USER MOD reduce.3.24.130724 H: found=0, std=0, add=984, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 986 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 82 SER OG : rot 94:sc= 1.17 USER MOD Set 1.2: A 96 THR OG1 : rot 125:sc= 2.3 USER MOD Single : A 27 MET CE :methyl -160:sc= -0.153 (180deg=-0.689) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 156:sc= 1.28 (180deg=1.15) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl 162:sc= -0.105 (180deg=-0.538) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 117:sc= 1.66 USER MOD Single : A 48 GLN : amide:sc= -0.178 K(o=-0.18,f=-0.83) USER MOD Single : A 52 TYR OH : rot 115:sc= -1.43! USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 GLN : amide:sc= -0.86 K(o=-0.86,f=0) USER MOD Single : A 62 THR OG1 : rot 78:sc= 1.29 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot -78:sc= 0.773 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot 180:sc= -0.0508 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc= 0.393 K(o=0.39,f=-0.88) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0489) USER MOD Single : A 95 ASN : amide:sc= -0.904 K(o=-0.9,f=0) USER MOD Single : A 101 THR OG1 : rot 78:sc= 0.0311 USER MOD Single : A 103 LYS NZ :NH3+ -145:sc= 1.04 (180deg=-0.803!) USER MOD Single : A 104 LYS NZ :NH3+ -177:sc= 1.23 (180deg=1.12) USER MOD Single : A 110 HIS : no HE2:sc= -1.5 K(o=-1.5,f=-3!) USER MOD Single : A 111 ASN : amide:sc= -0.244 X(o=-0.24,f=0) USER MOD Single : A 114 THR OG1 : rot 80:sc= 1.16 USER MOD Single : A 116 MET CE :methyl 151:sc= -1.72 (180deg=-2.67!) USER MOD Single : A 120 ASN : amide:sc= -0.0239 K(o=-0.024,f=-3.1!) USER MOD Single : A 124 LYS NZ :NH3+ 169:sc=-0.00933 (180deg=-0.148) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ -172:sc= 1.73 (180deg=1.67) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0.0485 USER MOD Single : A 139 LYS NZ :NH3+ -167:sc= -0.0341 (180deg=-0.219) USER MOD Single : A 141 MET CE :methyl -161:sc= -0.121 (180deg=-0.61) USER MOD Single : A 144 GLN : amide:sc= -1.45! K(o=-1.4!,f=-0.25) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 25 -19.545 2.334 29.124 1.00 0.00 N ATOM 2 CA GLY A 25 -19.642 1.245 28.171 1.00 0.00 C ATOM 3 C GLY A 25 -18.289 0.890 27.657 1.00 0.00 C ATOM 4 O GLY A 25 -17.281 1.436 28.122 1.00 0.00 O ATOM 0 HA2 GLY A 25 -20.098 0.376 28.645 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -20.290 1.533 27.343 1.00 0.00 H new ATOM 10 N ALA A 26 -18.243 0.011 26.705 1.00 0.00 N ATOM 11 CA ALA A 26 -17.003 -0.431 26.131 1.00 0.00 C ATOM 12 C ALA A 26 -16.667 0.432 24.930 1.00 0.00 C ATOM 13 O ALA A 26 -17.415 1.341 24.599 1.00 0.00 O ATOM 14 CB ALA A 26 -17.110 -1.887 25.739 1.00 0.00 C ATOM 0 H ALA A 26 -19.070 -0.426 26.298 1.00 0.00 H new ATOM 0 HA ALA A 26 -16.202 -0.334 26.864 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -16.167 -2.217 25.304 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -17.332 -2.486 26.622 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -17.909 -2.009 25.008 1.00 0.00 H new ATOM 20 N MET A 27 -15.562 0.153 24.282 1.00 0.00 N ATOM 21 CA MET A 27 -15.137 0.927 23.114 1.00 0.00 C ATOM 22 C MET A 27 -15.883 0.429 21.870 1.00 0.00 C ATOM 23 O MET A 27 -15.806 1.014 20.786 1.00 0.00 O ATOM 24 CB MET A 27 -13.628 0.794 22.942 1.00 0.00 C ATOM 25 CG MET A 27 -13.017 1.726 21.904 1.00 0.00 C ATOM 26 SD MET A 27 -11.209 1.616 21.830 1.00 0.00 S ATOM 27 CE MET A 27 -10.749 2.166 23.480 1.00 0.00 C ATOM 0 H MET A 27 -14.930 -0.606 24.536 1.00 0.00 H new ATOM 0 HA MET A 27 -15.376 1.981 23.255 1.00 0.00 H new ATOM 0 HB2 MET A 27 -13.149 0.981 23.903 1.00 0.00 H new ATOM 0 HB3 MET A 27 -13.398 -0.235 22.666 1.00 0.00 H new ATOM 0 HG2 MET A 27 -13.430 1.490 20.923 1.00 0.00 H new ATOM 0 HG3 MET A 27 -13.304 2.753 22.132 1.00 0.00 H new ATOM 0 HE1 MET A 27 -9.708 2.489 23.479 1.00 0.00 H new ATOM 0 HE2 MET A 27 -11.387 2.998 23.777 1.00 0.00 H new ATOM 0 HE3 MET A 27 -10.873 1.344 24.185 1.00 0.00 H new ATOM 37 N GLU A 28 -16.577 -0.687 22.060 1.00 0.00 N ATOM 38 CA GLU A 28 -17.450 -1.298 21.078 1.00 0.00 C ATOM 39 C GLU A 28 -16.720 -1.745 19.818 1.00 0.00 C ATOM 40 O GLU A 28 -17.294 -1.767 18.715 1.00 0.00 O ATOM 41 CB GLU A 28 -18.656 -0.402 20.770 1.00 0.00 C ATOM 42 CG GLU A 28 -19.568 -0.180 21.973 1.00 0.00 C ATOM 43 CD GLU A 28 -20.065 -1.482 22.560 1.00 0.00 C ATOM 44 OE1 GLU A 28 -20.952 -2.123 21.962 1.00 0.00 O ATOM 45 OE2 GLU A 28 -19.580 -1.900 23.625 1.00 0.00 O ATOM 0 H GLU A 28 -16.542 -1.207 22.937 1.00 0.00 H new ATOM 0 HA GLU A 28 -17.830 -2.215 21.529 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -18.300 0.563 20.410 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -19.235 -0.849 19.962 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -19.029 0.379 22.738 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -20.420 0.430 21.673 1.00 0.00 H new ATOM 52 N GLN A 29 -15.484 -2.166 20.000 1.00 0.00 N ATOM 53 CA GLN A 29 -14.695 -2.705 18.915 1.00 0.00 C ATOM 54 C GLN A 29 -15.186 -4.114 18.659 1.00 0.00 C ATOM 55 O GLN A 29 -15.002 -5.005 19.504 1.00 0.00 O ATOM 56 CB GLN A 29 -13.210 -2.742 19.286 1.00 0.00 C ATOM 57 CG GLN A 29 -12.625 -1.400 19.677 1.00 0.00 C ATOM 58 CD GLN A 29 -11.168 -1.497 20.055 1.00 0.00 C ATOM 59 OE1 GLN A 29 -10.824 -1.732 21.217 1.00 0.00 O ATOM 60 NE2 GLN A 29 -10.299 -1.301 19.106 1.00 0.00 N ATOM 0 H GLN A 29 -15.003 -2.144 20.899 1.00 0.00 H new ATOM 0 HA GLN A 29 -14.802 -2.079 18.029 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -13.073 -3.439 20.113 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -12.647 -3.137 18.440 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -12.737 -0.702 18.847 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -13.189 -0.991 20.515 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -10.616 -1.109 18.156 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -9.301 -1.339 19.313 1.00 0.00 H new ATOM 69 N LYS A 30 -15.854 -4.317 17.559 1.00 0.00 N ATOM 70 CA LYS A 30 -16.414 -5.613 17.276 1.00 0.00 C ATOM 71 C LYS A 30 -15.413 -6.444 16.512 1.00 0.00 C ATOM 72 O LYS A 30 -14.910 -6.029 15.458 1.00 0.00 O ATOM 73 CB LYS A 30 -17.740 -5.493 16.516 1.00 0.00 C ATOM 74 CG LYS A 30 -18.758 -4.576 17.189 1.00 0.00 C ATOM 75 CD LYS A 30 -19.100 -5.035 18.597 1.00 0.00 C ATOM 76 CE LYS A 30 -19.934 -3.992 19.322 1.00 0.00 C ATOM 77 NZ LYS A 30 -20.202 -4.369 20.723 1.00 0.00 N ATOM 0 H LYS A 30 -16.025 -3.608 16.846 1.00 0.00 H new ATOM 0 HA LYS A 30 -16.633 -6.114 18.219 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -17.539 -5.121 15.511 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -18.176 -6.486 16.407 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -18.362 -3.561 17.225 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -19.667 -4.542 16.589 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -19.647 -5.977 18.554 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -18.183 -5.224 19.155 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -19.415 -3.034 19.298 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -20.879 -3.856 18.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -20.396 -3.514 21.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -21.026 -5.002 20.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -19.372 -4.858 21.116 1.00 0.00 H new ATOM 91 N THR A 31 -15.097 -7.577 17.066 1.00 0.00 N ATOM 92 CA THR A 31 -14.160 -8.480 16.489 1.00 0.00 C ATOM 93 C THR A 31 -14.703 -9.091 15.189 1.00 0.00 C ATOM 94 O THR A 31 -15.761 -9.745 15.179 1.00 0.00 O ATOM 95 CB THR A 31 -13.854 -9.596 17.495 1.00 0.00 C ATOM 96 OG1 THR A 31 -13.455 -9.001 18.739 1.00 0.00 O ATOM 97 CG2 THR A 31 -12.744 -10.493 16.990 1.00 0.00 C ATOM 0 H THR A 31 -15.494 -7.901 17.948 1.00 0.00 H new ATOM 0 HA THR A 31 -13.250 -7.930 16.248 1.00 0.00 H new ATOM 0 HB THR A 31 -14.749 -10.203 17.631 1.00 0.00 H new ATOM 0 HG1 THR A 31 -13.258 -9.706 19.391 1.00 0.00 H new ATOM 0 HG21 THR A 31 -12.547 -11.276 17.723 1.00 0.00 H new ATOM 0 HG22 THR A 31 -13.044 -10.947 16.046 1.00 0.00 H new ATOM 0 HG23 THR A 31 -11.840 -9.903 16.838 1.00 0.00 H new ATOM 105 N VAL A 32 -13.994 -8.855 14.116 1.00 0.00 N ATOM 106 CA VAL A 32 -14.320 -9.415 12.839 1.00 0.00 C ATOM 107 C VAL A 32 -13.196 -10.337 12.440 1.00 0.00 C ATOM 108 O VAL A 32 -12.018 -9.990 12.579 1.00 0.00 O ATOM 109 CB VAL A 32 -14.578 -8.327 11.745 1.00 0.00 C ATOM 110 CG1 VAL A 32 -13.368 -7.427 11.525 1.00 0.00 C ATOM 111 CG2 VAL A 32 -15.025 -8.964 10.426 1.00 0.00 C ATOM 0 H VAL A 32 -13.165 -8.261 14.109 1.00 0.00 H new ATOM 0 HA VAL A 32 -15.257 -9.966 12.923 1.00 0.00 H new ATOM 0 HB VAL A 32 -15.386 -7.696 12.116 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -13.598 -6.689 10.756 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -13.120 -6.916 12.456 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -12.519 -8.031 11.205 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -15.197 -8.183 9.685 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -14.249 -9.641 10.067 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -15.948 -9.522 10.586 1.00 0.00 H new ATOM 121 N ILE A 33 -13.544 -11.506 12.006 1.00 0.00 N ATOM 122 CA ILE A 33 -12.581 -12.488 11.648 1.00 0.00 C ATOM 123 C ILE A 33 -12.495 -12.576 10.120 1.00 0.00 C ATOM 124 O ILE A 33 -13.402 -13.100 9.462 1.00 0.00 O ATOM 125 CB ILE A 33 -12.914 -13.900 12.256 1.00 0.00 C ATOM 126 CG1 ILE A 33 -13.013 -13.877 13.804 1.00 0.00 C ATOM 127 CG2 ILE A 33 -11.885 -14.936 11.833 1.00 0.00 C ATOM 128 CD1 ILE A 33 -14.279 -13.263 14.387 1.00 0.00 C ATOM 0 H ILE A 33 -14.512 -11.805 11.890 1.00 0.00 H new ATOM 0 HA ILE A 33 -11.620 -12.183 12.061 1.00 0.00 H new ATOM 0 HB ILE A 33 -13.892 -14.174 11.861 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -12.930 -14.901 14.168 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -12.155 -13.329 14.194 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -12.141 -15.902 12.268 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -11.877 -15.018 10.746 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -10.898 -14.632 12.181 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -14.235 -13.303 15.475 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -14.362 -12.225 14.065 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -15.148 -13.821 14.038 1.00 0.00 H new ATOM 140 N PRO A 34 -11.449 -11.995 9.530 1.00 0.00 N ATOM 141 CA PRO A 34 -11.217 -12.070 8.096 1.00 0.00 C ATOM 142 C PRO A 34 -10.948 -13.511 7.683 1.00 0.00 C ATOM 143 O PRO A 34 -10.291 -14.276 8.414 1.00 0.00 O ATOM 144 CB PRO A 34 -9.975 -11.198 7.872 1.00 0.00 C ATOM 145 CG PRO A 34 -9.861 -10.373 9.100 1.00 0.00 C ATOM 146 CD PRO A 34 -10.419 -11.209 10.204 1.00 0.00 C ATOM 0 HA PRO A 34 -12.071 -11.733 7.509 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -9.085 -11.809 7.723 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -10.085 -10.574 6.985 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -8.823 -10.107 9.297 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -10.415 -9.440 8.997 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -9.656 -11.844 10.655 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -10.837 -10.596 11.003 1.00 0.00 H new ATOM 154 N GLY A 35 -11.416 -13.876 6.531 1.00 0.00 N ATOM 155 CA GLY A 35 -11.323 -15.246 6.101 1.00 0.00 C ATOM 156 C GLY A 35 -12.640 -15.958 6.299 1.00 0.00 C ATOM 157 O GLY A 35 -12.839 -17.067 5.809 1.00 0.00 O ATOM 0 H GLY A 35 -11.868 -13.248 5.867 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -11.038 -15.284 5.050 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -10.540 -15.756 6.662 1.00 0.00 H new ATOM 161 N MET A 36 -13.537 -15.317 7.020 1.00 0.00 N ATOM 162 CA MET A 36 -14.907 -15.776 7.119 1.00 0.00 C ATOM 163 C MET A 36 -15.629 -15.184 5.927 1.00 0.00 C ATOM 164 O MET A 36 -15.156 -14.160 5.380 1.00 0.00 O ATOM 165 CB MET A 36 -15.582 -15.298 8.423 1.00 0.00 C ATOM 166 CG MET A 36 -15.021 -15.907 9.697 1.00 0.00 C ATOM 167 SD MET A 36 -15.873 -15.330 11.192 1.00 0.00 S ATOM 168 CE MET A 36 -17.536 -15.955 10.923 1.00 0.00 C ATOM 0 H MET A 36 -13.339 -14.469 7.551 1.00 0.00 H new ATOM 0 HA MET A 36 -14.941 -16.865 7.131 1.00 0.00 H new ATOM 0 HB2 MET A 36 -15.490 -14.214 8.486 1.00 0.00 H new ATOM 0 HB3 MET A 36 -16.647 -15.525 8.368 1.00 0.00 H new ATOM 0 HG2 MET A 36 -15.097 -16.993 9.638 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.961 -15.665 9.773 1.00 0.00 H new ATOM 0 HE1 MET A 36 -18.078 -15.965 11.868 1.00 0.00 H new ATOM 0 HE2 MET A 36 -18.056 -15.312 10.213 1.00 0.00 H new ATOM 0 HE3 MET A 36 -17.484 -16.968 10.524 1.00 0.00 H new ATOM 178 N PRO A 37 -16.734 -15.784 5.455 1.00 0.00 N ATOM 179 CA PRO A 37 -17.446 -15.246 4.305 1.00 0.00 C ATOM 180 C PRO A 37 -17.909 -13.823 4.592 1.00 0.00 C ATOM 181 O PRO A 37 -18.387 -13.516 5.693 1.00 0.00 O ATOM 182 CB PRO A 37 -18.658 -16.181 4.141 1.00 0.00 C ATOM 183 CG PRO A 37 -18.759 -16.923 5.432 1.00 0.00 C ATOM 184 CD PRO A 37 -17.367 -17.000 5.982 1.00 0.00 C ATOM 0 HA PRO A 37 -16.827 -15.202 3.409 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -19.568 -15.615 3.940 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -18.517 -16.865 3.304 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -19.423 -16.408 6.126 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -19.171 -17.920 5.276 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -17.364 -17.016 7.072 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -16.851 -17.900 5.649 1.00 0.00 H new ATOM 192 N THR A 38 -17.751 -12.969 3.639 1.00 0.00 N ATOM 193 CA THR A 38 -18.116 -11.601 3.796 1.00 0.00 C ATOM 194 C THR A 38 -19.040 -11.245 2.660 1.00 0.00 C ATOM 195 O THR A 38 -18.628 -11.174 1.500 1.00 0.00 O ATOM 196 CB THR A 38 -16.838 -10.722 3.786 1.00 0.00 C ATOM 197 OG1 THR A 38 -15.789 -11.407 4.521 1.00 0.00 O ATOM 198 CG2 THR A 38 -17.104 -9.402 4.481 1.00 0.00 C ATOM 0 H THR A 38 -17.363 -13.200 2.724 1.00 0.00 H new ATOM 0 HA THR A 38 -18.625 -11.429 4.745 1.00 0.00 H new ATOM 0 HB THR A 38 -16.543 -10.544 2.752 1.00 0.00 H new ATOM 0 HG1 THR A 38 -14.976 -10.859 4.518 1.00 0.00 H new ATOM 0 HG21 THR A 38 -16.199 -8.795 4.467 1.00 0.00 H new ATOM 0 HG22 THR A 38 -17.904 -8.873 3.963 1.00 0.00 H new ATOM 0 HG23 THR A 38 -17.400 -9.588 5.513 1.00 0.00 H new ATOM 206 N VAL A 39 -20.283 -11.055 2.992 1.00 0.00 N ATOM 207 CA VAL A 39 -21.293 -10.817 2.007 1.00 0.00 C ATOM 208 C VAL A 39 -21.605 -9.349 1.879 1.00 0.00 C ATOM 209 O VAL A 39 -21.585 -8.603 2.865 1.00 0.00 O ATOM 210 CB VAL A 39 -22.586 -11.627 2.283 1.00 0.00 C ATOM 211 CG1 VAL A 39 -22.308 -13.123 2.238 1.00 0.00 C ATOM 212 CG2 VAL A 39 -23.236 -11.238 3.612 1.00 0.00 C ATOM 0 H VAL A 39 -20.624 -11.061 3.953 1.00 0.00 H new ATOM 0 HA VAL A 39 -20.886 -11.164 1.057 1.00 0.00 H new ATOM 0 HB VAL A 39 -23.294 -11.380 1.492 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -23.230 -13.670 2.435 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -21.929 -13.393 1.252 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -21.566 -13.378 2.995 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -24.138 -11.831 3.763 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -22.538 -11.426 4.427 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -23.496 -10.180 3.594 1.00 0.00 H new ATOM 222 N ILE A 40 -21.879 -8.946 0.677 1.00 0.00 N ATOM 223 CA ILE A 40 -22.180 -7.578 0.372 1.00 0.00 C ATOM 224 C ILE A 40 -23.656 -7.344 0.665 1.00 0.00 C ATOM 225 O ILE A 40 -24.515 -8.024 0.082 1.00 0.00 O ATOM 226 CB ILE A 40 -21.929 -7.284 -1.127 1.00 0.00 C ATOM 227 CG1 ILE A 40 -20.514 -7.727 -1.540 1.00 0.00 C ATOM 228 CG2 ILE A 40 -22.116 -5.789 -1.400 1.00 0.00 C ATOM 229 CD1 ILE A 40 -20.273 -7.694 -3.032 1.00 0.00 C ATOM 0 H ILE A 40 -21.901 -9.566 -0.133 1.00 0.00 H new ATOM 0 HA ILE A 40 -21.544 -6.927 0.972 1.00 0.00 H new ATOM 0 HB ILE A 40 -22.649 -7.849 -1.719 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -19.784 -7.082 -1.050 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -20.340 -8.740 -1.176 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -21.938 -5.587 -2.456 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -23.133 -5.496 -1.141 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -21.410 -5.218 -0.798 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -19.254 -8.019 -3.243 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -20.977 -8.361 -3.529 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -20.413 -6.678 -3.401 1.00 0.00 H new ATOM 241 N PRO A 41 -23.984 -6.415 1.570 1.00 0.00 N ATOM 242 CA PRO A 41 -25.368 -6.129 1.897 1.00 0.00 C ATOM 243 C PRO A 41 -26.116 -5.516 0.697 1.00 0.00 C ATOM 244 O PRO A 41 -25.555 -4.701 -0.058 1.00 0.00 O ATOM 245 CB PRO A 41 -25.291 -5.141 3.071 1.00 0.00 C ATOM 246 CG PRO A 41 -23.922 -4.567 3.021 1.00 0.00 C ATOM 247 CD PRO A 41 -23.041 -5.579 2.336 1.00 0.00 C ATOM 0 HA PRO A 41 -25.923 -7.031 2.154 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -26.047 -4.361 2.977 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -25.470 -5.646 4.020 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -23.920 -3.623 2.476 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -23.556 -4.356 4.026 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -22.314 -5.097 1.683 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -22.478 -6.171 3.058 1.00 0.00 H new ATOM 255 N PRO A 42 -27.357 -5.940 0.471 1.00 0.00 N ATOM 256 CA PRO A 42 -28.169 -5.447 -0.637 1.00 0.00 C ATOM 257 C PRO A 42 -28.635 -4.008 -0.401 1.00 0.00 C ATOM 258 O PRO A 42 -28.824 -3.583 0.747 1.00 0.00 O ATOM 259 CB PRO A 42 -29.369 -6.395 -0.636 1.00 0.00 C ATOM 260 CG PRO A 42 -29.482 -6.848 0.778 1.00 0.00 C ATOM 261 CD PRO A 42 -28.074 -6.953 1.276 1.00 0.00 C ATOM 0 HA PRO A 42 -27.620 -5.429 -1.579 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -30.276 -5.888 -0.964 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -29.212 -7.236 -1.311 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -30.057 -6.139 1.373 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -29.994 -7.808 0.843 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -28.007 -6.741 2.343 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -27.666 -7.952 1.123 1.00 0.00 H new ATOM 269 N GLY A 43 -28.812 -3.265 -1.464 1.00 0.00 N ATOM 270 CA GLY A 43 -29.278 -1.908 -1.340 1.00 0.00 C ATOM 271 C GLY A 43 -28.152 -0.901 -1.351 1.00 0.00 C ATOM 272 O GLY A 43 -28.370 0.279 -1.104 1.00 0.00 O ATOM 0 H GLY A 43 -28.641 -3.575 -2.421 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -29.965 -1.688 -2.157 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -29.843 -1.805 -0.413 1.00 0.00 H new ATOM 276 N LEU A 44 -26.950 -1.363 -1.612 1.00 0.00 N ATOM 277 CA LEU A 44 -25.813 -0.497 -1.713 1.00 0.00 C ATOM 278 C LEU A 44 -25.702 -0.040 -3.132 1.00 0.00 C ATOM 279 O LEU A 44 -26.205 -0.712 -4.054 1.00 0.00 O ATOM 280 CB LEU A 44 -24.516 -1.206 -1.309 1.00 0.00 C ATOM 281 CG LEU A 44 -24.333 -1.592 0.155 1.00 0.00 C ATOM 282 CD1 LEU A 44 -22.979 -2.256 0.339 1.00 0.00 C ATOM 283 CD2 LEU A 44 -24.432 -0.374 1.043 1.00 0.00 C ATOM 0 H LEU A 44 -26.740 -2.350 -1.759 1.00 0.00 H new ATOM 0 HA LEU A 44 -25.953 0.344 -1.034 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -24.433 -2.114 -1.906 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -23.683 -0.562 -1.591 1.00 0.00 H new ATOM 0 HG LEU A 44 -25.123 -2.289 0.436 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -22.848 -2.532 1.385 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -22.925 -3.150 -0.282 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -22.191 -1.563 0.045 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -24.299 -0.670 2.083 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -23.657 0.341 0.767 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -25.412 0.087 0.920 1.00 0.00 H new ATOM 295 N THR A 45 -25.070 1.070 -3.325 1.00 0.00 N ATOM 296 CA THR A 45 -24.889 1.609 -4.631 1.00 0.00 C ATOM 297 C THR A 45 -23.598 1.036 -5.180 1.00 0.00 C ATOM 298 O THR A 45 -22.833 0.441 -4.420 1.00 0.00 O ATOM 299 CB THR A 45 -24.793 3.153 -4.552 1.00 0.00 C ATOM 300 OG1 THR A 45 -23.529 3.555 -3.990 1.00 0.00 O ATOM 301 CG2 THR A 45 -25.897 3.677 -3.653 1.00 0.00 C ATOM 0 H THR A 45 -24.663 1.631 -2.577 1.00 0.00 H new ATOM 0 HA THR A 45 -25.729 1.353 -5.277 1.00 0.00 H new ATOM 0 HB THR A 45 -24.888 3.556 -5.560 1.00 0.00 H new ATOM 0 HG1 THR A 45 -23.019 4.059 -4.658 1.00 0.00 H new ATOM 0 HG21 THR A 45 -25.833 4.764 -3.594 1.00 0.00 H new ATOM 0 HG22 THR A 45 -26.866 3.392 -4.063 1.00 0.00 H new ATOM 0 HG23 THR A 45 -25.786 3.253 -2.655 1.00 0.00 H new ATOM 309 N ARG A 46 -23.344 1.194 -6.466 1.00 0.00 N ATOM 310 CA ARG A 46 -22.097 0.723 -7.051 1.00 0.00 C ATOM 311 C ARG A 46 -20.896 1.335 -6.346 1.00 0.00 C ATOM 312 O ARG A 46 -19.917 0.647 -6.069 1.00 0.00 O ATOM 313 CB ARG A 46 -21.999 0.946 -8.589 1.00 0.00 C ATOM 314 CG ARG A 46 -22.215 2.369 -9.098 1.00 0.00 C ATOM 315 CD ARG A 46 -23.688 2.702 -9.266 1.00 0.00 C ATOM 316 NE ARG A 46 -23.920 4.087 -9.657 1.00 0.00 N ATOM 317 CZ ARG A 46 -24.977 4.510 -10.376 1.00 0.00 C ATOM 318 NH1 ARG A 46 -25.852 3.632 -10.875 1.00 0.00 N ATOM 319 NH2 ARG A 46 -25.149 5.805 -10.613 1.00 0.00 N ATOM 0 H ARG A 46 -23.980 1.643 -7.125 1.00 0.00 H new ATOM 0 HA ARG A 46 -22.092 -0.356 -6.899 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -21.014 0.615 -8.917 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -22.731 0.299 -9.073 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -21.762 3.075 -8.402 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -21.705 2.492 -10.054 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -24.120 2.041 -10.017 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -24.209 2.503 -8.329 1.00 0.00 H new ATOM 0 HE ARG A 46 -23.234 4.784 -9.366 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -25.722 2.634 -10.712 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -26.650 3.960 -11.419 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -24.479 6.483 -10.250 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -25.951 6.122 -11.158 1.00 0.00 H new ATOM 333 N GLU A 47 -21.014 2.607 -5.983 1.00 0.00 N ATOM 334 CA GLU A 47 -19.944 3.302 -5.310 1.00 0.00 C ATOM 335 C GLU A 47 -19.764 2.739 -3.922 1.00 0.00 C ATOM 336 O GLU A 47 -18.656 2.440 -3.514 1.00 0.00 O ATOM 337 CB GLU A 47 -20.201 4.815 -5.189 1.00 0.00 C ATOM 338 CG GLU A 47 -20.474 5.551 -6.490 1.00 0.00 C ATOM 339 CD GLU A 47 -21.838 5.278 -7.051 1.00 0.00 C ATOM 340 OE1 GLU A 47 -22.736 4.828 -6.293 1.00 0.00 O ATOM 341 OE2 GLU A 47 -22.047 5.493 -8.264 1.00 0.00 O ATOM 0 H GLU A 47 -21.847 3.172 -6.148 1.00 0.00 H new ATOM 0 HA GLU A 47 -19.048 3.157 -5.914 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -21.051 4.967 -4.524 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -19.336 5.273 -4.710 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -20.365 6.623 -6.323 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -19.722 5.265 -7.226 1.00 0.00 H new ATOM 348 N GLN A 48 -20.871 2.560 -3.208 1.00 0.00 N ATOM 349 CA GLN A 48 -20.808 2.098 -1.840 1.00 0.00 C ATOM 350 C GLN A 48 -20.370 0.641 -1.770 1.00 0.00 C ATOM 351 O GLN A 48 -19.629 0.266 -0.862 1.00 0.00 O ATOM 352 CB GLN A 48 -22.128 2.286 -1.112 1.00 0.00 C ATOM 353 CG GLN A 48 -22.012 2.104 0.388 1.00 0.00 C ATOM 354 CD GLN A 48 -21.097 3.130 1.033 1.00 0.00 C ATOM 355 OE1 GLN A 48 -19.893 2.913 1.185 1.00 0.00 O ATOM 356 NE2 GLN A 48 -21.651 4.254 1.400 1.00 0.00 N ATOM 0 H GLN A 48 -21.814 2.729 -3.558 1.00 0.00 H new ATOM 0 HA GLN A 48 -20.061 2.712 -1.336 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -22.513 3.284 -1.322 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -22.856 1.575 -1.503 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -23.003 2.174 0.836 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -21.636 1.103 0.601 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -22.651 4.400 1.259 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -21.084 4.986 1.828 1.00 0.00 H new ATOM 365 N GLU A 49 -20.819 -0.179 -2.727 1.00 0.00 N ATOM 366 CA GLU A 49 -20.382 -1.565 -2.773 1.00 0.00 C ATOM 367 C GLU A 49 -18.903 -1.615 -2.931 1.00 0.00 C ATOM 368 O GLU A 49 -18.222 -2.273 -2.161 1.00 0.00 O ATOM 369 CB GLU A 49 -21.039 -2.390 -3.885 1.00 0.00 C ATOM 370 CG GLU A 49 -22.490 -2.721 -3.646 1.00 0.00 C ATOM 371 CD GLU A 49 -23.101 -3.569 -4.734 1.00 0.00 C ATOM 372 OE1 GLU A 49 -23.345 -3.061 -5.836 1.00 0.00 O ATOM 373 OE2 GLU A 49 -23.347 -4.783 -4.499 1.00 0.00 O ATOM 0 H GLU A 49 -21.471 0.092 -3.463 1.00 0.00 H new ATOM 0 HA GLU A 49 -20.694 -2.014 -1.830 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -20.955 -1.843 -4.824 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -20.483 -3.320 -4.007 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -22.583 -3.243 -2.694 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -23.056 -1.794 -3.558 1.00 0.00 H new ATOM 380 N ARG A 50 -18.400 -0.868 -3.899 1.00 0.00 N ATOM 381 CA ARG A 50 -16.974 -0.820 -4.135 1.00 0.00 C ATOM 382 C ARG A 50 -16.260 -0.294 -2.937 1.00 0.00 C ATOM 383 O ARG A 50 -15.294 -0.856 -2.534 1.00 0.00 O ATOM 384 CB ARG A 50 -16.585 0.000 -5.350 1.00 0.00 C ATOM 385 CG ARG A 50 -17.053 -0.551 -6.663 1.00 0.00 C ATOM 386 CD ARG A 50 -16.703 -2.011 -6.817 1.00 0.00 C ATOM 387 NE ARG A 50 -17.022 -2.495 -8.164 1.00 0.00 N ATOM 388 CZ ARG A 50 -17.905 -3.461 -8.459 1.00 0.00 C ATOM 389 NH1 ARG A 50 -18.680 -3.989 -7.513 1.00 0.00 N ATOM 390 NH2 ARG A 50 -18.031 -3.870 -9.706 1.00 0.00 N ATOM 0 H ARG A 50 -18.957 -0.291 -4.529 1.00 0.00 H new ATOM 0 HA ARG A 50 -16.674 -1.849 -4.333 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -16.985 1.007 -5.233 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -15.499 0.089 -5.377 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -18.133 -0.426 -6.745 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -16.603 0.018 -7.477 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -15.641 -2.156 -6.618 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -17.249 -2.598 -6.078 1.00 0.00 H new ATOM 0 HE ARG A 50 -16.530 -2.060 -8.944 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -18.606 -3.659 -6.551 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -19.347 -4.723 -7.751 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -17.459 -3.452 -10.440 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -18.701 -4.604 -9.937 1.00 0.00 H new ATOM 404 N ALA A 51 -16.799 0.741 -2.341 1.00 0.00 N ATOM 405 CA ALA A 51 -16.205 1.362 -1.171 1.00 0.00 C ATOM 406 C ALA A 51 -16.055 0.350 -0.042 1.00 0.00 C ATOM 407 O ALA A 51 -15.010 0.260 0.576 1.00 0.00 O ATOM 408 CB ALA A 51 -17.067 2.524 -0.716 1.00 0.00 C ATOM 0 H ALA A 51 -17.665 1.182 -2.651 1.00 0.00 H new ATOM 0 HA ALA A 51 -15.214 1.729 -1.436 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -16.618 2.988 0.162 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -17.139 3.259 -1.518 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -18.064 2.161 -0.465 1.00 0.00 H new ATOM 414 N TYR A 52 -17.076 -0.449 0.167 1.00 0.00 N ATOM 415 CA TYR A 52 -17.066 -1.481 1.169 1.00 0.00 C ATOM 416 C TYR A 52 -16.059 -2.595 0.807 1.00 0.00 C ATOM 417 O TYR A 52 -15.278 -3.045 1.650 1.00 0.00 O ATOM 418 CB TYR A 52 -18.505 -2.001 1.338 1.00 0.00 C ATOM 419 CG TYR A 52 -18.631 -3.401 1.853 1.00 0.00 C ATOM 420 CD1 TYR A 52 -18.486 -3.709 3.197 1.00 0.00 C ATOM 421 CD2 TYR A 52 -18.891 -4.421 0.967 1.00 0.00 C ATOM 422 CE1 TYR A 52 -18.603 -5.013 3.636 1.00 0.00 C ATOM 423 CE2 TYR A 52 -19.009 -5.719 1.394 1.00 0.00 C ATOM 424 CZ TYR A 52 -18.864 -6.008 2.726 1.00 0.00 C ATOM 425 OH TYR A 52 -18.978 -7.301 3.147 1.00 0.00 O ATOM 0 H TYR A 52 -17.946 -0.397 -0.363 1.00 0.00 H new ATOM 0 HA TYR A 52 -16.728 -1.083 2.126 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -19.036 -1.334 2.017 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -19.009 -1.941 0.374 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -18.280 -2.922 3.907 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -19.004 -4.196 -0.083 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -18.490 -5.248 4.684 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -19.215 -6.508 0.686 1.00 0.00 H new ATOM 0 HH TYR A 52 -19.895 -7.614 2.998 1.00 0.00 H new ATOM 435 N ILE A 53 -16.065 -2.995 -0.445 1.00 0.00 N ATOM 436 CA ILE A 53 -15.171 -4.032 -0.960 1.00 0.00 C ATOM 437 C ILE A 53 -13.707 -3.553 -0.905 1.00 0.00 C ATOM 438 O ILE A 53 -12.805 -4.290 -0.499 1.00 0.00 O ATOM 439 CB ILE A 53 -15.599 -4.409 -2.412 1.00 0.00 C ATOM 440 CG1 ILE A 53 -17.009 -5.025 -2.369 1.00 0.00 C ATOM 441 CG2 ILE A 53 -14.601 -5.362 -3.073 1.00 0.00 C ATOM 442 CD1 ILE A 53 -17.692 -5.168 -3.712 1.00 0.00 C ATOM 0 H ILE A 53 -16.694 -2.611 -1.150 1.00 0.00 H new ATOM 0 HA ILE A 53 -15.245 -4.924 -0.338 1.00 0.00 H new ATOM 0 HB ILE A 53 -15.611 -3.505 -3.021 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -16.944 -6.010 -1.906 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -17.637 -4.410 -1.724 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -14.938 -5.599 -4.082 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -13.621 -4.888 -3.119 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -14.533 -6.280 -2.489 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -18.678 -5.611 -3.573 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -17.797 -4.186 -4.173 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -17.093 -5.810 -4.358 1.00 0.00 H new ATOM 454 N VAL A 54 -13.501 -2.312 -1.276 1.00 0.00 N ATOM 455 CA VAL A 54 -12.200 -1.680 -1.245 1.00 0.00 C ATOM 456 C VAL A 54 -11.731 -1.491 0.208 1.00 0.00 C ATOM 457 O VAL A 54 -10.567 -1.694 0.513 1.00 0.00 O ATOM 458 CB VAL A 54 -12.214 -0.322 -2.037 1.00 0.00 C ATOM 459 CG1 VAL A 54 -10.920 0.447 -1.864 1.00 0.00 C ATOM 460 CG2 VAL A 54 -12.457 -0.580 -3.532 1.00 0.00 C ATOM 0 H VAL A 54 -14.244 -1.701 -1.614 1.00 0.00 H new ATOM 0 HA VAL A 54 -11.483 -2.333 -1.743 1.00 0.00 H new ATOM 0 HB VAL A 54 -13.025 0.281 -1.628 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -10.972 1.379 -2.428 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -10.768 0.670 -0.808 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -10.088 -0.153 -2.232 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -12.464 0.369 -4.068 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -11.662 -1.213 -3.926 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -13.417 -1.079 -3.664 1.00 0.00 H new ATOM 470 N GLN A 55 -12.668 -1.164 1.098 1.00 0.00 N ATOM 471 CA GLN A 55 -12.397 -0.983 2.541 1.00 0.00 C ATOM 472 C GLN A 55 -11.765 -2.253 3.123 1.00 0.00 C ATOM 473 O GLN A 55 -10.740 -2.197 3.816 1.00 0.00 O ATOM 474 CB GLN A 55 -13.713 -0.693 3.267 1.00 0.00 C ATOM 475 CG GLN A 55 -13.592 -0.363 4.741 1.00 0.00 C ATOM 476 CD GLN A 55 -14.955 -0.265 5.397 1.00 0.00 C ATOM 477 OE1 GLN A 55 -15.574 0.800 5.437 1.00 0.00 O ATOM 478 NE2 GLN A 55 -15.427 -1.363 5.927 1.00 0.00 N ATOM 0 H GLN A 55 -13.645 -1.014 0.846 1.00 0.00 H new ATOM 0 HA GLN A 55 -11.707 -0.150 2.674 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -14.207 0.140 2.766 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -14.364 -1.560 3.160 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -13.000 -1.130 5.240 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -13.059 0.580 4.862 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -14.888 -2.227 5.875 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -16.335 -1.356 6.392 1.00 0.00 H new ATOM 487 N LEU A 56 -12.364 -3.391 2.795 1.00 0.00 N ATOM 488 CA LEU A 56 -11.884 -4.702 3.242 1.00 0.00 C ATOM 489 C LEU A 56 -10.466 -4.955 2.734 1.00 0.00 C ATOM 490 O LEU A 56 -9.640 -5.564 3.402 1.00 0.00 O ATOM 491 CB LEU A 56 -12.802 -5.796 2.728 1.00 0.00 C ATOM 492 CG LEU A 56 -14.280 -5.693 3.117 1.00 0.00 C ATOM 493 CD1 LEU A 56 -15.063 -6.822 2.486 1.00 0.00 C ATOM 494 CD2 LEU A 56 -14.454 -5.709 4.630 1.00 0.00 C ATOM 0 H LEU A 56 -13.199 -3.436 2.210 1.00 0.00 H new ATOM 0 HA LEU A 56 -11.880 -4.711 4.332 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -12.737 -5.812 1.640 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -12.422 -6.754 3.084 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.664 -4.743 2.746 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -16.112 -6.740 2.769 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.974 -6.765 1.401 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -14.668 -7.777 2.832 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -15.513 -5.634 4.875 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -14.053 -6.639 5.033 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.920 -4.865 5.067 1.00 0.00 H new ATOM 506 N GLN A 57 -10.218 -4.545 1.525 1.00 0.00 N ATOM 507 CA GLN A 57 -8.908 -4.666 0.922 1.00 0.00 C ATOM 508 C GLN A 57 -7.900 -3.722 1.584 1.00 0.00 C ATOM 509 O GLN A 57 -6.752 -4.077 1.780 1.00 0.00 O ATOM 510 CB GLN A 57 -8.974 -4.445 -0.574 1.00 0.00 C ATOM 511 CG GLN A 57 -9.880 -5.428 -1.284 1.00 0.00 C ATOM 512 CD GLN A 57 -9.874 -5.231 -2.772 1.00 0.00 C ATOM 513 OE1 GLN A 57 -9.069 -5.825 -3.478 1.00 0.00 O ATOM 514 NE2 GLN A 57 -10.759 -4.408 -3.257 1.00 0.00 N ATOM 0 H GLN A 57 -10.917 -4.114 0.920 1.00 0.00 H new ATOM 0 HA GLN A 57 -8.558 -5.685 1.090 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -9.324 -3.432 -0.770 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.970 -4.521 -0.990 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -9.563 -6.445 -1.052 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -10.897 -5.318 -0.909 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -11.411 -3.934 -2.632 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -10.800 -4.237 -4.262 1.00 0.00 H new ATOM 523 N ILE A 58 -8.347 -2.522 1.922 1.00 0.00 N ATOM 524 CA ILE A 58 -7.512 -1.532 2.612 1.00 0.00 C ATOM 525 C ILE A 58 -7.053 -2.070 3.958 1.00 0.00 C ATOM 526 O ILE A 58 -5.865 -1.947 4.314 1.00 0.00 O ATOM 527 CB ILE A 58 -8.266 -0.181 2.816 1.00 0.00 C ATOM 528 CG1 ILE A 58 -8.527 0.507 1.473 1.00 0.00 C ATOM 529 CG2 ILE A 58 -7.499 0.748 3.757 1.00 0.00 C ATOM 530 CD1 ILE A 58 -9.440 1.706 1.560 1.00 0.00 C ATOM 0 H ILE A 58 -9.296 -2.201 1.729 1.00 0.00 H new ATOM 0 HA ILE A 58 -6.644 -1.344 1.980 1.00 0.00 H new ATOM 0 HB ILE A 58 -9.227 -0.407 3.279 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -7.574 0.820 1.046 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -8.962 -0.218 0.785 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -8.051 1.680 3.878 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -7.382 0.267 4.728 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -6.516 0.960 3.337 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -9.573 2.135 0.567 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -10.408 1.398 1.955 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -8.999 2.452 2.221 1.00 0.00 H new ATOM 542 N GLU A 59 -7.968 -2.679 4.694 1.00 0.00 N ATOM 543 CA GLU A 59 -7.614 -3.227 5.976 1.00 0.00 C ATOM 544 C GLU A 59 -6.704 -4.412 5.788 1.00 0.00 C ATOM 545 O GLU A 59 -5.761 -4.567 6.520 1.00 0.00 O ATOM 546 CB GLU A 59 -8.816 -3.593 6.860 1.00 0.00 C ATOM 547 CG GLU A 59 -9.759 -4.619 6.281 1.00 0.00 C ATOM 548 CD GLU A 59 -10.539 -5.334 7.349 1.00 0.00 C ATOM 549 OE1 GLU A 59 -11.493 -4.761 7.903 1.00 0.00 O ATOM 550 OE2 GLU A 59 -10.188 -6.482 7.678 1.00 0.00 O ATOM 0 H GLU A 59 -8.944 -2.801 4.425 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.093 -2.437 6.517 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -8.443 -3.965 7.814 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.380 -2.684 7.071 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -10.450 -4.130 5.594 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.192 -5.345 5.699 1.00 0.00 H new ATOM 557 N ASP A 60 -6.969 -5.200 4.742 1.00 0.00 N ATOM 558 CA ASP A 60 -6.172 -6.392 4.411 1.00 0.00 C ATOM 559 C ASP A 60 -4.751 -5.963 4.157 1.00 0.00 C ATOM 560 O ASP A 60 -3.793 -6.557 4.661 1.00 0.00 O ATOM 561 CB ASP A 60 -6.669 -7.007 3.123 1.00 0.00 C ATOM 562 CG ASP A 60 -6.362 -8.475 2.990 1.00 0.00 C ATOM 563 OD1 ASP A 60 -5.195 -8.847 2.738 1.00 0.00 O ATOM 564 OD2 ASP A 60 -7.307 -9.291 3.113 1.00 0.00 O ATOM 0 H ASP A 60 -7.742 -5.032 4.098 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.248 -7.103 5.234 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -7.747 -6.864 3.056 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -6.224 -6.475 2.282 1.00 0.00 H new ATOM 569 N LEU A 61 -4.631 -4.901 3.373 1.00 0.00 N ATOM 570 CA LEU A 61 -3.354 -4.346 3.033 1.00 0.00 C ATOM 571 C LEU A 61 -2.643 -3.831 4.239 1.00 0.00 C ATOM 572 O LEU A 61 -1.519 -4.228 4.490 1.00 0.00 O ATOM 573 CB LEU A 61 -3.477 -3.243 1.988 1.00 0.00 C ATOM 574 CG LEU A 61 -3.726 -3.702 0.555 1.00 0.00 C ATOM 575 CD1 LEU A 61 -4.091 -2.520 -0.293 1.00 0.00 C ATOM 576 CD2 LEU A 61 -2.472 -4.352 -0.012 1.00 0.00 C ATOM 0 H LEU A 61 -5.424 -4.409 2.961 1.00 0.00 H new ATOM 0 HA LEU A 61 -2.765 -5.157 2.604 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -4.291 -2.580 2.282 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.562 -2.651 2.005 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.540 -4.427 0.553 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.269 -2.848 -1.317 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -4.994 -2.055 0.101 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.275 -1.797 -0.280 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -2.661 -4.676 -1.035 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.654 -3.632 -0.005 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -2.202 -5.214 0.597 1.00 0.00 H new ATOM 588 N THR A 62 -3.321 -3.021 5.039 1.00 0.00 N ATOM 589 CA THR A 62 -2.708 -2.403 6.153 1.00 0.00 C ATOM 590 C THR A 62 -2.338 -3.457 7.188 1.00 0.00 C ATOM 591 O THR A 62 -1.291 -3.395 7.764 1.00 0.00 O ATOM 592 CB THR A 62 -3.603 -1.282 6.737 1.00 0.00 C ATOM 593 OG1 THR A 62 -4.049 -0.438 5.650 1.00 0.00 O ATOM 594 CG2 THR A 62 -2.813 -0.414 7.709 1.00 0.00 C ATOM 0 H THR A 62 -4.307 -2.789 4.915 1.00 0.00 H new ATOM 0 HA THR A 62 -1.787 -1.917 5.831 1.00 0.00 H new ATOM 0 HB THR A 62 -4.443 -1.739 7.260 1.00 0.00 H new ATOM 0 HG1 THR A 62 -4.781 -0.880 5.171 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.460 0.367 8.108 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.441 -1.030 8.528 1.00 0.00 H new ATOM 0 HG23 THR A 62 -1.972 0.043 7.188 1.00 0.00 H new ATOM 602 N ARG A 63 -3.174 -4.476 7.305 1.00 0.00 N ATOM 603 CA ARG A 63 -2.974 -5.620 8.199 1.00 0.00 C ATOM 604 C ARG A 63 -1.630 -6.275 7.873 1.00 0.00 C ATOM 605 O ARG A 63 -0.842 -6.582 8.760 1.00 0.00 O ATOM 606 CB ARG A 63 -4.080 -6.621 7.882 1.00 0.00 C ATOM 607 CG ARG A 63 -4.150 -7.862 8.728 1.00 0.00 C ATOM 608 CD ARG A 63 -5.093 -8.864 8.067 1.00 0.00 C ATOM 609 NE ARG A 63 -6.467 -8.363 7.854 1.00 0.00 N ATOM 610 CZ ARG A 63 -7.226 -8.732 6.800 1.00 0.00 C ATOM 611 NH1 ARG A 63 -6.727 -9.590 5.905 1.00 0.00 N ATOM 612 NH2 ARG A 63 -8.464 -8.251 6.633 1.00 0.00 N ATOM 0 H ARG A 63 -4.038 -4.538 6.767 1.00 0.00 H new ATOM 0 HA ARG A 63 -2.991 -5.312 9.244 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.036 -6.104 7.962 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -3.970 -6.928 6.842 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -3.157 -8.297 8.840 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -4.505 -7.615 9.729 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -4.674 -9.158 7.105 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -5.139 -9.762 8.683 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.859 -7.710 8.533 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -5.783 -9.958 6.023 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -7.290 -9.877 5.104 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -8.851 -7.593 7.309 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -9.020 -8.543 5.830 1.00 0.00 H new ATOM 626 N LYS A 64 -1.374 -6.398 6.591 1.00 0.00 N ATOM 627 CA LYS A 64 -0.186 -6.976 6.053 1.00 0.00 C ATOM 628 C LYS A 64 1.048 -6.130 6.388 1.00 0.00 C ATOM 629 O LYS A 64 2.033 -6.654 6.873 1.00 0.00 O ATOM 630 CB LYS A 64 -0.422 -7.097 4.562 1.00 0.00 C ATOM 631 CG LYS A 64 0.753 -7.179 3.681 1.00 0.00 C ATOM 632 CD LYS A 64 0.306 -7.074 2.227 1.00 0.00 C ATOM 633 CE LYS A 64 -0.728 -8.145 1.884 1.00 0.00 C ATOM 634 NZ LYS A 64 -1.102 -8.149 0.460 1.00 0.00 N ATOM 0 H LYS A 64 -2.023 -6.081 5.871 1.00 0.00 H new ATOM 0 HA LYS A 64 0.019 -7.955 6.487 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -1.030 -7.985 4.391 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -1.016 -6.239 4.247 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.454 -6.378 3.916 1.00 0.00 H new ATOM 0 HG3 LYS A 64 1.278 -8.120 3.844 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.117 -6.086 2.045 1.00 0.00 H new ATOM 0 HD3 LYS A 64 1.170 -7.177 1.571 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -0.331 -9.124 2.152 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -1.621 -7.986 2.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -1.805 -8.896 0.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -1.507 -7.226 0.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -0.258 -8.328 -0.120 1.00 0.00 H new ATOM 648 N LEU A 65 0.979 -4.824 6.165 1.00 0.00 N ATOM 649 CA LEU A 65 2.105 -3.954 6.517 1.00 0.00 C ATOM 650 C LEU A 65 2.254 -3.761 8.034 1.00 0.00 C ATOM 651 O LEU A 65 3.312 -3.377 8.522 1.00 0.00 O ATOM 652 CB LEU A 65 2.109 -2.601 5.767 1.00 0.00 C ATOM 653 CG LEU A 65 0.780 -1.867 5.636 1.00 0.00 C ATOM 654 CD1 LEU A 65 0.942 -0.428 5.979 1.00 0.00 C ATOM 655 CD2 LEU A 65 0.286 -1.947 4.215 1.00 0.00 C ATOM 0 H LEU A 65 0.177 -4.348 5.752 1.00 0.00 H new ATOM 0 HA LEU A 65 2.988 -4.491 6.171 1.00 0.00 H new ATOM 0 HB2 LEU A 65 2.811 -1.938 6.272 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.499 -2.773 4.764 1.00 0.00 H new ATOM 0 HG LEU A 65 0.070 -2.337 6.317 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -0.017 0.080 5.880 1.00 0.00 H new ATOM 0 HD12 LEU A 65 1.297 -0.336 7.006 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.666 0.028 5.303 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.664 -1.420 4.130 1.00 0.00 H new ATOM 0 HD22 LEU A 65 1.017 -1.487 3.549 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.148 -2.992 3.936 1.00 0.00 H new ATOM 667 N ARG A 66 1.186 -4.006 8.761 1.00 0.00 N ATOM 668 CA ARG A 66 1.196 -3.901 10.209 1.00 0.00 C ATOM 669 C ARG A 66 1.892 -5.079 10.848 1.00 0.00 C ATOM 670 O ARG A 66 2.752 -4.902 11.703 1.00 0.00 O ATOM 671 CB ARG A 66 -0.220 -3.770 10.758 1.00 0.00 C ATOM 672 CG ARG A 66 -0.858 -2.422 10.478 1.00 0.00 C ATOM 673 CD ARG A 66 -2.344 -2.455 10.751 1.00 0.00 C ATOM 674 NE ARG A 66 -2.637 -2.774 12.155 1.00 0.00 N ATOM 675 CZ ARG A 66 -3.765 -3.341 12.608 1.00 0.00 C ATOM 676 NH1 ARG A 66 -4.727 -3.689 11.770 1.00 0.00 N ATOM 677 NH2 ARG A 66 -3.924 -3.560 13.909 1.00 0.00 N ATOM 0 H ARG A 66 0.286 -4.283 8.369 1.00 0.00 H new ATOM 0 HA ARG A 66 1.755 -3.000 10.461 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -0.842 -4.554 10.326 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -0.200 -3.936 11.835 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -0.388 -1.658 11.098 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -0.682 -2.142 9.439 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -2.781 -1.488 10.500 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -2.815 -3.195 10.105 1.00 0.00 H new ATOM 0 HE ARG A 66 -1.921 -2.545 12.844 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -4.615 -3.527 10.769 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -5.581 -4.120 12.124 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -3.188 -3.297 14.564 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -4.782 -3.991 14.252 1.00 0.00 H new ATOM 691 N THR A 67 1.560 -6.273 10.419 1.00 0.00 N ATOM 692 CA THR A 67 2.137 -7.449 11.021 1.00 0.00 C ATOM 693 C THR A 67 3.411 -7.873 10.288 1.00 0.00 C ATOM 694 O THR A 67 4.301 -8.506 10.864 1.00 0.00 O ATOM 695 CB THR A 67 1.124 -8.605 10.976 1.00 0.00 C ATOM 696 OG1 THR A 67 0.735 -8.821 9.611 1.00 0.00 O ATOM 697 CG2 THR A 67 -0.119 -8.272 11.799 1.00 0.00 C ATOM 0 H THR A 67 0.900 -6.455 9.663 1.00 0.00 H new ATOM 0 HA THR A 67 2.389 -7.211 12.054 1.00 0.00 H new ATOM 0 HB THR A 67 1.588 -9.498 11.393 1.00 0.00 H new ATOM 0 HG1 THR A 67 0.079 -8.143 9.347 1.00 0.00 H new ATOM 0 HG21 THR A 67 -0.821 -9.105 11.752 1.00 0.00 H new ATOM 0 HG22 THR A 67 0.167 -8.097 12.836 1.00 0.00 H new ATOM 0 HG23 THR A 67 -0.592 -7.376 11.397 1.00 0.00 H new ATOM 705 N GLY A 68 3.525 -7.466 9.044 1.00 0.00 N ATOM 706 CA GLY A 68 4.628 -7.881 8.221 1.00 0.00 C ATOM 707 C GLY A 68 4.320 -9.212 7.571 1.00 0.00 C ATOM 708 O GLY A 68 5.217 -9.926 7.124 1.00 0.00 O ATOM 0 H GLY A 68 2.861 -6.845 8.582 1.00 0.00 H new ATOM 0 HA2 GLY A 68 4.823 -7.130 7.455 1.00 0.00 H new ATOM 0 HA3 GLY A 68 5.532 -7.963 8.825 1.00 0.00 H new ATOM 712 N ASP A 69 3.043 -9.556 7.550 1.00 0.00 N ATOM 713 CA ASP A 69 2.581 -10.798 6.951 1.00 0.00 C ATOM 714 C ASP A 69 2.330 -10.574 5.487 1.00 0.00 C ATOM 715 O ASP A 69 1.328 -9.970 5.097 1.00 0.00 O ATOM 716 CB ASP A 69 1.307 -11.298 7.623 1.00 0.00 C ATOM 717 CG ASP A 69 0.820 -12.616 7.052 1.00 0.00 C ATOM 718 OD1 ASP A 69 1.375 -13.677 7.425 1.00 0.00 O ATOM 719 OD2 ASP A 69 -0.141 -12.615 6.244 1.00 0.00 O ATOM 0 H ASP A 69 2.298 -8.983 7.947 1.00 0.00 H new ATOM 0 HA ASP A 69 3.351 -11.557 7.088 1.00 0.00 H new ATOM 0 HB2 ASP A 69 1.487 -11.415 8.692 1.00 0.00 H new ATOM 0 HB3 ASP A 69 0.524 -10.548 7.512 1.00 0.00 H new ATOM 724 N LEU A 70 3.252 -11.002 4.686 1.00 0.00 N ATOM 725 CA LEU A 70 3.170 -10.792 3.262 1.00 0.00 C ATOM 726 C LEU A 70 2.705 -12.020 2.525 1.00 0.00 C ATOM 727 O LEU A 70 1.867 -11.929 1.635 1.00 0.00 O ATOM 728 CB LEU A 70 4.543 -10.359 2.734 1.00 0.00 C ATOM 729 CG LEU A 70 4.831 -8.859 2.626 1.00 0.00 C ATOM 730 CD1 LEU A 70 4.096 -8.285 1.450 1.00 0.00 C ATOM 731 CD2 LEU A 70 4.431 -8.106 3.896 1.00 0.00 C ATOM 0 H LEU A 70 4.084 -11.507 4.992 1.00 0.00 H new ATOM 0 HA LEU A 70 2.430 -10.011 3.085 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.303 -10.799 3.379 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.673 -10.796 1.744 1.00 0.00 H new ATOM 0 HG LEU A 70 5.906 -8.739 2.492 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.304 -7.217 1.377 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.425 -8.782 0.537 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.025 -8.438 1.580 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.653 -7.046 3.775 1.00 0.00 H new ATOM 0 HD22 LEU A 70 3.364 -8.235 4.075 1.00 0.00 H new ATOM 0 HD23 LEU A 70 4.991 -8.500 4.744 1.00 0.00 H new ATOM 743 N GLY A 71 3.248 -13.168 2.888 1.00 0.00 N ATOM 744 CA GLY A 71 2.924 -14.401 2.182 1.00 0.00 C ATOM 745 C GLY A 71 3.642 -14.469 0.835 1.00 0.00 C ATOM 746 O GLY A 71 3.463 -15.411 0.054 1.00 0.00 O ATOM 0 H GLY A 71 3.908 -13.276 3.658 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.208 -15.258 2.792 1.00 0.00 H new ATOM 0 HA3 GLY A 71 1.847 -14.463 2.027 1.00 0.00 H new ATOM 750 N ILE A 72 4.435 -13.454 0.568 1.00 0.00 N ATOM 751 CA ILE A 72 5.194 -13.335 -0.646 1.00 0.00 C ATOM 752 C ILE A 72 6.670 -13.437 -0.293 1.00 0.00 C ATOM 753 O ILE A 72 7.234 -12.507 0.301 1.00 0.00 O ATOM 754 CB ILE A 72 4.937 -11.957 -1.344 1.00 0.00 C ATOM 755 CG1 ILE A 72 3.437 -11.743 -1.638 1.00 0.00 C ATOM 756 CG2 ILE A 72 5.763 -11.819 -2.630 1.00 0.00 C ATOM 757 CD1 ILE A 72 2.815 -12.757 -2.586 1.00 0.00 C ATOM 0 H ILE A 72 4.569 -12.672 1.209 1.00 0.00 H new ATOM 0 HA ILE A 72 4.892 -14.127 -1.331 1.00 0.00 H new ATOM 0 HB ILE A 72 5.258 -11.181 -0.650 1.00 0.00 H new ATOM 0 HG12 ILE A 72 2.891 -11.767 -0.695 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.303 -10.746 -2.058 1.00 0.00 H new ATOM 0 HG21 ILE A 72 5.561 -10.852 -3.090 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.824 -11.893 -2.391 1.00 0.00 H new ATOM 0 HG23 ILE A 72 5.491 -12.614 -3.324 1.00 0.00 H new ATOM 0 HD11 ILE A 72 1.760 -12.522 -2.729 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.329 -12.720 -3.547 1.00 0.00 H new ATOM 0 HD13 ILE A 72 2.910 -13.757 -2.162 1.00 0.00 H new ATOM 769 N PRO A 73 7.301 -14.572 -0.563 1.00 0.00 N ATOM 770 CA PRO A 73 8.719 -14.741 -0.325 1.00 0.00 C ATOM 771 C PRO A 73 9.530 -14.092 -1.443 1.00 0.00 C ATOM 772 O PRO A 73 9.055 -13.996 -2.591 1.00 0.00 O ATOM 773 CB PRO A 73 8.920 -16.267 -0.349 1.00 0.00 C ATOM 774 CG PRO A 73 7.549 -16.852 -0.478 1.00 0.00 C ATOM 775 CD PRO A 73 6.703 -15.791 -1.100 1.00 0.00 C ATOM 0 HA PRO A 73 9.044 -14.281 0.609 1.00 0.00 H new ATOM 0 HB2 PRO A 73 9.554 -16.566 -1.184 1.00 0.00 H new ATOM 0 HB3 PRO A 73 9.409 -16.612 0.562 1.00 0.00 H new ATOM 0 HG2 PRO A 73 7.565 -17.750 -1.096 1.00 0.00 H new ATOM 0 HG3 PRO A 73 7.156 -17.143 0.496 1.00 0.00 H new ATOM 0 HD2 PRO A 73 6.746 -15.821 -2.189 1.00 0.00 H new ATOM 0 HD3 PRO A 73 5.654 -15.889 -0.819 1.00 0.00 H new ATOM 783 N PRO A 74 10.745 -13.624 -1.148 1.00 0.00 N ATOM 784 CA PRO A 74 11.596 -13.023 -2.153 1.00 0.00 C ATOM 785 C PRO A 74 12.047 -14.065 -3.165 1.00 0.00 C ATOM 786 O PRO A 74 12.179 -15.257 -2.843 1.00 0.00 O ATOM 787 CB PRO A 74 12.795 -12.487 -1.356 1.00 0.00 C ATOM 788 CG PRO A 74 12.819 -13.303 -0.113 1.00 0.00 C ATOM 789 CD PRO A 74 11.387 -13.652 0.184 1.00 0.00 C ATOM 0 HA PRO A 74 11.089 -12.243 -2.721 1.00 0.00 H new ATOM 0 HB2 PRO A 74 13.723 -12.594 -1.918 1.00 0.00 H new ATOM 0 HB3 PRO A 74 12.679 -11.427 -1.131 1.00 0.00 H new ATOM 0 HG2 PRO A 74 13.419 -14.203 -0.249 1.00 0.00 H new ATOM 0 HG3 PRO A 74 13.263 -12.745 0.711 1.00 0.00 H new ATOM 0 HD2 PRO A 74 11.301 -14.633 0.651 1.00 0.00 H new ATOM 0 HD3 PRO A 74 10.931 -12.933 0.865 1.00 0.00 H new ATOM 797 N ASN A 75 12.231 -13.645 -4.373 1.00 0.00 N ATOM 798 CA ASN A 75 12.686 -14.536 -5.409 1.00 0.00 C ATOM 799 C ASN A 75 14.168 -14.741 -5.305 1.00 0.00 C ATOM 800 O ASN A 75 14.901 -13.788 -5.065 1.00 0.00 O ATOM 801 CB ASN A 75 12.340 -13.981 -6.796 1.00 0.00 C ATOM 802 CG ASN A 75 10.908 -14.230 -7.183 1.00 0.00 C ATOM 803 OD1 ASN A 75 10.007 -13.481 -6.803 1.00 0.00 O ATOM 804 ND2 ASN A 75 10.691 -15.244 -7.973 1.00 0.00 N ATOM 0 H ASN A 75 12.074 -12.684 -4.677 1.00 0.00 H new ATOM 0 HA ASN A 75 12.180 -15.492 -5.278 1.00 0.00 H new ATOM 0 HB2 ASN A 75 12.535 -12.909 -6.812 1.00 0.00 H new ATOM 0 HB3 ASN A 75 12.996 -14.435 -7.538 1.00 0.00 H new ATOM 0 HD21 ASN A 75 9.746 -15.442 -8.301 1.00 0.00 H new ATOM 0 HD22 ASN A 75 11.467 -15.839 -8.264 1.00 0.00 H new ATOM 811 N PRO A 76 14.652 -15.982 -5.464 1.00 0.00 N ATOM 812 CA PRO A 76 16.091 -16.258 -5.511 1.00 0.00 C ATOM 813 C PRO A 76 16.707 -15.578 -6.731 1.00 0.00 C ATOM 814 O PRO A 76 17.901 -15.329 -6.791 1.00 0.00 O ATOM 815 CB PRO A 76 16.170 -17.789 -5.650 1.00 0.00 C ATOM 816 CG PRO A 76 14.825 -18.208 -6.132 1.00 0.00 C ATOM 817 CD PRO A 76 13.855 -17.225 -5.551 1.00 0.00 C ATOM 0 HA PRO A 76 16.628 -15.890 -4.637 1.00 0.00 H new ATOM 0 HB2 PRO A 76 16.949 -18.081 -6.354 1.00 0.00 H new ATOM 0 HB3 PRO A 76 16.410 -18.259 -4.696 1.00 0.00 H new ATOM 0 HG2 PRO A 76 14.781 -18.202 -7.221 1.00 0.00 H new ATOM 0 HG3 PRO A 76 14.593 -19.223 -5.809 1.00 0.00 H new ATOM 0 HD2 PRO A 76 12.979 -17.099 -6.187 1.00 0.00 H new ATOM 0 HD3 PRO A 76 13.495 -17.543 -4.572 1.00 0.00 H new ATOM 825 N GLU A 77 15.845 -15.262 -7.688 1.00 0.00 N ATOM 826 CA GLU A 77 16.212 -14.578 -8.903 1.00 0.00 C ATOM 827 C GLU A 77 16.390 -13.092 -8.705 1.00 0.00 C ATOM 828 O GLU A 77 16.876 -12.390 -9.590 1.00 0.00 O ATOM 829 CB GLU A 77 15.214 -14.871 -9.991 1.00 0.00 C ATOM 830 CG GLU A 77 15.329 -16.289 -10.487 1.00 0.00 C ATOM 831 CD GLU A 77 16.748 -16.587 -10.931 1.00 0.00 C ATOM 832 OE1 GLU A 77 17.107 -16.245 -12.064 1.00 0.00 O ATOM 833 OE2 GLU A 77 17.551 -17.119 -10.123 1.00 0.00 O ATOM 0 H GLU A 77 14.851 -15.483 -7.632 1.00 0.00 H new ATOM 0 HA GLU A 77 17.185 -14.962 -9.209 1.00 0.00 H new ATOM 0 HB2 GLU A 77 14.205 -14.698 -9.616 1.00 0.00 H new ATOM 0 HB3 GLU A 77 15.368 -14.182 -10.821 1.00 0.00 H new ATOM 0 HG2 GLU A 77 15.037 -16.981 -9.697 1.00 0.00 H new ATOM 0 HG3 GLU A 77 14.642 -16.446 -11.318 1.00 0.00 H new ATOM 840 N ASP A 78 16.025 -12.619 -7.537 1.00 0.00 N ATOM 841 CA ASP A 78 16.249 -11.226 -7.184 1.00 0.00 C ATOM 842 C ASP A 78 17.750 -11.105 -6.897 1.00 0.00 C ATOM 843 O ASP A 78 18.367 -10.063 -7.099 1.00 0.00 O ATOM 844 CB ASP A 78 15.383 -10.874 -5.976 1.00 0.00 C ATOM 845 CG ASP A 78 15.273 -9.396 -5.684 1.00 0.00 C ATOM 846 OD1 ASP A 78 14.353 -8.731 -6.246 1.00 0.00 O ATOM 847 OD2 ASP A 78 16.044 -8.880 -4.864 1.00 0.00 O ATOM 0 H ASP A 78 15.571 -13.173 -6.811 1.00 0.00 H new ATOM 0 HA ASP A 78 15.971 -10.529 -7.975 1.00 0.00 H new ATOM 0 HB2 ASP A 78 14.382 -11.274 -6.136 1.00 0.00 H new ATOM 0 HB3 ASP A 78 15.790 -11.374 -5.097 1.00 0.00 H new ATOM 852 N ARG A 79 18.307 -12.260 -6.467 1.00 0.00 N ATOM 853 CA ARG A 79 19.740 -12.558 -6.328 1.00 0.00 C ATOM 854 C ARG A 79 20.494 -11.703 -5.336 1.00 0.00 C ATOM 855 O ARG A 79 20.902 -12.171 -4.271 1.00 0.00 O ATOM 856 CB ARG A 79 20.427 -12.579 -7.703 1.00 0.00 C ATOM 857 CG ARG A 79 19.864 -13.642 -8.636 1.00 0.00 C ATOM 858 CD ARG A 79 20.485 -13.600 -10.013 1.00 0.00 C ATOM 859 NE ARG A 79 19.830 -14.555 -10.932 1.00 0.00 N ATOM 860 CZ ARG A 79 20.297 -14.917 -12.137 1.00 0.00 C ATOM 861 NH1 ARG A 79 21.462 -14.455 -12.568 1.00 0.00 N ATOM 862 NH2 ARG A 79 19.581 -15.722 -12.906 1.00 0.00 N ATOM 0 H ARG A 79 17.728 -13.053 -6.193 1.00 0.00 H new ATOM 0 HA ARG A 79 19.778 -13.555 -5.889 1.00 0.00 H new ATOM 0 HB2 ARG A 79 20.320 -11.600 -8.171 1.00 0.00 H new ATOM 0 HB3 ARG A 79 21.494 -12.752 -7.567 1.00 0.00 H new ATOM 0 HG2 ARG A 79 20.028 -14.627 -8.198 1.00 0.00 H new ATOM 0 HG3 ARG A 79 18.786 -13.508 -8.724 1.00 0.00 H new ATOM 0 HD2 ARG A 79 20.406 -12.591 -10.418 1.00 0.00 H new ATOM 0 HD3 ARG A 79 21.547 -13.833 -9.941 1.00 0.00 H new ATOM 0 HE ARG A 79 18.952 -14.973 -10.625 1.00 0.00 H new ATOM 0 HH11 ARG A 79 22.007 -13.822 -11.983 1.00 0.00 H new ATOM 0 HH12 ARG A 79 21.813 -14.733 -13.484 1.00 0.00 H new ATOM 0 HH21 ARG A 79 18.677 -16.066 -12.582 1.00 0.00 H new ATOM 0 HH22 ARG A 79 19.933 -15.999 -13.822 1.00 0.00 H new ATOM 876 N SER A 80 20.679 -10.492 -5.665 1.00 0.00 N ATOM 877 CA SER A 80 21.456 -9.610 -4.870 1.00 0.00 C ATOM 878 C SER A 80 20.519 -8.680 -4.112 1.00 0.00 C ATOM 879 O SER A 80 19.436 -8.361 -4.623 1.00 0.00 O ATOM 880 CB SER A 80 22.413 -8.823 -5.778 1.00 0.00 C ATOM 881 OG SER A 80 23.372 -8.102 -5.030 1.00 0.00 O ATOM 0 H SER A 80 20.292 -10.067 -6.508 1.00 0.00 H new ATOM 0 HA SER A 80 22.054 -10.165 -4.147 1.00 0.00 H new ATOM 0 HB2 SER A 80 22.921 -9.511 -6.454 1.00 0.00 H new ATOM 0 HB3 SER A 80 21.841 -8.132 -6.397 1.00 0.00 H new ATOM 0 HG SER A 80 23.964 -7.615 -5.640 1.00 0.00 H new ATOM 887 N PRO A 81 20.881 -8.288 -2.856 1.00 0.00 N ATOM 888 CA PRO A 81 20.104 -7.326 -2.067 1.00 0.00 C ATOM 889 C PRO A 81 19.785 -6.079 -2.885 1.00 0.00 C ATOM 890 O PRO A 81 20.543 -5.708 -3.797 1.00 0.00 O ATOM 891 CB PRO A 81 21.046 -6.961 -0.918 1.00 0.00 C ATOM 892 CG PRO A 81 21.907 -8.158 -0.744 1.00 0.00 C ATOM 893 CD PRO A 81 22.069 -8.768 -2.112 1.00 0.00 C ATOM 0 HA PRO A 81 19.149 -7.735 -1.737 1.00 0.00 H new ATOM 0 HB2 PRO A 81 21.639 -6.078 -1.157 1.00 0.00 H new ATOM 0 HB3 PRO A 81 20.491 -6.736 -0.007 1.00 0.00 H new ATOM 0 HG2 PRO A 81 22.875 -7.883 -0.324 1.00 0.00 H new ATOM 0 HG3 PRO A 81 21.451 -8.868 -0.054 1.00 0.00 H new ATOM 0 HD2 PRO A 81 22.996 -8.445 -2.587 1.00 0.00 H new ATOM 0 HD3 PRO A 81 22.098 -9.857 -2.064 1.00 0.00 H new ATOM 901 N SER A 82 18.709 -5.437 -2.564 1.00 0.00 N ATOM 902 CA SER A 82 18.264 -4.307 -3.308 1.00 0.00 C ATOM 903 C SER A 82 19.259 -3.131 -3.195 1.00 0.00 C ATOM 904 O SER A 82 19.878 -2.920 -2.118 1.00 0.00 O ATOM 905 CB SER A 82 16.860 -3.955 -2.834 1.00 0.00 C ATOM 906 OG SER A 82 16.803 -3.990 -1.424 1.00 0.00 O ATOM 0 H SER A 82 18.112 -5.684 -1.774 1.00 0.00 H new ATOM 0 HA SER A 82 18.223 -4.541 -4.372 1.00 0.00 H new ATOM 0 HB2 SER A 82 16.584 -2.963 -3.193 1.00 0.00 H new ATOM 0 HB3 SER A 82 16.139 -4.657 -3.253 1.00 0.00 H new ATOM 0 HG SER A 82 16.968 -3.092 -1.068 1.00 0.00 H new ATOM 912 N PRO A 83 19.475 -2.404 -4.324 1.00 0.00 N ATOM 913 CA PRO A 83 20.409 -1.272 -4.406 1.00 0.00 C ATOM 914 C PRO A 83 20.256 -0.295 -3.248 1.00 0.00 C ATOM 915 O PRO A 83 19.125 -0.032 -2.776 1.00 0.00 O ATOM 916 CB PRO A 83 20.014 -0.593 -5.715 1.00 0.00 C ATOM 917 CG PRO A 83 19.505 -1.699 -6.564 1.00 0.00 C ATOM 918 CD PRO A 83 18.818 -2.655 -5.633 1.00 0.00 C ATOM 0 HA PRO A 83 21.447 -1.602 -4.363 1.00 0.00 H new ATOM 0 HB2 PRO A 83 19.251 0.168 -5.554 1.00 0.00 H new ATOM 0 HB3 PRO A 83 20.866 -0.096 -6.178 1.00 0.00 H new ATOM 0 HG2 PRO A 83 18.813 -1.325 -7.319 1.00 0.00 H new ATOM 0 HG3 PRO A 83 20.321 -2.190 -7.095 1.00 0.00 H new ATOM 0 HD2 PRO A 83 17.745 -2.467 -5.585 1.00 0.00 H new ATOM 0 HD3 PRO A 83 18.946 -3.689 -5.954 1.00 0.00 H new ATOM 926 N GLU A 84 21.376 0.218 -2.777 1.00 0.00 N ATOM 927 CA GLU A 84 21.378 1.152 -1.680 1.00 0.00 C ATOM 928 C GLU A 84 20.730 2.462 -2.118 1.00 0.00 C ATOM 929 O GLU A 84 21.090 3.021 -3.161 1.00 0.00 O ATOM 930 CB GLU A 84 22.802 1.419 -1.185 1.00 0.00 C ATOM 931 CG GLU A 84 22.862 2.359 0.015 1.00 0.00 C ATOM 932 CD GLU A 84 24.262 2.702 0.431 1.00 0.00 C ATOM 933 OE1 GLU A 84 24.831 3.666 -0.102 1.00 0.00 O ATOM 934 OE2 GLU A 84 24.820 2.022 1.300 1.00 0.00 O ATOM 0 H GLU A 84 22.302 -0.002 -3.144 1.00 0.00 H new ATOM 0 HA GLU A 84 20.808 0.717 -0.859 1.00 0.00 H new ATOM 0 HB2 GLU A 84 23.269 0.471 -0.918 1.00 0.00 H new ATOM 0 HB3 GLU A 84 23.388 1.845 -2.000 1.00 0.00 H new ATOM 0 HG2 GLU A 84 22.326 3.278 -0.225 1.00 0.00 H new ATOM 0 HG3 GLU A 84 22.343 1.898 0.855 1.00 0.00 H new ATOM 941 N PRO A 85 19.739 2.933 -1.368 1.00 0.00 N ATOM 942 CA PRO A 85 19.084 4.194 -1.647 1.00 0.00 C ATOM 943 C PRO A 85 19.990 5.376 -1.326 1.00 0.00 C ATOM 944 O PRO A 85 20.965 5.256 -0.550 1.00 0.00 O ATOM 945 CB PRO A 85 17.883 4.190 -0.704 1.00 0.00 C ATOM 946 CG PRO A 85 18.304 3.314 0.422 1.00 0.00 C ATOM 947 CD PRO A 85 19.158 2.258 -0.192 1.00 0.00 C ATOM 0 HA PRO A 85 18.816 4.295 -2.699 1.00 0.00 H new ATOM 0 HB2 PRO A 85 17.645 5.196 -0.358 1.00 0.00 H new ATOM 0 HB3 PRO A 85 16.991 3.803 -1.197 1.00 0.00 H new ATOM 0 HG2 PRO A 85 18.857 3.879 1.173 1.00 0.00 H new ATOM 0 HG3 PRO A 85 17.440 2.878 0.924 1.00 0.00 H new ATOM 0 HD2 PRO A 85 19.930 1.914 0.497 1.00 0.00 H new ATOM 0 HD3 PRO A 85 18.573 1.384 -0.478 1.00 0.00 H new ATOM 955 N ILE A 86 19.691 6.498 -1.913 1.00 0.00 N ATOM 956 CA ILE A 86 20.419 7.693 -1.642 1.00 0.00 C ATOM 957 C ILE A 86 19.892 8.276 -0.317 1.00 0.00 C ATOM 958 O ILE A 86 18.751 7.991 0.086 1.00 0.00 O ATOM 959 CB ILE A 86 20.300 8.719 -2.817 1.00 0.00 C ATOM 960 CG1 ILE A 86 21.278 9.890 -2.648 1.00 0.00 C ATOM 961 CG2 ILE A 86 18.877 9.240 -2.940 1.00 0.00 C ATOM 962 CD1 ILE A 86 22.742 9.490 -2.634 1.00 0.00 C ATOM 0 H ILE A 86 18.937 6.606 -2.591 1.00 0.00 H new ATOM 0 HA ILE A 86 21.482 7.469 -1.549 1.00 0.00 H new ATOM 0 HB ILE A 86 20.562 8.191 -3.734 1.00 0.00 H new ATOM 0 HG12 ILE A 86 21.117 10.602 -3.458 1.00 0.00 H new ATOM 0 HG13 ILE A 86 21.047 10.408 -1.717 1.00 0.00 H new ATOM 0 HG21 ILE A 86 18.820 9.952 -3.764 1.00 0.00 H new ATOM 0 HG22 ILE A 86 18.200 8.408 -3.132 1.00 0.00 H new ATOM 0 HG23 ILE A 86 18.589 9.735 -2.012 1.00 0.00 H new ATOM 0 HD11 ILE A 86 23.361 10.379 -2.511 1.00 0.00 H new ATOM 0 HD12 ILE A 86 22.924 8.804 -1.807 1.00 0.00 H new ATOM 0 HD13 ILE A 86 22.994 9.000 -3.574 1.00 0.00 H new ATOM 974 N TYR A 87 20.719 9.016 0.359 1.00 0.00 N ATOM 975 CA TYR A 87 20.410 9.549 1.667 1.00 0.00 C ATOM 976 C TYR A 87 19.307 10.589 1.616 1.00 0.00 C ATOM 977 O TYR A 87 19.166 11.339 0.638 1.00 0.00 O ATOM 978 CB TYR A 87 21.663 10.154 2.306 1.00 0.00 C ATOM 979 CG TYR A 87 22.773 9.159 2.568 1.00 0.00 C ATOM 980 CD1 TYR A 87 23.541 8.650 1.529 1.00 0.00 C ATOM 981 CD2 TYR A 87 23.055 8.733 3.858 1.00 0.00 C ATOM 982 CE1 TYR A 87 24.553 7.747 1.768 1.00 0.00 C ATOM 983 CE2 TYR A 87 24.071 7.833 4.105 1.00 0.00 C ATOM 984 CZ TYR A 87 24.816 7.345 3.055 1.00 0.00 C ATOM 985 OH TYR A 87 25.829 6.448 3.293 1.00 0.00 O ATOM 0 H TYR A 87 21.645 9.275 0.018 1.00 0.00 H new ATOM 0 HA TYR A 87 20.054 8.718 2.275 1.00 0.00 H new ATOM 0 HB2 TYR A 87 22.044 10.942 1.656 1.00 0.00 H new ATOM 0 HB3 TYR A 87 21.384 10.625 3.248 1.00 0.00 H new ATOM 0 HD1 TYR A 87 23.341 8.968 0.516 1.00 0.00 H new ATOM 0 HD2 TYR A 87 22.469 9.112 4.682 1.00 0.00 H new ATOM 0 HE1 TYR A 87 25.137 7.357 0.948 1.00 0.00 H new ATOM 0 HE2 TYR A 87 24.281 7.513 5.115 1.00 0.00 H new ATOM 0 HH TYR A 87 25.887 6.267 4.254 1.00 0.00 H new ATOM 995 N ASN A 88 18.509 10.589 2.650 1.00 0.00 N ATOM 996 CA ASN A 88 17.449 11.562 2.853 1.00 0.00 C ATOM 997 C ASN A 88 18.064 12.911 3.168 1.00 0.00 C ATOM 998 O ASN A 88 19.227 12.979 3.582 1.00 0.00 O ATOM 999 CB ASN A 88 16.568 11.156 4.049 1.00 0.00 C ATOM 1000 CG ASN A 88 15.676 9.941 3.845 1.00 0.00 C ATOM 1001 OD1 ASN A 88 15.967 9.053 3.053 1.00 0.00 O ATOM 1002 ND2 ASN A 88 14.603 9.879 4.605 1.00 0.00 N ATOM 0 H ASN A 88 18.573 9.898 3.398 1.00 0.00 H new ATOM 0 HA ASN A 88 16.845 11.608 1.947 1.00 0.00 H new ATOM 0 HB2 ASN A 88 17.217 10.965 4.903 1.00 0.00 H new ATOM 0 HB3 ASN A 88 15.936 12.004 4.313 1.00 0.00 H new ATOM 0 HD21 ASN A 88 13.982 9.072 4.546 1.00 0.00 H new ATOM 0 HD22 ASN A 88 14.393 10.638 5.253 1.00 0.00 H new ATOM 1009 N SER A 89 17.278 13.966 3.043 1.00 0.00 N ATOM 1010 CA SER A 89 17.719 15.331 3.327 1.00 0.00 C ATOM 1011 C SER A 89 18.094 15.464 4.823 1.00 0.00 C ATOM 1012 O SER A 89 18.915 16.298 5.207 1.00 0.00 O ATOM 1013 CB SER A 89 16.592 16.317 2.936 1.00 0.00 C ATOM 1014 OG SER A 89 16.970 17.680 3.091 1.00 0.00 O ATOM 0 H SER A 89 16.306 13.905 2.739 1.00 0.00 H new ATOM 0 HA SER A 89 18.607 15.568 2.741 1.00 0.00 H new ATOM 0 HB2 SER A 89 16.305 16.140 1.899 1.00 0.00 H new ATOM 0 HB3 SER A 89 15.713 16.117 3.548 1.00 0.00 H new ATOM 0 HG SER A 89 16.223 18.258 2.829 1.00 0.00 H new ATOM 1020 N GLU A 90 17.515 14.594 5.640 1.00 0.00 N ATOM 1021 CA GLU A 90 17.776 14.545 7.072 1.00 0.00 C ATOM 1022 C GLU A 90 19.082 13.763 7.387 1.00 0.00 C ATOM 1023 O GLU A 90 19.428 13.568 8.549 1.00 0.00 O ATOM 1024 CB GLU A 90 16.584 13.882 7.773 1.00 0.00 C ATOM 1025 CG GLU A 90 16.348 12.453 7.321 1.00 0.00 C ATOM 1026 CD GLU A 90 15.118 11.819 7.907 1.00 0.00 C ATOM 1027 OE1 GLU A 90 15.046 11.668 9.148 1.00 0.00 O ATOM 1028 OE2 GLU A 90 14.200 11.448 7.132 1.00 0.00 O ATOM 0 H GLU A 90 16.843 13.895 5.323 1.00 0.00 H new ATOM 0 HA GLU A 90 17.907 15.563 7.437 1.00 0.00 H new ATOM 0 HB2 GLU A 90 16.751 13.893 8.850 1.00 0.00 H new ATOM 0 HB3 GLU A 90 15.686 14.470 7.584 1.00 0.00 H new ATOM 0 HG2 GLU A 90 16.270 12.435 6.234 1.00 0.00 H new ATOM 0 HG3 GLU A 90 17.216 11.851 7.588 1.00 0.00 H new ATOM 1035 N GLY A 91 19.782 13.304 6.350 1.00 0.00 N ATOM 1036 CA GLY A 91 21.025 12.561 6.549 1.00 0.00 C ATOM 1037 C GLY A 91 20.764 11.136 6.987 1.00 0.00 C ATOM 1038 O GLY A 91 21.535 10.542 7.746 1.00 0.00 O ATOM 0 H GLY A 91 19.513 13.432 5.374 1.00 0.00 H new ATOM 0 HA2 GLY A 91 21.598 12.557 5.622 1.00 0.00 H new ATOM 0 HA3 GLY A 91 21.634 13.066 7.299 1.00 0.00 H new ATOM 1042 N LYS A 92 19.673 10.596 6.516 1.00 0.00 N ATOM 1043 CA LYS A 92 19.256 9.265 6.875 1.00 0.00 C ATOM 1044 C LYS A 92 19.368 8.347 5.686 1.00 0.00 C ATOM 1045 O LYS A 92 18.921 8.685 4.591 1.00 0.00 O ATOM 1046 CB LYS A 92 17.793 9.299 7.340 1.00 0.00 C ATOM 1047 CG LYS A 92 17.162 7.948 7.661 1.00 0.00 C ATOM 1048 CD LYS A 92 15.656 8.101 7.855 1.00 0.00 C ATOM 1049 CE LYS A 92 14.968 6.785 8.194 1.00 0.00 C ATOM 1050 NZ LYS A 92 15.403 6.242 9.491 1.00 0.00 N ATOM 0 H LYS A 92 19.043 11.069 5.868 1.00 0.00 H new ATOM 0 HA LYS A 92 19.897 8.898 7.676 1.00 0.00 H new ATOM 0 HB2 LYS A 92 17.729 9.928 8.228 1.00 0.00 H new ATOM 0 HB3 LYS A 92 17.197 9.781 6.565 1.00 0.00 H new ATOM 0 HG2 LYS A 92 17.362 7.244 6.853 1.00 0.00 H new ATOM 0 HG3 LYS A 92 17.612 7.534 8.563 1.00 0.00 H new ATOM 0 HD2 LYS A 92 15.468 8.820 8.652 1.00 0.00 H new ATOM 0 HD3 LYS A 92 15.217 8.512 6.946 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.889 6.936 8.210 1.00 0.00 H new ATOM 0 HE3 LYS A 92 15.176 6.057 7.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 14.824 5.413 9.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 16.403 5.961 9.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.290 6.968 10.227 1.00 0.00 H new ATOM 1064 N ARG A 93 19.982 7.230 5.882 1.00 0.00 N ATOM 1065 CA ARG A 93 19.962 6.195 4.905 1.00 0.00 C ATOM 1066 C ARG A 93 18.991 5.185 5.445 1.00 0.00 C ATOM 1067 O ARG A 93 19.133 4.730 6.577 1.00 0.00 O ATOM 1068 CB ARG A 93 21.337 5.573 4.706 1.00 0.00 C ATOM 1069 CG ARG A 93 21.359 4.483 3.647 1.00 0.00 C ATOM 1070 CD ARG A 93 22.733 3.864 3.506 1.00 0.00 C ATOM 1071 NE ARG A 93 23.242 3.357 4.787 1.00 0.00 N ATOM 1072 CZ ARG A 93 24.371 2.653 4.967 1.00 0.00 C ATOM 1073 NH1 ARG A 93 25.078 2.204 3.935 1.00 0.00 N ATOM 1074 NH2 ARG A 93 24.759 2.370 6.200 1.00 0.00 N ATOM 0 H ARG A 93 20.512 7.008 6.725 1.00 0.00 H new ATOM 0 HA ARG A 93 19.672 6.574 3.925 1.00 0.00 H new ATOM 0 HB2 ARG A 93 22.044 6.354 4.427 1.00 0.00 H new ATOM 0 HB3 ARG A 93 21.680 5.156 5.653 1.00 0.00 H new ATOM 0 HG2 ARG A 93 20.637 3.709 3.907 1.00 0.00 H new ATOM 0 HG3 ARG A 93 21.048 4.900 2.689 1.00 0.00 H new ATOM 0 HD2 ARG A 93 22.691 3.048 2.784 1.00 0.00 H new ATOM 0 HD3 ARG A 93 23.426 4.606 3.109 1.00 0.00 H new ATOM 0 HE ARG A 93 22.686 3.559 5.618 1.00 0.00 H new ATOM 0 HH11 ARG A 93 24.766 2.392 2.982 1.00 0.00 H new ATOM 0 HH12 ARG A 93 25.933 1.671 4.096 1.00 0.00 H new ATOM 0 HH21 ARG A 93 24.203 2.686 6.995 1.00 0.00 H new ATOM 0 HH22 ARG A 93 25.614 1.836 6.356 1.00 0.00 H new ATOM 1088 N LEU A 94 18.009 4.861 4.692 1.00 0.00 N ATOM 1089 CA LEU A 94 16.949 4.027 5.211 1.00 0.00 C ATOM 1090 C LEU A 94 17.067 2.612 4.678 1.00 0.00 C ATOM 1091 O LEU A 94 18.107 2.224 4.127 1.00 0.00 O ATOM 1092 CB LEU A 94 15.548 4.641 4.921 1.00 0.00 C ATOM 1093 CG LEU A 94 14.930 4.451 3.521 1.00 0.00 C ATOM 1094 CD1 LEU A 94 13.624 5.194 3.413 1.00 0.00 C ATOM 1095 CD2 LEU A 94 15.875 4.859 2.420 1.00 0.00 C ATOM 0 H LEU A 94 17.900 5.148 3.719 1.00 0.00 H new ATOM 0 HA LEU A 94 17.056 3.980 6.295 1.00 0.00 H new ATOM 0 HB2 LEU A 94 14.850 4.228 5.649 1.00 0.00 H new ATOM 0 HB3 LEU A 94 15.611 5.712 5.111 1.00 0.00 H new ATOM 0 HG LEU A 94 14.737 3.386 3.394 1.00 0.00 H new ATOM 0 HD11 LEU A 94 13.203 5.048 2.418 1.00 0.00 H new ATOM 0 HD12 LEU A 94 12.927 4.815 4.161 1.00 0.00 H new ATOM 0 HD13 LEU A 94 13.795 6.257 3.582 1.00 0.00 H new ATOM 0 HD21 LEU A 94 15.395 4.707 1.453 1.00 0.00 H new ATOM 0 HD22 LEU A 94 16.135 5.911 2.535 1.00 0.00 H new ATOM 0 HD23 LEU A 94 16.780 4.254 2.475 1.00 0.00 H new ATOM 1107 N ASN A 95 16.020 1.857 4.844 1.00 0.00 N ATOM 1108 CA ASN A 95 15.989 0.478 4.445 1.00 0.00 C ATOM 1109 C ASN A 95 15.836 0.340 2.956 1.00 0.00 C ATOM 1110 O ASN A 95 15.260 1.200 2.295 1.00 0.00 O ATOM 1111 CB ASN A 95 14.891 -0.297 5.163 1.00 0.00 C ATOM 1112 CG ASN A 95 15.006 -0.259 6.676 1.00 0.00 C ATOM 1113 OD1 ASN A 95 14.004 -0.335 7.377 1.00 0.00 O ATOM 1114 ND2 ASN A 95 16.199 -0.082 7.185 1.00 0.00 N ATOM 0 H ASN A 95 15.151 2.185 5.266 1.00 0.00 H new ATOM 0 HA ASN A 95 16.948 0.047 4.734 1.00 0.00 H new ATOM 0 HB2 ASN A 95 13.922 0.108 4.871 1.00 0.00 H new ATOM 0 HB3 ASN A 95 14.915 -1.335 4.832 1.00 0.00 H new ATOM 0 HD21 ASN A 95 16.316 -0.003 8.195 1.00 0.00 H new ATOM 0 HD22 ASN A 95 17.012 -0.023 6.571 1.00 0.00 H new ATOM 1121 N THR A 96 16.414 -0.680 2.428 1.00 0.00 N ATOM 1122 CA THR A 96 16.309 -0.942 1.042 1.00 0.00 C ATOM 1123 C THR A 96 15.289 -2.080 0.749 1.00 0.00 C ATOM 1124 O THR A 96 14.318 -1.866 0.030 1.00 0.00 O ATOM 1125 CB THR A 96 17.705 -1.182 0.386 1.00 0.00 C ATOM 1126 OG1 THR A 96 17.573 -1.441 -1.000 1.00 0.00 O ATOM 1127 CG2 THR A 96 18.477 -2.317 1.048 1.00 0.00 C ATOM 0 H THR A 96 16.973 -1.356 2.948 1.00 0.00 H new ATOM 0 HA THR A 96 15.908 -0.047 0.567 1.00 0.00 H new ATOM 0 HB THR A 96 18.275 -0.265 0.533 1.00 0.00 H new ATOM 0 HG1 THR A 96 18.127 -0.810 -1.505 1.00 0.00 H new ATOM 0 HG21 THR A 96 19.440 -2.440 0.552 1.00 0.00 H new ATOM 0 HG22 THR A 96 18.638 -2.082 2.100 1.00 0.00 H new ATOM 0 HG23 THR A 96 17.906 -3.242 0.966 1.00 0.00 H new ATOM 1135 N ARG A 97 15.456 -3.247 1.379 1.00 0.00 N ATOM 1136 CA ARG A 97 14.586 -4.407 1.088 1.00 0.00 C ATOM 1137 C ARG A 97 13.242 -4.189 1.725 1.00 0.00 C ATOM 1138 O ARG A 97 12.193 -4.272 1.075 1.00 0.00 O ATOM 1139 CB ARG A 97 15.140 -5.662 1.726 1.00 0.00 C ATOM 1140 CG ARG A 97 16.569 -5.998 1.421 1.00 0.00 C ATOM 1141 CD ARG A 97 17.050 -7.009 2.437 1.00 0.00 C ATOM 1142 NE ARG A 97 17.015 -6.450 3.805 1.00 0.00 N ATOM 1143 CZ ARG A 97 17.805 -6.804 4.816 1.00 0.00 C ATOM 1144 NH1 ARG A 97 18.763 -7.717 4.642 1.00 0.00 N ATOM 1145 NH2 ARG A 97 17.631 -6.235 6.012 1.00 0.00 N ATOM 0 H ARG A 97 16.172 -3.420 2.084 1.00 0.00 H new ATOM 0 HA ARG A 97 14.523 -4.511 0.005 1.00 0.00 H new ATOM 0 HB2 ARG A 97 15.036 -5.569 2.807 1.00 0.00 H new ATOM 0 HB3 ARG A 97 14.519 -6.503 1.417 1.00 0.00 H new ATOM 0 HG2 ARG A 97 16.656 -6.403 0.413 1.00 0.00 H new ATOM 0 HG3 ARG A 97 17.186 -5.100 1.458 1.00 0.00 H new ATOM 0 HD2 ARG A 97 16.426 -7.901 2.390 1.00 0.00 H new ATOM 0 HD3 ARG A 97 18.067 -7.318 2.193 1.00 0.00 H new ATOM 0 HE ARG A 97 16.321 -5.726 3.991 1.00 0.00 H new ATOM 0 HH11 ARG A 97 18.895 -8.150 3.728 1.00 0.00 H new ATOM 0 HH12 ARG A 97 19.363 -7.982 5.423 1.00 0.00 H new ATOM 0 HH21 ARG A 97 16.899 -5.537 6.143 1.00 0.00 H new ATOM 0 HH22 ARG A 97 18.230 -6.498 6.794 1.00 0.00 H new ATOM 1159 N GLU A 98 13.305 -3.886 3.010 1.00 0.00 N ATOM 1160 CA GLU A 98 12.163 -3.689 3.851 1.00 0.00 C ATOM 1161 C GLU A 98 11.303 -2.586 3.305 1.00 0.00 C ATOM 1162 O GLU A 98 10.080 -2.706 3.213 1.00 0.00 O ATOM 1163 CB GLU A 98 12.599 -3.291 5.280 1.00 0.00 C ATOM 1164 CG GLU A 98 13.376 -4.357 6.086 1.00 0.00 C ATOM 1165 CD GLU A 98 14.879 -4.447 5.762 1.00 0.00 C ATOM 1166 OE1 GLU A 98 15.264 -4.543 4.592 1.00 0.00 O ATOM 1167 OE2 GLU A 98 15.703 -4.399 6.678 1.00 0.00 O ATOM 0 H GLU A 98 14.190 -3.769 3.503 1.00 0.00 H new ATOM 0 HA GLU A 98 11.607 -4.626 3.880 1.00 0.00 H new ATOM 0 HB2 GLU A 98 13.218 -2.397 5.211 1.00 0.00 H new ATOM 0 HB3 GLU A 98 11.708 -3.019 5.845 1.00 0.00 H new ATOM 0 HG2 GLU A 98 13.260 -4.144 7.149 1.00 0.00 H new ATOM 0 HG3 GLU A 98 12.921 -5.331 5.905 1.00 0.00 H new ATOM 1174 N PHE A 99 11.962 -1.529 2.913 1.00 0.00 N ATOM 1175 CA PHE A 99 11.318 -0.369 2.403 1.00 0.00 C ATOM 1176 C PHE A 99 10.680 -0.649 1.065 1.00 0.00 C ATOM 1177 O PHE A 99 9.575 -0.201 0.824 1.00 0.00 O ATOM 1178 CB PHE A 99 12.305 0.771 2.303 1.00 0.00 C ATOM 1179 CG PHE A 99 11.721 2.066 1.865 1.00 0.00 C ATOM 1180 CD1 PHE A 99 10.886 2.762 2.703 1.00 0.00 C ATOM 1181 CD2 PHE A 99 12.028 2.599 0.624 1.00 0.00 C ATOM 1182 CE1 PHE A 99 10.364 3.978 2.317 1.00 0.00 C ATOM 1183 CE2 PHE A 99 11.507 3.810 0.226 1.00 0.00 C ATOM 1184 CZ PHE A 99 10.671 4.503 1.073 1.00 0.00 C ATOM 0 H PHE A 99 12.979 -1.458 2.943 1.00 0.00 H new ATOM 0 HA PHE A 99 10.525 -0.082 3.093 1.00 0.00 H new ATOM 0 HB2 PHE A 99 12.776 0.912 3.276 1.00 0.00 H new ATOM 0 HB3 PHE A 99 13.094 0.490 1.605 1.00 0.00 H new ATOM 0 HD1 PHE A 99 10.636 2.354 3.671 1.00 0.00 H new ATOM 0 HD2 PHE A 99 12.685 2.057 -0.041 1.00 0.00 H new ATOM 0 HE1 PHE A 99 9.714 4.522 2.986 1.00 0.00 H new ATOM 0 HE2 PHE A 99 11.753 4.214 -0.745 1.00 0.00 H new ATOM 0 HZ PHE A 99 10.256 5.452 0.768 1.00 0.00 H new ATOM 1194 N ARG A 100 11.354 -1.439 0.229 1.00 0.00 N ATOM 1195 CA ARG A 100 10.848 -1.748 -1.105 1.00 0.00 C ATOM 1196 C ARG A 100 9.496 -2.437 -0.978 1.00 0.00 C ATOM 1197 O ARG A 100 8.522 -2.030 -1.609 1.00 0.00 O ATOM 1198 CB ARG A 100 11.815 -2.695 -1.845 1.00 0.00 C ATOM 1199 CG ARG A 100 11.514 -2.862 -3.335 1.00 0.00 C ATOM 1200 CD ARG A 100 12.319 -4.004 -3.962 1.00 0.00 C ATOM 1201 NE ARG A 100 11.835 -5.331 -3.509 1.00 0.00 N ATOM 1202 CZ ARG A 100 12.231 -6.527 -3.997 1.00 0.00 C ATOM 1203 NH1 ARG A 100 13.238 -6.606 -4.864 1.00 0.00 N ATOM 1204 NH2 ARG A 100 11.611 -7.637 -3.595 1.00 0.00 N ATOM 0 H ARG A 100 12.249 -1.875 0.453 1.00 0.00 H new ATOM 0 HA ARG A 100 10.755 -0.819 -1.667 1.00 0.00 H new ATOM 0 HB2 ARG A 100 12.832 -2.319 -1.731 1.00 0.00 H new ATOM 0 HB3 ARG A 100 11.782 -3.674 -1.368 1.00 0.00 H new ATOM 0 HG2 ARG A 100 10.449 -3.053 -3.470 1.00 0.00 H new ATOM 0 HG3 ARG A 100 11.739 -1.932 -3.856 1.00 0.00 H new ATOM 0 HD2 ARG A 100 12.251 -3.943 -5.048 1.00 0.00 H new ATOM 0 HD3 ARG A 100 13.372 -3.893 -3.702 1.00 0.00 H new ATOM 0 HE ARG A 100 11.141 -5.341 -2.762 1.00 0.00 H new ATOM 0 HH11 ARG A 100 13.719 -5.759 -5.166 1.00 0.00 H new ATOM 0 HH12 ARG A 100 13.529 -7.514 -5.226 1.00 0.00 H new ATOM 0 HH21 ARG A 100 10.845 -7.579 -2.924 1.00 0.00 H new ATOM 0 HH22 ARG A 100 11.903 -8.544 -3.958 1.00 0.00 H new ATOM 1218 N THR A 101 9.432 -3.423 -0.102 1.00 0.00 N ATOM 1219 CA THR A 101 8.224 -4.183 0.095 1.00 0.00 C ATOM 1220 C THR A 101 7.170 -3.394 0.894 1.00 0.00 C ATOM 1221 O THR A 101 6.037 -3.246 0.447 1.00 0.00 O ATOM 1222 CB THR A 101 8.555 -5.494 0.833 1.00 0.00 C ATOM 1223 OG1 THR A 101 9.664 -6.138 0.174 1.00 0.00 O ATOM 1224 CG2 THR A 101 7.357 -6.435 0.824 1.00 0.00 C ATOM 0 H THR A 101 10.213 -3.713 0.486 1.00 0.00 H new ATOM 0 HA THR A 101 7.803 -4.398 -0.887 1.00 0.00 H new ATOM 0 HB THR A 101 8.810 -5.260 1.867 1.00 0.00 H new ATOM 0 HG1 THR A 101 10.499 -5.692 0.427 1.00 0.00 H new ATOM 0 HG21 THR A 101 7.613 -7.355 1.350 1.00 0.00 H new ATOM 0 HG22 THR A 101 6.514 -5.955 1.321 1.00 0.00 H new ATOM 0 HG23 THR A 101 7.086 -6.670 -0.205 1.00 0.00 H new ATOM 1232 N ARG A 102 7.558 -2.841 2.040 1.00 0.00 N ATOM 1233 CA ARG A 102 6.596 -2.180 2.914 1.00 0.00 C ATOM 1234 C ARG A 102 6.032 -0.899 2.303 1.00 0.00 C ATOM 1235 O ARG A 102 4.849 -0.624 2.432 1.00 0.00 O ATOM 1236 CB ARG A 102 7.149 -1.972 4.332 1.00 0.00 C ATOM 1237 CG ARG A 102 6.128 -1.420 5.326 1.00 0.00 C ATOM 1238 CD ARG A 102 6.617 -1.532 6.761 1.00 0.00 C ATOM 1239 NE ARG A 102 6.833 -2.941 7.152 1.00 0.00 N ATOM 1240 CZ ARG A 102 6.660 -3.445 8.387 1.00 0.00 C ATOM 1241 NH1 ARG A 102 6.274 -2.656 9.401 1.00 0.00 N ATOM 1242 NH2 ARG A 102 6.874 -4.741 8.596 1.00 0.00 N ATOM 0 H ARG A 102 8.519 -2.837 2.381 1.00 0.00 H new ATOM 0 HA ARG A 102 5.749 -2.859 3.013 1.00 0.00 H new ATOM 0 HB2 ARG A 102 7.526 -2.924 4.706 1.00 0.00 H new ATOM 0 HB3 ARG A 102 7.998 -1.290 4.283 1.00 0.00 H new ATOM 0 HG2 ARG A 102 5.922 -0.375 5.093 1.00 0.00 H new ATOM 0 HG3 ARG A 102 5.188 -1.961 5.219 1.00 0.00 H new ATOM 0 HD2 ARG A 102 7.547 -0.975 6.874 1.00 0.00 H new ATOM 0 HD3 ARG A 102 5.889 -1.075 7.431 1.00 0.00 H new ATOM 0 HE ARG A 102 7.139 -3.586 6.423 1.00 0.00 H new ATOM 0 HH11 ARG A 102 6.108 -1.663 9.240 1.00 0.00 H new ATOM 0 HH12 ARG A 102 6.146 -3.050 10.333 1.00 0.00 H new ATOM 0 HH21 ARG A 102 7.166 -5.341 7.824 1.00 0.00 H new ATOM 0 HH22 ARG A 102 6.746 -5.135 9.528 1.00 0.00 H new ATOM 1256 N LYS A 103 6.869 -0.133 1.623 1.00 0.00 N ATOM 1257 CA LYS A 103 6.395 1.068 0.950 1.00 0.00 C ATOM 1258 C LYS A 103 5.437 0.695 -0.172 1.00 0.00 C ATOM 1259 O LYS A 103 4.420 1.335 -0.341 1.00 0.00 O ATOM 1260 CB LYS A 103 7.548 1.947 0.449 1.00 0.00 C ATOM 1261 CG LYS A 103 7.121 3.199 -0.317 1.00 0.00 C ATOM 1262 CD LYS A 103 6.263 4.194 0.492 1.00 0.00 C ATOM 1263 CE LYS A 103 7.028 4.902 1.622 1.00 0.00 C ATOM 1264 NZ LYS A 103 7.194 4.082 2.840 1.00 0.00 N ATOM 0 H LYS A 103 7.867 -0.316 1.522 1.00 0.00 H new ATOM 0 HA LYS A 103 5.853 1.670 1.679 1.00 0.00 H new ATOM 0 HB2 LYS A 103 8.151 2.251 1.304 1.00 0.00 H new ATOM 0 HB3 LYS A 103 8.189 1.346 -0.196 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.015 3.715 -0.669 1.00 0.00 H new ATOM 0 HG3 LYS A 103 6.561 2.893 -1.201 1.00 0.00 H new ATOM 0 HD2 LYS A 103 5.859 4.946 -0.186 1.00 0.00 H new ATOM 0 HD3 LYS A 103 5.413 3.662 0.920 1.00 0.00 H new ATOM 0 HE2 LYS A 103 8.012 5.192 1.255 1.00 0.00 H new ATOM 0 HE3 LYS A 103 6.502 5.820 1.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 7.146 4.694 3.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 6.437 3.371 2.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 8.117 3.603 2.813 1.00 0.00 H new ATOM 1278 N LYS A 104 5.755 -0.389 -0.893 1.00 0.00 N ATOM 1279 CA LYS A 104 4.909 -0.887 -1.978 1.00 0.00 C ATOM 1280 C LYS A 104 3.518 -1.218 -1.424 1.00 0.00 C ATOM 1281 O LYS A 104 2.501 -0.967 -2.075 1.00 0.00 O ATOM 1282 CB LYS A 104 5.594 -2.119 -2.631 1.00 0.00 C ATOM 1283 CG LYS A 104 5.027 -2.598 -3.963 1.00 0.00 C ATOM 1284 CD LYS A 104 3.687 -3.255 -3.813 1.00 0.00 C ATOM 1285 CE LYS A 104 3.206 -3.822 -5.122 1.00 0.00 C ATOM 1286 NZ LYS A 104 2.886 -2.762 -6.100 1.00 0.00 N ATOM 0 H LYS A 104 6.600 -0.939 -0.740 1.00 0.00 H new ATOM 0 HA LYS A 104 4.782 -0.129 -2.751 1.00 0.00 H new ATOM 0 HB2 LYS A 104 6.648 -1.884 -2.776 1.00 0.00 H new ATOM 0 HB3 LYS A 104 5.547 -2.948 -1.924 1.00 0.00 H new ATOM 0 HG2 LYS A 104 4.939 -1.750 -4.643 1.00 0.00 H new ATOM 0 HG3 LYS A 104 5.724 -3.301 -4.419 1.00 0.00 H new ATOM 0 HD2 LYS A 104 3.751 -4.051 -3.071 1.00 0.00 H new ATOM 0 HD3 LYS A 104 2.964 -2.530 -3.441 1.00 0.00 H new ATOM 0 HE2 LYS A 104 3.972 -4.478 -5.536 1.00 0.00 H new ATOM 0 HE3 LYS A 104 2.321 -4.434 -4.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 2.511 -3.193 -6.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 2.174 -2.121 -5.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 3.748 -2.225 -6.324 1.00 0.00 H new ATOM 1300 N LEU A 105 3.483 -1.737 -0.217 1.00 0.00 N ATOM 1301 CA LEU A 105 2.236 -2.053 0.454 1.00 0.00 C ATOM 1302 C LEU A 105 1.433 -0.789 0.705 1.00 0.00 C ATOM 1303 O LEU A 105 0.211 -0.749 0.471 1.00 0.00 O ATOM 1304 CB LEU A 105 2.518 -2.731 1.775 1.00 0.00 C ATOM 1305 CG LEU A 105 3.355 -3.985 1.728 1.00 0.00 C ATOM 1306 CD1 LEU A 105 3.490 -4.550 3.111 1.00 0.00 C ATOM 1307 CD2 LEU A 105 2.745 -4.986 0.780 1.00 0.00 C ATOM 0 H LEU A 105 4.317 -1.953 0.329 1.00 0.00 H new ATOM 0 HA LEU A 105 1.661 -2.722 -0.187 1.00 0.00 H new ATOM 0 HB2 LEU A 105 3.017 -2.013 2.426 1.00 0.00 H new ATOM 0 HB3 LEU A 105 1.564 -2.976 2.242 1.00 0.00 H new ATOM 0 HG LEU A 105 4.351 -3.745 1.356 1.00 0.00 H new ATOM 0 HD11 LEU A 105 4.095 -5.456 3.076 1.00 0.00 H new ATOM 0 HD12 LEU A 105 3.971 -3.817 3.758 1.00 0.00 H new ATOM 0 HD13 LEU A 105 2.502 -4.788 3.505 1.00 0.00 H new ATOM 0 HD21 LEU A 105 3.360 -5.886 0.756 1.00 0.00 H new ATOM 0 HD22 LEU A 105 1.741 -5.241 1.117 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.693 -4.555 -0.220 1.00 0.00 H new ATOM 1319 N GLU A 106 2.121 0.249 1.146 1.00 0.00 N ATOM 1320 CA GLU A 106 1.493 1.521 1.403 1.00 0.00 C ATOM 1321 C GLU A 106 0.992 2.123 0.100 1.00 0.00 C ATOM 1322 O GLU A 106 -0.035 2.788 0.072 1.00 0.00 O ATOM 1323 CB GLU A 106 2.448 2.490 2.085 1.00 0.00 C ATOM 1324 CG GLU A 106 3.053 1.980 3.381 1.00 0.00 C ATOM 1325 CD GLU A 106 3.741 3.090 4.138 1.00 0.00 C ATOM 1326 OE1 GLU A 106 4.938 3.340 3.890 1.00 0.00 O ATOM 1327 OE2 GLU A 106 3.081 3.768 4.980 1.00 0.00 O ATOM 0 H GLU A 106 3.123 0.229 1.333 1.00 0.00 H new ATOM 0 HA GLU A 106 0.653 1.349 2.076 1.00 0.00 H new ATOM 0 HB2 GLU A 106 3.255 2.730 1.393 1.00 0.00 H new ATOM 0 HB3 GLU A 106 1.916 3.419 2.289 1.00 0.00 H new ATOM 0 HG2 GLU A 106 2.272 1.543 4.003 1.00 0.00 H new ATOM 0 HG3 GLU A 106 3.769 1.187 3.164 1.00 0.00 H new ATOM 1334 N GLU A 107 1.720 1.866 -0.969 1.00 0.00 N ATOM 1335 CA GLU A 107 1.366 2.312 -2.308 1.00 0.00 C ATOM 1336 C GLU A 107 0.062 1.665 -2.786 1.00 0.00 C ATOM 1337 O GLU A 107 -0.771 2.328 -3.430 1.00 0.00 O ATOM 1338 CB GLU A 107 2.489 1.996 -3.286 1.00 0.00 C ATOM 1339 CG GLU A 107 3.794 2.740 -3.010 1.00 0.00 C ATOM 1340 CD GLU A 107 3.690 4.237 -3.182 1.00 0.00 C ATOM 1341 OE1 GLU A 107 3.222 4.941 -2.268 1.00 0.00 O ATOM 1342 OE2 GLU A 107 4.092 4.747 -4.246 1.00 0.00 O ATOM 0 H GLU A 107 2.589 1.333 -0.934 1.00 0.00 H new ATOM 0 HA GLU A 107 1.216 3.391 -2.269 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.684 0.924 -3.262 1.00 0.00 H new ATOM 0 HB3 GLU A 107 2.154 2.237 -4.295 1.00 0.00 H new ATOM 0 HG2 GLU A 107 4.117 2.522 -1.992 1.00 0.00 H new ATOM 0 HG3 GLU A 107 4.567 2.360 -3.678 1.00 0.00 H new ATOM 1349 N GLU A 108 -0.114 0.376 -2.501 1.00 0.00 N ATOM 1350 CA GLU A 108 -1.349 -0.311 -2.841 1.00 0.00 C ATOM 1351 C GLU A 108 -2.484 0.263 -1.999 1.00 0.00 C ATOM 1352 O GLU A 108 -3.572 0.568 -2.511 1.00 0.00 O ATOM 1353 CB GLU A 108 -1.226 -1.806 -2.571 1.00 0.00 C ATOM 1354 CG GLU A 108 -0.082 -2.498 -3.292 1.00 0.00 C ATOM 1355 CD GLU A 108 -0.209 -2.481 -4.796 1.00 0.00 C ATOM 1356 OE1 GLU A 108 -0.938 -3.315 -5.359 1.00 0.00 O ATOM 1357 OE2 GLU A 108 0.468 -1.668 -5.458 1.00 0.00 O ATOM 0 H GLU A 108 0.582 -0.208 -2.037 1.00 0.00 H new ATOM 0 HA GLU A 108 -1.554 -0.166 -3.902 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -1.104 -1.957 -1.498 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -2.160 -2.289 -2.856 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.855 -2.018 -3.011 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.025 -3.533 -2.953 1.00 0.00 H new ATOM 1364 N ARG A 109 -2.197 0.459 -0.708 1.00 0.00 N ATOM 1365 CA ARG A 109 -3.165 1.008 0.230 1.00 0.00 C ATOM 1366 C ARG A 109 -3.585 2.405 -0.205 1.00 0.00 C ATOM 1367 O ARG A 109 -4.757 2.712 -0.253 1.00 0.00 O ATOM 1368 CB ARG A 109 -2.537 1.093 1.628 1.00 0.00 C ATOM 1369 CG ARG A 109 -3.441 1.703 2.693 1.00 0.00 C ATOM 1370 CD ARG A 109 -2.668 1.991 3.969 1.00 0.00 C ATOM 1371 NE ARG A 109 -1.582 2.973 3.746 1.00 0.00 N ATOM 1372 CZ ARG A 109 -0.514 3.131 4.547 1.00 0.00 C ATOM 1373 NH1 ARG A 109 -0.419 2.430 5.664 1.00 0.00 N ATOM 1374 NH2 ARG A 109 0.436 4.009 4.227 1.00 0.00 N ATOM 0 H ARG A 109 -1.292 0.241 -0.292 1.00 0.00 H new ATOM 0 HA ARG A 109 -4.038 0.356 0.251 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -2.250 0.090 1.945 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -1.622 1.682 1.566 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -3.881 2.626 2.315 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -4.264 1.022 2.909 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -3.351 2.371 4.729 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -2.245 1.063 4.355 1.00 0.00 H new ATOM 0 HE ARG A 109 -1.649 3.574 2.924 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -1.155 1.771 5.917 1.00 0.00 H new ATOM 0 HH12 ARG A 109 0.391 2.548 6.273 1.00 0.00 H new ATOM 0 HH21 ARG A 109 0.353 4.562 3.374 1.00 0.00 H new ATOM 0 HH22 ARG A 109 1.246 4.128 4.835 1.00 0.00 H new ATOM 1388 N HIS A 110 -2.610 3.209 -0.578 1.00 0.00 N ATOM 1389 CA HIS A 110 -2.811 4.601 -0.967 1.00 0.00 C ATOM 1390 C HIS A 110 -3.717 4.692 -2.196 1.00 0.00 C ATOM 1391 O HIS A 110 -4.608 5.561 -2.267 1.00 0.00 O ATOM 1392 CB HIS A 110 -1.448 5.266 -1.229 1.00 0.00 C ATOM 1393 CG HIS A 110 -1.488 6.753 -1.400 1.00 0.00 C ATOM 1394 ND1 HIS A 110 -0.467 7.483 -1.948 1.00 0.00 N ATOM 1395 CD2 HIS A 110 -2.437 7.649 -1.045 1.00 0.00 C ATOM 1396 CE1 HIS A 110 -0.810 8.764 -1.911 1.00 0.00 C ATOM 1397 NE2 HIS A 110 -2.003 8.920 -1.369 1.00 0.00 N ATOM 0 H HIS A 110 -1.635 2.913 -0.622 1.00 0.00 H new ATOM 0 HA HIS A 110 -3.306 5.132 -0.154 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -0.781 5.029 -0.400 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -1.012 4.825 -2.125 1.00 0.00 H new ATOM 0 HD1 HIS A 110 0.405 7.107 -2.320 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -3.383 7.409 -0.582 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -0.194 9.572 -2.276 1.00 0.00 H new ATOM 1405 N ASN A 111 -3.515 3.772 -3.130 1.00 0.00 N ATOM 1406 CA ASN A 111 -4.336 3.700 -4.336 1.00 0.00 C ATOM 1407 C ASN A 111 -5.794 3.477 -3.953 1.00 0.00 C ATOM 1408 O ASN A 111 -6.702 4.154 -4.467 1.00 0.00 O ATOM 1409 CB ASN A 111 -3.847 2.556 -5.250 1.00 0.00 C ATOM 1410 CG ASN A 111 -4.738 2.335 -6.469 1.00 0.00 C ATOM 1411 OD1 ASN A 111 -4.564 2.974 -7.514 1.00 0.00 O ATOM 1412 ND2 ASN A 111 -5.659 1.408 -6.363 1.00 0.00 N ATOM 0 H ASN A 111 -2.786 3.061 -3.077 1.00 0.00 H new ATOM 0 HA ASN A 111 -4.249 4.640 -4.880 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -2.833 2.776 -5.585 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -3.799 1.633 -4.672 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -6.261 1.194 -7.158 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -5.774 0.901 -5.485 1.00 0.00 H new ATOM 1419 N LEU A 112 -6.003 2.579 -3.009 1.00 0.00 N ATOM 1420 CA LEU A 112 -7.330 2.268 -2.539 1.00 0.00 C ATOM 1421 C LEU A 112 -7.914 3.405 -1.709 1.00 0.00 C ATOM 1422 O LEU A 112 -9.079 3.724 -1.850 1.00 0.00 O ATOM 1423 CB LEU A 112 -7.355 0.969 -1.744 1.00 0.00 C ATOM 1424 CG LEU A 112 -6.928 -0.307 -2.470 1.00 0.00 C ATOM 1425 CD1 LEU A 112 -7.194 -1.509 -1.591 1.00 0.00 C ATOM 1426 CD2 LEU A 112 -7.641 -0.452 -3.808 1.00 0.00 C ATOM 0 H LEU A 112 -5.260 2.050 -2.552 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.953 2.138 -3.424 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.710 1.094 -0.874 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.369 0.822 -1.371 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.859 -0.243 -2.675 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.888 -2.416 -2.113 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -6.628 -1.415 -0.664 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.258 -1.564 -1.362 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.314 -1.370 -4.297 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.718 -0.492 -3.644 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.402 0.402 -4.442 1.00 0.00 H new ATOM 1438 N ILE A 113 -7.081 4.034 -0.864 1.00 0.00 N ATOM 1439 CA ILE A 113 -7.525 5.161 -0.022 1.00 0.00 C ATOM 1440 C ILE A 113 -8.092 6.268 -0.878 1.00 0.00 C ATOM 1441 O ILE A 113 -9.208 6.720 -0.646 1.00 0.00 O ATOM 1442 CB ILE A 113 -6.369 5.779 0.827 1.00 0.00 C ATOM 1443 CG1 ILE A 113 -5.737 4.745 1.762 1.00 0.00 C ATOM 1444 CG2 ILE A 113 -6.890 6.964 1.643 1.00 0.00 C ATOM 1445 CD1 ILE A 113 -6.692 4.132 2.751 1.00 0.00 C ATOM 0 H ILE A 113 -6.099 3.784 -0.745 1.00 0.00 H new ATOM 0 HA ILE A 113 -8.278 4.748 0.650 1.00 0.00 H new ATOM 0 HB ILE A 113 -5.599 6.121 0.135 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -5.297 3.950 1.160 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -4.922 5.219 2.309 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -6.076 7.387 2.231 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.284 7.725 0.969 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -7.682 6.626 2.311 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -6.160 3.412 3.372 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -7.114 4.914 3.382 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -7.495 3.626 2.215 1.00 0.00 H new ATOM 1457 N THR A 114 -7.352 6.641 -1.900 1.00 0.00 N ATOM 1458 CA THR A 114 -7.745 7.727 -2.764 1.00 0.00 C ATOM 1459 C THR A 114 -9.097 7.408 -3.454 1.00 0.00 C ATOM 1460 O THR A 114 -9.988 8.272 -3.546 1.00 0.00 O ATOM 1461 CB THR A 114 -6.644 7.995 -3.816 1.00 0.00 C ATOM 1462 OG1 THR A 114 -5.354 8.052 -3.157 1.00 0.00 O ATOM 1463 CG2 THR A 114 -6.890 9.325 -4.506 1.00 0.00 C ATOM 0 H THR A 114 -6.467 6.201 -2.152 1.00 0.00 H new ATOM 0 HA THR A 114 -7.874 8.626 -2.162 1.00 0.00 H new ATOM 0 HB THR A 114 -6.661 7.192 -4.553 1.00 0.00 H new ATOM 0 HG1 THR A 114 -5.032 7.142 -2.988 1.00 0.00 H new ATOM 0 HG21 THR A 114 -6.108 9.502 -5.244 1.00 0.00 H new ATOM 0 HG22 THR A 114 -7.860 9.303 -5.003 1.00 0.00 H new ATOM 0 HG23 THR A 114 -6.879 10.126 -3.767 1.00 0.00 H new ATOM 1471 N GLU A 115 -9.257 6.158 -3.858 1.00 0.00 N ATOM 1472 CA GLU A 115 -10.461 5.700 -4.521 1.00 0.00 C ATOM 1473 C GLU A 115 -11.641 5.630 -3.538 1.00 0.00 C ATOM 1474 O GLU A 115 -12.730 6.114 -3.837 1.00 0.00 O ATOM 1475 CB GLU A 115 -10.209 4.336 -5.160 1.00 0.00 C ATOM 1476 CG GLU A 115 -11.383 3.783 -5.937 1.00 0.00 C ATOM 1477 CD GLU A 115 -11.076 2.455 -6.562 1.00 0.00 C ATOM 1478 OE1 GLU A 115 -10.542 2.427 -7.694 1.00 0.00 O ATOM 1479 OE2 GLU A 115 -11.361 1.419 -5.956 1.00 0.00 O ATOM 0 H GLU A 115 -8.551 5.432 -3.733 1.00 0.00 H new ATOM 0 HA GLU A 115 -10.724 6.415 -5.301 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -9.351 4.414 -5.828 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -9.940 3.626 -4.378 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -12.240 3.680 -5.272 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -11.667 4.491 -6.715 1.00 0.00 H new ATOM 1486 N MET A 116 -11.397 5.064 -2.361 1.00 0.00 N ATOM 1487 CA MET A 116 -12.431 4.881 -1.342 1.00 0.00 C ATOM 1488 C MET A 116 -12.952 6.247 -0.884 1.00 0.00 C ATOM 1489 O MET A 116 -14.146 6.443 -0.774 1.00 0.00 O ATOM 1490 CB MET A 116 -11.867 4.091 -0.151 1.00 0.00 C ATOM 1491 CG MET A 116 -12.875 3.205 0.620 1.00 0.00 C ATOM 1492 SD MET A 116 -14.357 4.058 1.202 1.00 0.00 S ATOM 1493 CE MET A 116 -15.027 2.861 2.353 1.00 0.00 C ATOM 0 H MET A 116 -10.478 4.718 -2.084 1.00 0.00 H new ATOM 0 HA MET A 116 -13.259 4.314 -1.768 1.00 0.00 H new ATOM 0 HB2 MET A 116 -11.059 3.455 -0.513 1.00 0.00 H new ATOM 0 HB3 MET A 116 -11.426 4.798 0.551 1.00 0.00 H new ATOM 0 HG2 MET A 116 -13.179 2.381 -0.026 1.00 0.00 H new ATOM 0 HG3 MET A 116 -12.367 2.766 1.478 1.00 0.00 H new ATOM 0 HE1 MET A 116 -15.584 3.379 3.134 1.00 0.00 H new ATOM 0 HE2 MET A 116 -15.693 2.180 1.823 1.00 0.00 H new ATOM 0 HE3 MET A 116 -14.212 2.294 2.804 1.00 0.00 H new ATOM 1503 N VAL A 117 -12.038 7.205 -0.695 1.00 0.00 N ATOM 1504 CA VAL A 117 -12.400 8.568 -0.299 1.00 0.00 C ATOM 1505 C VAL A 117 -13.294 9.225 -1.378 1.00 0.00 C ATOM 1506 O VAL A 117 -14.200 10.001 -1.067 1.00 0.00 O ATOM 1507 CB VAL A 117 -11.119 9.441 -0.017 1.00 0.00 C ATOM 1508 CG1 VAL A 117 -11.465 10.893 0.207 1.00 0.00 C ATOM 1509 CG2 VAL A 117 -10.385 8.937 1.206 1.00 0.00 C ATOM 0 H VAL A 117 -11.035 7.058 -0.811 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.968 8.511 0.630 1.00 0.00 H new ATOM 0 HB VAL A 117 -10.486 9.356 -0.901 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -10.553 11.459 0.398 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -11.960 11.290 -0.679 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -12.132 10.980 1.065 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.504 9.554 1.382 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.044 8.989 2.073 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.078 7.904 1.046 1.00 0.00 H new ATOM 1519 N ALA A 118 -13.047 8.890 -2.637 1.00 0.00 N ATOM 1520 CA ALA A 118 -13.858 9.406 -3.732 1.00 0.00 C ATOM 1521 C ALA A 118 -15.242 8.752 -3.731 1.00 0.00 C ATOM 1522 O ALA A 118 -16.264 9.423 -3.899 1.00 0.00 O ATOM 1523 CB ALA A 118 -13.166 9.167 -5.065 1.00 0.00 C ATOM 0 H ALA A 118 -12.294 8.265 -2.925 1.00 0.00 H new ATOM 0 HA ALA A 118 -13.981 10.480 -3.590 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -13.785 9.558 -5.872 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -12.201 9.674 -5.070 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -13.015 8.097 -5.210 1.00 0.00 H new ATOM 1529 N LEU A 119 -15.261 7.447 -3.522 1.00 0.00 N ATOM 1530 CA LEU A 119 -16.493 6.666 -3.505 1.00 0.00 C ATOM 1531 C LEU A 119 -17.355 7.016 -2.299 1.00 0.00 C ATOM 1532 O LEU A 119 -18.581 7.119 -2.403 1.00 0.00 O ATOM 1533 CB LEU A 119 -16.168 5.169 -3.493 1.00 0.00 C ATOM 1534 CG LEU A 119 -15.408 4.631 -4.708 1.00 0.00 C ATOM 1535 CD1 LEU A 119 -15.017 3.185 -4.486 1.00 0.00 C ATOM 1536 CD2 LEU A 119 -16.248 4.761 -5.967 1.00 0.00 C ATOM 0 H LEU A 119 -14.420 6.894 -3.358 1.00 0.00 H new ATOM 0 HA LEU A 119 -17.055 6.909 -4.407 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -15.582 4.953 -2.600 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -17.103 4.616 -3.402 1.00 0.00 H new ATOM 0 HG LEU A 119 -14.502 5.224 -4.836 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -14.477 2.816 -5.358 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -14.378 3.112 -3.606 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -15.914 2.585 -4.334 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -15.689 4.373 -6.819 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -17.171 4.193 -5.849 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -16.487 5.811 -6.138 1.00 0.00 H new ATOM 1548 N ASN A 120 -16.726 7.194 -1.172 1.00 0.00 N ATOM 1549 CA ASN A 120 -17.422 7.498 0.049 1.00 0.00 C ATOM 1550 C ASN A 120 -16.707 8.615 0.801 1.00 0.00 C ATOM 1551 O ASN A 120 -15.616 8.422 1.313 1.00 0.00 O ATOM 1552 CB ASN A 120 -17.493 6.254 0.931 1.00 0.00 C ATOM 1553 CG ASN A 120 -18.268 6.466 2.215 1.00 0.00 C ATOM 1554 OD1 ASN A 120 -19.190 7.270 2.283 1.00 0.00 O ATOM 1555 ND2 ASN A 120 -17.903 5.751 3.238 1.00 0.00 N ATOM 0 H ASN A 120 -15.713 7.132 -1.072 1.00 0.00 H new ATOM 0 HA ASN A 120 -18.432 7.825 -0.198 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -17.955 5.444 0.367 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -16.480 5.934 1.176 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -18.389 5.851 4.129 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -17.131 5.090 3.149 1.00 0.00 H new ATOM 1562 N PRO A 121 -17.312 9.800 0.878 1.00 0.00 N ATOM 1563 CA PRO A 121 -16.733 10.955 1.604 1.00 0.00 C ATOM 1564 C PRO A 121 -16.704 10.726 3.125 1.00 0.00 C ATOM 1565 O PRO A 121 -15.971 11.392 3.865 1.00 0.00 O ATOM 1566 CB PRO A 121 -17.711 12.086 1.270 1.00 0.00 C ATOM 1567 CG PRO A 121 -18.987 11.381 0.968 1.00 0.00 C ATOM 1568 CD PRO A 121 -18.598 10.144 0.245 1.00 0.00 C ATOM 0 HA PRO A 121 -15.700 11.149 1.317 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -17.824 12.776 2.106 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -17.367 12.672 0.418 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -19.531 11.146 1.883 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -19.643 12.002 0.358 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -19.336 9.352 0.368 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -18.491 10.316 -0.826 1.00 0.00 H new ATOM 1576 N ASP A 122 -17.497 9.764 3.569 1.00 0.00 N ATOM 1577 CA ASP A 122 -17.628 9.428 4.984 1.00 0.00 C ATOM 1578 C ASP A 122 -16.557 8.408 5.387 1.00 0.00 C ATOM 1579 O ASP A 122 -16.456 8.002 6.543 1.00 0.00 O ATOM 1580 CB ASP A 122 -19.054 8.890 5.260 1.00 0.00 C ATOM 1581 CG ASP A 122 -19.323 8.583 6.724 1.00 0.00 C ATOM 1582 OD1 ASP A 122 -19.383 9.529 7.534 1.00 0.00 O ATOM 1583 OD2 ASP A 122 -19.507 7.393 7.080 1.00 0.00 O ATOM 0 H ASP A 122 -18.074 9.188 2.956 1.00 0.00 H new ATOM 0 HA ASP A 122 -17.477 10.323 5.588 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -19.782 9.623 4.913 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -19.210 7.984 4.674 1.00 0.00 H new ATOM 1588 N PHE A 123 -15.741 8.028 4.422 1.00 0.00 N ATOM 1589 CA PHE A 123 -14.682 7.070 4.636 1.00 0.00 C ATOM 1590 C PHE A 123 -13.606 7.598 5.566 1.00 0.00 C ATOM 1591 O PHE A 123 -13.139 8.739 5.425 1.00 0.00 O ATOM 1592 CB PHE A 123 -14.065 6.647 3.311 1.00 0.00 C ATOM 1593 CG PHE A 123 -12.790 5.866 3.444 1.00 0.00 C ATOM 1594 CD1 PHE A 123 -12.713 4.739 4.240 1.00 0.00 C ATOM 1595 CD2 PHE A 123 -11.674 6.284 2.792 1.00 0.00 C ATOM 1596 CE1 PHE A 123 -11.538 4.059 4.368 1.00 0.00 C ATOM 1597 CE2 PHE A 123 -10.498 5.620 2.904 1.00 0.00 C ATOM 1598 CZ PHE A 123 -10.414 4.498 3.698 1.00 0.00 C ATOM 0 H PHE A 123 -15.797 8.378 3.466 1.00 0.00 H new ATOM 0 HA PHE A 123 -15.133 6.202 5.116 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -14.790 6.046 2.762 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -13.871 7.538 2.713 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -13.591 4.394 4.765 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -11.725 7.166 2.170 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -11.487 3.179 4.992 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.627 5.971 2.371 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.479 3.967 3.795 1.00 0.00 H new ATOM 1608 N LYS A 124 -13.230 6.766 6.516 1.00 0.00 N ATOM 1609 CA LYS A 124 -12.174 7.069 7.434 1.00 0.00 C ATOM 1610 C LYS A 124 -10.987 6.182 7.175 1.00 0.00 C ATOM 1611 O LYS A 124 -11.045 4.972 7.404 1.00 0.00 O ATOM 1612 CB LYS A 124 -12.635 6.937 8.882 1.00 0.00 C ATOM 1613 CG LYS A 124 -13.841 7.792 9.189 1.00 0.00 C ATOM 1614 CD LYS A 124 -13.630 9.178 8.624 1.00 0.00 C ATOM 1615 CE LYS A 124 -14.777 10.114 8.944 1.00 0.00 C ATOM 1616 NZ LYS A 124 -14.918 10.353 10.396 1.00 0.00 N ATOM 0 H LYS A 124 -13.660 5.853 6.666 1.00 0.00 H new ATOM 0 HA LYS A 124 -11.881 8.107 7.275 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -12.872 5.894 9.090 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -11.817 7.217 9.546 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -14.737 7.344 8.759 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -13.997 7.846 10.266 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -12.704 9.593 9.023 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -13.510 9.112 7.543 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -14.620 11.065 8.435 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -15.705 9.694 8.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -15.585 11.134 10.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -15.276 9.492 10.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -13.992 10.601 10.799 1.00 0.00 H new ATOM 1630 N PRO A 125 -9.913 6.759 6.649 1.00 0.00 N ATOM 1631 CA PRO A 125 -8.688 6.027 6.358 1.00 0.00 C ATOM 1632 C PRO A 125 -8.037 5.455 7.631 1.00 0.00 C ATOM 1633 O PRO A 125 -8.252 5.982 8.739 1.00 0.00 O ATOM 1634 CB PRO A 125 -7.777 7.077 5.717 1.00 0.00 C ATOM 1635 CG PRO A 125 -8.664 8.211 5.343 1.00 0.00 C ATOM 1636 CD PRO A 125 -9.805 8.182 6.292 1.00 0.00 C ATOM 0 HA PRO A 125 -8.874 5.165 5.717 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -7.003 7.400 6.413 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -7.270 6.672 4.841 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -8.130 9.159 5.407 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -9.011 8.109 4.315 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -9.616 8.803 7.168 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -10.721 8.552 5.831 1.00 0.00 H new ATOM 1644 N PRO A 126 -7.257 4.357 7.492 1.00 0.00 N ATOM 1645 CA PRO A 126 -6.561 3.716 8.613 1.00 0.00 C ATOM 1646 C PRO A 126 -5.523 4.643 9.232 1.00 0.00 C ATOM 1647 O PRO A 126 -5.006 5.549 8.567 1.00 0.00 O ATOM 1648 CB PRO A 126 -5.878 2.504 7.971 1.00 0.00 C ATOM 1649 CG PRO A 126 -5.734 2.892 6.553 1.00 0.00 C ATOM 1650 CD PRO A 126 -6.986 3.651 6.236 1.00 0.00 C ATOM 0 HA PRO A 126 -7.241 3.451 9.422 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -4.911 2.300 8.430 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -6.479 1.601 8.080 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -4.848 3.508 6.399 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -5.629 2.017 5.912 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -6.842 4.342 5.405 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -7.804 2.986 5.960 1.00 0.00 H new ATOM 1658 N ALA A 127 -5.221 4.404 10.484 1.00 0.00 N ATOM 1659 CA ALA A 127 -4.307 5.230 11.257 1.00 0.00 C ATOM 1660 C ALA A 127 -2.926 5.368 10.610 1.00 0.00 C ATOM 1661 O ALA A 127 -2.337 6.444 10.628 1.00 0.00 O ATOM 1662 CB ALA A 127 -4.186 4.695 12.668 1.00 0.00 C ATOM 0 H ALA A 127 -5.606 3.619 11.009 1.00 0.00 H new ATOM 0 HA ALA A 127 -4.733 6.233 11.284 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -3.499 5.322 13.237 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -5.166 4.704 13.146 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -3.806 3.674 12.639 1.00 0.00 H new ATOM 1668 N ASP A 128 -2.427 4.297 10.013 1.00 0.00 N ATOM 1669 CA ASP A 128 -1.092 4.329 9.396 1.00 0.00 C ATOM 1670 C ASP A 128 -1.120 4.930 7.968 1.00 0.00 C ATOM 1671 O ASP A 128 -0.078 5.031 7.293 1.00 0.00 O ATOM 1672 CB ASP A 128 -0.418 2.928 9.426 1.00 0.00 C ATOM 1673 CG ASP A 128 1.010 2.929 8.868 1.00 0.00 C ATOM 1674 OD1 ASP A 128 1.937 3.478 9.520 1.00 0.00 O ATOM 1675 OD2 ASP A 128 1.229 2.415 7.750 1.00 0.00 O ATOM 0 H ASP A 128 -2.911 3.402 9.938 1.00 0.00 H new ATOM 0 HA ASP A 128 -0.477 4.997 9.999 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -0.399 2.564 10.453 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -1.025 2.228 8.851 1.00 0.00 H new ATOM 1680 N TYR A 129 -2.294 5.388 7.520 1.00 0.00 N ATOM 1681 CA TYR A 129 -2.400 6.005 6.208 1.00 0.00 C ATOM 1682 C TYR A 129 -1.694 7.320 6.204 1.00 0.00 C ATOM 1683 O TYR A 129 -1.881 8.155 7.087 1.00 0.00 O ATOM 1684 CB TYR A 129 -3.860 6.182 5.728 1.00 0.00 C ATOM 1685 CG TYR A 129 -4.031 7.206 4.591 1.00 0.00 C ATOM 1686 CD1 TYR A 129 -3.435 7.025 3.347 1.00 0.00 C ATOM 1687 CD2 TYR A 129 -4.796 8.348 4.779 1.00 0.00 C ATOM 1688 CE1 TYR A 129 -3.591 7.965 2.338 1.00 0.00 C ATOM 1689 CE2 TYR A 129 -4.957 9.284 3.774 1.00 0.00 C ATOM 1690 CZ TYR A 129 -4.353 9.091 2.560 1.00 0.00 C ATOM 1691 OH TYR A 129 -4.499 10.039 1.562 1.00 0.00 O ATOM 0 H TYR A 129 -3.168 5.341 8.043 1.00 0.00 H new ATOM 0 HA TYR A 129 -1.925 5.323 5.503 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -4.240 5.217 5.393 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -4.474 6.490 6.574 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -2.843 6.141 3.164 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -5.277 8.510 5.732 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -3.116 7.814 1.380 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -5.558 10.165 3.946 1.00 0.00 H new ATOM 0 HH TYR A 129 -5.069 10.768 1.884 1.00 0.00 H new ATOM 1701 N LYS A 130 -0.874 7.486 5.223 1.00 0.00 N ATOM 1702 CA LYS A 130 -0.107 8.651 5.088 1.00 0.00 C ATOM 1703 C LYS A 130 -0.511 9.374 3.834 1.00 0.00 C ATOM 1704 O LYS A 130 -0.512 8.777 2.739 1.00 0.00 O ATOM 1705 CB LYS A 130 1.343 8.281 5.041 1.00 0.00 C ATOM 1706 CG LYS A 130 1.771 7.502 6.259 1.00 0.00 C ATOM 1707 CD LYS A 130 3.218 7.143 6.226 1.00 0.00 C ATOM 1708 CE LYS A 130 3.562 6.216 7.389 1.00 0.00 C ATOM 1709 NZ LYS A 130 2.804 4.938 7.324 1.00 0.00 N ATOM 0 H LYS A 130 -0.724 6.797 4.486 1.00 0.00 H new ATOM 0 HA LYS A 130 -0.275 9.311 5.939 1.00 0.00 H new ATOM 0 HB2 LYS A 130 1.536 7.689 4.146 1.00 0.00 H new ATOM 0 HB3 LYS A 130 1.945 9.186 4.961 1.00 0.00 H new ATOM 0 HG2 LYS A 130 1.566 8.090 7.153 1.00 0.00 H new ATOM 0 HG3 LYS A 130 1.175 6.592 6.332 1.00 0.00 H new ATOM 0 HD2 LYS A 130 3.457 6.655 5.281 1.00 0.00 H new ATOM 0 HD3 LYS A 130 3.825 8.047 6.281 1.00 0.00 H new ATOM 0 HE2 LYS A 130 4.631 6.004 7.380 1.00 0.00 H new ATOM 0 HE3 LYS A 130 3.344 6.719 8.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 2.962 4.396 8.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 1.789 5.141 7.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 3.130 4.382 6.508 1.00 0.00 H new ATOM 1723 N PRO A 131 -0.842 10.650 3.968 1.00 0.00 N ATOM 1724 CA PRO A 131 -1.300 11.472 2.860 1.00 0.00 C ATOM 1725 C PRO A 131 -0.156 11.721 1.881 1.00 0.00 C ATOM 1726 O PRO A 131 1.018 11.723 2.293 1.00 0.00 O ATOM 1727 CB PRO A 131 -1.747 12.781 3.531 1.00 0.00 C ATOM 1728 CG PRO A 131 -1.015 12.832 4.828 1.00 0.00 C ATOM 1729 CD PRO A 131 -0.724 11.411 5.222 1.00 0.00 C ATOM 0 HA PRO A 131 -2.100 11.008 2.284 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -1.505 13.643 2.910 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -2.826 12.793 3.688 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -0.091 13.402 4.728 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -1.615 13.329 5.591 1.00 0.00 H new ATOM 0 HD2 PRO A 131 0.273 11.315 5.653 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -1.431 11.054 5.971 1.00 0.00 H new ATOM 1737 N PRO A 132 -0.454 11.908 0.586 1.00 0.00 N ATOM 1738 CA PRO A 132 0.576 12.092 -0.425 1.00 0.00 C ATOM 1739 C PRO A 132 1.460 13.266 -0.115 1.00 0.00 C ATOM 1740 O PRO A 132 0.977 14.327 0.328 1.00 0.00 O ATOM 1741 CB PRO A 132 -0.176 12.388 -1.705 1.00 0.00 C ATOM 1742 CG PRO A 132 -1.583 12.695 -1.282 1.00 0.00 C ATOM 1743 CD PRO A 132 -1.804 11.972 0.012 1.00 0.00 C ATOM 0 HA PRO A 132 1.214 11.210 -0.483 1.00 0.00 H new ATOM 0 HB2 PRO A 132 0.267 13.231 -2.235 1.00 0.00 H new ATOM 0 HB3 PRO A 132 -0.147 11.535 -2.383 1.00 0.00 H new ATOM 0 HG2 PRO A 132 -1.725 13.768 -1.156 1.00 0.00 H new ATOM 0 HG3 PRO A 132 -2.296 12.365 -2.038 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -2.495 12.509 0.662 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -2.223 10.978 -0.147 1.00 0.00 H new ATOM 1751 N ALA A 133 2.747 13.062 -0.318 1.00 0.00 N ATOM 1752 CA ALA A 133 3.777 14.070 -0.114 1.00 0.00 C ATOM 1753 C ALA A 133 3.750 14.661 1.264 1.00 0.00 C ATOM 1754 O ALA A 133 4.240 15.777 1.474 1.00 0.00 O ATOM 1755 CB ALA A 133 3.755 15.130 -1.211 1.00 0.00 C ATOM 0 H ALA A 133 3.118 12.167 -0.638 1.00 0.00 H new ATOM 0 HA ALA A 133 4.735 13.557 -0.191 1.00 0.00 H new ATOM 0 HB1 ALA A 133 4.538 15.864 -1.023 1.00 0.00 H new ATOM 0 HB2 ALA A 133 3.926 14.657 -2.178 1.00 0.00 H new ATOM 0 HB3 ALA A 133 2.785 15.628 -1.217 1.00 0.00 H new ATOM 1761 N THR A 134 3.193 13.888 2.217 1.00 0.00 N ATOM 1762 CA THR A 134 3.173 14.262 3.603 1.00 0.00 C ATOM 1763 C THR A 134 2.404 15.616 3.770 1.00 0.00 C ATOM 1764 O THR A 134 2.573 16.354 4.748 1.00 0.00 O ATOM 1765 CB THR A 134 4.654 14.375 4.047 1.00 0.00 C ATOM 1766 OG1 THR A 134 5.369 13.237 3.515 1.00 0.00 O ATOM 1767 CG2 THR A 134 4.778 14.315 5.517 1.00 0.00 C ATOM 0 H THR A 134 2.750 12.990 2.024 1.00 0.00 H new ATOM 0 HA THR A 134 2.655 13.529 4.222 1.00 0.00 H new ATOM 0 HB THR A 134 5.051 15.324 3.687 1.00 0.00 H new ATOM 0 HG1 THR A 134 6.310 13.288 3.782 1.00 0.00 H new ATOM 0 HG21 THR A 134 5.828 14.397 5.797 1.00 0.00 H new ATOM 0 HG22 THR A 134 4.218 15.137 5.963 1.00 0.00 H new ATOM 0 HG23 THR A 134 4.379 13.367 5.877 1.00 0.00 H new ATOM 1775 N ARG A 135 1.516 15.886 2.826 1.00 0.00 N ATOM 1776 CA ARG A 135 0.838 17.153 2.743 1.00 0.00 C ATOM 1777 C ARG A 135 -0.543 17.117 3.383 1.00 0.00 C ATOM 1778 O ARG A 135 -1.412 16.322 2.986 1.00 0.00 O ATOM 1779 CB ARG A 135 0.659 17.537 1.284 1.00 0.00 C ATOM 1780 CG ARG A 135 0.032 18.906 1.082 1.00 0.00 C ATOM 1781 CD ARG A 135 -0.758 18.946 -0.200 1.00 0.00 C ATOM 1782 NE ARG A 135 -1.910 18.023 -0.134 1.00 0.00 N ATOM 1783 CZ ARG A 135 -2.969 18.065 -0.943 1.00 0.00 C ATOM 1784 NH1 ARG A 135 -2.981 18.886 -1.987 1.00 0.00 N ATOM 1785 NH2 ARG A 135 -4.003 17.258 -0.724 1.00 0.00 N ATOM 0 H ARG A 135 1.250 15.224 2.097 1.00 0.00 H new ATOM 0 HA ARG A 135 1.453 17.876 3.279 1.00 0.00 H new ATOM 0 HB2 ARG A 135 1.631 17.517 0.791 1.00 0.00 H new ATOM 0 HB3 ARG A 135 0.037 16.787 0.794 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -0.619 19.141 1.924 1.00 0.00 H new ATOM 0 HG3 ARG A 135 0.811 19.668 1.059 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -1.109 19.961 -0.385 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -0.115 18.674 -1.037 1.00 0.00 H new ATOM 0 HE ARG A 135 -1.894 17.299 0.585 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -2.178 19.487 -2.172 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -3.793 18.915 -2.604 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -3.985 16.608 0.062 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -4.814 17.289 -1.342 1.00 0.00 H new ATOM 1799 N VAL A 136 -0.742 17.979 4.343 1.00 0.00 N ATOM 1800 CA VAL A 136 -2.034 18.217 4.926 1.00 0.00 C ATOM 1801 C VAL A 136 -2.337 19.697 4.748 1.00 0.00 C ATOM 1802 O VAL A 136 -1.902 20.547 5.533 1.00 0.00 O ATOM 1803 CB VAL A 136 -2.119 17.841 6.430 1.00 0.00 C ATOM 1804 CG1 VAL A 136 -3.527 18.112 6.951 1.00 0.00 C ATOM 1805 CG2 VAL A 136 -1.751 16.381 6.648 1.00 0.00 C ATOM 0 H VAL A 136 0.003 18.546 4.749 1.00 0.00 H new ATOM 0 HA VAL A 136 -2.761 17.580 4.423 1.00 0.00 H new ATOM 0 HB VAL A 136 -1.406 18.455 6.981 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -3.582 17.847 8.007 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -3.762 19.169 6.830 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -4.244 17.514 6.389 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -1.818 16.143 7.710 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -2.438 15.745 6.089 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -0.732 16.207 6.301 1.00 0.00 H new ATOM 1815 N SER A 137 -3.008 20.009 3.694 1.00 0.00 N ATOM 1816 CA SER A 137 -3.291 21.369 3.351 1.00 0.00 C ATOM 1817 C SER A 137 -4.710 21.758 3.737 1.00 0.00 C ATOM 1818 O SER A 137 -5.081 22.932 3.705 1.00 0.00 O ATOM 1819 CB SER A 137 -3.054 21.520 1.875 1.00 0.00 C ATOM 1820 OG SER A 137 -3.666 20.447 1.179 1.00 0.00 O ATOM 0 H SER A 137 -3.382 19.325 3.036 1.00 0.00 H new ATOM 0 HA SER A 137 -2.637 22.042 3.905 1.00 0.00 H new ATOM 0 HB2 SER A 137 -3.460 22.470 1.527 1.00 0.00 H new ATOM 0 HB3 SER A 137 -1.984 21.536 1.669 1.00 0.00 H new ATOM 0 HG SER A 137 -3.511 20.550 0.217 1.00 0.00 H new ATOM 1826 N ASP A 138 -5.493 20.772 4.106 1.00 0.00 N ATOM 1827 CA ASP A 138 -6.871 21.001 4.510 1.00 0.00 C ATOM 1828 C ASP A 138 -6.963 21.536 5.911 1.00 0.00 C ATOM 1829 O ASP A 138 -7.965 22.138 6.284 1.00 0.00 O ATOM 1830 CB ASP A 138 -7.711 19.728 4.411 1.00 0.00 C ATOM 1831 CG ASP A 138 -8.139 19.388 3.010 1.00 0.00 C ATOM 1832 OD1 ASP A 138 -9.239 19.818 2.611 1.00 0.00 O ATOM 1833 OD2 ASP A 138 -7.429 18.630 2.309 1.00 0.00 O ATOM 0 H ASP A 138 -5.202 19.795 4.137 1.00 0.00 H new ATOM 0 HA ASP A 138 -7.266 21.745 3.818 1.00 0.00 H new ATOM 0 HB2 ASP A 138 -7.139 18.894 4.818 1.00 0.00 H new ATOM 0 HB3 ASP A 138 -8.598 19.840 5.034 1.00 0.00 H new ATOM 1838 N LYS A 139 -5.927 21.327 6.692 1.00 0.00 N ATOM 1839 CA LYS A 139 -5.953 21.732 8.077 1.00 0.00 C ATOM 1840 C LYS A 139 -5.741 23.232 8.230 1.00 0.00 C ATOM 1841 O LYS A 139 -6.556 23.912 8.834 1.00 0.00 O ATOM 1842 CB LYS A 139 -4.934 20.949 8.915 1.00 0.00 C ATOM 1843 CG LYS A 139 -4.971 21.263 10.400 1.00 0.00 C ATOM 1844 CD LYS A 139 -6.322 20.926 10.961 1.00 0.00 C ATOM 1845 CE LYS A 139 -6.419 21.199 12.449 1.00 0.00 C ATOM 1846 NZ LYS A 139 -5.409 20.450 13.221 1.00 0.00 N ATOM 0 H LYS A 139 -5.060 20.881 6.392 1.00 0.00 H new ATOM 0 HA LYS A 139 -6.948 21.497 8.456 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -5.111 19.882 8.777 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -3.933 21.158 8.537 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -4.200 20.695 10.920 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -4.753 22.319 10.563 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -7.083 21.505 10.439 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -6.537 19.874 10.773 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -6.293 22.267 12.630 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -7.415 20.931 12.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -5.646 20.490 14.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -5.397 19.459 12.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -4.471 20.873 13.068 1.00 0.00 H new ATOM 1860 N VAL A 140 -4.655 23.743 7.692 1.00 0.00 N ATOM 1861 CA VAL A 140 -4.359 25.153 7.831 1.00 0.00 C ATOM 1862 C VAL A 140 -4.416 25.832 6.478 1.00 0.00 C ATOM 1863 O VAL A 140 -3.790 25.376 5.511 1.00 0.00 O ATOM 1864 CB VAL A 140 -2.966 25.402 8.494 1.00 0.00 C ATOM 1865 CG1 VAL A 140 -2.709 26.894 8.698 1.00 0.00 C ATOM 1866 CG2 VAL A 140 -2.863 24.674 9.825 1.00 0.00 C ATOM 0 H VAL A 140 -3.968 23.210 7.159 1.00 0.00 H new ATOM 0 HA VAL A 140 -5.116 25.580 8.489 1.00 0.00 H new ATOM 0 HB VAL A 140 -2.207 25.010 7.817 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -1.732 27.035 9.161 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -2.730 27.402 7.734 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -3.481 27.311 9.345 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -1.885 24.862 10.268 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -3.641 25.034 10.498 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -2.989 23.603 9.665 1.00 0.00 H new ATOM 1876 N MET A 141 -5.184 26.876 6.400 1.00 0.00 N ATOM 1877 CA MET A 141 -5.289 27.661 5.206 1.00 0.00 C ATOM 1878 C MET A 141 -4.236 28.750 5.275 1.00 0.00 C ATOM 1879 O MET A 141 -4.390 29.742 5.983 1.00 0.00 O ATOM 1880 CB MET A 141 -6.690 28.269 5.088 1.00 0.00 C ATOM 1881 CG MET A 141 -6.937 29.027 3.791 1.00 0.00 C ATOM 1882 SD MET A 141 -8.592 29.764 3.709 1.00 0.00 S ATOM 1883 CE MET A 141 -9.641 28.312 3.902 1.00 0.00 C ATOM 0 H MET A 141 -5.762 27.211 7.171 1.00 0.00 H new ATOM 0 HA MET A 141 -5.128 27.038 4.326 1.00 0.00 H new ATOM 0 HB2 MET A 141 -7.428 27.471 5.175 1.00 0.00 H new ATOM 0 HB3 MET A 141 -6.851 28.946 5.927 1.00 0.00 H new ATOM 0 HG2 MET A 141 -6.189 29.813 3.687 1.00 0.00 H new ATOM 0 HG3 MET A 141 -6.805 28.348 2.948 1.00 0.00 H new ATOM 0 HE1 MET A 141 -10.645 28.538 3.543 1.00 0.00 H new ATOM 0 HE2 MET A 141 -9.227 27.485 3.325 1.00 0.00 H new ATOM 0 HE3 MET A 141 -9.686 28.033 4.955 1.00 0.00 H new ATOM 1893 N ILE A 142 -3.158 28.536 4.586 1.00 0.00 N ATOM 1894 CA ILE A 142 -2.031 29.441 4.619 1.00 0.00 C ATOM 1895 C ILE A 142 -2.096 30.377 3.409 1.00 0.00 C ATOM 1896 O ILE A 142 -2.452 29.932 2.310 1.00 0.00 O ATOM 1897 CB ILE A 142 -0.689 28.637 4.578 1.00 0.00 C ATOM 1898 CG1 ILE A 142 -0.651 27.609 5.723 1.00 0.00 C ATOM 1899 CG2 ILE A 142 0.520 29.572 4.666 1.00 0.00 C ATOM 1900 CD1 ILE A 142 0.577 26.718 5.725 1.00 0.00 C ATOM 0 H ILE A 142 -3.026 27.727 3.979 1.00 0.00 H new ATOM 0 HA ILE A 142 -2.070 30.021 5.541 1.00 0.00 H new ATOM 0 HB ILE A 142 -0.639 28.111 3.625 1.00 0.00 H new ATOM 0 HG12 ILE A 142 -0.701 28.140 6.674 1.00 0.00 H new ATOM 0 HG13 ILE A 142 -1.540 26.981 5.661 1.00 0.00 H new ATOM 0 HG21 ILE A 142 1.437 28.984 4.635 1.00 0.00 H new ATOM 0 HG22 ILE A 142 0.505 30.266 3.826 1.00 0.00 H new ATOM 0 HG23 ILE A 142 0.479 30.132 5.600 1.00 0.00 H new ATOM 0 HD11 ILE A 142 0.522 26.025 6.564 1.00 0.00 H new ATOM 0 HD12 ILE A 142 0.620 26.156 4.792 1.00 0.00 H new ATOM 0 HD13 ILE A 142 1.472 27.332 5.820 1.00 0.00 H new ATOM 1912 N PRO A 143 -1.855 31.688 3.594 1.00 0.00 N ATOM 1913 CA PRO A 143 -1.729 32.620 2.474 1.00 0.00 C ATOM 1914 C PRO A 143 -0.509 32.246 1.638 1.00 0.00 C ATOM 1915 O PRO A 143 0.559 31.938 2.184 1.00 0.00 O ATOM 1916 CB PRO A 143 -1.514 33.974 3.142 1.00 0.00 C ATOM 1917 CG PRO A 143 -1.994 33.801 4.542 1.00 0.00 C ATOM 1918 CD PRO A 143 -1.723 32.370 4.892 1.00 0.00 C ATOM 0 HA PRO A 143 -2.594 32.615 1.810 1.00 0.00 H new ATOM 0 HB2 PRO A 143 -0.463 34.262 3.119 1.00 0.00 H new ATOM 0 HB3 PRO A 143 -2.070 34.759 2.629 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -1.472 34.475 5.221 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -3.057 34.029 4.622 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -0.729 32.239 5.319 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -2.436 31.990 5.623 1.00 0.00 H new ATOM 1926 N GLN A 144 -0.649 32.281 0.344 1.00 0.00 N ATOM 1927 CA GLN A 144 0.384 31.780 -0.538 1.00 0.00 C ATOM 1928 C GLN A 144 0.790 32.804 -1.563 1.00 0.00 C ATOM 1929 O GLN A 144 -0.070 33.362 -2.265 1.00 0.00 O ATOM 1930 CB GLN A 144 -0.133 30.538 -1.244 1.00 0.00 C ATOM 1931 CG GLN A 144 -0.396 29.364 -0.316 1.00 0.00 C ATOM 1932 CD GLN A 144 -1.609 28.563 -0.720 1.00 0.00 C ATOM 1933 OE1 GLN A 144 -1.647 27.347 -0.539 1.00 0.00 O ATOM 1934 NE2 GLN A 144 -2.642 29.239 -1.177 1.00 0.00 N ATOM 0 H GLN A 144 -1.471 32.652 -0.133 1.00 0.00 H new ATOM 0 HA GLN A 144 1.262 31.546 0.063 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -1.056 30.788 -1.768 1.00 0.00 H new ATOM 0 HB3 GLN A 144 0.591 30.235 -2.001 1.00 0.00 H new ATOM 0 HG2 GLN A 144 0.478 28.712 -0.305 1.00 0.00 H new ATOM 0 HG3 GLN A 144 -0.531 29.733 0.701 1.00 0.00 H new ATOM 0 HE21 GLN A 144 -2.572 30.247 -1.314 1.00 0.00 H new ATOM 0 HE22 GLN A 144 -3.513 28.754 -1.394 1.00 0.00 H new ATOM 1943 N ASP A 145 2.077 33.055 -1.624 1.00 0.00 N ATOM 1944 CA ASP A 145 2.723 33.925 -2.605 1.00 0.00 C ATOM 1945 C ASP A 145 4.175 34.042 -2.228 1.00 0.00 C ATOM 1946 O ASP A 145 5.012 33.373 -2.832 1.00 0.00 O ATOM 1947 CB ASP A 145 2.107 35.322 -2.692 1.00 0.00 C ATOM 1948 CG ASP A 145 2.755 36.148 -3.775 1.00 0.00 C ATOM 1949 OD1 ASP A 145 2.436 35.951 -4.964 1.00 0.00 O ATOM 1950 OD2 ASP A 145 3.595 37.006 -3.465 1.00 0.00 O ATOM 1951 OXT ASP A 145 4.476 34.711 -1.225 1.00 0.00 O ATOM 0 H ASP A 145 2.740 32.645 -0.966 1.00 0.00 H new ATOM 0 HA ASP A 145 2.586 33.475 -3.588 1.00 0.00 H new ATOM 0 HB2 ASP A 145 1.038 35.237 -2.888 1.00 0.00 H new ATOM 0 HB3 ASP A 145 2.216 35.829 -1.733 1.00 0.00 H new TER 1956 ASP A 145