USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 590 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 HIS : no HD1:sc= -0.162 K(o=-0.16,f=-0.78) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 TYR OH : rot 141:sc= 0.102 USER MOD Single : A 63 THR OG1 : rot 117:sc= 1.06 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -0.194 X(o=-0.19,f=-0.026) USER MOD Single : A 74 SER OG : rot 180:sc= 0.005 USER MOD Single : A 77 GLN : amide:sc= 0.13 X(o=0.13,f=0) USER MOD Single : A 87 SER OG : rot 51:sc= -2.44! USER MOD Single : A 89 HIS :FLIP no HD1:sc= -0.0588! C(o=-4.5!,f=-0.059!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -0.431 K(o=-0.43,f=-2.7!) USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 GLN :FLIP amide:sc= 0 F(o=-1.1!,f=0) USER MOD Single : A 106 ASN : amide:sc= 0.0188 K(o=0.019,f=-4.2!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 CYS SG : rot 38:sc= 1.27 USER MOD Single : A 115 THR OG1 : rot -9:sc= 0.518! USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -2.38! C(o=-2.4!,f=-10!) USER MOD Single : A 130 ASN : amide:sc= -1.2 K(o=-1.2,f=-5.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 51 -17.368 7.843 44.675 1.00 0.00 N ATOM 2 CA MET A 51 -17.975 8.569 45.827 1.00 0.00 C ATOM 3 C MET A 51 -17.098 9.762 46.195 1.00 0.00 C ATOM 4 O MET A 51 -16.692 9.914 47.347 1.00 0.00 O ATOM 5 CB MET A 51 -18.090 7.618 47.020 1.00 0.00 C ATOM 6 CG MET A 51 -16.769 6.869 47.203 1.00 0.00 C ATOM 7 SD MET A 51 -16.502 6.536 48.963 1.00 0.00 S ATOM 8 CE MET A 51 -17.090 4.826 48.962 1.00 0.00 C ATOM 0 HA MET A 51 -18.968 8.927 45.555 1.00 0.00 H new ATOM 0 HB2 MET A 51 -18.331 8.178 47.923 1.00 0.00 H new ATOM 0 HB3 MET A 51 -18.903 6.910 46.857 1.00 0.00 H new ATOM 0 HG2 MET A 51 -16.789 5.934 46.644 1.00 0.00 H new ATOM 0 HG3 MET A 51 -15.945 7.461 46.805 1.00 0.00 H new ATOM 0 HE1 MET A 51 -17.013 4.414 49.968 1.00 0.00 H new ATOM 0 HE2 MET A 51 -18.130 4.799 48.637 1.00 0.00 H new ATOM 0 HE3 MET A 51 -16.481 4.232 48.280 1.00 0.00 H new ATOM 20 N HIS A 52 -16.812 10.605 45.207 1.00 0.00 N ATOM 21 CA HIS A 52 -15.982 11.782 45.441 1.00 0.00 C ATOM 22 C HIS A 52 -16.805 13.057 45.287 1.00 0.00 C ATOM 23 O HIS A 52 -17.455 13.269 44.264 1.00 0.00 O ATOM 24 CB HIS A 52 -14.817 11.802 44.448 1.00 0.00 C ATOM 25 CG HIS A 52 -13.862 10.688 44.778 1.00 0.00 C ATOM 26 ND1 HIS A 52 -12.989 10.758 45.853 1.00 0.00 N ATOM 27 CD2 HIS A 52 -13.630 9.472 44.185 1.00 0.00 C ATOM 28 CE1 HIS A 52 -12.279 9.614 45.874 1.00 0.00 C ATOM 29 NE2 HIS A 52 -12.631 8.795 44.879 1.00 0.00 N ATOM 0 H HIS A 52 -17.139 10.497 44.247 1.00 0.00 H new ATOM 0 HA HIS A 52 -15.594 11.735 46.458 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -15.190 11.687 43.430 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -14.303 12.762 44.493 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -14.144 9.097 43.312 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -11.518 9.386 46.606 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -12.250 7.872 44.672 1.00 0.00 H new ATOM 38 N LEU A 53 -16.773 13.903 46.312 1.00 0.00 N ATOM 39 CA LEU A 53 -17.523 15.154 46.279 1.00 0.00 C ATOM 40 C LEU A 53 -16.620 16.309 45.858 1.00 0.00 C ATOM 41 O LEU A 53 -15.676 16.663 46.564 1.00 0.00 O ATOM 42 CB LEU A 53 -18.110 15.442 47.663 1.00 0.00 C ATOM 43 CG LEU A 53 -18.521 16.913 47.757 1.00 0.00 C ATOM 44 CD1 LEU A 53 -19.473 17.252 46.609 1.00 0.00 C ATOM 45 CD2 LEU A 53 -19.227 17.159 49.093 1.00 0.00 C ATOM 0 H LEU A 53 -16.241 13.748 47.168 1.00 0.00 H new ATOM 0 HA LEU A 53 -18.330 15.056 45.552 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -18.974 14.802 47.842 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -17.376 15.210 48.435 1.00 0.00 H new ATOM 0 HG LEU A 53 -17.634 17.543 47.691 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -19.766 18.300 46.676 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -18.972 17.075 45.657 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -20.361 16.623 46.674 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -19.521 18.206 49.162 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -20.114 16.529 49.157 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -18.550 16.917 49.912 1.00 0.00 H new ATOM 57 N THR A 54 -16.920 16.895 44.703 1.00 0.00 N ATOM 58 CA THR A 54 -16.132 18.013 44.199 1.00 0.00 C ATOM 59 C THR A 54 -17.035 19.196 43.866 1.00 0.00 C ATOM 60 O THR A 54 -18.148 19.016 43.371 1.00 0.00 O ATOM 61 CB THR A 54 -15.361 17.588 42.947 1.00 0.00 C ATOM 62 OG1 THR A 54 -15.377 18.647 41.999 1.00 0.00 O ATOM 63 CG2 THR A 54 -16.014 16.346 42.340 1.00 0.00 C ATOM 0 H THR A 54 -17.697 16.617 44.103 1.00 0.00 H new ATOM 0 HA THR A 54 -15.427 18.315 44.973 1.00 0.00 H new ATOM 0 HB THR A 54 -14.330 17.358 43.216 1.00 0.00 H new ATOM 0 HG1 THR A 54 -14.882 18.376 41.198 1.00 0.00 H new ATOM 0 HG21 THR A 54 -15.464 16.045 41.449 1.00 0.00 H new ATOM 0 HG22 THR A 54 -15.999 15.534 43.068 1.00 0.00 H new ATOM 0 HG23 THR A 54 -17.046 16.572 42.071 1.00 0.00 H new ATOM 71 N TYR A 55 -16.551 20.402 44.134 1.00 0.00 N ATOM 72 CA TYR A 55 -17.328 21.604 43.851 1.00 0.00 C ATOM 73 C TYR A 55 -16.523 22.566 42.986 1.00 0.00 C ATOM 74 O TYR A 55 -15.297 22.623 43.082 1.00 0.00 O ATOM 75 CB TYR A 55 -17.712 22.295 45.160 1.00 0.00 C ATOM 76 CG TYR A 55 -16.486 22.433 46.031 1.00 0.00 C ATOM 77 CD1 TYR A 55 -15.605 23.504 45.837 1.00 0.00 C ATOM 78 CD2 TYR A 55 -16.228 21.487 47.031 1.00 0.00 C ATOM 79 CE1 TYR A 55 -14.469 23.630 46.645 1.00 0.00 C ATOM 80 CE2 TYR A 55 -15.092 21.613 47.837 1.00 0.00 C ATOM 81 CZ TYR A 55 -14.211 22.685 47.645 1.00 0.00 C ATOM 82 OH TYR A 55 -13.090 22.808 48.440 1.00 0.00 O ATOM 0 H TYR A 55 -15.633 20.574 44.543 1.00 0.00 H new ATOM 0 HA TYR A 55 -18.231 21.315 43.313 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -18.138 23.277 44.955 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -18.477 21.717 45.678 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -15.802 24.232 45.064 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -16.906 20.660 47.180 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -13.791 24.457 46.497 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -14.894 20.883 48.608 1.00 0.00 H new ATOM 0 HH TYR A 55 -13.313 22.559 49.361 1.00 0.00 H new ATOM 92 N GLU A 56 -17.216 23.323 42.142 1.00 0.00 N ATOM 93 CA GLU A 56 -16.546 24.279 41.268 1.00 0.00 C ATOM 94 C GLU A 56 -17.500 25.388 40.839 1.00 0.00 C ATOM 95 O GLU A 56 -18.635 25.125 40.440 1.00 0.00 O ATOM 96 CB GLU A 56 -16.009 23.562 40.029 1.00 0.00 C ATOM 97 CG GLU A 56 -15.770 24.582 38.913 1.00 0.00 C ATOM 98 CD GLU A 56 -14.753 24.036 37.916 1.00 0.00 C ATOM 99 OE1 GLU A 56 -14.036 23.117 38.274 1.00 0.00 O ATOM 100 OE2 GLU A 56 -14.708 24.546 36.809 1.00 0.00 O ATOM 0 H GLU A 56 -18.231 23.294 42.045 1.00 0.00 H new ATOM 0 HA GLU A 56 -15.720 24.726 41.822 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -15.080 23.045 40.269 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -16.719 22.804 39.698 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -16.708 24.803 38.404 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -15.409 25.519 39.337 1.00 0.00 H new ATOM 107 N ILE A 57 -17.029 26.628 40.907 1.00 0.00 N ATOM 108 CA ILE A 57 -17.845 27.768 40.506 1.00 0.00 C ATOM 109 C ILE A 57 -17.421 28.241 39.119 1.00 0.00 C ATOM 110 O ILE A 57 -16.410 27.787 38.585 1.00 0.00 O ATOM 111 CB ILE A 57 -17.692 28.907 41.515 1.00 0.00 C ATOM 112 CG1 ILE A 57 -17.825 28.346 42.933 1.00 0.00 C ATOM 113 CG2 ILE A 57 -18.784 29.952 41.276 1.00 0.00 C ATOM 114 CD1 ILE A 57 -19.128 27.555 43.049 1.00 0.00 C ATOM 0 H ILE A 57 -16.093 26.869 41.234 1.00 0.00 H new ATOM 0 HA ILE A 57 -18.891 27.463 40.477 1.00 0.00 H new ATOM 0 HB ILE A 57 -16.714 29.372 41.395 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -16.975 27.703 43.162 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -17.815 29.159 43.659 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -18.675 30.764 41.995 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -18.693 30.349 40.265 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -19.763 29.489 41.397 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -19.223 27.156 44.059 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -19.972 28.211 42.838 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -19.120 26.733 42.333 1.00 0.00 H new ATOM 126 N PHE A 58 -18.196 29.148 38.533 1.00 0.00 N ATOM 127 CA PHE A 58 -17.874 29.653 37.203 1.00 0.00 C ATOM 128 C PHE A 58 -17.950 31.176 37.161 1.00 0.00 C ATOM 129 O PHE A 58 -18.371 31.818 38.124 1.00 0.00 O ATOM 130 CB PHE A 58 -18.836 29.062 36.172 1.00 0.00 C ATOM 131 CG PHE A 58 -18.407 27.654 35.835 1.00 0.00 C ATOM 132 CD1 PHE A 58 -17.142 27.419 35.280 1.00 0.00 C ATOM 133 CD2 PHE A 58 -19.274 26.583 36.079 1.00 0.00 C ATOM 134 CE1 PHE A 58 -16.746 26.113 34.969 1.00 0.00 C ATOM 135 CE2 PHE A 58 -18.877 25.277 35.768 1.00 0.00 C ATOM 136 CZ PHE A 58 -17.614 25.042 35.213 1.00 0.00 C ATOM 0 H PHE A 58 -19.039 29.543 38.950 1.00 0.00 H new ATOM 0 HA PHE A 58 -16.854 29.352 36.965 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -19.852 29.060 36.566 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -18.844 29.677 35.272 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -16.473 28.245 35.092 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -20.249 26.764 36.507 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -15.771 25.932 34.541 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -19.546 24.450 35.957 1.00 0.00 H new ATOM 0 HZ PHE A 58 -17.309 24.034 34.973 1.00 0.00 H new ATOM 146 N GLY A 59 -17.535 31.744 36.034 1.00 0.00 N ATOM 147 CA GLY A 59 -17.550 33.191 35.860 1.00 0.00 C ATOM 148 C GLY A 59 -16.587 33.606 34.752 1.00 0.00 C ATOM 149 O GLY A 59 -15.591 32.928 34.500 1.00 0.00 O ATOM 0 H GLY A 59 -17.185 31.225 35.229 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -18.559 33.523 35.616 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -17.271 33.678 36.794 1.00 0.00 H new ATOM 153 N PRO A 60 -16.865 34.697 34.090 1.00 0.00 N ATOM 154 CA PRO A 60 -16.007 35.205 32.987 1.00 0.00 C ATOM 155 C PRO A 60 -14.517 35.051 33.304 1.00 0.00 C ATOM 156 O PRO A 60 -14.090 35.285 34.434 1.00 0.00 O ATOM 157 CB PRO A 60 -16.401 36.678 32.888 1.00 0.00 C ATOM 158 CG PRO A 60 -17.819 36.741 33.357 1.00 0.00 C ATOM 159 CD PRO A 60 -18.027 35.569 34.324 1.00 0.00 C ATOM 0 HA PRO A 60 -16.152 34.656 32.057 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -15.754 37.300 33.507 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -16.309 37.042 31.865 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -18.018 37.690 33.854 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -18.507 36.672 32.514 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -18.068 35.909 35.359 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -18.963 35.048 34.123 1.00 0.00 H new ATOM 167 N PRO A 61 -13.728 34.661 32.336 1.00 0.00 N ATOM 168 CA PRO A 61 -12.260 34.471 32.523 1.00 0.00 C ATOM 169 C PRO A 61 -11.534 35.791 32.772 1.00 0.00 C ATOM 170 O PRO A 61 -11.787 36.787 32.093 1.00 0.00 O ATOM 171 CB PRO A 61 -11.798 33.831 31.212 1.00 0.00 C ATOM 172 CG PRO A 61 -12.829 34.205 30.199 1.00 0.00 C ATOM 173 CD PRO A 61 -14.147 34.361 30.958 1.00 0.00 C ATOM 0 HA PRO A 61 -12.040 33.859 33.397 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -10.813 34.197 30.923 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -11.719 32.748 31.310 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -12.559 35.133 29.695 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.913 33.438 29.429 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -14.755 35.164 30.542 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -14.745 33.451 30.911 1.00 0.00 H new ATOM 181 N GLY A 62 -10.632 35.789 33.748 1.00 0.00 N ATOM 182 CA GLY A 62 -9.875 36.991 34.078 1.00 0.00 C ATOM 183 C GLY A 62 -10.487 37.708 35.277 1.00 0.00 C ATOM 184 O GLY A 62 -9.982 38.738 35.722 1.00 0.00 O ATOM 0 H GLY A 62 -10.408 34.975 34.320 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -8.841 36.725 34.297 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -9.857 37.661 33.219 1.00 0.00 H new ATOM 188 N THR A 63 -11.579 37.154 35.795 1.00 0.00 N ATOM 189 CA THR A 63 -12.254 37.750 36.943 1.00 0.00 C ATOM 190 C THR A 63 -11.629 37.264 38.246 1.00 0.00 C ATOM 191 O THR A 63 -11.294 36.087 38.384 1.00 0.00 O ATOM 192 CB THR A 63 -13.740 37.384 36.921 1.00 0.00 C ATOM 193 OG1 THR A 63 -14.235 37.505 35.595 1.00 0.00 O ATOM 194 CG2 THR A 63 -14.512 38.325 37.845 1.00 0.00 C ATOM 0 H THR A 63 -12.012 36.301 35.442 1.00 0.00 H new ATOM 0 HA THR A 63 -12.144 38.833 36.883 1.00 0.00 H new ATOM 0 HB THR A 63 -13.868 36.357 37.264 1.00 0.00 H new ATOM 0 HG1 THR A 63 -14.536 36.628 35.277 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.570 38.064 37.829 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.130 38.231 38.862 1.00 0.00 H new ATOM 0 HG23 THR A 63 -14.387 39.353 37.505 1.00 0.00 H new ATOM 202 N VAL A 64 -11.478 38.176 39.200 1.00 0.00 N ATOM 203 CA VAL A 64 -10.895 37.827 40.490 1.00 0.00 C ATOM 204 C VAL A 64 -11.950 37.907 41.589 1.00 0.00 C ATOM 205 O VAL A 64 -12.582 38.944 41.784 1.00 0.00 O ATOM 206 CB VAL A 64 -9.738 38.774 40.817 1.00 0.00 C ATOM 207 CG1 VAL A 64 -10.140 40.210 40.480 1.00 0.00 C ATOM 208 CG2 VAL A 64 -9.406 38.675 42.308 1.00 0.00 C ATOM 0 H VAL A 64 -11.749 39.155 39.106 1.00 0.00 H new ATOM 0 HA VAL A 64 -10.519 36.806 40.435 1.00 0.00 H new ATOM 0 HB VAL A 64 -8.864 38.495 40.229 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -9.315 40.883 40.713 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.378 40.282 39.419 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.014 40.490 41.067 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -8.582 39.349 42.543 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.281 38.954 42.895 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -9.118 37.652 42.549 1.00 0.00 H new ATOM 218 N ALA A 65 -12.136 36.800 42.299 1.00 0.00 N ATOM 219 CA ALA A 65 -13.120 36.750 43.375 1.00 0.00 C ATOM 220 C ALA A 65 -12.551 36.019 44.587 1.00 0.00 C ATOM 221 O ALA A 65 -11.626 35.217 44.462 1.00 0.00 O ATOM 222 CB ALA A 65 -14.383 36.034 42.892 1.00 0.00 C ATOM 0 H ALA A 65 -11.623 35.931 42.151 1.00 0.00 H new ATOM 0 HA ALA A 65 -13.368 37.771 43.664 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -15.114 36.000 43.700 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -14.805 36.573 42.044 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -14.131 35.018 42.588 1.00 0.00 H new ATOM 228 N ASP A 66 -13.109 36.302 45.758 1.00 0.00 N ATOM 229 CA ASP A 66 -12.647 35.664 46.984 1.00 0.00 C ATOM 230 C ASP A 66 -13.475 34.417 47.277 1.00 0.00 C ATOM 231 O ASP A 66 -14.677 34.502 47.528 1.00 0.00 O ATOM 232 CB ASP A 66 -12.758 36.639 48.158 1.00 0.00 C ATOM 233 CG ASP A 66 -12.643 38.073 47.654 1.00 0.00 C ATOM 234 OD1 ASP A 66 -11.526 38.535 47.494 1.00 0.00 O ATOM 235 OD2 ASP A 66 -13.673 38.689 47.437 1.00 0.00 O ATOM 0 H ASP A 66 -13.875 36.963 45.884 1.00 0.00 H new ATOM 0 HA ASP A 66 -11.604 35.376 46.852 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -13.710 36.499 48.669 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -11.973 36.436 48.886 1.00 0.00 H new ATOM 240 N ILE A 67 -12.822 33.260 47.236 1.00 0.00 N ATOM 241 CA ILE A 67 -13.506 31.999 47.493 1.00 0.00 C ATOM 242 C ILE A 67 -13.146 31.462 48.874 1.00 0.00 C ATOM 243 O ILE A 67 -11.971 31.384 49.236 1.00 0.00 O ATOM 244 CB ILE A 67 -13.119 30.975 46.425 1.00 0.00 C ATOM 245 CG1 ILE A 67 -13.638 31.446 45.064 1.00 0.00 C ATOM 246 CG2 ILE A 67 -13.740 29.619 46.766 1.00 0.00 C ATOM 247 CD1 ILE A 67 -12.907 30.693 43.951 1.00 0.00 C ATOM 0 H ILE A 67 -11.827 33.170 47.029 1.00 0.00 H new ATOM 0 HA ILE A 67 -14.581 32.175 47.458 1.00 0.00 H new ATOM 0 HB ILE A 67 -12.034 30.876 46.390 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -14.711 31.271 44.992 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -13.482 32.519 44.955 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -13.463 28.890 46.004 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -13.374 29.285 47.737 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -14.825 29.714 46.800 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -13.276 31.028 42.982 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -11.837 30.891 44.020 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -13.086 29.623 44.057 1.00 0.00 H new ATOM 259 N SER A 68 -14.160 31.083 49.636 1.00 0.00 N ATOM 260 CA SER A 68 -13.968 30.563 50.987 1.00 0.00 C ATOM 261 C SER A 68 -14.808 29.328 51.215 1.00 0.00 C ATOM 262 O SER A 68 -16.032 29.380 51.046 1.00 0.00 O ATOM 263 CB SER A 68 -14.264 31.657 52.045 1.00 0.00 C ATOM 264 OG SER A 68 -14.100 31.189 53.388 1.00 0.00 O ATOM 0 H SER A 68 -15.135 31.125 49.341 1.00 0.00 H new ATOM 0 HA SER A 68 -12.923 30.272 51.096 1.00 0.00 H new ATOM 0 HB2 SER A 68 -13.602 32.506 51.878 1.00 0.00 H new ATOM 0 HB3 SER A 68 -15.284 32.017 51.913 1.00 0.00 H new ATOM 0 HG SER A 68 -14.297 31.917 54.014 1.00 0.00 H new ATOM 270 N TYR A 69 -14.186 28.240 51.639 1.00 0.00 N ATOM 271 CA TYR A 69 -14.917 27.006 51.904 1.00 0.00 C ATOM 272 C TYR A 69 -14.292 26.251 53.073 1.00 0.00 C ATOM 273 O TYR A 69 -13.126 26.460 53.408 1.00 0.00 O ATOM 274 CB TYR A 69 -14.915 26.117 50.659 1.00 0.00 C ATOM 275 CG TYR A 69 -15.540 24.781 50.991 1.00 0.00 C ATOM 276 CD1 TYR A 69 -16.867 24.722 51.435 1.00 0.00 C ATOM 277 CD2 TYR A 69 -14.795 23.604 50.855 1.00 0.00 C ATOM 278 CE1 TYR A 69 -17.447 23.486 51.743 1.00 0.00 C ATOM 279 CE2 TYR A 69 -15.376 22.367 51.163 1.00 0.00 C ATOM 280 CZ TYR A 69 -16.703 22.308 51.607 1.00 0.00 C ATOM 281 OH TYR A 69 -17.274 21.090 51.911 1.00 0.00 O ATOM 0 H TYR A 69 -13.182 28.183 51.807 1.00 0.00 H new ATOM 0 HA TYR A 69 -15.944 27.265 52.162 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -15.469 26.600 49.854 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -13.895 25.974 50.303 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -17.443 25.630 51.540 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -13.772 23.649 50.512 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -18.470 23.441 52.086 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -14.801 21.459 51.058 1.00 0.00 H new ATOM 0 HH TYR A 69 -16.620 20.376 51.760 1.00 0.00 H new ATOM 291 N PHE A 70 -15.076 25.371 53.689 1.00 0.00 N ATOM 292 CA PHE A 70 -14.593 24.590 54.821 1.00 0.00 C ATOM 293 C PHE A 70 -13.945 23.294 54.344 1.00 0.00 C ATOM 294 O PHE A 70 -14.470 22.617 53.461 1.00 0.00 O ATOM 295 CB PHE A 70 -15.754 24.265 55.762 1.00 0.00 C ATOM 296 CG PHE A 70 -15.238 24.136 57.176 1.00 0.00 C ATOM 297 CD1 PHE A 70 -14.849 25.276 57.887 1.00 0.00 C ATOM 298 CD2 PHE A 70 -15.150 22.874 57.773 1.00 0.00 C ATOM 299 CE1 PHE A 70 -14.372 25.155 59.197 1.00 0.00 C ATOM 300 CE2 PHE A 70 -14.673 22.751 59.083 1.00 0.00 C ATOM 301 CZ PHE A 70 -14.283 23.892 59.795 1.00 0.00 C ATOM 0 H PHE A 70 -16.043 25.182 53.425 1.00 0.00 H new ATOM 0 HA PHE A 70 -13.846 25.180 55.353 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -16.509 25.050 55.710 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -16.237 23.337 55.454 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -14.917 26.250 57.425 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -15.450 21.994 57.223 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -14.073 26.035 59.746 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -14.606 21.777 59.544 1.00 0.00 H new ATOM 0 HZ PHE A 70 -13.914 23.798 60.805 1.00 0.00 H new ATOM 311 N ASP A 71 -12.805 22.954 54.935 1.00 0.00 N ATOM 312 CA ASP A 71 -12.096 21.734 54.563 1.00 0.00 C ATOM 313 C ASP A 71 -12.213 20.693 55.672 1.00 0.00 C ATOM 314 O ASP A 71 -11.737 20.903 56.787 1.00 0.00 O ATOM 315 CB ASP A 71 -10.621 22.047 54.301 1.00 0.00 C ATOM 316 CG ASP A 71 -10.307 21.878 52.819 1.00 0.00 C ATOM 317 OD1 ASP A 71 -10.885 20.994 52.208 1.00 0.00 O ATOM 318 OD2 ASP A 71 -9.493 22.635 52.316 1.00 0.00 O ATOM 0 H ASP A 71 -12.354 23.501 55.668 1.00 0.00 H new ATOM 0 HA ASP A 71 -12.546 21.333 53.655 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -10.396 23.066 54.615 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -9.989 21.384 54.893 1.00 0.00 H new ATOM 323 N VAL A 72 -12.853 19.572 55.358 1.00 0.00 N ATOM 324 CA VAL A 72 -13.032 18.507 56.337 1.00 0.00 C ATOM 325 C VAL A 72 -11.730 17.737 56.543 1.00 0.00 C ATOM 326 O VAL A 72 -11.646 16.866 57.408 1.00 0.00 O ATOM 327 CB VAL A 72 -14.125 17.544 55.868 1.00 0.00 C ATOM 328 CG1 VAL A 72 -14.467 16.573 57.000 1.00 0.00 C ATOM 329 CG2 VAL A 72 -15.376 18.340 55.483 1.00 0.00 C ATOM 0 H VAL A 72 -13.254 19.378 54.440 1.00 0.00 H new ATOM 0 HA VAL A 72 -13.326 18.960 57.284 1.00 0.00 H new ATOM 0 HB VAL A 72 -13.770 16.984 55.003 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -15.245 15.886 56.668 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -13.577 16.007 57.275 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -14.822 17.133 57.865 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -16.155 17.655 55.149 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -15.732 18.900 56.348 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -15.133 19.033 54.678 1.00 0.00 H new ATOM 339 N ASN A 73 -10.720 18.063 55.744 1.00 0.00 N ATOM 340 CA ASN A 73 -9.429 17.391 55.853 1.00 0.00 C ATOM 341 C ASN A 73 -8.516 18.137 56.820 1.00 0.00 C ATOM 342 O ASN A 73 -7.529 17.585 57.306 1.00 0.00 O ATOM 343 CB ASN A 73 -8.765 17.308 54.476 1.00 0.00 C ATOM 344 CG ASN A 73 -8.766 15.864 53.984 1.00 0.00 C ATOM 345 OD1 ASN A 73 -9.208 15.589 52.868 1.00 0.00 O ATOM 346 ND2 ASN A 73 -8.295 14.922 54.754 1.00 0.00 N ATOM 0 H ASN A 73 -10.768 18.781 55.021 1.00 0.00 H new ATOM 0 HA ASN A 73 -9.595 16.384 56.235 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -9.297 17.943 53.767 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -7.742 17.681 54.533 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -8.292 13.954 54.432 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -7.930 15.153 55.678 1.00 0.00 H new ATOM 353 N SER A 74 -8.851 19.393 57.094 1.00 0.00 N ATOM 354 CA SER A 74 -8.052 20.202 58.008 1.00 0.00 C ATOM 355 C SER A 74 -8.691 21.573 58.215 1.00 0.00 C ATOM 356 O SER A 74 -9.871 21.675 58.548 1.00 0.00 O ATOM 357 CB SER A 74 -6.639 20.379 57.447 1.00 0.00 C ATOM 358 OG SER A 74 -5.797 20.909 58.462 1.00 0.00 O ATOM 0 H SER A 74 -9.662 19.870 56.701 1.00 0.00 H new ATOM 0 HA SER A 74 -8.004 19.688 58.968 1.00 0.00 H new ATOM 0 HB2 SER A 74 -6.251 19.422 57.098 1.00 0.00 H new ATOM 0 HB3 SER A 74 -6.657 21.048 56.587 1.00 0.00 H new ATOM 0 HG SER A 74 -4.890 21.023 58.108 1.00 0.00 H new ATOM 364 N GLU A 75 -7.899 22.621 58.014 1.00 0.00 N ATOM 365 CA GLU A 75 -8.388 23.986 58.180 1.00 0.00 C ATOM 366 C GLU A 75 -8.851 24.554 56.843 1.00 0.00 C ATOM 367 O GLU A 75 -8.339 24.178 55.788 1.00 0.00 O ATOM 368 CB GLU A 75 -7.272 24.866 58.748 1.00 0.00 C ATOM 369 CG GLU A 75 -6.017 24.708 57.890 1.00 0.00 C ATOM 370 CD GLU A 75 -5.203 25.997 57.911 1.00 0.00 C ATOM 371 OE1 GLU A 75 -5.808 27.056 57.928 1.00 0.00 O ATOM 372 OE2 GLU A 75 -3.986 25.907 57.909 1.00 0.00 O ATOM 0 H GLU A 75 -6.920 22.553 57.737 1.00 0.00 H new ATOM 0 HA GLU A 75 -9.233 23.972 58.868 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -7.588 25.909 58.762 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -7.059 24.583 59.779 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -5.413 23.881 58.264 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -6.296 24.461 56.866 1.00 0.00 H new ATOM 379 N PRO A 76 -9.800 25.452 56.868 1.00 0.00 N ATOM 380 CA PRO A 76 -10.334 26.089 55.630 1.00 0.00 C ATOM 381 C PRO A 76 -9.244 26.822 54.852 1.00 0.00 C ATOM 382 O PRO A 76 -8.381 27.474 55.440 1.00 0.00 O ATOM 383 CB PRO A 76 -11.397 27.074 56.138 1.00 0.00 C ATOM 384 CG PRO A 76 -11.147 27.236 57.601 1.00 0.00 C ATOM 385 CD PRO A 76 -10.466 25.955 58.075 1.00 0.00 C ATOM 0 HA PRO A 76 -10.738 25.351 54.937 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -11.320 28.031 55.621 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -12.401 26.692 55.954 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -10.515 28.103 57.792 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -12.082 27.398 58.138 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.752 26.153 58.874 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -11.188 25.237 58.463 1.00 0.00 H new ATOM 393 N GLN A 77 -9.287 26.702 53.529 1.00 0.00 N ATOM 394 CA GLN A 77 -8.293 27.351 52.683 1.00 0.00 C ATOM 395 C GLN A 77 -8.892 28.567 51.983 1.00 0.00 C ATOM 396 O GLN A 77 -10.107 28.658 51.809 1.00 0.00 O ATOM 397 CB GLN A 77 -7.773 26.362 51.638 1.00 0.00 C ATOM 398 CG GLN A 77 -8.949 25.787 50.845 1.00 0.00 C ATOM 399 CD GLN A 77 -8.910 26.300 49.410 1.00 0.00 C ATOM 400 OE1 GLN A 77 -8.226 25.726 48.564 1.00 0.00 O ATOM 401 NE2 GLN A 77 -9.607 27.353 49.083 1.00 0.00 N ATOM 0 H GLN A 77 -9.993 26.166 53.024 1.00 0.00 H new ATOM 0 HA GLN A 77 -7.468 27.682 53.314 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -7.077 26.862 50.964 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.223 25.558 52.126 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -8.905 24.698 50.852 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -9.890 26.071 51.316 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -10.174 27.828 49.786 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -9.585 27.701 48.125 1.00 0.00 H new ATOM 410 N ARG A 78 -8.030 29.497 51.584 1.00 0.00 N ATOM 411 CA ARG A 78 -8.485 30.704 50.904 1.00 0.00 C ATOM 412 C ARG A 78 -7.512 31.091 49.792 1.00 0.00 C ATOM 413 O ARG A 78 -6.316 31.256 50.032 1.00 0.00 O ATOM 414 CB ARG A 78 -8.602 31.855 51.905 1.00 0.00 C ATOM 415 CG ARG A 78 -9.691 32.824 51.443 1.00 0.00 C ATOM 416 CD ARG A 78 -9.698 34.055 52.351 1.00 0.00 C ATOM 417 NE ARG A 78 -10.583 33.836 53.489 1.00 0.00 N ATOM 418 CZ ARG A 78 -11.884 34.090 53.404 1.00 0.00 C ATOM 419 NH1 ARG A 78 -12.389 34.546 52.291 1.00 0.00 N ATOM 420 NH2 ARG A 78 -12.658 33.881 54.433 1.00 0.00 N ATOM 0 H ARG A 78 -7.021 29.439 51.718 1.00 0.00 H new ATOM 0 HA ARG A 78 -9.462 30.505 50.464 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -8.842 31.467 52.895 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -7.648 32.376 51.989 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -9.513 33.122 50.410 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -10.664 32.334 51.470 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -8.687 34.263 52.702 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -10.026 34.929 51.789 1.00 0.00 H new ATOM 0 HE ARG A 78 -10.197 33.482 54.364 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -11.785 34.708 51.485 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -13.388 34.741 52.226 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -12.264 33.523 55.303 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -13.657 34.076 54.368 1.00 0.00 H new ATOM 434 N VAL A 79 -8.034 31.235 48.579 1.00 0.00 N ATOM 435 CA VAL A 79 -7.203 31.603 47.440 1.00 0.00 C ATOM 436 C VAL A 79 -7.576 32.992 46.933 1.00 0.00 C ATOM 437 O VAL A 79 -8.707 33.223 46.505 1.00 0.00 O ATOM 438 CB VAL A 79 -7.375 30.582 46.315 1.00 0.00 C ATOM 439 CG1 VAL A 79 -6.345 30.854 45.219 1.00 0.00 C ATOM 440 CG2 VAL A 79 -7.162 29.173 46.872 1.00 0.00 C ATOM 0 H VAL A 79 -9.022 31.104 48.360 1.00 0.00 H new ATOM 0 HA VAL A 79 -6.162 31.614 47.762 1.00 0.00 H new ATOM 0 HB VAL A 79 -8.379 30.664 45.900 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -6.467 30.127 44.417 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -6.492 31.859 44.823 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.341 30.771 45.635 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -7.284 28.443 46.072 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.157 29.093 47.285 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -7.893 28.977 47.656 1.00 0.00 H new ATOM 450 N ASP A 80 -6.620 33.912 46.985 1.00 0.00 N ATOM 451 CA ASP A 80 -6.859 35.277 46.528 1.00 0.00 C ATOM 452 C ASP A 80 -5.983 35.602 45.323 1.00 0.00 C ATOM 453 O ASP A 80 -4.785 35.320 45.321 1.00 0.00 O ATOM 454 CB ASP A 80 -6.563 36.267 47.657 1.00 0.00 C ATOM 455 CG ASP A 80 -5.399 35.759 48.503 1.00 0.00 C ATOM 456 OD1 ASP A 80 -4.670 34.909 48.021 1.00 0.00 O ATOM 457 OD2 ASP A 80 -5.255 36.231 49.619 1.00 0.00 O ATOM 0 H ASP A 80 -5.678 33.740 47.336 1.00 0.00 H new ATOM 0 HA ASP A 80 -7.906 35.362 46.235 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -6.321 37.245 47.241 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -7.448 36.396 48.280 1.00 0.00 H new ATOM 462 N GLY A 81 -6.589 36.198 44.301 1.00 0.00 N ATOM 463 CA GLY A 81 -5.854 36.557 43.093 1.00 0.00 C ATOM 464 C GLY A 81 -5.934 35.445 42.054 1.00 0.00 C ATOM 465 O GLY A 81 -5.008 35.249 41.267 1.00 0.00 O ATOM 0 H GLY A 81 -7.579 36.441 44.284 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.260 37.479 42.676 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.811 36.752 43.342 1.00 0.00 H new ATOM 469 N ALA A 82 -7.048 34.720 42.054 1.00 0.00 N ATOM 470 CA ALA A 82 -7.238 33.628 41.105 1.00 0.00 C ATOM 471 C ALA A 82 -7.868 34.146 39.815 1.00 0.00 C ATOM 472 O ALA A 82 -8.640 35.103 39.830 1.00 0.00 O ATOM 473 CB ALA A 82 -8.138 32.552 41.720 1.00 0.00 C ATOM 0 H ALA A 82 -7.828 34.867 42.695 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.264 33.197 40.874 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -8.275 31.740 41.005 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.673 32.163 42.626 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -9.107 32.986 41.967 1.00 0.00 H new ATOM 479 N VAL A 83 -7.535 33.503 38.699 1.00 0.00 N ATOM 480 CA VAL A 83 -8.075 33.906 37.406 1.00 0.00 C ATOM 481 C VAL A 83 -9.471 33.324 37.211 1.00 0.00 C ATOM 482 O VAL A 83 -10.423 34.047 36.919 1.00 0.00 O ATOM 483 CB VAL A 83 -7.161 33.421 36.279 1.00 0.00 C ATOM 484 CG1 VAL A 83 -7.645 33.996 34.948 1.00 0.00 C ATOM 485 CG2 VAL A 83 -5.728 33.888 36.545 1.00 0.00 C ATOM 0 H VAL A 83 -6.899 32.707 38.664 1.00 0.00 H new ATOM 0 HA VAL A 83 -8.133 34.994 37.381 1.00 0.00 H new ATOM 0 HB VAL A 83 -7.185 32.332 36.236 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -6.994 33.651 34.144 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -8.665 33.663 34.757 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -7.621 35.085 34.992 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -5.078 33.542 35.742 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.702 34.977 36.589 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.382 33.478 37.494 1.00 0.00 H new ATOM 495 N LEU A 84 -9.582 32.010 37.374 1.00 0.00 N ATOM 496 CA LEU A 84 -10.863 31.333 37.216 1.00 0.00 C ATOM 497 C LEU A 84 -11.017 30.244 38.272 1.00 0.00 C ATOM 498 O LEU A 84 -10.029 29.681 38.748 1.00 0.00 O ATOM 499 CB LEU A 84 -10.972 30.715 35.818 1.00 0.00 C ATOM 500 CG LEU A 84 -9.581 30.572 35.195 1.00 0.00 C ATOM 501 CD1 LEU A 84 -8.790 29.494 35.940 1.00 0.00 C ATOM 502 CD2 LEU A 84 -9.724 30.167 33.725 1.00 0.00 C ATOM 0 H LEU A 84 -8.804 31.395 37.614 1.00 0.00 H new ATOM 0 HA LEU A 84 -11.658 32.068 37.341 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -11.453 29.739 35.880 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -11.600 31.340 35.184 1.00 0.00 H new ATOM 0 HG LEU A 84 -9.054 31.523 35.267 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.800 29.395 35.494 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -8.689 29.776 36.988 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -9.317 28.542 35.870 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -8.735 30.064 33.278 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -10.252 29.216 33.659 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -10.286 30.932 33.190 1.00 0.00 H new ATOM 514 N PRO A 85 -12.230 29.944 38.642 1.00 0.00 N ATOM 515 CA PRO A 85 -12.528 28.900 39.666 1.00 0.00 C ATOM 516 C PRO A 85 -11.949 27.540 39.284 1.00 0.00 C ATOM 517 O PRO A 85 -11.680 27.276 38.113 1.00 0.00 O ATOM 518 CB PRO A 85 -14.060 28.847 39.721 1.00 0.00 C ATOM 519 CG PRO A 85 -14.544 29.570 38.503 1.00 0.00 C ATOM 520 CD PRO A 85 -13.452 30.565 38.124 1.00 0.00 C ATOM 0 HA PRO A 85 -12.079 29.142 40.629 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -14.414 27.816 39.729 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -14.434 29.320 40.629 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -14.732 28.872 37.687 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -15.483 30.084 38.705 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -13.401 30.713 37.045 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -13.627 31.543 38.572 1.00 0.00 H new ATOM 528 N TRP A 86 -11.760 26.684 40.283 1.00 0.00 N ATOM 529 CA TRP A 86 -11.211 25.355 40.044 1.00 0.00 C ATOM 530 C TRP A 86 -12.076 24.292 40.713 1.00 0.00 C ATOM 531 O TRP A 86 -13.236 24.542 41.043 1.00 0.00 O ATOM 532 CB TRP A 86 -9.784 25.276 40.586 1.00 0.00 C ATOM 533 CG TRP A 86 -8.944 26.320 39.922 1.00 0.00 C ATOM 534 CD1 TRP A 86 -9.063 27.653 40.120 1.00 0.00 C ATOM 535 CD2 TRP A 86 -7.866 26.144 38.958 1.00 0.00 C ATOM 536 NE1 TRP A 86 -8.128 28.306 39.338 1.00 0.00 N ATOM 537 CE2 TRP A 86 -7.366 27.419 38.604 1.00 0.00 C ATOM 538 CE3 TRP A 86 -7.278 25.013 38.363 1.00 0.00 C ATOM 539 CZ2 TRP A 86 -6.320 27.567 37.693 1.00 0.00 C ATOM 540 CZ3 TRP A 86 -6.226 25.158 37.444 1.00 0.00 C ATOM 541 CH2 TRP A 86 -5.749 26.433 37.109 1.00 0.00 C ATOM 0 H TRP A 86 -11.977 26.885 41.259 1.00 0.00 H new ATOM 0 HA TRP A 86 -11.200 25.172 38.970 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -9.784 25.426 41.666 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -9.367 24.286 40.401 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -9.772 28.129 40.781 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -8.015 29.319 39.307 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -7.638 24.026 38.615 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -5.954 28.551 37.441 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -5.782 24.283 36.993 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -4.941 26.539 36.400 1.00 0.00 H new ATOM 552 N SER A 87 -11.507 23.115 40.920 1.00 0.00 N ATOM 553 CA SER A 87 -12.228 22.004 41.533 1.00 0.00 C ATOM 554 C SER A 87 -11.402 21.356 42.621 1.00 0.00 C ATOM 555 O SER A 87 -10.185 21.223 42.483 1.00 0.00 O ATOM 556 CB SER A 87 -12.668 20.974 40.462 1.00 0.00 C ATOM 557 OG SER A 87 -13.578 21.523 39.503 1.00 0.00 O ATOM 0 H SER A 87 -10.541 22.901 40.671 1.00 0.00 H new ATOM 0 HA SER A 87 -13.130 22.400 42.000 1.00 0.00 H new ATOM 0 HB2 SER A 87 -11.786 20.596 39.944 1.00 0.00 H new ATOM 0 HB3 SER A 87 -13.137 20.123 40.955 1.00 0.00 H new ATOM 0 HG SER A 87 -13.210 22.357 39.143 1.00 0.00 H new ATOM 563 N LEU A 88 -12.064 20.894 43.678 1.00 0.00 N ATOM 564 CA LEU A 88 -11.373 20.226 44.773 1.00 0.00 C ATOM 565 C LEU A 88 -12.036 18.885 45.074 1.00 0.00 C ATOM 566 O LEU A 88 -13.255 18.753 44.980 1.00 0.00 O ATOM 567 CB LEU A 88 -11.400 21.107 46.024 1.00 0.00 C ATOM 568 CG LEU A 88 -9.989 21.214 46.609 1.00 0.00 C ATOM 569 CD1 LEU A 88 -9.958 22.322 47.663 1.00 0.00 C ATOM 570 CD2 LEU A 88 -9.600 19.881 47.255 1.00 0.00 C ATOM 0 H LEU A 88 -13.074 20.970 43.798 1.00 0.00 H new ATOM 0 HA LEU A 88 -10.338 20.052 44.479 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.777 22.099 45.774 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -12.080 20.685 46.764 1.00 0.00 H new ATOM 0 HG LEU A 88 -9.282 21.450 45.813 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -8.954 22.399 48.080 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -10.233 23.271 47.202 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -10.665 22.087 48.459 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -8.596 19.958 47.671 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -10.305 19.643 48.051 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -9.622 19.092 46.503 1.00 0.00 H new ATOM 582 N HIS A 89 -11.227 17.893 45.435 1.00 0.00 N ATOM 583 CA HIS A 89 -11.754 16.569 45.741 1.00 0.00 C ATOM 584 C HIS A 89 -11.679 16.285 47.237 1.00 0.00 C ATOM 585 O HIS A 89 -10.611 16.365 47.843 1.00 0.00 O ATOM 586 CB HIS A 89 -10.968 15.501 44.978 1.00 0.00 C ATOM 587 CG HIS A 89 -9.536 15.938 44.835 1.00 0.00 C ATOM 588 ND1 HIS A 89 -8.967 17.060 44.284 1.00 0.00 N flip ATOM 589 CD2 HIS A 89 -8.479 15.167 45.296 1.00 0.00 C flip ATOM 590 CE1 HIS A 89 -7.583 16.989 44.400 1.00 0.00 C flip ATOM 591 NE2 HIS A 89 -7.341 15.829 45.017 1.00 0.00 N flip ATOM 0 H HIS A 89 -10.214 17.980 45.522 1.00 0.00 H new ATOM 0 HA HIS A 89 -12.799 16.542 45.433 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -11.018 14.550 45.508 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -11.411 15.342 43.995 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -8.555 14.209 45.789 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -6.859 17.716 44.063 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -6.408 15.487 45.248 1.00 0.00 H new ATOM 600 N ILE A 90 -12.822 15.944 47.824 1.00 0.00 N ATOM 601 CA ILE A 90 -12.882 15.639 49.248 1.00 0.00 C ATOM 602 C ILE A 90 -13.617 14.321 49.471 1.00 0.00 C ATOM 603 O ILE A 90 -14.722 14.123 48.964 1.00 0.00 O ATOM 604 CB ILE A 90 -13.595 16.771 49.997 1.00 0.00 C ATOM 605 CG1 ILE A 90 -12.566 17.813 50.435 1.00 0.00 C ATOM 606 CG2 ILE A 90 -14.307 16.214 51.232 1.00 0.00 C ATOM 607 CD1 ILE A 90 -13.274 19.133 50.744 1.00 0.00 C ATOM 0 H ILE A 90 -13.716 15.872 47.337 1.00 0.00 H new ATOM 0 HA ILE A 90 -11.866 15.545 49.632 1.00 0.00 H new ATOM 0 HB ILE A 90 -14.330 17.230 49.336 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -12.029 17.461 51.316 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -11.826 17.961 49.649 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -14.811 17.025 51.758 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -15.041 15.470 50.924 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -13.577 15.750 51.895 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -12.540 19.875 51.056 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -13.790 19.486 49.852 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -13.997 18.979 51.545 1.00 0.00 H new ATOM 619 N THR A 91 -12.998 13.419 50.225 1.00 0.00 N ATOM 620 CA THR A 91 -13.606 12.121 50.497 1.00 0.00 C ATOM 621 C THR A 91 -14.076 12.032 51.946 1.00 0.00 C ATOM 622 O THR A 91 -13.288 12.196 52.876 1.00 0.00 O ATOM 623 CB THR A 91 -12.599 11.002 50.218 1.00 0.00 C ATOM 624 OG1 THR A 91 -11.449 11.549 49.589 1.00 0.00 O ATOM 625 CG2 THR A 91 -13.234 9.953 49.303 1.00 0.00 C ATOM 0 H THR A 91 -12.084 13.560 50.655 1.00 0.00 H new ATOM 0 HA THR A 91 -14.470 12.008 49.842 1.00 0.00 H new ATOM 0 HB THR A 91 -12.311 10.531 51.158 1.00 0.00 H new ATOM 0 HG1 THR A 91 -10.802 10.834 49.411 1.00 0.00 H new ATOM 0 HG21 THR A 91 -12.514 9.158 49.107 1.00 0.00 H new ATOM 0 HG22 THR A 91 -14.115 9.533 49.788 1.00 0.00 H new ATOM 0 HG23 THR A 91 -13.525 10.419 48.362 1.00 0.00 H new ATOM 633 N THR A 92 -15.366 11.765 52.125 1.00 0.00 N ATOM 634 CA THR A 92 -15.934 11.647 53.464 1.00 0.00 C ATOM 635 C THR A 92 -16.663 10.317 53.612 1.00 0.00 C ATOM 636 O THR A 92 -17.544 9.990 52.816 1.00 0.00 O ATOM 637 CB THR A 92 -16.910 12.797 53.722 1.00 0.00 C ATOM 638 OG1 THR A 92 -16.346 14.012 53.248 1.00 0.00 O ATOM 639 CG2 THR A 92 -17.186 12.910 55.222 1.00 0.00 C ATOM 0 H THR A 92 -16.034 11.627 51.366 1.00 0.00 H new ATOM 0 HA THR A 92 -15.123 11.692 54.191 1.00 0.00 H new ATOM 0 HB THR A 92 -17.846 12.603 53.198 1.00 0.00 H new ATOM 0 HG1 THR A 92 -16.971 14.749 53.411 1.00 0.00 H new ATOM 0 HG21 THR A 92 -17.881 13.730 55.403 1.00 0.00 H new ATOM 0 HG22 THR A 92 -17.621 11.978 55.583 1.00 0.00 H new ATOM 0 HG23 THR A 92 -16.252 13.103 55.750 1.00 0.00 H new ATOM 647 N ASN A 93 -16.291 9.552 54.633 1.00 0.00 N ATOM 648 CA ASN A 93 -16.920 8.256 54.871 1.00 0.00 C ATOM 649 C ASN A 93 -17.412 7.652 53.559 1.00 0.00 C ATOM 650 O ASN A 93 -16.697 7.656 52.556 1.00 0.00 O ATOM 651 CB ASN A 93 -18.097 8.420 55.834 1.00 0.00 C ATOM 652 CG ASN A 93 -17.778 9.494 56.868 1.00 0.00 C ATOM 653 OD1 ASN A 93 -16.611 9.713 57.197 1.00 0.00 O ATOM 654 ND2 ASN A 93 -18.749 10.180 57.404 1.00 0.00 N ATOM 0 H ASN A 93 -15.564 9.803 55.304 1.00 0.00 H new ATOM 0 HA ASN A 93 -16.181 7.586 55.311 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -18.996 8.692 55.280 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -18.304 7.473 56.333 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -18.543 10.900 58.097 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -19.714 9.997 57.130 1.00 0.00 H new ATOM 661 N ASP A 94 -18.635 7.133 53.574 1.00 0.00 N ATOM 662 CA ASP A 94 -19.211 6.528 52.378 1.00 0.00 C ATOM 663 C ASP A 94 -20.683 6.906 52.242 1.00 0.00 C ATOM 664 O ASP A 94 -21.549 6.305 52.877 1.00 0.00 O ATOM 665 CB ASP A 94 -19.078 5.006 52.446 1.00 0.00 C ATOM 666 CG ASP A 94 -17.866 4.626 53.290 1.00 0.00 C ATOM 667 OD1 ASP A 94 -16.847 5.285 53.161 1.00 0.00 O ATOM 668 OD2 ASP A 94 -17.975 3.681 54.055 1.00 0.00 O ATOM 0 H ASP A 94 -19.242 7.119 54.393 1.00 0.00 H new ATOM 0 HA ASP A 94 -18.669 6.901 51.509 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -19.981 4.573 52.876 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -18.975 4.596 51.441 1.00 0.00 H new ATOM 673 N ALA A 95 -20.959 7.906 51.410 1.00 0.00 N ATOM 674 CA ALA A 95 -22.330 8.355 51.199 1.00 0.00 C ATOM 675 C ALA A 95 -22.350 9.677 50.438 1.00 0.00 C ATOM 676 O ALA A 95 -21.316 10.145 49.961 1.00 0.00 O ATOM 677 CB ALA A 95 -23.037 8.526 52.545 1.00 0.00 C ATOM 0 H ALA A 95 -20.257 8.417 50.875 1.00 0.00 H new ATOM 0 HA ALA A 95 -22.852 7.602 50.609 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -24.061 8.862 52.378 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -23.049 7.573 53.073 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -22.506 9.266 53.144 1.00 0.00 H new ATOM 683 N ALA A 96 -23.533 10.274 50.329 1.00 0.00 N ATOM 684 CA ALA A 96 -23.675 11.542 49.623 1.00 0.00 C ATOM 685 C ALA A 96 -23.514 12.714 50.586 1.00 0.00 C ATOM 686 O ALA A 96 -24.062 12.703 51.688 1.00 0.00 O ATOM 687 CB ALA A 96 -25.048 11.617 48.955 1.00 0.00 C ATOM 0 H ALA A 96 -24.400 9.904 50.717 1.00 0.00 H new ATOM 0 HA ALA A 96 -22.896 11.600 48.863 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -25.146 12.567 48.430 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -25.152 10.797 48.244 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -25.827 11.540 49.714 1.00 0.00 H new ATOM 693 N VAL A 97 -22.761 13.723 50.165 1.00 0.00 N ATOM 694 CA VAL A 97 -22.535 14.897 50.998 1.00 0.00 C ATOM 695 C VAL A 97 -22.646 16.170 50.166 1.00 0.00 C ATOM 696 O VAL A 97 -22.521 16.136 48.943 1.00 0.00 O ATOM 697 CB VAL A 97 -21.150 14.818 51.639 1.00 0.00 C ATOM 698 CG1 VAL A 97 -21.289 14.429 53.112 1.00 0.00 C ATOM 699 CG2 VAL A 97 -20.312 13.764 50.911 1.00 0.00 C ATOM 0 H VAL A 97 -22.299 13.752 49.256 1.00 0.00 H new ATOM 0 HA VAL A 97 -23.295 14.922 51.779 1.00 0.00 H new ATOM 0 HB VAL A 97 -20.660 15.789 51.565 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -20.301 14.373 53.568 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -21.886 15.178 53.631 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -21.779 13.458 53.187 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -19.324 13.706 51.367 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -20.803 12.794 50.985 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -20.212 14.040 49.861 1.00 0.00 H new ATOM 709 N MET A 98 -22.884 17.293 50.837 1.00 0.00 N ATOM 710 CA MET A 98 -23.011 18.570 50.143 1.00 0.00 C ATOM 711 C MET A 98 -22.127 19.629 50.794 1.00 0.00 C ATOM 712 O MET A 98 -21.927 19.623 52.008 1.00 0.00 O ATOM 713 CB MET A 98 -24.468 19.036 50.168 1.00 0.00 C ATOM 714 CG MET A 98 -25.106 18.644 51.502 1.00 0.00 C ATOM 715 SD MET A 98 -25.781 16.968 51.384 1.00 0.00 S ATOM 716 CE MET A 98 -25.608 16.532 53.131 1.00 0.00 C ATOM 0 H MET A 98 -22.992 17.345 51.850 1.00 0.00 H new ATOM 0 HA MET A 98 -22.690 18.431 49.111 1.00 0.00 H new ATOM 0 HB2 MET A 98 -24.518 20.116 50.032 1.00 0.00 H new ATOM 0 HB3 MET A 98 -25.019 18.585 49.343 1.00 0.00 H new ATOM 0 HG2 MET A 98 -24.364 18.693 52.299 1.00 0.00 H new ATOM 0 HG3 MET A 98 -25.897 19.348 51.759 1.00 0.00 H new ATOM 0 HE1 MET A 98 -25.972 15.517 53.290 1.00 0.00 H new ATOM 0 HE2 MET A 98 -24.558 16.591 53.418 1.00 0.00 H new ATOM 0 HE3 MET A 98 -26.190 17.225 53.738 1.00 0.00 H new ATOM 726 N GLY A 99 -21.603 20.539 49.977 1.00 0.00 N ATOM 727 CA GLY A 99 -20.744 21.601 50.482 1.00 0.00 C ATOM 728 C GLY A 99 -21.389 22.966 50.269 1.00 0.00 C ATOM 729 O GLY A 99 -22.169 23.156 49.337 1.00 0.00 O ATOM 0 H GLY A 99 -21.758 20.561 48.969 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.552 21.446 51.544 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -19.779 21.566 49.976 1.00 0.00 H new ATOM 733 N ASN A 100 -21.059 23.916 51.140 1.00 0.00 N ATOM 734 CA ASN A 100 -21.615 25.259 51.034 1.00 0.00 C ATOM 735 C ASN A 100 -20.529 26.261 50.656 1.00 0.00 C ATOM 736 O ASN A 100 -19.596 26.496 51.423 1.00 0.00 O ATOM 737 CB ASN A 100 -22.248 25.668 52.364 1.00 0.00 C ATOM 738 CG ASN A 100 -23.285 26.763 52.132 1.00 0.00 C ATOM 739 OD1 ASN A 100 -22.967 27.948 52.216 1.00 0.00 O ATOM 740 ND2 ASN A 100 -24.514 26.433 51.843 1.00 0.00 N ATOM 0 H ASN A 100 -20.415 23.782 51.920 1.00 0.00 H new ATOM 0 HA ASN A 100 -22.377 25.256 50.255 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -22.718 24.804 52.834 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -21.478 26.024 53.049 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -25.213 27.159 51.686 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -24.775 25.449 51.774 1.00 0.00 H new ATOM 747 N ILE A 101 -20.660 26.848 49.473 1.00 0.00 N ATOM 748 CA ILE A 101 -19.684 27.826 49.005 1.00 0.00 C ATOM 749 C ILE A 101 -20.388 29.057 48.443 1.00 0.00 C ATOM 750 O ILE A 101 -21.399 28.943 47.750 1.00 0.00 O ATOM 751 CB ILE A 101 -18.796 27.204 47.927 1.00 0.00 C ATOM 752 CG1 ILE A 101 -18.089 28.315 47.148 1.00 0.00 C ATOM 753 CG2 ILE A 101 -19.654 26.376 46.968 1.00 0.00 C ATOM 754 CD1 ILE A 101 -16.704 27.833 46.710 1.00 0.00 C ATOM 0 H ILE A 101 -21.426 26.667 48.824 1.00 0.00 H new ATOM 0 HA ILE A 101 -19.067 28.130 49.850 1.00 0.00 H new ATOM 0 HB ILE A 101 -18.054 26.558 48.397 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -18.680 28.595 46.276 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -17.996 29.206 47.769 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -19.019 25.934 46.201 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -20.158 25.584 47.522 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -20.397 27.019 46.497 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -16.202 28.625 46.155 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -16.114 27.575 47.589 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -16.809 26.955 46.073 1.00 0.00 H new ATOM 766 N VAL A 102 -19.849 30.231 48.750 1.00 0.00 N ATOM 767 CA VAL A 102 -20.435 31.478 48.271 1.00 0.00 C ATOM 768 C VAL A 102 -19.359 32.379 47.671 1.00 0.00 C ATOM 769 O VAL A 102 -18.166 32.158 47.874 1.00 0.00 O ATOM 770 CB VAL A 102 -21.130 32.203 49.424 1.00 0.00 C ATOM 771 CG1 VAL A 102 -22.172 33.175 48.868 1.00 0.00 C ATOM 772 CG2 VAL A 102 -21.821 31.176 50.326 1.00 0.00 C ATOM 0 H VAL A 102 -19.014 30.346 49.324 1.00 0.00 H new ATOM 0 HA VAL A 102 -21.166 31.243 47.498 1.00 0.00 H new ATOM 0 HB VAL A 102 -20.390 32.759 50.001 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -22.665 33.690 49.692 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -21.681 33.906 48.225 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -22.913 32.623 48.290 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -22.317 31.690 51.149 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -22.559 30.621 49.747 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -21.079 30.485 50.725 1.00 0.00 H new ATOM 782 N ALA A 103 -19.792 33.395 46.932 1.00 0.00 N ATOM 783 CA ALA A 103 -18.858 34.326 46.306 1.00 0.00 C ATOM 784 C ALA A 103 -19.427 35.741 46.319 1.00 0.00 C ATOM 785 O ALA A 103 -20.640 35.932 46.242 1.00 0.00 O ATOM 786 CB ALA A 103 -18.582 33.894 44.864 1.00 0.00 C ATOM 0 H ALA A 103 -20.776 33.595 46.752 1.00 0.00 H new ATOM 0 HA ALA A 103 -17.926 34.317 46.871 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -17.884 34.593 44.402 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -18.149 32.893 44.860 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -19.515 33.888 44.301 1.00 0.00 H new ATOM 792 N GLN A 104 -18.544 36.730 46.416 1.00 0.00 N ATOM 793 CA GLN A 104 -18.973 38.124 46.436 1.00 0.00 C ATOM 794 C GLN A 104 -18.168 38.942 45.429 1.00 0.00 C ATOM 795 O GLN A 104 -17.424 39.850 45.796 1.00 0.00 O ATOM 796 CB GLN A 104 -18.800 38.703 47.845 1.00 0.00 C ATOM 797 CG GLN A 104 -20.174 38.951 48.470 1.00 0.00 C ATOM 798 CD GLN A 104 -20.015 39.602 49.841 1.00 0.00 C ATOM 799 OE1 GLN A 104 -18.823 39.746 50.350 1.00 0.00 O flip ATOM 800 NE2 GLN A 104 -21.003 39.990 50.463 1.00 0.00 N flip ATOM 0 H GLN A 104 -17.535 36.594 46.481 1.00 0.00 H new ATOM 0 HA GLN A 104 -20.026 38.172 46.159 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -18.227 38.014 48.465 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -18.236 39.635 47.800 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -20.767 39.594 47.820 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -20.714 38.009 48.566 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -21.934 39.876 50.063 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -20.891 40.425 51.379 1.00 0.00 H new ATOM 809 N GLY A 105 -18.324 38.610 44.150 1.00 0.00 N ATOM 810 CA GLY A 105 -17.609 39.317 43.094 1.00 0.00 C ATOM 811 C GLY A 105 -18.581 40.004 42.143 1.00 0.00 C ATOM 812 O GLY A 105 -19.772 39.691 42.124 1.00 0.00 O ATOM 0 H GLY A 105 -18.935 37.861 43.822 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -16.941 40.057 43.535 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -16.986 38.616 42.539 1.00 0.00 H new ATOM 816 N ASN A 106 -18.068 40.943 41.355 1.00 0.00 N ATOM 817 CA ASN A 106 -18.903 41.669 40.405 1.00 0.00 C ATOM 818 C ASN A 106 -19.027 40.894 39.096 1.00 0.00 C ATOM 819 O ASN A 106 -18.775 41.434 38.019 1.00 0.00 O ATOM 820 CB ASN A 106 -18.305 43.050 40.129 1.00 0.00 C ATOM 821 CG ASN A 106 -16.793 43.013 40.320 1.00 0.00 C ATOM 822 OD1 ASN A 106 -16.311 42.767 41.428 1.00 0.00 O ATOM 823 ND2 ASN A 106 -16.009 43.246 39.304 1.00 0.00 N ATOM 0 H ASN A 106 -17.086 41.218 41.355 1.00 0.00 H new ATOM 0 HA ASN A 106 -19.896 41.785 40.840 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -18.544 43.362 39.112 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -18.746 43.787 40.800 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -14.997 43.225 39.426 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -16.408 43.449 38.388 1.00 0.00 H new ATOM 830 N SER A 107 -19.417 39.628 39.198 1.00 0.00 N ATOM 831 CA SER A 107 -19.573 38.788 38.015 1.00 0.00 C ATOM 832 C SER A 107 -20.988 38.913 37.457 1.00 0.00 C ATOM 833 O SER A 107 -21.743 39.802 37.849 1.00 0.00 O ATOM 834 CB SER A 107 -19.286 37.328 38.370 1.00 0.00 C ATOM 835 OG SER A 107 -17.881 37.141 38.478 1.00 0.00 O ATOM 0 H SER A 107 -19.630 39.163 40.081 1.00 0.00 H new ATOM 0 HA SER A 107 -18.864 39.121 37.256 1.00 0.00 H new ATOM 0 HB2 SER A 107 -19.773 37.067 39.310 1.00 0.00 H new ATOM 0 HB3 SER A 107 -19.695 36.668 37.605 1.00 0.00 H new ATOM 0 HG SER A 107 -17.692 36.207 38.707 1.00 0.00 H new ATOM 841 N ASP A 108 -21.341 38.020 36.538 1.00 0.00 N ATOM 842 CA ASP A 108 -22.668 38.047 35.935 1.00 0.00 C ATOM 843 C ASP A 108 -23.481 36.827 36.359 1.00 0.00 C ATOM 844 O ASP A 108 -24.664 36.939 36.678 1.00 0.00 O ATOM 845 CB ASP A 108 -22.550 38.074 34.410 1.00 0.00 C ATOM 846 CG ASP A 108 -23.623 38.984 33.821 1.00 0.00 C ATOM 847 OD1 ASP A 108 -23.718 40.119 34.261 1.00 0.00 O ATOM 848 OD2 ASP A 108 -24.335 38.534 32.939 1.00 0.00 O ATOM 0 H ASP A 108 -20.733 37.275 36.197 1.00 0.00 H new ATOM 0 HA ASP A 108 -23.179 38.946 36.278 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -21.561 38.429 34.120 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -22.657 37.065 34.011 1.00 0.00 H new ATOM 853 N SER A 109 -22.839 35.667 36.371 1.00 0.00 N ATOM 854 CA SER A 109 -23.504 34.420 36.739 1.00 0.00 C ATOM 855 C SER A 109 -22.730 33.690 37.811 1.00 0.00 C ATOM 856 O SER A 109 -21.535 33.420 37.640 1.00 0.00 O ATOM 857 CB SER A 109 -23.730 33.528 35.493 1.00 0.00 C ATOM 858 OG SER A 109 -24.373 32.287 35.805 1.00 0.00 O ATOM 0 H SER A 109 -21.854 35.561 36.129 1.00 0.00 H new ATOM 0 HA SER A 109 -24.483 34.664 37.152 1.00 0.00 H new ATOM 0 HB2 SER A 109 -24.335 34.072 34.768 1.00 0.00 H new ATOM 0 HB3 SER A 109 -22.770 33.325 35.019 1.00 0.00 H new ATOM 0 HG SER A 109 -24.492 31.765 34.984 1.00 0.00 H new ATOM 864 N ILE A 110 -23.404 33.319 38.892 1.00 0.00 N ATOM 865 CA ILE A 110 -22.762 32.590 39.982 1.00 0.00 C ATOM 866 C ILE A 110 -23.710 31.535 40.544 1.00 0.00 C ATOM 867 O ILE A 110 -24.927 31.722 40.549 1.00 0.00 O ATOM 868 CB ILE A 110 -22.354 33.561 41.092 1.00 0.00 C ATOM 869 CG1 ILE A 110 -20.988 34.169 40.759 1.00 0.00 C ATOM 870 CG2 ILE A 110 -22.266 32.812 42.422 1.00 0.00 C ATOM 871 CD1 ILE A 110 -20.836 35.507 41.483 1.00 0.00 C ATOM 0 H ILE A 110 -24.395 33.510 39.039 1.00 0.00 H new ATOM 0 HA ILE A 110 -21.872 32.095 39.593 1.00 0.00 H new ATOM 0 HB ILE A 110 -23.098 34.354 41.171 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -20.192 33.488 41.060 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -20.895 34.313 39.683 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -21.975 33.505 43.211 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -23.237 32.378 42.660 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -21.523 32.018 42.344 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -19.864 35.940 41.247 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -21.625 36.187 41.160 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -20.911 35.349 42.559 1.00 0.00 H new ATOM 883 N GLY A 111 -23.148 30.427 41.016 1.00 0.00 N ATOM 884 CA GLY A 111 -23.957 29.353 41.578 1.00 0.00 C ATOM 885 C GLY A 111 -23.087 28.174 41.999 1.00 0.00 C ATOM 886 O GLY A 111 -21.929 28.067 41.593 1.00 0.00 O ATOM 0 H GLY A 111 -22.143 30.250 41.021 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -24.513 29.724 42.439 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -24.691 29.023 40.843 1.00 0.00 H new ATOM 890 N CYS A 112 -23.652 27.289 42.815 1.00 0.00 N ATOM 891 CA CYS A 112 -22.917 26.121 43.285 1.00 0.00 C ATOM 892 C CYS A 112 -23.589 24.836 42.809 1.00 0.00 C ATOM 893 O CYS A 112 -24.766 24.836 42.450 1.00 0.00 O ATOM 894 CB CYS A 112 -22.849 26.126 44.813 1.00 0.00 C ATOM 895 SG CYS A 112 -24.379 26.824 45.483 1.00 0.00 S ATOM 0 H CYS A 112 -24.609 27.358 43.162 1.00 0.00 H new ATOM 0 HA CYS A 112 -21.908 26.163 42.876 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -22.706 25.111 45.185 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -21.993 26.711 45.148 1.00 0.00 H new ATOM 0 HG CYS A 112 -25.386 26.438 44.757 1.00 0.00 H new ATOM 901 N ARG A 113 -22.830 23.744 42.808 1.00 0.00 N ATOM 902 CA ARG A 113 -23.362 22.457 42.373 1.00 0.00 C ATOM 903 C ARG A 113 -22.643 21.311 43.080 1.00 0.00 C ATOM 904 O ARG A 113 -21.502 21.460 43.520 1.00 0.00 O ATOM 905 CB ARG A 113 -23.197 22.308 40.859 1.00 0.00 C ATOM 906 CG ARG A 113 -21.731 22.536 40.482 1.00 0.00 C ATOM 907 CD ARG A 113 -21.602 22.608 38.960 1.00 0.00 C ATOM 908 NE ARG A 113 -21.922 21.315 38.365 1.00 0.00 N ATOM 909 CZ ARG A 113 -21.709 21.081 37.073 1.00 0.00 C ATOM 910 NH1 ARG A 113 -21.213 22.018 36.312 1.00 0.00 N ATOM 911 NH2 ARG A 113 -21.998 19.914 36.567 1.00 0.00 N ATOM 0 H ARG A 113 -21.853 23.724 43.101 1.00 0.00 H new ATOM 0 HA ARG A 113 -24.421 22.419 42.629 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -23.515 21.314 40.544 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -23.833 23.025 40.340 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -21.368 23.460 40.933 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -21.114 21.727 40.872 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -22.272 23.373 38.567 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -20.588 22.901 38.687 1.00 0.00 H new ATOM 0 HE ARG A 113 -22.316 20.578 38.950 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -20.988 22.931 36.708 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -21.050 21.838 35.321 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -22.387 19.182 37.162 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -21.835 19.733 35.576 1.00 0.00 H new ATOM 925 N ILE A 114 -23.316 20.171 43.181 1.00 0.00 N ATOM 926 CA ILE A 114 -22.733 19.005 43.833 1.00 0.00 C ATOM 927 C ILE A 114 -23.052 17.740 43.045 1.00 0.00 C ATOM 928 O ILE A 114 -24.213 17.343 42.932 1.00 0.00 O ATOM 929 CB ILE A 114 -23.276 18.871 45.257 1.00 0.00 C ATOM 930 CG1 ILE A 114 -22.624 19.928 46.151 1.00 0.00 C ATOM 931 CG2 ILE A 114 -22.955 17.477 45.800 1.00 0.00 C ATOM 932 CD1 ILE A 114 -23.694 20.589 47.022 1.00 0.00 C ATOM 0 H ILE A 114 -24.260 20.029 42.822 1.00 0.00 H new ATOM 0 HA ILE A 114 -21.652 19.137 43.871 1.00 0.00 H new ATOM 0 HB ILE A 114 -24.356 19.016 45.248 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -21.861 19.468 46.779 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -22.123 20.678 45.539 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -23.343 17.384 46.814 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -23.418 16.723 45.164 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -21.875 17.330 45.809 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -23.230 21.342 47.659 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -24.440 21.063 46.384 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -24.175 19.834 47.644 1.00 0.00 H new ATOM 944 N THR A 115 -22.017 17.108 42.501 1.00 0.00 N ATOM 945 CA THR A 115 -22.202 15.888 41.723 1.00 0.00 C ATOM 946 C THR A 115 -21.494 14.713 42.390 1.00 0.00 C ATOM 947 O THR A 115 -20.301 14.781 42.686 1.00 0.00 O ATOM 948 CB THR A 115 -21.655 16.080 40.307 1.00 0.00 C ATOM 949 OG1 THR A 115 -20.253 15.853 40.311 1.00 0.00 O ATOM 950 CG2 THR A 115 -21.943 17.506 39.835 1.00 0.00 C ATOM 0 H THR A 115 -21.049 17.417 42.583 1.00 0.00 H new ATOM 0 HA THR A 115 -23.269 15.672 41.672 1.00 0.00 H new ATOM 0 HB THR A 115 -22.137 15.374 39.631 1.00 0.00 H new ATOM 0 HG1 THR A 115 -19.938 15.768 41.235 1.00 0.00 H new ATOM 0 HG21 THR A 115 -21.553 17.641 38.826 1.00 0.00 H new ATOM 0 HG22 THR A 115 -23.019 17.678 39.834 1.00 0.00 H new ATOM 0 HG23 THR A 115 -21.462 18.216 40.508 1.00 0.00 H new ATOM 958 N VAL A 116 -22.237 13.634 42.617 1.00 0.00 N ATOM 959 CA VAL A 116 -21.673 12.445 43.246 1.00 0.00 C ATOM 960 C VAL A 116 -21.919 11.218 42.373 1.00 0.00 C ATOM 961 O VAL A 116 -23.023 11.018 41.865 1.00 0.00 O ATOM 962 CB VAL A 116 -22.302 12.234 44.625 1.00 0.00 C ATOM 963 CG1 VAL A 116 -22.248 10.750 44.996 1.00 0.00 C ATOM 964 CG2 VAL A 116 -21.529 13.046 45.665 1.00 0.00 C ATOM 0 H VAL A 116 -23.225 13.559 42.376 1.00 0.00 H new ATOM 0 HA VAL A 116 -20.598 12.587 43.361 1.00 0.00 H new ATOM 0 HB VAL A 116 -23.341 12.562 44.602 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -22.697 10.604 45.979 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -22.799 10.170 44.256 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -21.210 10.418 45.018 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -21.976 12.897 46.648 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -20.490 12.717 45.685 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -21.570 14.104 45.404 1.00 0.00 H new ATOM 974 N ASP A 117 -20.884 10.402 42.197 1.00 0.00 N ATOM 975 CA ASP A 117 -21.003 9.200 41.380 1.00 0.00 C ATOM 976 C ASP A 117 -21.581 9.541 40.010 1.00 0.00 C ATOM 977 O ASP A 117 -22.154 8.684 39.337 1.00 0.00 O ATOM 978 CB ASP A 117 -21.905 8.180 42.077 1.00 0.00 C ATOM 979 CG ASP A 117 -21.100 7.386 43.101 1.00 0.00 C ATOM 980 OD1 ASP A 117 -20.126 6.766 42.707 1.00 0.00 O ATOM 981 OD2 ASP A 117 -21.468 7.413 44.264 1.00 0.00 O ATOM 0 H ASP A 117 -19.961 10.550 42.605 1.00 0.00 H new ATOM 0 HA ASP A 117 -20.009 8.773 41.248 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -22.733 8.691 42.569 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -22.340 7.504 41.341 1.00 0.00 H new ATOM 986 N GLY A 118 -21.428 10.797 39.605 1.00 0.00 N ATOM 987 CA GLY A 118 -21.940 11.242 38.314 1.00 0.00 C ATOM 988 C GLY A 118 -23.446 11.466 38.375 1.00 0.00 C ATOM 989 O GLY A 118 -24.092 11.695 37.352 1.00 0.00 O ATOM 0 H GLY A 118 -20.957 11.521 40.148 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -21.442 12.166 38.020 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -21.709 10.499 37.551 1.00 0.00 H new ATOM 993 N LYS A 119 -23.999 11.398 39.581 1.00 0.00 N ATOM 994 CA LYS A 119 -25.431 11.595 39.768 1.00 0.00 C ATOM 995 C LYS A 119 -25.689 12.795 40.676 1.00 0.00 C ATOM 996 O LYS A 119 -25.159 12.868 41.785 1.00 0.00 O ATOM 997 CB LYS A 119 -26.056 10.340 40.384 1.00 0.00 C ATOM 998 CG LYS A 119 -27.200 9.844 39.495 1.00 0.00 C ATOM 999 CD LYS A 119 -26.626 9.225 38.219 1.00 0.00 C ATOM 1000 CE LYS A 119 -27.557 8.115 37.726 1.00 0.00 C ATOM 1001 NZ LYS A 119 -27.028 7.552 36.451 1.00 0.00 N ATOM 0 H LYS A 119 -23.481 11.209 40.439 1.00 0.00 H new ATOM 0 HA LYS A 119 -25.885 11.784 38.795 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -25.301 9.561 40.490 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -26.429 10.561 41.384 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -27.798 9.107 40.032 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -27.864 10.671 39.243 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -26.515 9.989 37.450 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -25.632 8.821 38.413 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -27.634 7.330 38.478 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -28.561 8.510 37.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -27.661 6.798 36.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -26.976 8.304 35.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -26.078 7.161 36.612 1.00 0.00 H new ATOM 1015 N VAL A 120 -26.502 13.731 40.199 1.00 0.00 N ATOM 1016 CA VAL A 120 -26.816 14.922 40.978 1.00 0.00 C ATOM 1017 C VAL A 120 -27.780 14.588 42.112 1.00 0.00 C ATOM 1018 O VAL A 120 -28.728 13.824 41.931 1.00 0.00 O ATOM 1019 CB VAL A 120 -27.438 15.990 40.077 1.00 0.00 C ATOM 1020 CG1 VAL A 120 -28.821 15.529 39.614 1.00 0.00 C ATOM 1021 CG2 VAL A 120 -27.572 17.299 40.860 1.00 0.00 C ATOM 0 H VAL A 120 -26.952 13.689 39.285 1.00 0.00 H new ATOM 0 HA VAL A 120 -25.889 15.303 41.406 1.00 0.00 H new ATOM 0 HB VAL A 120 -26.800 16.148 39.207 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -29.263 16.291 38.972 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -28.726 14.596 39.058 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -29.461 15.370 40.482 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -28.015 18.062 40.220 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -28.210 17.139 41.729 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -26.586 17.629 41.189 1.00 0.00 H new ATOM 1031 N ARG A 121 -27.531 15.169 43.282 1.00 0.00 N ATOM 1032 CA ARG A 121 -28.382 14.932 44.443 1.00 0.00 C ATOM 1033 C ARG A 121 -29.081 16.222 44.858 1.00 0.00 C ATOM 1034 O ARG A 121 -30.298 16.351 44.727 1.00 0.00 O ATOM 1035 CB ARG A 121 -27.540 14.402 45.606 1.00 0.00 C ATOM 1036 CG ARG A 121 -28.430 14.200 46.836 1.00 0.00 C ATOM 1037 CD ARG A 121 -29.406 13.052 46.577 1.00 0.00 C ATOM 1038 NE ARG A 121 -30.676 13.571 46.083 1.00 0.00 N ATOM 1039 CZ ARG A 121 -31.471 14.298 46.860 1.00 0.00 C ATOM 1040 NH1 ARG A 121 -31.122 14.556 48.091 1.00 0.00 N ATOM 1041 NH2 ARG A 121 -32.601 14.754 46.395 1.00 0.00 N ATOM 0 H ARG A 121 -26.751 15.804 43.451 1.00 0.00 H new ATOM 0 HA ARG A 121 -29.137 14.191 44.179 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -27.069 13.459 45.327 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -26.738 15.103 45.836 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -27.817 13.980 47.710 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -28.979 15.116 47.055 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -28.980 12.360 45.850 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -29.568 12.489 47.496 1.00 0.00 H new ATOM 0 HE ARG A 121 -30.959 13.372 45.123 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -30.239 14.199 48.456 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -31.732 15.114 48.688 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -32.875 14.552 45.433 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -33.210 15.312 46.993 1.00 0.00 H new ATOM 1055 N ALA A 122 -28.300 17.175 45.357 1.00 0.00 N ATOM 1056 CA ALA A 122 -28.851 18.455 45.787 1.00 0.00 C ATOM 1057 C ALA A 122 -27.888 19.587 45.444 1.00 0.00 C ATOM 1058 O ALA A 122 -26.710 19.540 45.796 1.00 0.00 O ATOM 1059 CB ALA A 122 -29.104 18.435 47.295 1.00 0.00 C ATOM 0 H ALA A 122 -27.291 17.086 45.473 1.00 0.00 H new ATOM 0 HA ALA A 122 -29.794 18.621 45.266 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -29.515 19.395 47.608 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -29.812 17.641 47.535 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -28.165 18.255 47.819 1.00 0.00 H new ATOM 1065 N GLU A 123 -28.393 20.601 44.750 1.00 0.00 N ATOM 1066 CA GLU A 123 -27.562 21.736 44.363 1.00 0.00 C ATOM 1067 C GLU A 123 -28.385 23.021 44.312 1.00 0.00 C ATOM 1068 O GLU A 123 -29.442 23.068 43.681 1.00 0.00 O ATOM 1069 CB GLU A 123 -26.937 21.477 42.992 1.00 0.00 C ATOM 1070 CG GLU A 123 -27.899 20.644 42.142 1.00 0.00 C ATOM 1071 CD GLU A 123 -27.520 20.751 40.669 1.00 0.00 C ATOM 1072 OE1 GLU A 123 -26.380 21.085 40.393 1.00 0.00 O ATOM 1073 OE2 GLU A 123 -28.376 20.496 39.837 1.00 0.00 O ATOM 0 H GLU A 123 -29.365 20.661 44.446 1.00 0.00 H new ATOM 0 HA GLU A 123 -26.776 21.855 45.109 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -26.721 22.422 42.495 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -25.988 20.953 43.106 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -27.868 19.602 42.459 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -28.922 20.992 42.289 1.00 0.00 H new ATOM 1080 N ARG A 124 -27.890 24.060 44.977 1.00 0.00 N ATOM 1081 CA ARG A 124 -28.583 25.343 44.996 1.00 0.00 C ATOM 1082 C ARG A 124 -28.024 26.264 43.918 1.00 0.00 C ATOM 1083 O ARG A 124 -26.816 26.481 43.840 1.00 0.00 O ATOM 1084 CB ARG A 124 -28.424 26.004 46.366 1.00 0.00 C ATOM 1085 CG ARG A 124 -29.707 25.810 47.178 1.00 0.00 C ATOM 1086 CD ARG A 124 -29.859 24.334 47.548 1.00 0.00 C ATOM 1087 NE ARG A 124 -30.845 24.179 48.611 1.00 0.00 N ATOM 1088 CZ ARG A 124 -31.468 23.020 48.806 1.00 0.00 C ATOM 1089 NH1 ARG A 124 -31.198 21.998 48.040 1.00 0.00 N ATOM 1090 NH2 ARG A 124 -32.349 22.906 49.762 1.00 0.00 N ATOM 0 H ARG A 124 -27.018 24.040 45.506 1.00 0.00 H new ATOM 0 HA ARG A 124 -29.641 25.168 44.800 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -27.576 25.569 46.896 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -28.214 27.067 46.247 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -29.675 26.420 48.080 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -30.569 26.142 46.600 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -30.165 23.762 46.672 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -28.899 23.932 47.872 1.00 0.00 H new ATOM 0 HE ARG A 124 -31.061 24.972 49.215 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -30.510 22.089 47.293 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -31.675 21.109 48.189 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -32.560 23.705 50.359 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -32.827 22.017 49.912 1.00 0.00 H new ATOM 1104 N VAL A 125 -28.911 26.802 43.087 1.00 0.00 N ATOM 1105 CA VAL A 125 -28.488 27.697 42.015 1.00 0.00 C ATOM 1106 C VAL A 125 -29.083 29.087 42.204 1.00 0.00 C ATOM 1107 O VAL A 125 -30.301 29.262 42.176 1.00 0.00 O ATOM 1108 CB VAL A 125 -28.925 27.134 40.663 1.00 0.00 C ATOM 1109 CG1 VAL A 125 -30.451 27.166 40.565 1.00 0.00 C ATOM 1110 CG2 VAL A 125 -28.325 27.985 39.541 1.00 0.00 C ATOM 0 H VAL A 125 -29.916 26.637 43.133 1.00 0.00 H new ATOM 0 HA VAL A 125 -27.401 27.775 42.044 1.00 0.00 H new ATOM 0 HB VAL A 125 -28.577 26.105 40.568 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -30.762 26.764 39.601 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -30.880 26.562 41.365 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -30.800 28.194 40.660 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -28.635 27.585 38.576 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -28.674 29.013 39.637 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -27.237 27.964 39.610 1.00 0.00 H new ATOM 1120 N SER A 126 -28.215 30.075 42.392 1.00 0.00 N ATOM 1121 CA SER A 126 -28.661 31.449 42.577 1.00 0.00 C ATOM 1122 C SER A 126 -27.957 32.373 41.590 1.00 0.00 C ATOM 1123 O SER A 126 -26.738 32.530 41.634 1.00 0.00 O ATOM 1124 CB SER A 126 -28.371 31.909 44.006 1.00 0.00 C ATOM 1125 OG SER A 126 -29.587 31.957 44.741 1.00 0.00 O ATOM 0 H SER A 126 -27.203 29.950 42.420 1.00 0.00 H new ATOM 0 HA SER A 126 -29.735 31.490 42.397 1.00 0.00 H new ATOM 0 HB2 SER A 126 -27.670 31.225 44.485 1.00 0.00 H new ATOM 0 HB3 SER A 126 -27.900 32.892 43.995 1.00 0.00 H new ATOM 0 HG SER A 126 -29.404 32.250 45.658 1.00 0.00 H new ATOM 1131 N ASN A 127 -28.732 32.977 40.696 1.00 0.00 N ATOM 1132 CA ASN A 127 -28.167 33.878 39.700 1.00 0.00 C ATOM 1133 C ASN A 127 -28.291 35.328 40.155 1.00 0.00 C ATOM 1134 O ASN A 127 -29.365 35.775 40.557 1.00 0.00 O ATOM 1135 CB ASN A 127 -28.889 33.698 38.365 1.00 0.00 C ATOM 1136 CG ASN A 127 -28.312 34.656 37.329 1.00 0.00 C ATOM 1137 OD1 ASN A 127 -27.431 35.456 37.646 1.00 0.00 O ATOM 1138 ND2 ASN A 127 -28.756 34.621 36.102 1.00 0.00 N ATOM 0 H ASN A 127 -29.744 32.860 40.641 1.00 0.00 H new ATOM 0 HA ASN A 127 -27.111 33.637 39.578 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -28.783 32.669 38.020 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -29.956 33.884 38.491 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -28.373 35.257 35.403 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -29.486 33.957 35.842 1.00 0.00 H new ATOM 1145 N GLU A 128 -27.181 36.056 40.087 1.00 0.00 N ATOM 1146 CA GLU A 128 -27.174 37.456 40.492 1.00 0.00 C ATOM 1147 C GLU A 128 -26.289 38.274 39.558 1.00 0.00 C ATOM 1148 O GLU A 128 -25.145 37.906 39.287 1.00 0.00 O ATOM 1149 CB GLU A 128 -26.662 37.581 41.928 1.00 0.00 C ATOM 1150 CG GLU A 128 -27.389 36.569 42.817 1.00 0.00 C ATOM 1151 CD GLU A 128 -27.291 36.996 44.279 1.00 0.00 C ATOM 1152 OE1 GLU A 128 -26.258 36.753 44.879 1.00 0.00 O ATOM 1153 OE2 GLU A 128 -28.252 37.561 44.774 1.00 0.00 O ATOM 0 H GLU A 128 -26.282 35.703 39.758 1.00 0.00 H new ATOM 0 HA GLU A 128 -28.193 37.839 40.438 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -25.587 37.403 41.959 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -26.828 38.593 42.298 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -28.435 36.497 42.520 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -26.952 35.579 42.688 1.00 0.00 H new ATOM 1160 N VAL A 129 -26.826 39.385 39.068 1.00 0.00 N ATOM 1161 CA VAL A 129 -26.077 40.251 38.164 1.00 0.00 C ATOM 1162 C VAL A 129 -25.164 41.187 38.949 1.00 0.00 C ATOM 1163 O VAL A 129 -25.575 42.271 39.358 1.00 0.00 O ATOM 1164 CB VAL A 129 -27.043 41.076 37.309 1.00 0.00 C ATOM 1165 CG1 VAL A 129 -27.444 40.273 36.069 1.00 0.00 C ATOM 1166 CG2 VAL A 129 -28.294 41.412 38.123 1.00 0.00 C ATOM 0 H VAL A 129 -27.771 39.706 39.279 1.00 0.00 H new ATOM 0 HA VAL A 129 -25.464 39.623 37.517 1.00 0.00 H new ATOM 0 HB VAL A 129 -26.552 41.999 37.002 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -28.132 40.861 35.461 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -26.554 40.037 35.485 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -27.932 39.348 36.377 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -28.979 41.999 37.511 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -28.785 40.490 38.434 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -28.011 41.987 39.005 1.00 0.00 H new ATOM 1176 N ASN A 130 -23.923 40.758 39.153 1.00 0.00 N ATOM 1177 CA ASN A 130 -22.957 41.567 39.889 1.00 0.00 C ATOM 1178 C ASN A 130 -23.129 41.370 41.392 1.00 0.00 C ATOM 1179 O ASN A 130 -23.444 42.311 42.121 1.00 0.00 O ATOM 1180 CB ASN A 130 -23.136 43.044 39.533 1.00 0.00 C ATOM 1181 CG ASN A 130 -21.772 43.713 39.388 1.00 0.00 C ATOM 1182 OD1 ASN A 130 -21.041 43.853 40.368 1.00 0.00 O ATOM 1183 ND2 ASN A 130 -21.387 44.139 38.216 1.00 0.00 N ATOM 0 H ASN A 130 -23.564 39.862 38.822 1.00 0.00 H new ATOM 0 HA ASN A 130 -21.952 41.249 39.610 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -23.697 43.137 38.603 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -23.716 43.546 40.307 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -20.478 44.589 38.110 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -21.995 44.021 37.406 1.00 0.00 H new ATOM 1190 N ALA A 131 -22.917 40.140 41.851 1.00 0.00 N ATOM 1191 CA ALA A 131 -23.050 39.831 43.268 1.00 0.00 C ATOM 1192 C ALA A 131 -22.069 40.664 44.094 1.00 0.00 C ATOM 1193 O ALA A 131 -21.088 40.146 44.628 1.00 0.00 O ATOM 1194 CB ALA A 131 -22.796 38.337 43.500 1.00 0.00 C ATOM 0 H ALA A 131 -22.654 39.347 41.266 1.00 0.00 H new ATOM 0 HA ALA A 131 -24.063 40.076 43.585 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -22.897 38.111 44.562 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -23.522 37.752 42.934 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -21.789 38.084 43.169 1.00 0.00 H new