54 22.671 -19.743 -4.048 1.00 0.00 C ATOM 827 CG1 VAL A 54 21.621 -19.238 -5.039 1.00 0.00 C ATOM 828 CG2 VAL A 54 22.279 -19.320 -2.632 1.00 0.00 C ATOM 0 H VAL A 54 20.709 -21.041 -3.531 1.00 0.00 H new ATOM 0 HA VAL A 54 23.163 -21.609 -5.069 1.00 0.00 H new ATOM 0 HB VAL A 54 23.643 -19.317 -4.299 1.00 0.00 H new ATOM 0 HG11 VAL A 54 21.565 -18.151 -4.987 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.899 -19.539 -6.049 1.00 0.00 H new ATOM 0 HG13 VAL A 54 20.649 -19.664 -4.788 1.00 0.00 H new ATOM 0 HG21 VAL A 54 22.223 -18.233 -2.579 1.00 0.00 H new ATOM 0 HG22 VAL A 54 21.308 -19.746 -2.381 1.00 0.00 H new ATOM 0 HG23 VAL A 54 23.026 -19.680 -1.925 1.00 0.00 H new ATOM 838 N PRO A 55 24.781 -21.164 -2.848 1.00 0.00 N ATOM 839 CA PRO A 55 25.728 -21.623 -1.797 1.00 0.00 C ATOM 840 C PRO A 55 25.584 -20.764 -0.536 1.00 0.00 C ATOM 841 O PRO A 55 26.550 -20.236 -0.021 1.00 0.00 O ATOM 842 CB PRO A 55 27.114 -21.437 -2.419 1.00 0.00 C ATOM 843 CG PRO A 55 26.875 -21.305 -3.886 1.00 0.00 C ATOM 844 CD PRO A 55 25.498 -20.728 -4.053 1.00 0.00 C ATOM 0 HA PRO A 55 25.546 -22.654 -1.495 1.00 0.00 H new ATOM 0 HB2 PRO A 55 27.608 -20.551 -2.020 1.00 0.00 H new ATOM 0 HB3 PRO A 55 27.760 -22.288 -2.201 1.00 0.00 H new ATOM 0 HG2 PRO A 55 27.623 -20.657 -4.342 1.00 0.00 H new ATOM 0 HG3 PRO A 55 26.950 -22.275 -4.378 1.00 0.00 H new ATOM 0 HD2 PRO A 55 25.527 -19.641 -4.129 1.00 0.00 H new ATOM 0 HD3 PRO A 55 25.018 -21.098 -4.959 1.00 0.00 H new ATOM 852 N GLY A 56 24.387 -20.622 -0.033 1.00 0.00 N ATOM 853 CA GLY A 56 24.191 -19.800 1.195 1.00 0.00 C ATOM 854 C GLY A 56 22.893 -18.995 1.083 1.00 0.00 C ATOM 855 O GLY A 56 22.862 -17.812 1.363 1.00 0.00 O ATOM 0 H GLY A 56 23.539 -21.038 -0.418 1.00 0.00 H new ATOM 0 HA2 GLY A 56 24.154 -20.445 2.073 1.00 0.00 H new ATOM 0 HA3 GLY A 56 25.037 -19.126 1.330 1.00 0.00 H new ATOM 859 N ALA A 57 21.821 -19.622 0.682 1.00 0.00 N ATOM 860 CA ALA A 57 20.527 -18.885 0.562 1.00 0.00 C ATOM 861 C ALA A 57 19.650 -19.163 1.785 1.00 0.00 C ATOM 862 O ALA A 57 19.358 -20.297 2.107 1.00 0.00 O ATOM 863 CB ALA A 57 19.868 -19.434 -0.706 1.00 0.00 C ATOM 0 H ALA A 57 21.783 -20.610 0.432 1.00 0.00 H new ATOM 0 HA ALA A 57 20.670 -17.806 0.509 1.00 0.00 H new ATOM 0 HB1 ALA A 57 18.909 -18.939 -0.861 1.00 0.00 H new ATOM 0 HB2 ALA A 57 20.516 -19.248 -1.563 1.00 0.00 H new ATOM 0 HB3 ALA A 57 19.709 -20.507 -0.598 1.00 0.00 H new ATOM 869 N LEU A 58 19.229 -18.135 2.470 1.00 0.00 N ATOM 870 CA LEU A 58 18.374 -18.339 3.674 1.00 0.00 C ATOM 871 C LEU A 58 16.949 -17.852 3.397 1.00 0.00 C ATOM 872 O LEU A 58 16.729 -16.995 2.564 1.00 0.00 O ATOM 873 CB LEU A 58 19.021 -17.489 4.772 1.00 0.00 C ATOM 874 CG LEU A 58 20.486 -17.901 4.968 1.00 0.00 C ATOM 875 CD1 LEU A 58 20.611 -19.427 4.943 1.00 0.00 C ATOM 876 CD2 LEU A 58 21.341 -17.302 3.849 1.00 0.00 C ATOM 0 H LEU A 58 19.440 -17.162 2.248 1.00 0.00 H new ATOM 0 HA LEU A 58 18.306 -19.389 3.957 1.00 0.00 H new ATOM 0 HB2 LEU A 58 18.965 -16.434 4.505 1.00 0.00 H new ATOM 0 HB3 LEU A 58 18.473 -17.611 5.706 1.00 0.00 H new ATOM 0 HG LEU A 58 20.833 -17.530 5.933 1.00 0.00 H new ATOM 0 HD11 LEU A 58 21.655 -19.709 5.083 1.00 0.00 H new ATOM 0 HD12 LEU A 58 20.009 -19.855 5.745 1.00 0.00 H new ATOM 0 HD13 LEU A 58 20.259 -19.805 3.983 1.00 0.00 H new ATOM 0 HD21 LEU A 58 22.381 -17.595 3.989 1.00 0.00 H new ATOM 0 HD22 LEU A 58 20.988 -17.668 2.885 1.00 0.00 H new ATOM 0 HD23 LEU A 58 21.264 -16.215 3.874 1.00 0.00 H new ATOM 888 N ASP A 59 15.979 -18.386 4.090 1.00 0.00 N ATOM 889 CA ASP A 59 14.574 -17.942 3.859 1.00 0.00 C ATOM 890 C ASP A 59 14.095 -17.066 5.019 1.00 0.00 C ATOM 891 O ASP A 59 13.884 -17.538 6.119 1.00 0.00 O ATOM 892 CB ASP A 59 13.749 -19.228 3.801 1.00 0.00 C ATOM 893 CG ASP A 59 13.110 -19.367 2.418 1.00 0.00 C ATOM 894 OD1 ASP A 59 13.006 -18.364 1.732 1.00 0.00 O ATOM 895 OD2 ASP A 59 12.737 -20.475 2.069 1.00 0.00 O ATOM 0 H ASP A 59 16.098 -19.106 4.802 1.00 0.00 H new ATOM 0 HA ASP A 59 14.481 -17.352 2.947 1.00 0.00 H new ATOM 0 HB2 ASP A 59 14.385 -20.089 4.007 1.00 0.00 H new ATOM 0 HB3 ASP A 59 12.976 -19.211 4.570 1.00 0.00 H new ATOM 900 N TYR A 60 13.907 -15.800 4.780 1.00 0.00 N ATOM 901 CA TYR A 60 13.425 -14.898 5.862 1.00 0.00 C ATOM 902 C TYR A 60 11.951 -15.190 6.139 1.00 0.00 C ATOM 903 O TYR A 60 11.418 -14.839 7.173 1.00 0.00 O ATOM 904 CB TYR A 60 13.594 -13.486 5.300 1.00 0.00 C ATOM 905 CG TYR A 60 12.926 -13.404 3.949 1.00 0.00 C ATOM 906 CD1 TYR A 60 11.530 -13.332 3.860 1.00 0.00 C ATOM 907 CD2 TYR A 60 13.701 -13.404 2.784 1.00 0.00 C ATOM 908 CE1 TYR A 60 10.911 -13.259 2.606 1.00 0.00 C ATOM 909 CE2 TYR A 60 13.082 -13.332 1.530 1.00 0.00 C ATOM 910 CZ TYR A 60 11.686 -13.259 1.441 1.00 0.00 C ATOM 911 OH TYR A 60 11.076 -13.187 0.205 1.00 0.00 O ATOM 0 H TYR A 60 14.067 -15.349 3.879 1.00 0.00 H new ATOM 0 HA TYR A 60 13.969 -15.028 6.798 1.00 0.00 H new ATOM 0 HB2 TYR A 60 13.155 -12.756 5.980 1.00 0.00 H new ATOM 0 HB3 TYR A 60 14.653 -13.242 5.211 1.00 0.00 H new ATOM 0 HD1 TYR A 60 10.931 -13.333 4.759 1.00 0.00 H new ATOM 0 HD2 TYR A 60 14.777 -13.460 2.852 1.00 0.00 H new ATOM 0 HE1 TYR A 60 9.835 -13.203 2.538 1.00 0.00 H new ATOM 0 HE2 TYR A 60 13.681 -13.333 0.631 1.00 0.00 H new ATOM 0 HH TYR A 60 11.753 -13.030 -0.485 1.00 0.00 H new ATOM 921 N ALA A 61 11.291 -15.842 5.219 1.00 0.00 N ATOM 922 CA ALA A 61 9.855 -16.168 5.428 1.00 0.00 C ATOM 923 C ALA A 61 9.704 -16.946 6.733 1.00 0.00 C ATOM 924 O ALA A 61 8.741 -16.786 7.457 1.00 0.00 O ATOM 925 CB ALA A 61 9.462 -17.035 4.232 1.00 0.00 C ATOM 0 H ALA A 61 11.685 -16.161 4.334 1.00 0.00 H new ATOM 0 HA ALA A 61 9.225 -15.281 5.499 1.00 0.00 H new ATOM 0 HB1 ALA A 61 8.412 -17.316 4.316 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.615 -16.474 3.310 1.00 0.00 H new ATOM 0 HB3 ALA A 61 10.078 -17.934 4.216 1.00 0.00 H new ATOM 931 N ALA A 62 10.660 -17.776 7.048 1.00 0.00 N ATOM 932 CA ALA A 62 10.579 -18.550 8.317 1.00 0.00 C ATOM 933 C ALA A 62 10.524 -17.579 9.494 1.00 0.00 C ATOM 934 O ALA A 62 9.901 -17.835 10.505 1.00 0.00 O ATOM 935 CB ALA A 62 11.860 -19.383 8.361 1.00 0.00 C ATOM 0 H ALA A 62 11.491 -17.951 6.483 1.00 0.00 H new ATOM 0 HA ALA A 62 9.693 -19.182 8.372 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.873 -19.983 9.271 1.00 0.00 H new ATOM 0 HB2 ALA A 62 11.896 -20.041 7.493 1.00 0.00 H new ATOM 0 HB3 ALA A 62 12.725 -18.720 8.351 1.00 0.00 H new ATOM 941 N PHE A 63 11.174 -16.463 9.355 1.00 0.00 N ATOM 942 CA PHE A 63 11.178 -15.445 10.446 1.00 0.00 C ATOM 943 C PHE A 63 9.759 -14.925 10.689 1.00 0.00 C ATOM 944 O PHE A 63 9.294 -14.861 11.810 1.00 0.00 O ATOM 945 CB PHE A 63 12.078 -14.321 9.927 1.00 0.00 C ATOM 946 CG PHE A 63 12.812 -13.687 11.083 1.00 0.00 C ATOM 947 CD1 PHE A 63 13.783 -14.415 11.775 1.00 0.00 C ATOM 948 CD2 PHE A 63 12.523 -12.370 11.462 1.00 0.00 C ATOM 949 CE1 PHE A 63 14.468 -13.831 12.847 1.00 0.00 C ATOM 950 CE2 PHE A 63 13.207 -11.784 12.534 1.00 0.00 C ATOM 951 CZ PHE A 63 14.180 -12.516 13.227 1.00 0.00 C ATOM 0 H PHE A 63 11.709 -16.206 8.526 1.00 0.00 H new ATOM 0 HA PHE A 63 11.533 -15.852 11.393 1.00 0.00 H new ATOM 0 HB2 PHE A 63 12.791 -14.717 9.203 1.00 0.00 H new ATOM 0 HB3 PHE A 63 11.480 -13.572 9.408 1.00 0.00 H new ATOM 0 HD1 PHE A 63 14.006 -15.430 11.482 1.00 0.00 H new ATOM 0 HD2 PHE A 63 11.773 -11.807 10.927 1.00 0.00 H new ATOM 0 HE1 PHE A 63 15.218 -14.395 13.380 1.00 0.00 H new ATOM 0 HE2 PHE A 63 12.985 -10.768 12.826 1.00 0.00 H new ATOM 0 HZ PHE A 63 14.708 -12.065 14.054 1.00 0.00 H new ATOM 961 N SER A 64 9.068 -14.550 9.648 1.00 0.00 N ATOM 962 CA SER A 64 7.680 -14.031 9.819 1.00 0.00 C ATOM 963 C SER A 64 6.767 -15.124 10.380 1.00 0.00 C ATOM 964 O SER A 64 5.998 -14.896 11.292 1.00 0.00 O ATOM 965 CB SER A 64 7.233 -13.628 8.414 1.00 0.00 C ATOM 966 OG SER A 64 7.405 -14.730 7.533 1.00 0.00 O ATOM 0 H SER A 64 9.404 -14.580 8.685 1.00 0.00 H new ATOM 0 HA SER A 64 7.636 -13.195 10.518 1.00 0.00 H new ATOM 0 HB2 SER A 64 6.188 -13.318 8.427 1.00 0.00 H new ATOM 0 HB3 SER A 64 7.815 -12.775 8.065 1.00 0.00 H new ATOM 0 HG SER A 64 8.154 -15.282 7.842 1.00 0.00 H new ATOM 972 N SER A 65 6.845 -16.310 9.841 1.00 0.00 N ATOM 973 CA SER A 65 5.979 -17.416 10.343 1.00 0.00 C ATOM 974 C SER A 65 6.379 -17.797 11.770 1.00 0.00 C ATOM 975 O SER A 65 5.541 -18.076 12.605 1.00 0.00 O ATOM 976 CB SER A 65 6.233 -18.581 9.386 1.00 0.00 C ATOM 977 OG SER A 65 5.875 -18.194 8.067 1.00 0.00 O ATOM 0 H SER A 65 7.470 -16.561 9.075 1.00 0.00 H new ATOM 0 HA SER A 65 4.926 -17.135 10.374 1.00 0.00 H new ATOM 0 HB2 SER A 65 7.283 -18.871 9.419 1.00 0.00 H new ATOM 0 HB3 SER A 65 5.652 -19.451 9.692 1.00 0.00 H new ATOM 0 HG SER A 65 6.619 -17.706 7.656 1.00 0.00 H new ATOM 983 N ALA A 66 7.651 -17.813 12.057 1.00 0.00 N ATOM 984 CA ALA A 66 8.102 -18.180 13.431 1.00 0.00 C ATOM 985 C ALA A 66 7.733 -17.076 14.425 1.00 0.00 C ATOM 986 O ALA A 66 7.260 -17.340 15.512 1.00 0.00 O ATOM 987 CB ALA A 66 9.621 -18.321 13.326 1.00 0.00 C ATOM 0 H ALA A 66 8.399 -17.588 11.400 1.00 0.00 H new ATOM 0 HA ALA A 66 7.631 -19.096 13.787 1.00 0.00 H new ATOM 0 HB1 ALA A 66 10.030 -18.591 14.300 1.00 0.00 H new ATOM 0 HB2 ALA A 66 9.865 -19.098 12.602 1.00 0.00 H new ATOM 0 HB3 ALA A 66 10.053 -17.374 13.001 1.00 0.00 H new ATOM 993 N LEU A 67 7.948 -15.841 14.064 1.00 0.00 N ATOM 994 CA LEU A 67 7.611 -14.724 14.992 1.00 0.00 C ATOM 995 C LEU A 67 6.094 -14.529 15.062 1.00 0.00 C ATOM 996 O LEU A 67 5.529 -14.362 16.125 1.00 0.00 O ATOM 997 CB LEU A 67 8.284 -13.494 14.383 1.00 0.00 C ATOM 998 CG LEU A 67 9.779 -13.518 14.703 1.00 0.00 C ATOM 999 CD1 LEU A 67 10.528 -12.621 13.716 1.00 0.00 C ATOM 1000 CD2 LEU A 67 10.003 -13.003 16.127 1.00 0.00 C ATOM 0 H LEU A 67 8.342 -15.557 13.167 1.00 0.00 H new ATOM 0 HA LEU A 67 7.950 -14.915 16.010 1.00 0.00 H new ATOM 0 HB2 LEU A 67 8.133 -13.481 13.304 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.831 -12.585 14.779 1.00 0.00 H new ATOM 0 HG LEU A 67 10.151 -14.539 14.621 1.00 0.00 H new ATOM 0 HD11 LEU A 67 11.594 -12.639 13.945 1.00 0.00 H new ATOM 0 HD12 LEU A 67 10.369 -12.985 12.701 1.00 0.00 H new ATOM 0 HD13 LEU A 67 10.156 -11.600 13.798 1.00 0.00 H new ATOM 0 HD21 LEU A 67 11.068 -13.020 16.357 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.630 -11.982 16.207 1.00 0.00 H new ATOM 0 HD23 LEU A 67 9.470 -13.640 16.832 1.00 0.00 H new ATOM 1012 N TYR A 68 5.430 -14.546 13.938 1.00 0.00 N ATOM 1013 CA TYR A 68 3.951 -14.360 13.943 1.00 0.00 C ATOM 1014 C TYR A 68 3.245 -15.715 13.835 1.00 0.00 C ATOM 1015 O TYR A 68 2.068 -15.792 13.542 1.00 0.00 O ATOM 1016 CB TYR A 68 3.660 -13.503 12.713 1.00 0.00 C ATOM 1017 CG TYR A 68 3.923 -12.052 13.037 1.00 0.00 C ATOM 1018 CD1 TYR A 68 3.368 -11.481 14.190 1.00 0.00 C ATOM 1019 CD2 TYR A 68 4.721 -11.279 12.188 1.00 0.00 C ATOM 1020 CE1 TYR A 68 3.613 -10.137 14.492 1.00 0.00 C ATOM 1021 CE2 TYR A 68 4.966 -9.934 12.490 1.00 0.00 C ATOM 1022 CZ TYR A 68 4.411 -9.362 13.642 1.00 0.00 C ATOM 1023 OH TYR A 68 4.654 -8.038 13.940 1.00 0.00 O ATOM 0 H TYR A 68 5.848 -14.681 13.017 1.00 0.00 H new ATOM 0 HA TYR A 68 3.595 -13.892 14.861 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.287 -13.820 11.879 1.00 0.00 H new ATOM 0 HB3 TYR A 68 2.624 -13.635 12.401 1.00 0.00 H new ATOM 0 HD1 TYR A 68 2.751 -12.078 14.845 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.148 -11.719 11.299 1.00 0.00 H new ATOM 0 HE1 TYR A 68 3.186 -9.697 15.381 1.00 0.00 H new ATOM 0 HE2 TYR A 68 5.583 -9.337 11.835 1.00 0.00 H new ATOM 0 HH TYR A 68 5.227 -7.647 13.248 1.00 0.00 H new ATOM 1033 N GLY A 69 3.956 -16.785 14.066 1.00 0.00 N ATOM 1034 CA GLY A 69 3.327 -18.133 13.973 1.00 0.00 C ATOM 1035 C GLY A 69 1.984 -18.127 14.707 1.00 0.00 C ATOM 1036 O GLY A 69 1.926 -18.013 15.915 1.00 0.00 O ATOM 0 H GLY A 69 4.945 -16.784 14.315 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.180 -18.405 12.928 1.00 0.00 H new ATOM 0 HA3 GLY A 69 3.987 -18.884 14.408 1.00 0.00 H new ATOM 1040 N GLU A 70 0.904 -18.253 13.985 1.00 0.00 N ATOM 1041 CA GLU A 70 -0.435 -18.257 14.639 1.00 0.00 C ATOM 1042 C GLU A 70 -1.152 -19.583 14.367 1.00 0.00 C ATOM 1043 O GLU A 70 -2.106 -19.933 15.034 1.00 0.00 O ATOM 1044 CB GLU A 70 -1.193 -17.096 13.996 1.00 0.00 C ATOM 1045 CG GLU A 70 -1.497 -17.430 12.535 1.00 0.00 C ATOM 1046 CD GLU A 70 -1.624 -16.137 11.730 1.00 0.00 C ATOM 1047 OE1 GLU A 70 -2.443 -15.311 12.098 1.00 0.00 O ATOM 1048 OE2 GLU A 70 -0.899 -15.993 10.760 1.00 0.00 O ATOM 0 H GLU A 70 0.891 -18.353 12.970 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.367 -18.149 15.721 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -2.120 -16.909 14.538 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -0.600 -16.184 14.055 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -0.703 -18.052 12.121 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -2.421 -18.005 12.467 1.00 0.00 H new ATOM 1055 N SER A 71 -0.700 -20.323 13.391 1.00 0.00 N ATOM 1056 CA SER A 71 -1.355 -21.626 13.077 1.00 0.00 C ATOM 1057 C SER A 71 -0.665 -22.291 11.882 1.00 0.00 C ATOM 1058 O SER A 71 -0.808 -21.865 10.753 1.00 0.00 O ATOM 1059 CB SER A 71 -2.800 -21.271 12.731 1.00 0.00 C ATOM 1060 OG SER A 71 -3.679 -22.081 13.501 1.00 0.00 O ATOM 0 H SER A 71 0.094 -20.082 12.798 1.00 0.00 H new ATOM 0 HA SER A 71 -1.296 -22.328 13.909 1.00 0.00 H new ATOM 0 HB2 SER A 71 -2.986 -20.217 12.934 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.981 -21.427 11.667 1.00 0.00 H new ATOM 0 HG SER A 71 -4.607 -21.855 13.283 1.00 0.00 H new ATOM 1066 N ASP A 72 0.082 -23.335 12.121 1.00 0.00 N ATOM 1067 CA ASP A 72 0.779 -24.026 10.998 1.00 0.00 C ATOM 1068 C ASP A 72 -0.225 -24.826 10.163 1.00 0.00 C ATOM 1069 O ASP A 72 -1.090 -25.495 10.691 1.00 0.00 O ATOM 1070 CB ASP A 72 1.783 -24.962 11.672 1.00 0.00 C ATOM 1071 CG ASP A 72 3.205 -24.478 11.385 1.00 0.00 C ATOM 1072 OD1 ASP A 72 3.487 -24.179 10.236 1.00 0.00 O ATOM 1073 OD2 ASP A 72 3.988 -24.415 12.318 1.00 0.00 O ATOM 0 H ASP A 72 0.240 -23.739 13.044 1.00 0.00 H new ATOM 0 HA ASP A 72 1.266 -23.325 10.321 1.00 0.00 H new ATOM 0 HB2 ASP A 72 1.607 -24.988 12.747 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.652 -25.979 11.303 1.00 0.00 H new ATOM 1078 N LEU A 73 -0.114 -24.763 8.865 1.00 0.00 N ATOM 1079 CA LEU A 73 -1.061 -25.520 7.997 1.00 0.00 C ATOM 1080 C LEU A 73 -0.582 -25.494 6.543 1.00 0.00 C ATOM 1081 O LEU A 73 0.547 -25.151 6.258 1.00 0.00 O ATOM 1082 CB LEU A 73 -2.397 -24.789 8.134 1.00 0.00 C ATOM 1083 CG LEU A 73 -3.534 -25.721 7.710 1.00 0.00 C ATOM 1084 CD1 LEU A 73 -4.513 -25.894 8.872 1.00 0.00 C ATOM 1085 CD2 LEU A 73 -4.266 -25.116 6.511 1.00 0.00 C ATOM 0 H LEU A 73 0.592 -24.220 8.367 1.00 0.00 H new ATOM 0 HA LEU A 73 -1.139 -26.568 8.287 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -2.543 -24.466 9.165 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -2.398 -23.892 7.515 1.00 0.00 H new ATOM 0 HG LEU A 73 -3.125 -26.693 7.434 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -5.323 -26.558 8.570 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -3.991 -26.324 9.727 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -4.924 -24.923 9.149 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -5.076 -25.779 6.207 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -4.676 -24.144 6.787 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -3.568 -24.993 5.683 1.00 0.00 H new TER 1097 LEU A 73 ATOM 1098 N GLY B 7 14.954 3.353 -3.640 1.00 0.00 N ATOM 1099 CA GLY B 7 13.490 3.628 -3.613 1.00 0.00 C ATOM 1100 C GLY B 7 12.995 3.620 -2.165 1.00 0.00 C ATOM 1101 O GLY B 7 13.173 4.574 -1.433 1.00 0.00 O ATOM 0 HA2 GLY B 7 13.282 4.594 -4.074 1.00 0.00 H new ATOM 0 HA3 GLY B 7 12.957 2.876 -4.195 1.00 0.00 H new ATOM 1105 N LYS B 8 12.373 2.552 -1.745 1.00 0.00 N ATOM 1106 CA LYS B 8 11.867 2.486 -0.344 1.00 0.00 C ATOM 1107 C LYS B 8 12.621 1.409 0.441 1.00 0.00 C ATOM 1108 O LYS B 8 12.056 0.725 1.273 1.00 0.00 O ATOM 1109 CB LYS B 8 10.389 2.119 -0.474 1.00 0.00 C ATOM 1110 CG LYS B 8 10.262 0.658 -0.911 1.00 0.00 C ATOM 1111 CD LYS B 8 8.828 0.384 -1.366 1.00 0.00 C ATOM 1112 CE LYS B 8 7.970 0.010 -0.153 1.00 0.00 C ATOM 1113 NZ LYS B 8 6.802 -0.719 -0.722 1.00 0.00 N ATOM 0 H LYS B 8 12.193 1.723 -2.311 1.00 0.00 H new ATOM 0 HA LYS B 8 12.008 3.425 0.191 1.00 0.00 H new ATOM 0 HB2 LYS B 8 9.881 2.270 0.478 1.00 0.00 H new ATOM 0 HB3 LYS B 8 9.904 2.771 -1.201 1.00 0.00 H new ATOM 0 HG2 LYS B 8 10.959 0.448 -1.723 1.00 0.00 H new ATOM 0 HG3 LYS B 8 10.526 -0.004 -0.086 1.00 0.00 H new ATOM 0 HD2 LYS B 8 8.417 1.265 -1.858 1.00 0.00 H new ATOM 0 HD3 LYS B 8 8.815 -0.424 -2.097 1.00 0.00 H new ATOM 0 HE2 LYS B 8 8.525 -0.616 0.546 1.00 0.00 H new ATOM 0 HE3 LYS B 8 7.653 0.897 0.396 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 6.166 -1.009 0.048 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 6.290 -0.096 -1.378 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 7.134 -1.562 -1.233 1.00 0.00 H new ATOM 1127 N LYS B 9 13.890 1.249 0.184 1.00 0.00 N ATOM 1128 CA LYS B 9 14.675 0.214 0.915 1.00 0.00 C ATOM 1129 C LYS B 9 14.757 0.565 2.404 1.00 0.00 C ATOM 1130 O LYS B 9 14.557 -0.274 3.260 1.00 0.00 O ATOM 1131 CB LYS B 9 16.066 0.246 0.278 1.00 0.00 C ATOM 1132 CG LYS B 9 16.635 -1.173 0.227 1.00 0.00 C ATOM 1133 CD LYS B 9 18.160 -1.108 0.116 1.00 0.00 C ATOM 1134 CE LYS B 9 18.772 -1.042 1.518 1.00 0.00 C ATOM 1135 NZ LYS B 9 20.243 -1.066 1.294 1.00 0.00 N ATOM 0 H LYS B 9 14.418 1.790 -0.501 1.00 0.00 H new ATOM 0 HA LYS B 9 14.219 -0.774 0.847 1.00 0.00 H new ATOM 0 HB2 LYS B 9 16.008 0.663 -0.728 1.00 0.00 H new ATOM 0 HB3 LYS B 9 16.727 0.894 0.854 1.00 0.00 H new ATOM 0 HG2 LYS B 9 16.348 -1.724 1.123 1.00 0.00 H new ATOM 0 HG3 LYS B 9 16.220 -1.712 -0.625 1.00 0.00 H new ATOM 0 HD2 LYS B 9 18.534 -1.983 -0.415 1.00 0.00 H new ATOM 0 HD3 LYS B 9 18.456 -0.233 -0.463 1.00 0.00 H new ATOM 0 HE2 LYS B 9 18.466 -0.135 2.040 1.00 0.00 H new ATOM 0 HE3 LYS B 9 18.451 -1.886 2.129 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 20.716 -0.512 2.036 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 20.583 -2.048 1.325 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 20.459 -0.654 0.364 1.00 0.00 H new ATOM 1149 N ALA B 10 15.047 1.797 2.718 1.00 0.00 N ATOM 1150 CA ALA B 10 15.138 2.200 4.151 1.00 0.00 C ATOM 1151 C ALA B 10 13.837 1.852 4.879 1.00 0.00 C ATOM 1152 O ALA B 10 13.848 1.368 5.995 1.00 0.00 O ATOM 1153 CB ALA B 10 15.349 3.714 4.124 1.00 0.00 C ATOM 0 H ALA B 10 15.225 2.543 2.045 1.00 0.00 H new ATOM 0 HA ALA B 10 15.944 1.686 4.675 1.00 0.00 H new ATOM 0 HB1 ALA B 10 15.426 4.089 5.145 1.00 0.00 H new ATOM 0 HB2 ALA B 10 16.267 3.944 3.583 1.00 0.00 H new ATOM 0 HB3 ALA B 10 14.505 4.190 3.625 1.00 0.00 H new ATOM 1159 N GLU B 11 12.716 2.092 4.257 1.00 0.00 N ATOM 1160 CA GLU B 11 11.416 1.772 4.913 1.00 0.00 C ATOM 1161 C GLU B 11 11.328 0.272 5.203 1.00 0.00 C ATOM 1162 O GLU B 11 10.870 -0.142 6.248 1.00 0.00 O ATOM 1163 CB GLU B 11 10.349 2.185 3.900 1.00 0.00 C ATOM 1164 CG GLU B 11 10.385 3.702 3.710 1.00 0.00 C ATOM 1165 CD GLU B 11 9.530 4.086 2.500 1.00 0.00 C ATOM 1166 OE1 GLU B 11 8.513 3.445 2.292 1.00 0.00 O ATOM 1167 OE2 GLU B 11 9.907 5.013 1.803 1.00 0.00 O ATOM 0 H GLU B 11 12.643 2.496 3.323 1.00 0.00 H new ATOM 0 HA GLU B 11 11.295 2.288 5.865 1.00 0.00 H new ATOM 0 HB2 GLU B 11 10.524 1.684 2.948 1.00 0.00 H new ATOM 0 HB3 GLU B 11 9.363 1.875 4.247 1.00 0.00 H new ATOM 0 HG2 GLU B 11 10.012 4.200 4.605 1.00 0.00 H new ATOM 0 HG3 GLU B 11 11.412 4.036 3.564 1.00 0.00 H new ATOM 1174 N ALA B 12 11.766 -0.545 4.283 1.00 0.00 N ATOM 1175 CA ALA B 12 11.708 -2.017 4.508 1.00 0.00 C ATOM 1176 C ALA B 12 12.587 -2.403 5.700 1.00 0.00 C ATOM 1177 O ALA B 12 12.256 -3.285 6.468 1.00 0.00 O ATOM 1178 CB ALA B 12 12.249 -2.636 3.217 1.00 0.00 C ATOM 0 H ALA B 12 12.160 -0.257 3.388 1.00 0.00 H new ATOM 0 HA ALA B 12 10.699 -2.363 4.733 1.00 0.00 H new ATOM 0 HB1 ALA B 12 12.239 -3.723 3.302 1.00 0.00 H new ATOM 0 HB2 ALA B 12 11.623 -2.332 2.378 1.00 0.00 H new ATOM 0 HB3 ALA B 12 13.271 -2.295 3.050 1.00 0.00 H new ATOM 1184 N VAL B 13 13.703 -1.747 5.863 1.00 0.00 N ATOM 1185 CA VAL B 13 14.600 -2.073 7.009 1.00 0.00 C ATOM 1186 C VAL B 13 13.916 -1.720 8.331 1.00 0.00 C ATOM 1187 O VAL B 13 13.933 -2.484 9.275 1.00 0.00 O ATOM 1188 CB VAL B 13 15.841 -1.205 6.802 1.00 0.00 C ATOM 1189 CG1 VAL B 13 16.862 -1.497 7.903 1.00 0.00 C ATOM 1190 CG2 VAL B 13 16.461 -1.521 5.438 1.00 0.00 C ATOM 0 H VAL B 13 14.033 -0.999 5.253 1.00 0.00 H new ATOM 0 HA VAL B 13 14.847 -3.134 7.050 1.00 0.00 H new ATOM 0 HB VAL B 13 15.557 -0.153 6.841 1.00 0.00 H new ATOM 0 HG11 VAL B 13 17.746 -0.877 7.753 1.00 0.00 H new ATOM 0 HG12 VAL B 13 16.423 -1.274 8.875 1.00 0.00 H new ATOM 0 HG13 VAL B 13 17.146 -2.549 7.866 1.00 0.00 H new ATOM 0 HG21 VAL B 13 17.346 -0.903 5.289 1.00 0.00 H new ATOM 0 HG22 VAL B 13 16.743 -2.573 5.401 1.00 0.00 H new ATOM 0 HG23 VAL B 13 15.736 -1.312 4.652 1.00 0.00 H new ATOM 1200 N ALA B 14 13.310 -0.567 8.404 1.00 0.00 N ATOM 1201 CA ALA B 14 12.623 -0.162 9.664 1.00 0.00 C ATOM 1202 C ALA B 14 11.554 -1.192 10.038 1.00 0.00 C ATOM 1203 O ALA B 14 11.378 -1.526 11.192 1.00 0.00 O ATOM 1204 CB ALA B 14 11.978 1.188 9.347 1.00 0.00 C ATOM 0 H ALA B 14 13.261 0.113 7.645 1.00 0.00 H new ATOM 0 HA ALA B 14 13.311 -0.098 10.507 1.00 0.00 H new ATOM 0 HB1 ALA B 14 11.451 1.555 10.228 1.00 0.00 H new ATOM 0 HB2 ALA B 14 12.750 1.903 9.063 1.00 0.00 H new ATOM 0 HB3 ALA B 14 11.273 1.070 8.525 1.00 0.00 H new ATOM 1210 N THR B 15 10.842 -1.699 9.069 1.00 0.00 N ATOM 1211 CA THR B 15 9.786 -2.709 9.370 1.00 0.00 C ATOM 1212 C THR B 15 10.426 -4.029 9.807 1.00 0.00 C ATOM 1213 O THR B 15 9.962 -4.683 10.719 1.00 0.00 O ATOM 1214 CB THR B 15 9.027 -2.890 8.055 1.00 0.00 C ATOM 1215 OG1 THR B 15 8.237 -1.735 7.804 1.00 0.00 O ATOM 1216 CG2 THR B 15 8.123 -4.119 8.150 1.00 0.00 C ATOM 0 H THR B 15 10.945 -1.459 8.083 1.00 0.00 H new ATOM 0 HA THR B 15 9.129 -2.392 10.180 1.00 0.00 H new ATOM 0 HB THR B 15 9.738 -3.029 7.240 1.00 0.00 H new ATOM 0 HG1 THR B 15 7.751 -1.848 6.961 1.00 0.00 H new ATOM 0 HG21 THR B 15 7.583 -4.247 7.212 1.00 0.00 H new ATOM 0 HG22 THR B 15 8.730 -5.003 8.342 1.00 0.00 H new ATOM 0 HG23 THR B 15 7.410 -3.984 8.964 1.00 0.00 H new ATOM 1224 N VAL B 16 11.490 -4.425 9.162 1.00 0.00 N ATOM 1225 CA VAL B 16 12.160 -5.702 9.540 1.00 0.00 C ATOM 1226 C VAL B 16 12.781 -5.582 10.934 1.00 0.00 C ATOM 1227 O VAL B 16 12.644 -6.461 11.763 1.00 0.00 O ATOM 1228 CB VAL B 16 13.247 -5.906 8.484 1.00 0.00 C ATOM 1229 CG1 VAL B 16 14.078 -7.140 8.838 1.00 0.00 C ATOM 1230 CG2 VAL B 16 12.595 -6.106 7.115 1.00 0.00 C ATOM 0 H VAL B 16 11.924 -3.919 8.390 1.00 0.00 H new ATOM 0 HA VAL B 16 11.463 -6.539 9.575 1.00 0.00 H new ATOM 0 HB VAL B 16 13.894 -5.029 8.455 1.00 0.00 H new ATOM 0 HG11 VAL B 16 14.853 -7.285 8.085 1.00 0.00 H new ATOM 0 HG12 VAL B 16 14.542 -6.998 9.814 1.00 0.00 H new ATOM 0 HG13 VAL B 16 13.432 -8.017 8.868 1.00 0.00 H new ATOM 0 HG21 VAL B 16 13.369 -6.252 6.361 1.00 0.00 H new ATOM 0 HG22 VAL B 16 11.948 -6.983 7.145 1.00 0.00 H new ATOM 0 HG23 VAL B 16 12.003 -5.226 6.862 1.00 0.00 H new ATOM 1240 N VAL B 17 13.462 -4.501 11.201 1.00 0.00 N ATOM 1241 CA VAL B 17 14.089 -4.328 12.544 1.00 0.00 C ATOM 1242 C VAL B 17 13.009 -4.286 13.627 1.00 0.00 C ATOM 1243 O VAL B 17 13.132 -4.903 14.666 1.00 0.00 O ATOM 1244 CB VAL B 17 14.826 -2.991 12.471 1.00 0.00 C ATOM 1245 CG1 VAL B 17 15.554 -2.737 13.793 1.00 0.00 C ATOM 1246 CG2 VAL B 17 15.842 -3.030 11.329 1.00 0.00 C ATOM 0 H VAL B 17 13.612 -3.731 10.549 1.00 0.00 H new ATOM 0 HA VAL B 17 14.761 -5.149 12.794 1.00 0.00 H new ATOM 0 HB VAL B 17 14.109 -2.190 12.291 1.00 0.00 H new ATOM 0 HG11 VAL B 17 16.080 -1.784 13.741 1.00 0.00 H new ATOM 0 HG12 VAL B 17 14.830 -2.709 14.607 1.00 0.00 H new ATOM 0 HG13 VAL B 17 16.271 -3.538 13.973 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.368 -2.077 11.277 1.00 0.00 H new ATOM 0 HG22 VAL B 17 16.560 -3.831 11.508 1.00 0.00 H new ATOM 0 HG23 VAL B 17 15.324 -3.211 10.387 1.00 0.00 H new ATOM 1256 N ALA B 18 11.951 -3.559 13.391 1.00 0.00 N ATOM 1257 CA ALA B 18 10.861 -3.475 14.406 1.00 0.00 C ATOM 1258 C ALA B 18 10.317 -4.871 14.715 1.00 0.00 C ATOM 1259 O ALA B 18 10.012 -5.194 15.846 1.00 0.00 O ATOM 1260 CB ALA B 18 9.783 -2.610 13.753 1.00 0.00 C ATOM 0 H ALA B 18 11.794 -3.020 12.540 1.00 0.00 H new ATOM 0 HA ALA B 18 11.205 -3.055 15.351 1.00 0.00 H new ATOM 0 HB1 ALA B 18 8.942 -2.499 14.437 1.00 0.00 H new ATOM 0 HB2 ALA B 18 10.195 -1.628 13.522 1.00 0.00 H new ATOM 0 HB3 ALA B 18 9.442 -3.086 12.834 1.00 0.00 H new ATOM 1266 N ALA B 19 10.191 -5.703 13.717 1.00 0.00 N ATOM 1267 CA ALA B 19 9.664 -7.078 13.955 1.00 0.00 C ATOM 1268 C ALA B 19 10.659 -7.889 14.789 1.00 0.00 C ATOM 1269 O ALA B 19 10.281 -8.630 15.675 1.00 0.00 O ATOM 1270 CB ALA B 19 9.511 -7.689 12.561 1.00 0.00 C ATOM 0 H ALA B 19 10.430 -5.491 12.748 1.00 0.00 H new ATOM 0 HA ALA B 19 8.722 -7.070 14.504 1.00 0.00 H new ATOM 0 HB1 ALA B 19 9.126 -8.705 12.649 1.00 0.00 H new ATOM 0 HB2 ALA B 19 8.816 -7.088 11.974 1.00 0.00 H new ATOM 0 HB3 ALA B 19 10.481 -7.710 12.065 1.00 0.00 H new ATOM 1276 N VAL B 20 11.926 -7.757 14.511 1.00 0.00 N ATOM 1277 CA VAL B 20 12.944 -8.521 15.288 1.00 0.00 C ATOM 1278 C VAL B 20 12.969 -8.047 16.743 1.00 0.00 C ATOM 1279 O VAL B 20 13.075 -8.835 17.661 1.00 0.00 O ATOM 1280 CB VAL B 20 14.276 -8.213 14.603 1.00 0.00 C ATOM 1281 CG1 VAL B 20 15.410 -8.911 15.355 1.00 0.00 C ATOM 1282 CG2 VAL B 20 14.234 -8.719 13.159 1.00 0.00 C ATOM 0 H VAL B 20 12.301 -7.153 13.780 1.00 0.00 H new ATOM 0 HA VAL B 20 12.730 -9.590 15.307 1.00 0.00 H new ATOM 0 HB VAL B 20 14.447 -7.136 14.607 1.00 0.00 H new ATOM 0 HG11 VAL B 20 16.360 -8.692 14.867 1.00 0.00 H new ATOM 0 HG12 VAL B 20 15.439 -8.552 16.384 1.00 0.00 H new ATOM 0 HG13 VAL B 20 15.240 -9.988 15.351 1.00 0.00 H new ATOM 0 HG21 VAL B 20 15.183 -8.500 12.669 1.00 0.00 H new ATOM 0 HG22 VAL B 20 14.064 -9.796 13.156 1.00 0.00 H new ATOM 0 HG23 VAL B 20 13.426 -8.222 12.623 1.00 0.00 H new ATOM 1292 N ASP B 21 12.874 -6.764 16.960 1.00 0.00 N ATOM 1293 CA ASP B 21 12.895 -6.240 18.356 1.00 0.00 C ATOM 1294 C ASP B 21 11.707 -6.794 19.148 1.00 0.00 C ATOM 1295 O ASP B 21 11.787 -6.999 20.342 1.00 0.00 O ATOM 1296 CB ASP B 21 12.783 -4.723 18.213 1.00 0.00 C ATOM 1297 CG ASP B 21 13.117 -4.057 19.548 1.00 0.00 C ATOM 1298 OD1 ASP B 21 13.250 -4.773 20.527 1.00 0.00 O ATOM 1299 OD2 ASP B 21 13.234 -2.843 19.571 1.00 0.00 O ATOM 0 H ASP B 21 12.783 -6.056 16.232 1.00 0.00 H new ATOM 0 HA ASP B 21 13.798 -6.533 18.892 1.00 0.00 H new ATOM 0 HB2 ASP B 21 13.463 -4.369 17.438 1.00 0.00 H new ATOM 0 HB3 ASP B 21 11.775 -4.450 17.901 1.00 0.00 H new ATOM 1304 N GLN B 22 10.604 -7.034 18.492 1.00 0.00 N ATOM 1305 CA GLN B 22 9.413 -7.572 19.210 1.00 0.00 C ATOM 1306 C GLN B 22 9.719 -8.963 19.772 1.00 0.00 C ATOM 1307 O GLN B 22 9.315 -9.304 20.866 1.00 0.00 O ATOM 1308 CB GLN B 22 8.314 -7.652 18.151 1.00 0.00 C ATOM 1309 CG GLN B 22 7.024 -7.050 18.709 1.00 0.00 C ATOM 1310 CD GLN B 22 5.965 -8.145 18.841 1.00 0.00 C ATOM 1311 OE1 GLN B 22 4.822 -7.949 18.477 1.00 0.00 O ATOM 1312 NE2 GLN B 22 6.297 -9.299 19.351 1.00 0.00 N ATOM 0 H GLN B 22 10.476 -6.881 17.492 1.00 0.00 H new ATOM 0 HA GLN B 22 9.121 -6.946 20.053 1.00 0.00 H new ATOM 0 HB2 GLN B 22 8.620 -7.115 17.253 1.00 0.00 H new ATOM 0 HB3 GLN B 22 8.148 -8.690 17.861 1.00 0.00 H new ATOM 0 HG2 GLN B 22 7.214 -6.594 19.681 1.00 0.00 H new ATOM 0 HG3 GLN B 22 6.665 -6.259 18.050 1.00 0.00 H new ATOM 0 HE21 GLN B 22 7.256 -9.465 19.657 1.00 0.00 H new ATOM 0 HE22 GLN B 22 5.598 -10.036 19.444 1.00 0.00 H new ATOM 1321 N ALA B 23 10.427 -9.771 19.031 1.00 0.00 N ATOM 1322 CA ALA B 23 10.755 -11.140 19.522 1.00 0.00 C ATOM 1323 C ALA B 23 11.678 -11.061 20.742 1.00 0.00 C ATOM 1324 O ALA B 23 11.555 -11.829 21.675 1.00 0.00 O ATOM 1325 CB ALA B 23 11.470 -11.819 18.353 1.00 0.00 C ATOM 0 H ALA B 23 10.793 -9.542 18.107 1.00 0.00 H new ATOM 0 HA ALA B 23 9.866 -11.690 19.833 1.00 0.00 H new ATOM 0 HB1 ALA B 23 11.745 -12.835 18.636 1.00 0.00 H new ATOM 0 HB2 ALA B 23 10.806 -11.850 17.489 1.00 0.00 H new ATOM 0 HB3 ALA B 23 12.369 -11.257 18.100 1.00 0.00 H new ATOM 1331 N ARG B 24 12.605 -10.142 20.741 1.00 0.00 N ATOM 1332 CA ARG B 24 13.537 -10.017 21.900 1.00 0.00 C ATOM 1333 C ARG B 24 12.753 -9.760 23.190 1.00 0.00 C ATOM 1334 O ARG B 24 13.078 -10.280 24.239 1.00 0.00 O ATOM 1335 CB ARG B 24 14.425 -8.819 21.565 1.00 0.00 C ATOM 1336 CG ARG B 24 15.896 -9.221 21.692 1.00 0.00 C ATOM 1337 CD ARG B 24 16.217 -9.541 23.153 1.00 0.00 C ATOM 1338 NE ARG B 24 17.689 -9.772 23.179 1.00 0.00 N ATOM 1339 CZ ARG B 24 18.515 -8.759 23.191 1.00 0.00 C ATOM 1340 NH1 ARG B 24 18.056 -7.535 23.188 1.00 0.00 N ATOM 1341 NH2 ARG B 24 19.803 -8.970 23.210 1.00 0.00 N ATOM 0 H ARG B 24 12.758 -9.472 19.988 1.00 0.00 H new ATOM 0 HA ARG B 24 14.118 -10.925 22.060 1.00 0.00 H new ATOM 0 HB2 ARG B 24 14.218 -8.472 20.553 1.00 0.00 H new ATOM 0 HB3 ARG B 24 14.204 -7.990 22.238 1.00 0.00 H new ATOM 0 HG2 ARG B 24 16.101 -10.089 21.066 1.00 0.00 H new ATOM 0 HG3 ARG B 24 16.536 -8.413 21.337 1.00 0.00 H new ATOM 0 HD2 ARG B 24 15.934 -8.718 23.809 1.00 0.00 H new ATOM 0 HD3 ARG B 24 15.673 -10.422 23.494 1.00 0.00 H new ATOM 0 HE ARG B 24 18.053 -10.725 23.187 1.00 0.00 H new ATOM 0 HH11 ARG B 24 17.050 -7.368 23.176 1.00 0.00 H new ATOM 0 HH12 ARG B 24 18.704 -6.747 23.197 1.00 0.00 H new ATOM 0 HH21 ARG B 24 20.163 -9.924 23.215 1.00 0.00 H new ATOM 0 HH22 ARG B 24 20.449 -8.181 23.219 1.00 0.00 H new ATOM 1355 N VAL B 25 11.726 -8.957 23.124 1.00 0.00 N ATOM 1356 CA VAL B 25 10.927 -8.666 24.349 1.00 0.00 C ATOM 1357 C VAL B 25 10.275 -9.944 24.875 1.00 0.00 C ATOM 1358 O VAL B 25 9.914 -10.040 26.032 1.00 0.00 O ATOM 1359 CB VAL B 25 9.865 -7.662 23.901 1.00 0.00 C ATOM 1360 CG1 VAL B 25 9.009 -7.252 25.102 1.00 0.00 C ATOM 1361 CG2 VAL B 25 10.551 -6.426 23.317 1.00 0.00 C ATOM 0 H VAL B 25 11.406 -8.490 22.276 1.00 0.00 H new ATOM 0 HA VAL B 25 11.542 -8.272 25.158 1.00 0.00 H new ATOM 0 HB VAL B 25 9.229 -8.119 23.143 1.00 0.00 H new ATOM 0 HG11 VAL B 25 8.252 -6.536 24.782 1.00 0.00 H new ATOM 0 HG12 VAL B 25 8.522 -8.133 25.519 1.00 0.00 H new ATOM 0 HG13 VAL B 25 9.643 -6.794 25.861 1.00 0.00 H new ATOM 0 HG21 VAL B 25 9.796 -5.708 22.997 1.00 0.00 H new ATOM 0 HG22 VAL B 25 11.186 -5.970 24.076 1.00 0.00 H new ATOM 0 HG23 VAL B 25 11.160 -6.718 22.462 1.00 0.00 H new ATOM 1371 N ARG B 26 10.122 -10.926 24.036 1.00 0.00 N ATOM 1372 CA ARG B 26 9.492 -12.199 24.487 1.00 0.00 C ATOM 1373 C ARG B 26 10.441 -13.376 24.243 1.00 0.00 C ATOM 1374 O ARG B 26 10.017 -14.488 23.999 1.00 0.00 O ATOM 1375 CB ARG B 26 8.228 -12.341 23.639 1.00 0.00 C ATOM 1376 CG ARG B 26 6.997 -12.288 24.548 1.00 0.00 C ATOM 1377 CD ARG B 26 6.198 -13.586 24.402 1.00 0.00 C ATOM 1378 NE ARG B 26 4.770 -13.159 24.407 1.00 0.00 N ATOM 1379 CZ ARG B 26 4.268 -12.539 23.373 1.00 0.00 C ATOM 1380 NH1 ARG B 26 5.013 -12.287 22.331 1.00 0.00 N ATOM 1381 NH2 ARG B 26 3.017 -12.170 23.382 1.00 0.00 N ATOM 0 H ARG B 26 10.405 -10.905 23.056 1.00 0.00 H new ATOM 0 HA ARG B 26 9.266 -12.191 25.553 1.00 0.00 H new ATOM 0 HB2 ARG B 26 8.182 -11.542 22.899 1.00 0.00 H new ATOM 0 HB3 ARG B 26 8.249 -13.283 23.091 1.00 0.00 H new ATOM 0 HG2 ARG B 26 7.303 -12.152 25.585 1.00 0.00 H new ATOM 0 HG3 ARG B 26 6.374 -11.433 24.285 1.00 0.00 H new ATOM 0 HD2 ARG B 26 6.452 -14.105 23.478 1.00 0.00 H new ATOM 0 HD3 ARG B 26 6.408 -14.274 25.221 1.00 0.00 H new ATOM 0 HE ARG B 26 4.184 -13.351 25.219 1.00 0.00 H new ATOM 0 HH11 ARG B 26 5.992 -12.575 22.322 1.00 0.00 H new ATOM 0 HH12 ARG B 26 4.616 -11.803 21.526 1.00 0.00 H new ATOM 0 HH21 ARG B 26 2.433 -12.366 24.195 1.00 0.00 H new ATOM 0 HH22 ARG B 26 2.622 -11.686 22.576 1.00 0.00 H new ATOM 1395 N GLU B 27 11.723 -13.141 24.307 1.00 0.00 N ATOM 1396 CA GLU B 27 12.695 -14.247 24.081 1.00 0.00 C ATOM 1397 C GLU B 27 12.791 -15.129 25.331 1.00 0.00 C ATOM 1398 O GLU B 27 13.375 -14.738 26.323 1.00 0.00 O ATOM 1399 CB GLU B 27 14.031 -13.556 23.810 1.00 0.00 C ATOM 1400 CG GLU B 27 15.121 -14.612 23.623 1.00 0.00 C ATOM 1401 CD GLU B 27 16.342 -13.976 22.959 1.00 0.00 C ATOM 1402 OE1 GLU B 27 16.211 -12.872 22.455 1.00 0.00 O ATOM 1403 OE2 GLU B 27 17.389 -14.603 22.965 1.00 0.00 O ATOM 0 H GLU B 27 12.139 -12.231 24.506 1.00 0.00 H new ATOM 0 HA GLU B 27 12.398 -14.894 23.256 1.00 0.00 H new ATOM 0 HB2 GLU B 27 13.956 -12.933 22.919 1.00 0.00 H new ATOM 0 HB3 GLU B 27 14.287 -12.897 24.639 1.00 0.00 H new ATOM 0 HG2 GLU B 27 15.399 -15.037 24.587 1.00 0.00 H new ATOM 0 HG3 GLU B 27 14.746 -15.431 23.010 1.00 0.00 H new ATOM 1410 N PRO B 28 12.209 -16.293 25.237 1.00 0.00 N ATOM 1411 CA PRO B 28 12.246 -17.215 26.403 1.00 0.00 C ATOM 1412 C PRO B 28 13.695 -17.553 26.768 1.00 0.00 C ATOM 1413 O PRO B 28 14.495 -17.893 25.919 1.00 0.00 O ATOM 1414 CB PRO B 28 11.508 -18.461 25.921 1.00 0.00 C ATOM 1415 CG PRO B 28 11.592 -18.415 24.431 1.00 0.00 C ATOM 1416 CD PRO B 28 11.699 -16.966 24.035 1.00 0.00 C ATOM 0 HA PRO B 28 11.793 -16.783 27.295 1.00 0.00 H new ATOM 0 HB2 PRO B 28 11.969 -19.368 26.313 1.00 0.00 H new ATOM 0 HB3 PRO B 28 10.471 -18.459 26.257 1.00 0.00 H new ATOM 0 HG2 PRO B 28 12.457 -18.975 24.077 1.00 0.00 H new ATOM 0 HG3 PRO B 28 10.711 -18.872 23.982 1.00 0.00 H new ATOM 0 HD2 PRO B 28 12.374 -16.834 23.190 1.00 0.00 H new ATOM 0 HD3 PRO B 28 10.731 -16.564 23.735 1.00 0.00 H new ATOM 1424 N ARG B 29 14.038 -17.464 28.024 1.00 0.00 N ATOM 1425 CA ARG B 29 15.434 -17.783 28.439 1.00 0.00 C ATOM 1426 C ARG B 29 15.426 -18.701 29.664 1.00 0.00 C ATOM 1427 O ARG B 29 14.778 -19.729 29.677 1.00 0.00 O ATOM 1428 CB ARG B 29 16.067 -16.435 28.787 1.00 0.00 C ATOM 1429 CG ARG B 29 17.590 -16.576 28.803 1.00 0.00 C ATOM 1430 CD ARG B 29 18.173 -15.721 29.931 1.00 0.00 C ATOM 1431 NE ARG B 29 19.568 -16.210 30.104 1.00 0.00 N ATOM 1432 CZ ARG B 29 19.796 -17.339 30.718 1.00 0.00 C ATOM 1433 NH1 ARG B 29 18.802 -18.049 31.179 1.00 0.00 N ATOM 1434 NH2 ARG B 29 21.022 -17.760 30.872 1.00 0.00 N ATOM 0 H ARG B 29 13.413 -17.185 28.780 1.00 0.00 H new ATOM 0 HA ARG B 29 15.986 -18.302 27.655 1.00 0.00 H new ATOM 0 HB2 ARG B 29 15.768 -15.682 28.058 1.00 0.00 H new ATOM 0 HB3 ARG B 29 15.712 -16.095 29.760 1.00 0.00 H new ATOM 0 HG2 ARG B 29 17.867 -17.621 28.944 1.00 0.00 H new ATOM 0 HG3 ARG B 29 18.004 -16.263 27.845 1.00 0.00 H new ATOM 0 HD2 ARG B 29 18.155 -14.662 29.673 1.00 0.00 H new ATOM 0 HD3 ARG B 29 17.598 -15.835 30.850 1.00 0.00 H new ATOM 0 HE ARG B 29 20.348 -15.661 29.742 1.00 0.00 H new ATOM 0 HH11 ARG B 29 17.843 -17.722 31.060 1.00 0.00 H new ATOM 0 HH12 ARG B 29 18.984 -18.931 31.658 1.00 0.00 H new ATOM 0 HH21 ARG B 29 21.800 -17.207 30.513 1.00 0.00 H new ATOM 0 HH22 ARG B 29 21.202 -18.642 31.352 1.00 0.00 H new TER 1448 ARG B 29