USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 956 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 173 ASN : amide:sc= 0.403 K(o=0.49,f=-7.6!) USER MOD Set 1.2: A 176 THR OG1 : rot 90:sc= 0.0909 USER MOD Set 2.1: A 114 LYS NZ :NH3+ -172:sc=-0.00553 (180deg=-0.0785) USER MOD Set 2.2: A 165 TYR OH : rot 180:sc= -0.0725 USER MOD Set 3.1: A 151 THR OG1 : rot 111:sc= 0.777 USER MOD Set 3.2: A 155 MET CE :methyl -155:sc= -3.6! (180deg=-5.26!) USER MOD Set 4.1: A 141 GLN : amide:sc= 0.801 K(o=0.89,f=-0.2) USER MOD Set 4.2: A 147 TYR OH : rot 86:sc= 0.0914 USER MOD Set 5.1: A 80 HIS : no HD1:sc= 1.08 K(o=2.4,f=-6.6!) USER MOD Set 5.2: A 82 SER OG : rot -11:sc= 1.34 USER MOD Single : A 76 GLN : amide:sc= -1.3 K(o=-1.3,f=-8!) USER MOD Single : A 77 SER OG : rot 180:sc= -0.23 USER MOD Single : A 84 GLN : amide:sc= -0.275 K(o=-0.27,f=-2.6!) USER MOD Single : A 85 THR OG1 : rot 120:sc= 0.786 USER MOD Single : A 87 THR OG1 : rot -90:sc= -0.804 USER MOD Single : A 88 LYS NZ :NH3+ -169:sc= 1.15 (180deg=1.08) USER MOD Single : A 90 THR OG1 : rot 143:sc= -0.51 USER MOD Single : A 92 CYS SG : rot 42:sc= 0.0334 USER MOD Single : A 93 SER OG : rot 180:sc= -0.967 USER MOD Single : A 103 ASN : amide:sc= -3.53! C(o=-3.5!,f=-5.2!) USER MOD Single : A 104 THR OG1 : rot 75:sc= 1.36 USER MOD Single : A 107 LYS NZ :NH3+ -166:sc= -0.0433 (180deg=-0.28) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0.0685 USER MOD Single : A 112 LYS NZ :NH3+ 168:sc= -0.0308 (180deg=-0.23) USER MOD Single : A 118 HIS : no HD1:sc= -0.533 K(o=-0.53,f=-5.3!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= 1.73 K(o=1.7,f=-11!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 ASN : amide:sc= -2.4! K(o=-2.4!,f=0) USER MOD Single : A 135 LYS NZ :NH3+ 168:sc= -0.0429 (180deg=-0.24) USER MOD Single : A 139 SER OG : rot 140:sc= -0.714 USER MOD Single : A 140 ASN : amide:sc= -0.731 K(o=-0.73,f=0) USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 LYS NZ :NH3+ -171:sc= 1.13 (180deg=1.08) USER MOD Single : A 154 LYS NZ :NH3+ 137:sc= -0.0263 (180deg=-0.286) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 TYR OH : rot 37:sc= 0.157 USER MOD Single : A 163 LYS NZ :NH3+ 167:sc= 1.21 (180deg=0.731) USER MOD Single : A 166 LYS NZ :NH3+ -133:sc= 0.0777 (180deg=-0.00206) USER MOD Single : A 170 TYR OH : rot 180:sc= 0 USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 180 SER OG : rot 180:sc= -0.619 USER MOD Single : A 183 MET CE :methyl -169:sc= -1.83 (180deg=-2.62) USER MOD Single : A 187 LYS NZ :NH3+ -163:sc= 1.3 (180deg=0.504) USER MOD Single : A 188 CYS SG : rot 40:sc= 0.0347 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 73 24.854 5.357 -2.154 1.00 3.12 N ATOM 2 CA ARG A 73 23.727 6.303 -1.987 1.00 2.69 C ATOM 3 C ARG A 73 22.611 5.657 -1.177 1.00 2.08 C ATOM 4 O ARG A 73 22.338 6.067 -0.049 1.00 2.31 O ATOM 5 CB ARG A 73 23.196 6.753 -3.353 1.00 3.05 C ATOM 6 CG ARG A 73 22.056 7.758 -3.273 1.00 3.69 C ATOM 7 CD ARG A 73 22.509 9.089 -2.693 1.00 4.24 C ATOM 8 NE ARG A 73 23.521 9.735 -3.528 1.00 4.97 N ATOM 9 CZ ARG A 73 24.111 10.890 -3.227 1.00 5.85 C ATOM 10 NH1 ARG A 73 23.795 11.536 -2.112 1.00 6.18 N ATOM 11 NH2 ARG A 73 25.017 11.404 -4.047 1.00 6.67 N ATOM 0 HA ARG A 73 24.089 7.179 -1.450 1.00 2.69 H new ATOM 0 HB2 ARG A 73 24.015 7.192 -3.923 1.00 3.05 H new ATOM 0 HB3 ARG A 73 22.857 5.877 -3.906 1.00 3.05 H new ATOM 0 HG2 ARG A 73 21.644 7.918 -4.269 1.00 3.69 H new ATOM 0 HG3 ARG A 73 21.254 7.349 -2.658 1.00 3.69 H new ATOM 0 HD2 ARG A 73 21.649 9.750 -2.589 1.00 4.24 H new ATOM 0 HD3 ARG A 73 22.912 8.930 -1.693 1.00 4.24 H new ATOM 0 HE ARG A 73 23.792 9.272 -4.395 1.00 4.97 H new ATOM 0 HH11 ARG A 73 23.096 11.148 -1.479 1.00 6.18 H new ATOM 0 HH12 ARG A 73 24.251 12.420 -1.888 1.00 6.18 H new ATOM 0 HH21 ARG A 73 25.262 10.915 -4.908 1.00 6.67 H new ATOM 0 HH22 ARG A 73 25.469 12.289 -3.817 1.00 6.67 H new ATOM 25 N TRP A 74 21.970 4.647 -1.750 1.00 1.61 N ATOM 26 CA TRP A 74 20.902 3.936 -1.065 1.00 1.14 C ATOM 27 C TRP A 74 20.703 2.564 -1.702 1.00 0.96 C ATOM 28 O TRP A 74 20.830 2.412 -2.918 1.00 1.19 O ATOM 29 CB TRP A 74 19.603 4.749 -1.105 1.00 1.25 C ATOM 30 CG TRP A 74 18.561 4.220 -0.174 1.00 1.15 C ATOM 31 CD1 TRP A 74 17.414 3.569 -0.512 1.00 1.14 C ATOM 32 CD2 TRP A 74 18.580 4.287 1.255 1.00 1.26 C ATOM 33 NE1 TRP A 74 16.719 3.221 0.619 1.00 1.26 N ATOM 34 CE2 TRP A 74 17.415 3.655 1.719 1.00 1.34 C ATOM 35 CE3 TRP A 74 19.471 4.822 2.188 1.00 1.43 C ATOM 36 CZ2 TRP A 74 17.119 3.538 3.075 1.00 1.61 C ATOM 37 CZ3 TRP A 74 19.178 4.709 3.533 1.00 1.66 C ATOM 38 CH2 TRP A 74 18.010 4.070 3.965 1.00 1.75 C ATOM 0 H TRP A 74 22.172 4.302 -2.688 1.00 1.61 H new ATOM 0 HA TRP A 74 21.180 3.799 -0.020 1.00 1.14 H new ATOM 0 HB2 TRP A 74 19.820 5.786 -0.849 1.00 1.25 H new ATOM 0 HB3 TRP A 74 19.210 4.748 -2.122 1.00 1.25 H new ATOM 0 HD1 TRP A 74 17.097 3.357 -1.523 1.00 1.14 H new ATOM 0 HE1 TRP A 74 15.830 2.721 0.639 1.00 1.26 H new ATOM 0 HE3 TRP A 74 20.375 5.316 1.863 1.00 1.43 H new ATOM 0 HZ2 TRP A 74 16.219 3.045 3.411 1.00 1.61 H new ATOM 0 HZ3 TRP A 74 19.860 5.120 4.262 1.00 1.66 H new ATOM 0 HH2 TRP A 74 17.808 3.996 5.023 1.00 1.75 H new ATOM 49 N ASP A 75 20.397 1.570 -0.877 1.00 0.79 N ATOM 50 CA ASP A 75 20.339 0.179 -1.330 1.00 0.78 C ATOM 51 C ASP A 75 18.917 -0.266 -1.645 1.00 0.67 C ATOM 52 O ASP A 75 18.700 -1.047 -2.560 1.00 0.92 O ATOM 53 CB ASP A 75 20.925 -0.757 -0.261 1.00 0.92 C ATOM 54 CG ASP A 75 22.418 -0.591 -0.080 1.00 1.37 C ATOM 55 OD1 ASP A 75 22.836 0.338 0.643 1.00 2.01 O ATOM 56 OD2 ASP A 75 23.183 -1.391 -0.658 1.00 1.86 O ATOM 0 H ASP A 75 20.184 1.698 0.112 1.00 0.79 H new ATOM 0 HA ASP A 75 20.927 0.123 -2.246 1.00 0.78 H new ATOM 0 HB2 ASP A 75 20.427 -0.569 0.690 1.00 0.92 H new ATOM 0 HB3 ASP A 75 20.711 -1.790 -0.535 1.00 0.92 H new ATOM 61 N GLN A 76 17.964 0.236 -0.877 1.00 0.59 N ATOM 62 CA GLN A 76 16.587 -0.269 -0.896 1.00 0.77 C ATOM 63 C GLN A 76 15.697 0.517 -1.855 1.00 0.69 C ATOM 64 O GLN A 76 14.479 0.389 -1.815 1.00 0.94 O ATOM 65 CB GLN A 76 16.013 -0.173 0.512 1.00 1.07 C ATOM 66 CG GLN A 76 16.994 -0.623 1.578 1.00 1.21 C ATOM 67 CD GLN A 76 16.622 -0.123 2.952 1.00 1.75 C ATOM 68 OE1 GLN A 76 17.489 0.136 3.777 1.00 2.30 O ATOM 69 NE2 GLN A 76 15.332 0.006 3.208 1.00 2.36 N ATOM 0 H GLN A 76 18.115 1.003 -0.222 1.00 0.59 H new ATOM 0 HA GLN A 76 16.611 -1.302 -1.242 1.00 0.77 H new ATOM 0 HB2 GLN A 76 15.716 0.857 0.709 1.00 1.07 H new ATOM 0 HB3 GLN A 76 15.111 -0.782 0.574 1.00 1.07 H new ATOM 0 HG2 GLN A 76 17.038 -1.712 1.591 1.00 1.21 H new ATOM 0 HG3 GLN A 76 17.992 -0.267 1.323 1.00 1.21 H new ATOM 0 HE21 GLN A 76 14.644 -0.222 2.490 1.00 2.36 H new ATOM 0 HE22 GLN A 76 15.024 0.333 4.124 1.00 2.36 H new ATOM 78 N SER A 77 16.318 1.322 -2.694 1.00 0.51 N ATOM 79 CA SER A 77 15.642 2.371 -3.458 1.00 0.56 C ATOM 80 C SER A 77 14.470 1.906 -4.345 1.00 0.43 C ATOM 81 O SER A 77 13.667 2.738 -4.765 1.00 0.54 O ATOM 82 CB SER A 77 16.677 3.063 -4.342 1.00 0.80 C ATOM 83 OG SER A 77 17.882 3.299 -3.631 1.00 1.52 O ATOM 0 H SER A 77 17.321 1.271 -2.872 1.00 0.51 H new ATOM 0 HA SER A 77 15.197 3.034 -2.716 1.00 0.56 H new ATOM 0 HB2 SER A 77 16.883 2.446 -5.217 1.00 0.80 H new ATOM 0 HB3 SER A 77 16.275 4.009 -4.706 1.00 0.80 H new ATOM 0 HG SER A 77 18.528 3.742 -4.220 1.00 1.52 H new ATOM 89 N ASP A 78 14.334 0.613 -4.627 1.00 0.35 N ATOM 90 CA ASP A 78 13.457 0.207 -5.731 1.00 0.38 C ATOM 91 C ASP A 78 12.410 -0.843 -5.360 1.00 0.33 C ATOM 92 O ASP A 78 12.160 -1.773 -6.127 1.00 0.42 O ATOM 93 CB ASP A 78 14.282 -0.267 -6.931 1.00 0.51 C ATOM 94 CG ASP A 78 13.849 0.413 -8.212 1.00 0.94 C ATOM 95 OD1 ASP A 78 14.262 1.568 -8.447 1.00 1.66 O ATOM 96 OD2 ASP A 78 13.083 -0.193 -8.988 1.00 1.66 O ATOM 0 H ASP A 78 14.798 -0.148 -4.131 1.00 0.35 H new ATOM 0 HA ASP A 78 12.895 1.103 -5.994 1.00 0.38 H new ATOM 0 HB2 ASP A 78 15.337 -0.064 -6.750 1.00 0.51 H new ATOM 0 HB3 ASP A 78 14.179 -1.347 -7.039 1.00 0.51 H new ATOM 101 N LEU A 79 11.818 -0.726 -4.181 1.00 0.26 N ATOM 102 CA LEU A 79 10.644 -1.538 -3.851 1.00 0.26 C ATOM 103 C LEU A 79 9.400 -0.911 -4.477 1.00 0.30 C ATOM 104 O LEU A 79 8.972 0.175 -4.079 1.00 0.51 O ATOM 105 CB LEU A 79 10.453 -1.675 -2.332 1.00 0.28 C ATOM 106 CG LEU A 79 11.268 -2.778 -1.639 1.00 0.28 C ATOM 107 CD1 LEU A 79 10.940 -4.143 -2.219 1.00 0.29 C ATOM 108 CD2 LEU A 79 12.760 -2.505 -1.732 1.00 0.30 C ATOM 0 H LEU A 79 12.121 -0.089 -3.444 1.00 0.26 H new ATOM 0 HA LEU A 79 10.801 -2.538 -4.254 1.00 0.26 H new ATOM 0 HB2 LEU A 79 10.705 -0.721 -1.868 1.00 0.28 H new ATOM 0 HB3 LEU A 79 9.396 -1.856 -2.135 1.00 0.28 H new ATOM 0 HG LEU A 79 10.990 -2.777 -0.585 1.00 0.28 H new ATOM 0 HD11 LEU A 79 11.530 -4.906 -1.711 1.00 0.29 H new ATOM 0 HD12 LEU A 79 9.879 -4.352 -2.079 1.00 0.29 H new ATOM 0 HD13 LEU A 79 11.175 -4.152 -3.283 1.00 0.29 H new ATOM 0 HD21 LEU A 79 13.308 -3.304 -1.232 1.00 0.30 H new ATOM 0 HD22 LEU A 79 13.057 -2.462 -2.780 1.00 0.30 H new ATOM 0 HD23 LEU A 79 12.986 -1.553 -1.251 1.00 0.30 H new ATOM 120 N HIS A 80 8.822 -1.587 -5.462 1.00 0.21 N ATOM 121 CA HIS A 80 7.693 -1.034 -6.203 1.00 0.25 C ATOM 122 C HIS A 80 6.418 -1.818 -5.934 1.00 0.22 C ATOM 123 O HIS A 80 6.401 -3.041 -6.041 1.00 0.23 O ATOM 124 CB HIS A 80 7.992 -1.037 -7.710 1.00 0.33 C ATOM 125 CG HIS A 80 6.856 -0.549 -8.562 1.00 1.03 C ATOM 126 ND1 HIS A 80 5.991 -1.395 -9.228 1.00 1.94 N ATOM 127 CD2 HIS A 80 6.445 0.708 -8.856 1.00 1.86 C ATOM 128 CE1 HIS A 80 5.104 -0.678 -9.896 1.00 2.58 C ATOM 129 NE2 HIS A 80 5.356 0.599 -9.685 1.00 2.50 N ATOM 0 H HIS A 80 9.114 -2.516 -5.766 1.00 0.21 H new ATOM 0 HA HIS A 80 7.544 -0.009 -5.864 1.00 0.25 H new ATOM 0 HB2 HIS A 80 8.866 -0.413 -7.897 1.00 0.33 H new ATOM 0 HB3 HIS A 80 8.252 -2.050 -8.016 1.00 0.33 H new ATOM 0 HD2 HIS A 80 6.891 1.626 -8.503 1.00 1.86 H new ATOM 0 HE1 HIS A 80 4.308 -1.071 -10.511 1.00 2.58 H new ATOM 0 HE2 HIS A 80 4.827 1.380 -10.075 1.00 2.50 H new ATOM 138 N ILE A 81 5.352 -1.103 -5.593 1.00 0.23 N ATOM 139 CA ILE A 81 4.037 -1.714 -5.461 1.00 0.23 C ATOM 140 C ILE A 81 3.554 -2.157 -6.835 1.00 0.26 C ATOM 141 O ILE A 81 3.057 -1.351 -7.621 1.00 0.36 O ATOM 142 CB ILE A 81 3.006 -0.739 -4.856 1.00 0.24 C ATOM 143 CG1 ILE A 81 3.497 -0.193 -3.512 1.00 0.23 C ATOM 144 CG2 ILE A 81 1.665 -1.441 -4.686 1.00 0.28 C ATOM 145 CD1 ILE A 81 2.605 0.883 -2.932 1.00 0.27 C ATOM 0 H ILE A 81 5.374 -0.101 -5.403 1.00 0.23 H new ATOM 0 HA ILE A 81 4.129 -2.566 -4.788 1.00 0.23 H new ATOM 0 HB ILE A 81 2.882 0.102 -5.538 1.00 0.24 H new ATOM 0 HG12 ILE A 81 3.570 -1.015 -2.800 1.00 0.23 H new ATOM 0 HG13 ILE A 81 4.502 0.209 -3.638 1.00 0.23 H new ATOM 0 HG21 ILE A 81 0.942 -0.746 -4.258 1.00 0.28 H new ATOM 0 HG22 ILE A 81 1.308 -1.784 -5.657 1.00 0.28 H new ATOM 0 HG23 ILE A 81 1.784 -2.296 -4.021 1.00 0.28 H new ATOM 0 HD11 ILE A 81 3.015 1.222 -1.981 1.00 0.27 H new ATOM 0 HD12 ILE A 81 2.552 1.723 -3.624 1.00 0.27 H new ATOM 0 HD13 ILE A 81 1.605 0.480 -2.773 1.00 0.27 H new ATOM 157 N SER A 82 3.728 -3.431 -7.131 1.00 0.25 N ATOM 158 CA SER A 82 3.437 -3.944 -8.459 1.00 0.29 C ATOM 159 C SER A 82 2.097 -4.669 -8.492 1.00 0.33 C ATOM 160 O SER A 82 1.518 -4.870 -9.560 1.00 0.43 O ATOM 161 CB SER A 82 4.565 -4.873 -8.916 1.00 0.32 C ATOM 162 OG SER A 82 5.801 -4.174 -8.972 1.00 1.10 O ATOM 0 H SER A 82 4.069 -4.130 -6.471 1.00 0.25 H new ATOM 0 HA SER A 82 3.370 -3.100 -9.146 1.00 0.29 H new ATOM 0 HB2 SER A 82 4.649 -5.716 -8.230 1.00 0.32 H new ATOM 0 HB3 SER A 82 4.329 -5.284 -9.898 1.00 0.32 H new ATOM 0 HG SER A 82 5.638 -3.213 -8.871 1.00 1.10 H new ATOM 168 N ASP A 83 1.597 -5.034 -7.323 1.00 0.33 N ATOM 169 CA ASP A 83 0.349 -5.778 -7.226 1.00 0.38 C ATOM 170 C ASP A 83 -0.318 -5.478 -5.894 1.00 0.30 C ATOM 171 O ASP A 83 0.333 -4.979 -4.978 1.00 0.27 O ATOM 172 CB ASP A 83 0.622 -7.280 -7.377 1.00 0.46 C ATOM 173 CG ASP A 83 -0.632 -8.127 -7.321 1.00 1.27 C ATOM 174 OD1 ASP A 83 -1.585 -7.842 -8.078 1.00 2.07 O ATOM 175 OD2 ASP A 83 -0.661 -9.101 -6.543 1.00 1.90 O ATOM 0 H ASP A 83 2.036 -4.827 -6.426 1.00 0.33 H new ATOM 0 HA ASP A 83 -0.323 -5.473 -8.028 1.00 0.38 H new ATOM 0 HB2 ASP A 83 1.129 -7.456 -8.326 1.00 0.46 H new ATOM 0 HB3 ASP A 83 1.303 -7.599 -6.588 1.00 0.46 H new ATOM 180 N GLN A 84 -1.609 -5.762 -5.792 1.00 0.31 N ATOM 181 CA GLN A 84 -2.352 -5.498 -4.572 1.00 0.35 C ATOM 182 C GLN A 84 -3.689 -6.229 -4.587 1.00 0.34 C ATOM 183 O GLN A 84 -3.933 -7.058 -5.467 1.00 0.39 O ATOM 184 CB GLN A 84 -2.536 -3.980 -4.368 1.00 0.49 C ATOM 185 CG GLN A 84 -3.204 -3.250 -5.529 1.00 0.64 C ATOM 186 CD GLN A 84 -4.717 -3.234 -5.437 1.00 1.32 C ATOM 187 OE1 GLN A 84 -5.285 -3.261 -4.346 1.00 2.14 O ATOM 188 NE2 GLN A 84 -5.380 -3.169 -6.581 1.00 1.98 N ATOM 0 H GLN A 84 -2.163 -6.176 -6.542 1.00 0.31 H new ATOM 0 HA GLN A 84 -1.780 -5.878 -3.726 1.00 0.35 H new ATOM 0 HB2 GLN A 84 -3.129 -3.819 -3.468 1.00 0.49 H new ATOM 0 HB3 GLN A 84 -1.559 -3.531 -4.190 1.00 0.49 H new ATOM 0 HG2 GLN A 84 -2.838 -2.224 -5.562 1.00 0.64 H new ATOM 0 HG3 GLN A 84 -2.909 -3.724 -6.465 1.00 0.64 H new ATOM 0 HE21 GLN A 84 -4.871 -3.149 -7.465 1.00 1.98 H new ATOM 0 HE22 GLN A 84 -6.400 -3.139 -6.579 1.00 1.98 H new ATOM 197 N THR A 85 -4.520 -5.940 -3.592 1.00 0.34 N ATOM 198 CA THR A 85 -5.846 -6.535 -3.454 1.00 0.39 C ATOM 199 C THR A 85 -6.584 -6.631 -4.794 1.00 0.50 C ATOM 200 O THR A 85 -6.708 -5.646 -5.526 1.00 0.54 O ATOM 201 CB THR A 85 -6.694 -5.701 -2.480 1.00 0.32 C ATOM 202 OG1 THR A 85 -5.954 -5.463 -1.274 1.00 0.43 O ATOM 203 CG2 THR A 85 -7.998 -6.405 -2.148 1.00 0.42 C ATOM 0 H THR A 85 -4.290 -5.279 -2.850 1.00 0.34 H new ATOM 0 HA THR A 85 -5.704 -7.546 -3.072 1.00 0.39 H new ATOM 0 HB THR A 85 -6.930 -4.752 -2.961 1.00 0.32 H new ATOM 0 HG1 THR A 85 -5.842 -4.498 -1.144 1.00 0.43 H new ATOM 0 HG21 THR A 85 -8.577 -5.792 -1.457 1.00 0.42 H new ATOM 0 HG22 THR A 85 -8.571 -6.561 -3.062 1.00 0.42 H new ATOM 0 HG23 THR A 85 -7.784 -7.369 -1.686 1.00 0.42 H new ATOM 211 N ASP A 86 -7.091 -7.816 -5.101 1.00 0.69 N ATOM 212 CA ASP A 86 -7.751 -8.058 -6.376 1.00 0.89 C ATOM 213 C ASP A 86 -9.170 -7.499 -6.357 1.00 0.83 C ATOM 214 O ASP A 86 -10.145 -8.229 -6.177 1.00 1.12 O ATOM 215 CB ASP A 86 -7.770 -9.554 -6.696 1.00 1.20 C ATOM 216 CG ASP A 86 -8.231 -9.837 -8.112 1.00 1.67 C ATOM 217 OD1 ASP A 86 -9.355 -10.353 -8.291 1.00 2.32 O ATOM 218 OD2 ASP A 86 -7.468 -9.545 -9.055 1.00 2.23 O ATOM 0 H ASP A 86 -7.058 -8.627 -4.483 1.00 0.69 H new ATOM 0 HA ASP A 86 -7.188 -7.546 -7.157 1.00 0.89 H new ATOM 0 HB2 ASP A 86 -6.771 -9.966 -6.553 1.00 1.20 H new ATOM 0 HB3 ASP A 86 -8.429 -10.065 -5.994 1.00 1.20 H new ATOM 223 N THR A 87 -9.265 -6.190 -6.509 1.00 0.72 N ATOM 224 CA THR A 87 -10.547 -5.504 -6.533 1.00 0.74 C ATOM 225 C THR A 87 -10.809 -4.873 -7.898 1.00 0.81 C ATOM 226 O THR A 87 -11.694 -5.318 -8.631 1.00 1.42 O ATOM 227 CB THR A 87 -10.585 -4.414 -5.454 1.00 1.14 C ATOM 228 OG1 THR A 87 -9.327 -3.724 -5.439 1.00 1.36 O ATOM 229 CG2 THR A 87 -10.871 -5.009 -4.083 1.00 1.87 C ATOM 0 H THR A 87 -8.460 -5.574 -6.619 1.00 0.72 H new ATOM 0 HA THR A 87 -11.323 -6.243 -6.335 1.00 0.74 H new ATOM 0 HB THR A 87 -11.388 -3.715 -5.688 1.00 1.14 H new ATOM 0 HG1 THR A 87 -8.717 -4.169 -4.814 1.00 1.36 H new ATOM 0 HG21 THR A 87 -10.892 -4.213 -3.338 1.00 1.87 H new ATOM 0 HG22 THR A 87 -11.836 -5.515 -4.100 1.00 1.87 H new ATOM 0 HG23 THR A 87 -10.090 -5.725 -3.827 1.00 1.87 H new ATOM 237 N LYS A 88 -10.031 -3.842 -8.225 1.00 1.18 N ATOM 238 CA LYS A 88 -10.132 -3.156 -9.514 1.00 1.58 C ATOM 239 C LYS A 88 -11.485 -2.457 -9.643 1.00 1.51 C ATOM 240 O LYS A 88 -12.298 -2.794 -10.507 1.00 1.95 O ATOM 241 CB LYS A 88 -9.929 -4.140 -10.675 1.00 1.89 C ATOM 242 CG LYS A 88 -8.672 -4.998 -10.564 1.00 2.02 C ATOM 243 CD LYS A 88 -7.398 -4.172 -10.671 1.00 2.39 C ATOM 244 CE LYS A 88 -6.162 -5.053 -10.568 1.00 2.73 C ATOM 245 NZ LYS A 88 -4.914 -4.308 -10.880 1.00 3.20 N ATOM 0 H LYS A 88 -9.315 -3.459 -7.607 1.00 1.18 H new ATOM 0 HA LYS A 88 -9.344 -2.405 -9.560 1.00 1.58 H new ATOM 0 HB2 LYS A 88 -10.797 -4.796 -10.735 1.00 1.89 H new ATOM 0 HB3 LYS A 88 -9.889 -3.578 -11.608 1.00 1.89 H new ATOM 0 HG2 LYS A 88 -8.680 -5.528 -9.612 1.00 2.02 H new ATOM 0 HG3 LYS A 88 -8.680 -5.753 -11.350 1.00 2.02 H new ATOM 0 HD2 LYS A 88 -7.388 -3.636 -11.620 1.00 2.39 H new ATOM 0 HD3 LYS A 88 -7.380 -3.422 -9.880 1.00 2.39 H new ATOM 0 HE2 LYS A 88 -6.095 -5.466 -9.561 1.00 2.73 H new ATOM 0 HE3 LYS A 88 -6.261 -5.896 -11.252 1.00 2.73 H new ATOM 0 HZ1 LYS A 88 -4.125 -4.979 -10.981 1.00 3.20 H new ATOM 0 HZ2 LYS A 88 -5.037 -3.782 -11.769 1.00 3.20 H new ATOM 0 HZ3 LYS A 88 -4.706 -3.642 -10.109 1.00 3.20 H new ATOM 259 N GLY A 89 -11.726 -1.493 -8.768 1.00 1.22 N ATOM 260 CA GLY A 89 -12.960 -0.733 -8.821 1.00 1.14 C ATOM 261 C GLY A 89 -13.853 -0.988 -7.621 1.00 0.96 C ATOM 262 O GLY A 89 -13.362 -1.179 -6.504 1.00 1.01 O ATOM 0 H GLY A 89 -11.088 -1.222 -8.020 1.00 1.22 H new ATOM 0 HA2 GLY A 89 -12.726 0.330 -8.876 1.00 1.14 H new ATOM 0 HA3 GLY A 89 -13.501 -0.988 -9.733 1.00 1.14 H new ATOM 266 N THR A 90 -15.163 -0.992 -7.844 1.00 0.97 N ATOM 267 CA THR A 90 -16.117 -1.227 -6.773 1.00 0.88 C ATOM 268 C THR A 90 -16.431 -2.711 -6.634 1.00 0.82 C ATOM 269 O THR A 90 -17.020 -3.326 -7.527 1.00 1.04 O ATOM 270 CB THR A 90 -17.428 -0.444 -6.992 1.00 1.06 C ATOM 271 OG1 THR A 90 -17.158 0.965 -6.990 1.00 1.25 O ATOM 272 CG2 THR A 90 -18.452 -0.770 -5.911 1.00 1.02 C ATOM 0 H THR A 90 -15.586 -0.835 -8.759 1.00 0.97 H new ATOM 0 HA THR A 90 -15.651 -0.871 -5.854 1.00 0.88 H new ATOM 0 HB THR A 90 -17.842 -0.739 -7.956 1.00 1.06 H new ATOM 0 HG1 THR A 90 -17.729 1.408 -7.652 1.00 1.25 H new ATOM 0 HG21 THR A 90 -19.365 -0.203 -6.092 1.00 1.02 H new ATOM 0 HG22 THR A 90 -18.677 -1.836 -5.932 1.00 1.02 H new ATOM 0 HG23 THR A 90 -18.047 -0.504 -4.934 1.00 1.02 H new ATOM 280 N VAL A 91 -16.012 -3.275 -5.515 1.00 0.65 N ATOM 281 CA VAL A 91 -16.303 -4.654 -5.175 1.00 0.77 C ATOM 282 C VAL A 91 -16.894 -4.686 -3.777 1.00 0.55 C ATOM 283 O VAL A 91 -16.508 -3.875 -2.937 1.00 0.46 O ATOM 284 CB VAL A 91 -15.016 -5.514 -5.204 1.00 1.02 C ATOM 285 CG1 VAL A 91 -15.294 -6.950 -4.787 1.00 1.43 C ATOM 286 CG2 VAL A 91 -14.379 -5.476 -6.584 1.00 1.51 C ATOM 0 H VAL A 91 -15.457 -2.785 -4.813 1.00 0.65 H new ATOM 0 HA VAL A 91 -17.004 -5.062 -5.903 1.00 0.77 H new ATOM 0 HB VAL A 91 -14.318 -5.088 -4.483 1.00 1.02 H new ATOM 0 HG11 VAL A 91 -14.368 -7.524 -4.819 1.00 1.43 H new ATOM 0 HG12 VAL A 91 -15.694 -6.963 -3.773 1.00 1.43 H new ATOM 0 HG13 VAL A 91 -16.019 -7.393 -5.469 1.00 1.43 H new ATOM 0 HG21 VAL A 91 -13.476 -6.086 -6.585 1.00 1.51 H new ATOM 0 HG22 VAL A 91 -15.082 -5.867 -7.320 1.00 1.51 H new ATOM 0 HG23 VAL A 91 -14.122 -4.448 -6.838 1.00 1.51 H new ATOM 296 N CYS A 92 -17.826 -5.587 -3.509 1.00 0.79 N ATOM 297 CA CYS A 92 -18.319 -5.710 -2.157 1.00 0.64 C ATOM 298 C CYS A 92 -17.518 -6.787 -1.454 1.00 0.62 C ATOM 299 O CYS A 92 -17.556 -7.960 -1.833 1.00 1.20 O ATOM 300 CB CYS A 92 -19.814 -6.048 -2.155 1.00 1.10 C ATOM 301 SG CYS A 92 -20.248 -7.514 -3.123 1.00 1.91 S ATOM 0 H CYS A 92 -18.242 -6.223 -4.189 1.00 0.79 H new ATOM 0 HA CYS A 92 -18.201 -4.763 -1.630 1.00 0.64 H new ATOM 0 HB2 CYS A 92 -20.139 -6.198 -1.125 1.00 1.10 H new ATOM 0 HB3 CYS A 92 -20.368 -5.194 -2.543 1.00 1.10 H new ATOM 0 HG CYS A 92 -19.371 -8.450 -2.910 1.00 1.91 H new ATOM 307 N SER A 93 -16.783 -6.375 -0.439 1.00 0.69 N ATOM 308 CA SER A 93 -15.873 -7.271 0.237 1.00 1.02 C ATOM 309 C SER A 93 -15.567 -6.821 1.658 1.00 0.58 C ATOM 310 O SER A 93 -14.942 -5.779 1.856 1.00 0.73 O ATOM 311 CB SER A 93 -14.580 -7.385 -0.570 1.00 1.83 C ATOM 312 OG SER A 93 -14.175 -6.119 -1.062 1.00 2.58 O ATOM 0 H SER A 93 -16.800 -5.426 -0.067 1.00 0.69 H new ATOM 0 HA SER A 93 -16.356 -8.245 0.309 1.00 1.02 H new ATOM 0 HB2 SER A 93 -13.792 -7.805 0.056 1.00 1.83 H new ATOM 0 HB3 SER A 93 -14.726 -8.073 -1.403 1.00 1.83 H new ATOM 0 HG SER A 93 -13.345 -6.217 -1.573 1.00 2.58 H new ATOM 318 N PRO A 94 -16.015 -7.564 2.668 1.00 0.78 N ATOM 319 CA PRO A 94 -15.437 -7.464 3.994 1.00 0.67 C ATOM 320 C PRO A 94 -14.172 -8.312 4.035 1.00 0.53 C ATOM 321 O PRO A 94 -14.246 -9.544 4.062 1.00 0.59 O ATOM 322 CB PRO A 94 -16.518 -8.050 4.916 1.00 0.93 C ATOM 323 CG PRO A 94 -17.665 -8.436 4.027 1.00 1.39 C ATOM 324 CD PRO A 94 -17.123 -8.516 2.626 1.00 1.43 C ATOM 0 HA PRO A 94 -15.163 -6.450 4.284 1.00 0.67 H new ATOM 0 HB2 PRO A 94 -16.139 -8.915 5.459 1.00 0.93 H new ATOM 0 HB3 PRO A 94 -16.832 -7.319 5.661 1.00 0.93 H new ATOM 0 HG2 PRO A 94 -18.086 -9.393 4.334 1.00 1.39 H new ATOM 0 HG3 PRO A 94 -18.467 -7.700 4.090 1.00 1.39 H new ATOM 0 HD2 PRO A 94 -16.786 -9.522 2.377 1.00 1.43 H new ATOM 0 HD3 PRO A 94 -17.871 -8.238 1.884 1.00 1.43 H new ATOM 332 N PHE A 95 -13.016 -7.667 4.030 1.00 0.43 N ATOM 333 CA PHE A 95 -11.778 -8.383 3.783 1.00 0.40 C ATOM 334 C PHE A 95 -10.574 -7.551 4.210 1.00 0.33 C ATOM 335 O PHE A 95 -10.635 -6.322 4.222 1.00 0.32 O ATOM 336 CB PHE A 95 -11.710 -8.700 2.281 1.00 0.46 C ATOM 337 CG PHE A 95 -10.684 -9.729 1.892 1.00 0.50 C ATOM 338 CD1 PHE A 95 -10.838 -11.057 2.263 1.00 1.26 C ATOM 339 CD2 PHE A 95 -9.577 -9.374 1.138 1.00 1.35 C ATOM 340 CE1 PHE A 95 -9.905 -12.005 1.892 1.00 1.33 C ATOM 341 CE2 PHE A 95 -8.642 -10.319 0.768 1.00 1.36 C ATOM 342 CZ PHE A 95 -8.806 -11.636 1.145 1.00 0.68 C ATOM 0 H PHE A 95 -12.910 -6.665 4.191 1.00 0.43 H new ATOM 0 HA PHE A 95 -11.757 -9.304 4.366 1.00 0.40 H new ATOM 0 HB2 PHE A 95 -12.691 -9.045 1.954 1.00 0.46 H new ATOM 0 HB3 PHE A 95 -11.500 -7.777 1.740 1.00 0.46 H new ATOM 0 HD1 PHE A 95 -11.696 -11.352 2.848 1.00 1.26 H new ATOM 0 HD2 PHE A 95 -9.444 -8.346 0.836 1.00 1.35 H new ATOM 0 HE1 PHE A 95 -10.036 -13.036 2.187 1.00 1.33 H new ATOM 0 HE2 PHE A 95 -7.782 -10.028 0.183 1.00 1.36 H new ATOM 0 HZ PHE A 95 -8.075 -12.377 0.856 1.00 0.68 H new ATOM 352 N ALA A 96 -9.502 -8.232 4.593 1.00 0.37 N ATOM 353 CA ALA A 96 -8.243 -7.578 4.903 1.00 0.38 C ATOM 354 C ALA A 96 -7.467 -7.341 3.618 1.00 0.35 C ATOM 355 O ALA A 96 -7.300 -8.249 2.805 1.00 0.51 O ATOM 356 CB ALA A 96 -7.427 -8.417 5.875 1.00 0.49 C ATOM 0 H ALA A 96 -9.483 -9.247 4.696 1.00 0.37 H new ATOM 0 HA ALA A 96 -8.447 -6.619 5.379 1.00 0.38 H new ATOM 0 HB1 ALA A 96 -6.488 -7.909 6.094 1.00 0.49 H new ATOM 0 HB2 ALA A 96 -7.990 -8.554 6.799 1.00 0.49 H new ATOM 0 HB3 ALA A 96 -7.218 -9.390 5.430 1.00 0.49 H new ATOM 362 N LEU A 97 -6.983 -6.129 3.450 1.00 0.24 N ATOM 363 CA LEU A 97 -6.404 -5.707 2.185 1.00 0.22 C ATOM 364 C LEU A 97 -4.905 -5.934 2.169 1.00 0.22 C ATOM 365 O LEU A 97 -4.259 -5.924 3.216 1.00 0.24 O ATOM 366 CB LEU A 97 -6.726 -4.230 1.941 1.00 0.23 C ATOM 367 CG LEU A 97 -8.219 -3.899 1.937 1.00 0.46 C ATOM 368 CD1 LEU A 97 -8.441 -2.424 1.661 1.00 1.40 C ATOM 369 CD2 LEU A 97 -8.945 -4.754 0.913 1.00 1.07 C ATOM 0 H LEU A 97 -6.978 -5.412 4.176 1.00 0.24 H new ATOM 0 HA LEU A 97 -6.838 -6.306 1.385 1.00 0.22 H new ATOM 0 HB2 LEU A 97 -6.236 -3.633 2.710 1.00 0.23 H new ATOM 0 HB3 LEU A 97 -6.298 -3.931 0.984 1.00 0.23 H new ATOM 0 HG LEU A 97 -8.626 -4.122 2.923 1.00 0.46 H new ATOM 0 HD11 LEU A 97 -9.510 -2.210 1.663 1.00 1.40 H new ATOM 0 HD12 LEU A 97 -7.951 -1.832 2.434 1.00 1.40 H new ATOM 0 HD13 LEU A 97 -8.021 -2.169 0.688 1.00 1.40 H new ATOM 0 HD21 LEU A 97 -10.007 -4.508 0.921 1.00 1.07 H new ATOM 0 HD22 LEU A 97 -8.535 -4.561 -0.078 1.00 1.07 H new ATOM 0 HD23 LEU A 97 -8.815 -5.807 1.161 1.00 1.07 H new ATOM 381 N PHE A 98 -4.350 -6.139 0.981 1.00 0.23 N ATOM 382 CA PHE A 98 -2.927 -6.381 0.853 1.00 0.23 C ATOM 383 C PHE A 98 -2.345 -5.658 -0.350 1.00 0.22 C ATOM 384 O PHE A 98 -3.059 -5.290 -1.283 1.00 0.25 O ATOM 385 CB PHE A 98 -2.633 -7.888 0.764 1.00 0.24 C ATOM 386 CG PHE A 98 -3.369 -8.604 -0.337 1.00 0.26 C ATOM 387 CD1 PHE A 98 -4.568 -9.254 -0.078 1.00 1.26 C ATOM 388 CD2 PHE A 98 -2.862 -8.635 -1.629 1.00 1.18 C ATOM 389 CE1 PHE A 98 -5.243 -9.917 -1.084 1.00 1.31 C ATOM 390 CE2 PHE A 98 -3.536 -9.298 -2.637 1.00 1.17 C ATOM 391 CZ PHE A 98 -4.727 -9.939 -2.365 1.00 0.40 C ATOM 0 H PHE A 98 -4.864 -6.142 0.100 1.00 0.23 H new ATOM 0 HA PHE A 98 -2.448 -5.985 1.748 1.00 0.23 H new ATOM 0 HB2 PHE A 98 -1.562 -8.028 0.619 1.00 0.24 H new ATOM 0 HB3 PHE A 98 -2.889 -8.352 1.716 1.00 0.24 H new ATOM 0 HD1 PHE A 98 -4.977 -9.241 0.921 1.00 1.26 H new ATOM 0 HD2 PHE A 98 -1.930 -8.135 -1.849 1.00 1.18 H new ATOM 0 HE1 PHE A 98 -6.175 -10.419 -0.869 1.00 1.31 H new ATOM 0 HE2 PHE A 98 -3.130 -9.314 -3.638 1.00 1.17 H new ATOM 0 HZ PHE A 98 -5.255 -10.457 -3.152 1.00 0.40 H new ATOM 401 N ALA A 99 -1.046 -5.441 -0.292 1.00 0.20 N ATOM 402 CA ALA A 99 -0.298 -4.861 -1.391 1.00 0.19 C ATOM 403 C ALA A 99 1.035 -5.575 -1.513 1.00 0.17 C ATOM 404 O ALA A 99 1.605 -6.010 -0.511 1.00 0.19 O ATOM 405 CB ALA A 99 -0.089 -3.371 -1.185 1.00 0.21 C ATOM 0 H ALA A 99 -0.476 -5.663 0.524 1.00 0.20 H new ATOM 0 HA ALA A 99 -0.866 -4.986 -2.313 1.00 0.19 H new ATOM 0 HB1 ALA A 99 0.475 -2.963 -2.024 1.00 0.21 H new ATOM 0 HB2 ALA A 99 -1.057 -2.873 -1.122 1.00 0.21 H new ATOM 0 HB3 ALA A 99 0.465 -3.206 -0.261 1.00 0.21 H new ATOM 411 N VAL A 100 1.518 -5.716 -2.728 1.00 0.17 N ATOM 412 CA VAL A 100 2.748 -6.438 -2.976 1.00 0.18 C ATOM 413 C VAL A 100 3.790 -5.531 -3.614 1.00 0.19 C ATOM 414 O VAL A 100 3.543 -4.908 -4.651 1.00 0.22 O ATOM 415 CB VAL A 100 2.498 -7.657 -3.884 1.00 0.23 C ATOM 416 CG1 VAL A 100 3.788 -8.415 -4.138 1.00 0.26 C ATOM 417 CG2 VAL A 100 1.446 -8.576 -3.277 1.00 0.25 C ATOM 0 H VAL A 100 1.075 -5.338 -3.565 1.00 0.17 H new ATOM 0 HA VAL A 100 3.124 -6.787 -2.014 1.00 0.18 H new ATOM 0 HB VAL A 100 2.123 -7.294 -4.841 1.00 0.23 H new ATOM 0 HG11 VAL A 100 3.586 -9.271 -4.781 1.00 0.26 H new ATOM 0 HG12 VAL A 100 4.507 -7.756 -4.625 1.00 0.26 H new ATOM 0 HG13 VAL A 100 4.199 -8.762 -3.190 1.00 0.26 H new ATOM 0 HG21 VAL A 100 1.286 -9.430 -3.935 1.00 0.25 H new ATOM 0 HG22 VAL A 100 1.788 -8.927 -2.303 1.00 0.25 H new ATOM 0 HG23 VAL A 100 0.511 -8.029 -3.157 1.00 0.25 H new ATOM 427 N LEU A 101 4.949 -5.457 -2.985 1.00 0.19 N ATOM 428 CA LEU A 101 6.044 -4.656 -3.491 1.00 0.19 C ATOM 429 C LEU A 101 7.136 -5.562 -4.024 1.00 0.21 C ATOM 430 O LEU A 101 7.708 -6.368 -3.288 1.00 0.23 O ATOM 431 CB LEU A 101 6.620 -3.726 -2.416 1.00 0.19 C ATOM 432 CG LEU A 101 5.693 -2.601 -1.942 1.00 0.22 C ATOM 433 CD1 LEU A 101 4.663 -3.121 -0.950 1.00 0.30 C ATOM 434 CD2 LEU A 101 6.504 -1.463 -1.333 1.00 0.21 C ATOM 0 H LEU A 101 5.155 -5.948 -2.115 1.00 0.19 H new ATOM 0 HA LEU A 101 5.654 -4.030 -4.294 1.00 0.19 H new ATOM 0 HB2 LEU A 101 6.900 -4.329 -1.552 1.00 0.19 H new ATOM 0 HB3 LEU A 101 7.536 -3.278 -2.802 1.00 0.19 H new ATOM 0 HG LEU A 101 5.156 -2.217 -2.809 1.00 0.22 H new ATOM 0 HD11 LEU A 101 4.019 -2.301 -0.631 1.00 0.30 H new ATOM 0 HD12 LEU A 101 4.058 -3.894 -1.425 1.00 0.30 H new ATOM 0 HD13 LEU A 101 5.173 -3.541 -0.083 1.00 0.30 H new ATOM 0 HD21 LEU A 101 5.830 -0.673 -1.002 1.00 0.21 H new ATOM 0 HD22 LEU A 101 7.072 -1.836 -0.481 1.00 0.21 H new ATOM 0 HD23 LEU A 101 7.190 -1.065 -2.080 1.00 0.21 H new ATOM 446 N GLU A 102 7.415 -5.433 -5.304 1.00 0.24 N ATOM 447 CA GLU A 102 8.428 -6.242 -5.944 1.00 0.29 C ATOM 448 C GLU A 102 9.751 -5.500 -5.938 1.00 0.28 C ATOM 449 O GLU A 102 9.799 -4.291 -6.183 1.00 0.26 O ATOM 450 CB GLU A 102 8.013 -6.592 -7.377 1.00 0.34 C ATOM 451 CG GLU A 102 9.016 -7.476 -8.103 1.00 0.41 C ATOM 452 CD GLU A 102 8.499 -7.990 -9.430 1.00 0.53 C ATOM 453 OE1 GLU A 102 8.173 -9.191 -9.520 1.00 1.32 O ATOM 454 OE2 GLU A 102 8.414 -7.197 -10.391 1.00 0.95 O ATOM 0 H GLU A 102 6.950 -4.770 -5.925 1.00 0.24 H new ATOM 0 HA GLU A 102 8.541 -7.173 -5.389 1.00 0.29 H new ATOM 0 HB2 GLU A 102 7.047 -7.096 -7.354 1.00 0.34 H new ATOM 0 HB3 GLU A 102 7.878 -5.670 -7.943 1.00 0.34 H new ATOM 0 HG2 GLU A 102 9.934 -6.913 -8.270 1.00 0.41 H new ATOM 0 HG3 GLU A 102 9.273 -8.323 -7.467 1.00 0.41 H new ATOM 461 N ASN A 103 10.815 -6.218 -5.628 1.00 0.38 N ATOM 462 CA ASN A 103 12.142 -5.633 -5.607 1.00 0.44 C ATOM 463 C ASN A 103 12.723 -5.611 -7.011 1.00 0.37 C ATOM 464 O ASN A 103 13.172 -6.640 -7.524 1.00 0.51 O ATOM 465 CB ASN A 103 13.066 -6.419 -4.680 1.00 0.68 C ATOM 466 CG ASN A 103 14.339 -5.660 -4.396 1.00 0.87 C ATOM 467 OD1 ASN A 103 15.326 -5.772 -5.123 1.00 1.76 O ATOM 468 ND2 ASN A 103 14.319 -4.876 -3.334 1.00 1.64 N ATOM 0 H ASN A 103 10.785 -7.209 -5.387 1.00 0.38 H new ATOM 0 HA ASN A 103 12.060 -4.612 -5.233 1.00 0.44 H new ATOM 0 HB2 ASN A 103 12.550 -6.630 -3.743 1.00 0.68 H new ATOM 0 HB3 ASN A 103 13.308 -7.380 -5.134 1.00 0.68 H new ATOM 0 HD21 ASN A 103 15.145 -4.331 -3.087 1.00 1.64 H new ATOM 0 HD22 ASN A 103 13.478 -4.815 -2.761 1.00 1.64 H new ATOM 475 N THR A 104 12.705 -4.450 -7.635 1.00 0.34 N ATOM 476 CA THR A 104 13.191 -4.319 -8.992 1.00 0.38 C ATOM 477 C THR A 104 14.623 -3.794 -9.042 1.00 0.50 C ATOM 478 O THR A 104 14.916 -2.790 -9.690 1.00 0.70 O ATOM 479 CB THR A 104 12.254 -3.431 -9.828 1.00 0.55 C ATOM 480 OG1 THR A 104 11.729 -2.369 -9.021 1.00 0.77 O ATOM 481 CG2 THR A 104 11.109 -4.253 -10.393 1.00 0.73 C ATOM 0 H THR A 104 12.359 -3.584 -7.223 1.00 0.34 H new ATOM 0 HA THR A 104 13.199 -5.319 -9.427 1.00 0.38 H new ATOM 0 HB THR A 104 12.828 -3.007 -10.652 1.00 0.55 H new ATOM 0 HG1 THR A 104 12.426 -1.697 -8.870 1.00 0.77 H new ATOM 0 HG21 THR A 104 10.455 -3.610 -10.982 1.00 0.73 H new ATOM 0 HG22 THR A 104 11.508 -5.044 -11.028 1.00 0.73 H new ATOM 0 HG23 THR A 104 10.541 -4.696 -9.575 1.00 0.73 H new ATOM 489 N GLY A 105 15.511 -4.477 -8.335 1.00 0.52 N ATOM 490 CA GLY A 105 16.930 -4.224 -8.481 1.00 0.72 C ATOM 491 C GLY A 105 17.605 -3.779 -7.203 1.00 0.66 C ATOM 492 O GLY A 105 18.712 -4.219 -6.898 1.00 0.80 O ATOM 0 H GLY A 105 15.273 -5.204 -7.661 1.00 0.52 H new ATOM 0 HA2 GLY A 105 17.416 -5.131 -8.841 1.00 0.72 H new ATOM 0 HA3 GLY A 105 17.077 -3.459 -9.244 1.00 0.72 H new ATOM 496 N GLU A 106 16.939 -2.935 -6.441 1.00 0.60 N ATOM 497 CA GLU A 106 17.539 -2.371 -5.245 1.00 0.56 C ATOM 498 C GLU A 106 17.038 -3.102 -4.008 1.00 0.65 C ATOM 499 O GLU A 106 15.981 -2.780 -3.462 1.00 1.05 O ATOM 500 CB GLU A 106 17.246 -0.877 -5.162 1.00 0.68 C ATOM 501 CG GLU A 106 17.793 -0.094 -6.347 1.00 1.25 C ATOM 502 CD GLU A 106 19.292 -0.245 -6.498 1.00 1.91 C ATOM 503 OE1 GLU A 106 19.734 -0.919 -7.451 1.00 2.54 O ATOM 504 OE2 GLU A 106 20.036 0.303 -5.657 1.00 2.47 O ATOM 0 H GLU A 106 15.985 -2.624 -6.626 1.00 0.60 H new ATOM 0 HA GLU A 106 18.620 -2.499 -5.296 1.00 0.56 H new ATOM 0 HB2 GLU A 106 16.168 -0.727 -5.102 1.00 0.68 H new ATOM 0 HB3 GLU A 106 17.675 -0.479 -4.242 1.00 0.68 H new ATOM 0 HG2 GLU A 106 17.303 -0.433 -7.260 1.00 1.25 H new ATOM 0 HG3 GLU A 106 17.547 0.961 -6.226 1.00 1.25 H new ATOM 511 N LYS A 107 17.818 -4.086 -3.584 1.00 0.61 N ATOM 512 CA LYS A 107 17.434 -5.014 -2.524 1.00 0.69 C ATOM 513 C LYS A 107 17.151 -4.326 -1.191 1.00 0.66 C ATOM 514 O LYS A 107 17.751 -3.307 -0.849 1.00 0.76 O ATOM 515 CB LYS A 107 18.538 -6.056 -2.321 1.00 0.86 C ATOM 516 CG LYS A 107 18.827 -6.899 -3.553 1.00 1.37 C ATOM 517 CD LYS A 107 17.594 -7.651 -4.020 1.00 1.80 C ATOM 518 CE LYS A 107 17.893 -8.502 -5.239 1.00 2.66 C ATOM 519 NZ LYS A 107 18.362 -7.685 -6.388 1.00 3.32 N ATOM 0 H LYS A 107 18.745 -4.266 -3.969 1.00 0.61 H new ATOM 0 HA LYS A 107 16.507 -5.485 -2.849 1.00 0.69 H new ATOM 0 HB2 LYS A 107 19.453 -5.547 -2.019 1.00 0.86 H new ATOM 0 HB3 LYS A 107 18.255 -6.715 -1.501 1.00 0.86 H new ATOM 0 HG2 LYS A 107 19.188 -6.257 -4.357 1.00 1.37 H new ATOM 0 HG3 LYS A 107 19.623 -7.609 -3.330 1.00 1.37 H new ATOM 0 HD2 LYS A 107 17.226 -8.285 -3.213 1.00 1.80 H new ATOM 0 HD3 LYS A 107 16.801 -6.941 -4.256 1.00 1.80 H new ATOM 0 HE2 LYS A 107 18.652 -9.242 -4.987 1.00 2.66 H new ATOM 0 HE3 LYS A 107 16.996 -9.051 -5.527 1.00 2.66 H new ATOM 0 HZ1 LYS A 107 18.328 -8.256 -7.257 1.00 3.32 H new ATOM 0 HZ2 LYS A 107 17.747 -6.853 -6.496 1.00 3.32 H new ATOM 0 HZ3 LYS A 107 19.339 -7.373 -6.216 1.00 3.32 H new ATOM 533 N LEU A 108 16.224 -4.911 -0.445 1.00 0.59 N ATOM 534 CA LEU A 108 15.942 -4.489 0.916 1.00 0.57 C ATOM 535 C LEU A 108 17.056 -5.024 1.812 1.00 0.63 C ATOM 536 O LEU A 108 17.040 -6.189 2.208 1.00 0.74 O ATOM 537 CB LEU A 108 14.568 -5.034 1.347 1.00 0.60 C ATOM 538 CG LEU A 108 13.913 -4.385 2.579 1.00 0.58 C ATOM 539 CD1 LEU A 108 14.617 -4.780 3.869 1.00 0.61 C ATOM 540 CD2 LEU A 108 13.887 -2.874 2.430 1.00 0.56 C ATOM 0 H LEU A 108 15.649 -5.689 -0.767 1.00 0.59 H new ATOM 0 HA LEU A 108 15.908 -3.402 0.993 1.00 0.57 H new ATOM 0 HB2 LEU A 108 13.883 -4.930 0.505 1.00 0.60 H new ATOM 0 HB3 LEU A 108 14.673 -6.101 1.542 1.00 0.60 H new ATOM 0 HG LEU A 108 12.889 -4.754 2.639 1.00 0.58 H new ATOM 0 HD11 LEU A 108 14.123 -4.301 4.714 1.00 0.61 H new ATOM 0 HD12 LEU A 108 14.574 -5.862 3.990 1.00 0.61 H new ATOM 0 HD13 LEU A 108 15.658 -4.460 3.828 1.00 0.61 H new ATOM 0 HD21 LEU A 108 13.421 -2.430 3.309 1.00 0.56 H new ATOM 0 HD22 LEU A 108 14.906 -2.500 2.332 1.00 0.56 H new ATOM 0 HD23 LEU A 108 13.315 -2.606 1.542 1.00 0.56 H new ATOM 552 N LYS A 109 18.036 -4.182 2.099 1.00 0.62 N ATOM 553 CA LYS A 109 19.242 -4.633 2.774 1.00 0.73 C ATOM 554 C LYS A 109 19.334 -4.129 4.215 1.00 0.75 C ATOM 555 O LYS A 109 19.824 -4.841 5.092 1.00 1.15 O ATOM 556 CB LYS A 109 20.465 -4.171 1.978 1.00 0.92 C ATOM 557 CG LYS A 109 21.787 -4.710 2.498 1.00 1.17 C ATOM 558 CD LYS A 109 22.948 -4.231 1.644 1.00 1.66 C ATOM 559 CE LYS A 109 24.262 -4.856 2.081 1.00 2.07 C ATOM 560 NZ LYS A 109 25.393 -4.431 1.214 1.00 2.72 N ATOM 0 H LYS A 109 18.020 -3.187 1.876 1.00 0.62 H new ATOM 0 HA LYS A 109 19.208 -5.721 2.823 1.00 0.73 H new ATOM 0 HB2 LYS A 109 20.345 -4.477 0.939 1.00 0.92 H new ATOM 0 HB3 LYS A 109 20.501 -3.082 1.988 1.00 0.92 H new ATOM 0 HG2 LYS A 109 21.934 -4.389 3.529 1.00 1.17 H new ATOM 0 HG3 LYS A 109 21.762 -5.800 2.504 1.00 1.17 H new ATOM 0 HD2 LYS A 109 22.757 -4.477 0.599 1.00 1.66 H new ATOM 0 HD3 LYS A 109 23.023 -3.145 1.707 1.00 1.66 H new ATOM 0 HE2 LYS A 109 24.471 -4.577 3.114 1.00 2.07 H new ATOM 0 HE3 LYS A 109 24.174 -5.942 2.056 1.00 2.07 H new ATOM 0 HZ1 LYS A 109 26.271 -4.879 1.545 1.00 2.72 H new ATOM 0 HZ2 LYS A 109 25.206 -4.720 0.233 1.00 2.72 H new ATOM 0 HZ3 LYS A 109 25.494 -3.397 1.257 1.00 2.72 H new ATOM 574 N LYS A 110 18.864 -2.916 4.466 1.00 0.62 N ATOM 575 CA LYS A 110 19.078 -2.289 5.769 1.00 0.73 C ATOM 576 C LYS A 110 17.766 -2.040 6.512 1.00 0.77 C ATOM 577 O LYS A 110 17.367 -2.816 7.383 1.00 1.53 O ATOM 578 CB LYS A 110 19.823 -0.961 5.601 1.00 0.93 C ATOM 579 CG LYS A 110 21.120 -1.064 4.816 1.00 1.14 C ATOM 580 CD LYS A 110 21.833 0.275 4.769 1.00 1.46 C ATOM 581 CE LYS A 110 23.126 0.191 3.979 1.00 1.80 C ATOM 582 NZ LYS A 110 23.873 1.477 3.999 1.00 1.59 N ATOM 0 H LYS A 110 18.339 -2.351 3.798 1.00 0.62 H new ATOM 0 HA LYS A 110 19.675 -2.981 6.362 1.00 0.73 H new ATOM 0 HB2 LYS A 110 19.165 -0.250 5.101 1.00 0.93 H new ATOM 0 HB3 LYS A 110 20.041 -0.553 6.588 1.00 0.93 H new ATOM 0 HG2 LYS A 110 21.769 -1.810 5.275 1.00 1.14 H new ATOM 0 HG3 LYS A 110 20.910 -1.404 3.802 1.00 1.14 H new ATOM 0 HD2 LYS A 110 21.178 1.021 4.318 1.00 1.46 H new ATOM 0 HD3 LYS A 110 22.047 0.610 5.784 1.00 1.46 H new ATOM 0 HE2 LYS A 110 23.753 -0.599 4.392 1.00 1.80 H new ATOM 0 HE3 LYS A 110 22.904 -0.084 2.948 1.00 1.80 H new ATOM 0 HZ1 LYS A 110 24.750 1.378 3.448 1.00 1.59 H new ATOM 0 HZ2 LYS A 110 23.285 2.227 3.582 1.00 1.59 H new ATOM 0 HZ3 LYS A 110 24.107 1.727 4.981 1.00 1.59 H new ATOM 596 N SER A 111 17.099 -0.959 6.149 1.00 0.51 N ATOM 597 CA SER A 111 15.915 -0.501 6.849 1.00 0.52 C ATOM 598 C SER A 111 14.665 -1.128 6.237 1.00 0.48 C ATOM 599 O SER A 111 14.753 -1.924 5.306 1.00 0.86 O ATOM 600 CB SER A 111 15.846 1.030 6.766 1.00 0.72 C ATOM 601 OG SER A 111 14.903 1.566 7.680 1.00 1.55 O ATOM 0 H SER A 111 17.365 -0.373 5.358 1.00 0.51 H new ATOM 0 HA SER A 111 15.968 -0.803 7.895 1.00 0.52 H new ATOM 0 HB2 SER A 111 16.831 1.450 6.972 1.00 0.72 H new ATOM 0 HB3 SER A 111 15.579 1.327 5.752 1.00 0.72 H new ATOM 0 HG SER A 111 14.888 2.543 7.600 1.00 1.55 H new ATOM 607 N LYS A 112 13.510 -0.758 6.759 1.00 0.39 N ATOM 608 CA LYS A 112 12.243 -1.302 6.294 1.00 0.32 C ATOM 609 C LYS A 112 11.380 -0.199 5.698 1.00 0.28 C ATOM 610 O LYS A 112 11.351 0.923 6.213 1.00 0.33 O ATOM 611 CB LYS A 112 11.496 -1.967 7.452 1.00 0.45 C ATOM 612 CG LYS A 112 12.301 -3.045 8.155 1.00 0.55 C ATOM 613 CD LYS A 112 11.553 -3.611 9.350 1.00 0.69 C ATOM 614 CE LYS A 112 12.350 -4.708 10.038 1.00 0.84 C ATOM 615 NZ LYS A 112 13.664 -4.218 10.531 1.00 1.53 N ATOM 0 H LYS A 112 13.421 -0.076 7.513 1.00 0.39 H new ATOM 0 HA LYS A 112 12.450 -2.047 5.526 1.00 0.32 H new ATOM 0 HB2 LYS A 112 11.215 -1.204 8.178 1.00 0.45 H new ATOM 0 HB3 LYS A 112 10.572 -2.404 7.074 1.00 0.45 H new ATOM 0 HG2 LYS A 112 12.527 -3.848 7.453 1.00 0.55 H new ATOM 0 HG3 LYS A 112 13.254 -2.632 8.484 1.00 0.55 H new ATOM 0 HD2 LYS A 112 11.343 -2.812 10.061 1.00 0.69 H new ATOM 0 HD3 LYS A 112 10.592 -4.008 9.024 1.00 0.69 H new ATOM 0 HE2 LYS A 112 11.774 -5.104 10.874 1.00 0.84 H new ATOM 0 HE3 LYS A 112 12.508 -5.532 9.342 1.00 0.84 H new ATOM 0 HZ1 LYS A 112 14.084 -4.928 11.164 1.00 1.53 H new ATOM 0 HZ2 LYS A 112 14.299 -4.055 9.724 1.00 1.53 H new ATOM 0 HZ3 LYS A 112 13.530 -3.328 11.051 1.00 1.53 H new ATOM 629 N TRP A 113 10.690 -0.521 4.611 1.00 0.24 N ATOM 630 CA TRP A 113 9.771 0.419 3.982 1.00 0.22 C ATOM 631 C TRP A 113 8.524 0.576 4.837 1.00 0.21 C ATOM 632 O TRP A 113 7.955 -0.412 5.306 1.00 0.25 O ATOM 633 CB TRP A 113 9.402 -0.042 2.566 1.00 0.22 C ATOM 634 CG TRP A 113 10.475 0.217 1.548 1.00 0.23 C ATOM 635 CD1 TRP A 113 11.776 -0.201 1.593 1.00 0.24 C ATOM 636 CD2 TRP A 113 10.334 0.943 0.318 1.00 0.24 C ATOM 637 NE1 TRP A 113 12.451 0.240 0.482 1.00 0.25 N ATOM 638 CE2 TRP A 113 11.590 0.939 -0.315 1.00 0.25 C ATOM 639 CE3 TRP A 113 9.270 1.602 -0.308 1.00 0.28 C ATOM 640 CZ2 TRP A 113 11.812 1.565 -1.538 1.00 0.29 C ATOM 641 CZ3 TRP A 113 9.496 2.218 -1.525 1.00 0.32 C ATOM 642 CH2 TRP A 113 10.759 2.195 -2.127 1.00 0.32 C ATOM 0 H TRP A 113 10.750 -1.427 4.146 1.00 0.24 H new ATOM 0 HA TRP A 113 10.265 1.387 3.900 1.00 0.22 H new ATOM 0 HB2 TRP A 113 9.183 -1.110 2.587 1.00 0.22 H new ATOM 0 HB3 TRP A 113 8.488 0.465 2.255 1.00 0.22 H new ATOM 0 HD1 TRP A 113 12.209 -0.792 2.387 1.00 0.24 H new ATOM 0 HE1 TRP A 113 13.437 0.072 0.284 1.00 0.25 H new ATOM 0 HE3 TRP A 113 8.292 1.629 0.150 1.00 0.28 H new ATOM 0 HZ2 TRP A 113 12.786 1.551 -2.004 1.00 0.29 H new ATOM 0 HZ3 TRP A 113 8.682 2.727 -2.020 1.00 0.32 H new ATOM 0 HH2 TRP A 113 10.901 2.687 -3.078 1.00 0.32 H new ATOM 653 N LYS A 114 8.119 1.817 5.050 1.00 0.20 N ATOM 654 CA LYS A 114 6.996 2.121 5.921 1.00 0.24 C ATOM 655 C LYS A 114 5.747 2.395 5.095 1.00 0.20 C ATOM 656 O LYS A 114 5.789 3.158 4.127 1.00 0.24 O ATOM 657 CB LYS A 114 7.332 3.336 6.786 1.00 0.37 C ATOM 658 CG LYS A 114 6.270 3.675 7.818 1.00 0.58 C ATOM 659 CD LYS A 114 6.243 2.671 8.957 1.00 1.04 C ATOM 660 CE LYS A 114 5.102 2.955 9.920 1.00 1.08 C ATOM 661 NZ LYS A 114 5.249 4.271 10.594 1.00 1.66 N ATOM 0 H LYS A 114 8.556 2.636 4.628 1.00 0.20 H new ATOM 0 HA LYS A 114 6.803 1.264 6.566 1.00 0.24 H new ATOM 0 HB2 LYS A 114 8.276 3.154 7.299 1.00 0.37 H new ATOM 0 HB3 LYS A 114 7.483 4.199 6.138 1.00 0.37 H new ATOM 0 HG2 LYS A 114 6.458 4.672 8.218 1.00 0.58 H new ATOM 0 HG3 LYS A 114 5.293 3.704 7.337 1.00 0.58 H new ATOM 0 HD2 LYS A 114 6.138 1.664 8.554 1.00 1.04 H new ATOM 0 HD3 LYS A 114 7.191 2.702 9.494 1.00 1.04 H new ATOM 0 HE2 LYS A 114 4.157 2.930 9.378 1.00 1.08 H new ATOM 0 HE3 LYS A 114 5.059 2.167 10.672 1.00 1.08 H new ATOM 0 HZ1 LYS A 114 4.527 4.363 11.337 1.00 1.66 H new ATOM 0 HZ2 LYS A 114 6.195 4.339 11.021 1.00 1.66 H new ATOM 0 HZ3 LYS A 114 5.128 5.033 9.897 1.00 1.66 H new ATOM 675 N TRP A 115 4.641 1.776 5.476 1.00 0.17 N ATOM 676 CA TRP A 115 3.401 1.936 4.740 1.00 0.15 C ATOM 677 C TRP A 115 2.249 2.285 5.667 1.00 0.16 C ATOM 678 O TRP A 115 2.282 1.983 6.863 1.00 0.18 O ATOM 679 CB TRP A 115 3.069 0.655 3.971 1.00 0.15 C ATOM 680 CG TRP A 115 2.808 -0.529 4.851 1.00 0.16 C ATOM 681 CD1 TRP A 115 3.726 -1.427 5.295 1.00 0.19 C ATOM 682 CD2 TRP A 115 1.548 -0.950 5.387 1.00 0.17 C ATOM 683 NE1 TRP A 115 3.120 -2.377 6.076 1.00 0.22 N ATOM 684 CE2 TRP A 115 1.784 -2.107 6.148 1.00 0.20 C ATOM 685 CE3 TRP A 115 0.246 -0.459 5.299 1.00 0.18 C ATOM 686 CZ2 TRP A 115 0.768 -2.781 6.814 1.00 0.23 C ATOM 687 CZ3 TRP A 115 -0.763 -1.129 5.961 1.00 0.20 C ATOM 688 CH2 TRP A 115 -0.497 -2.279 6.712 1.00 0.22 C ATOM 0 H TRP A 115 4.578 1.161 6.287 1.00 0.17 H new ATOM 0 HA TRP A 115 3.539 2.757 4.036 1.00 0.15 H new ATOM 0 HB2 TRP A 115 2.192 0.833 3.348 1.00 0.15 H new ATOM 0 HB3 TRP A 115 3.895 0.421 3.299 1.00 0.15 H new ATOM 0 HD1 TRP A 115 4.781 -1.397 5.066 1.00 0.19 H new ATOM 0 HE1 TRP A 115 3.591 -3.159 6.530 1.00 0.22 H new ATOM 0 HE3 TRP A 115 0.031 0.429 4.723 1.00 0.18 H new ATOM 0 HZ2 TRP A 115 0.972 -3.670 7.392 1.00 0.23 H new ATOM 0 HZ3 TRP A 115 -1.776 -0.759 5.898 1.00 0.20 H new ATOM 0 HH2 TRP A 115 -1.308 -2.779 7.221 1.00 0.22 H new ATOM 699 N GLU A 116 1.242 2.930 5.099 1.00 0.17 N ATOM 700 CA GLU A 116 0.000 3.209 5.802 1.00 0.20 C ATOM 701 C GLU A 116 -1.177 2.929 4.882 1.00 0.19 C ATOM 702 O GLU A 116 -1.106 3.182 3.679 1.00 0.25 O ATOM 703 CB GLU A 116 -0.075 4.670 6.237 1.00 0.32 C ATOM 704 CG GLU A 116 1.091 5.158 7.069 1.00 0.50 C ATOM 705 CD GLU A 116 0.961 6.631 7.376 1.00 0.64 C ATOM 706 OE1 GLU A 116 0.549 7.392 6.473 1.00 1.40 O ATOM 707 OE2 GLU A 116 1.259 7.037 8.514 1.00 1.22 O ATOM 0 H GLU A 116 1.263 3.274 4.139 1.00 0.17 H new ATOM 0 HA GLU A 116 -0.034 2.571 6.685 1.00 0.20 H new ATOM 0 HB2 GLU A 116 -0.151 5.294 5.346 1.00 0.32 H new ATOM 0 HB3 GLU A 116 -0.993 4.816 6.807 1.00 0.32 H new ATOM 0 HG2 GLU A 116 1.140 4.592 7.999 1.00 0.50 H new ATOM 0 HG3 GLU A 116 2.024 4.975 6.536 1.00 0.50 H new ATOM 714 N LEU A 117 -2.255 2.417 5.440 1.00 0.17 N ATOM 715 CA LEU A 117 -3.481 2.255 4.687 1.00 0.16 C ATOM 716 C LEU A 117 -4.357 3.468 4.911 1.00 0.15 C ATOM 717 O LEU A 117 -4.659 3.822 6.051 1.00 0.19 O ATOM 718 CB LEU A 117 -4.242 0.999 5.101 1.00 0.19 C ATOM 719 CG LEU A 117 -5.527 0.758 4.308 1.00 0.21 C ATOM 720 CD1 LEU A 117 -5.226 0.159 2.945 1.00 0.22 C ATOM 721 CD2 LEU A 117 -6.477 -0.127 5.086 1.00 0.25 C ATOM 0 H LEU A 117 -2.307 2.107 6.410 1.00 0.17 H new ATOM 0 HA LEU A 117 -3.222 2.154 3.633 1.00 0.16 H new ATOM 0 HB2 LEU A 117 -3.588 0.135 4.983 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -4.489 1.069 6.160 1.00 0.19 H new ATOM 0 HG LEU A 117 -6.009 1.722 4.149 1.00 0.21 H new ATOM 0 HD11 LEU A 117 -6.159 -0.001 2.404 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -4.591 0.841 2.380 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -4.712 -0.794 3.072 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -7.385 -0.286 4.504 1.00 0.25 H new ATOM 0 HD22 LEU A 117 -6.000 -1.087 5.284 1.00 0.25 H new ATOM 0 HD23 LEU A 117 -6.731 0.354 6.031 1.00 0.25 H new ATOM 733 N HIS A 118 -4.752 4.111 3.836 1.00 0.13 N ATOM 734 CA HIS A 118 -5.547 5.316 3.934 1.00 0.14 C ATOM 735 C HIS A 118 -6.938 5.082 3.389 1.00 0.18 C ATOM 736 O HIS A 118 -7.125 4.284 2.472 1.00 0.21 O ATOM 737 CB HIS A 118 -4.883 6.470 3.178 1.00 0.18 C ATOM 738 CG HIS A 118 -3.631 6.987 3.828 1.00 0.20 C ATOM 739 ND1 HIS A 118 -3.444 8.315 4.139 1.00 0.50 N ATOM 740 CD2 HIS A 118 -2.498 6.351 4.217 1.00 0.24 C ATOM 741 CE1 HIS A 118 -2.254 8.474 4.691 1.00 0.45 C ATOM 742 NE2 HIS A 118 -1.658 7.301 4.754 1.00 0.22 N ATOM 0 H HIS A 118 -4.536 3.820 2.882 1.00 0.13 H new ATOM 0 HA HIS A 118 -5.619 5.583 4.988 1.00 0.14 H new ATOM 0 HB2 HIS A 118 -4.645 6.139 2.167 1.00 0.18 H new ATOM 0 HB3 HIS A 118 -5.597 7.289 3.086 1.00 0.18 H new ATOM 0 HD2 HIS A 118 -2.293 5.295 4.123 1.00 0.24 H new ATOM 0 HE1 HIS A 118 -1.839 9.410 5.034 1.00 0.45 H new ATOM 0 HE2 HIS A 118 -0.729 7.126 5.137 1.00 0.22 H new ATOM 751 N LYS A 119 -7.906 5.756 3.976 1.00 0.22 N ATOM 752 CA LYS A 119 -9.255 5.759 3.448 1.00 0.29 C ATOM 753 C LYS A 119 -9.444 7.000 2.592 1.00 0.27 C ATOM 754 O LYS A 119 -9.546 8.115 3.107 1.00 0.43 O ATOM 755 CB LYS A 119 -10.289 5.730 4.571 1.00 0.43 C ATOM 756 CG LYS A 119 -11.714 5.619 4.062 1.00 0.70 C ATOM 757 CD LYS A 119 -12.718 5.675 5.195 1.00 0.84 C ATOM 758 CE LYS A 119 -14.139 5.623 4.668 1.00 1.04 C ATOM 759 NZ LYS A 119 -15.139 5.738 5.759 1.00 1.69 N ATOM 0 H LYS A 119 -7.783 6.311 4.823 1.00 0.22 H new ATOM 0 HA LYS A 119 -9.401 4.863 2.844 1.00 0.29 H new ATOM 0 HB2 LYS A 119 -10.078 4.888 5.230 1.00 0.43 H new ATOM 0 HB3 LYS A 119 -10.192 6.636 5.170 1.00 0.43 H new ATOM 0 HG2 LYS A 119 -11.913 6.427 3.358 1.00 0.70 H new ATOM 0 HG3 LYS A 119 -11.834 4.684 3.515 1.00 0.70 H new ATOM 0 HD2 LYS A 119 -12.549 4.841 5.877 1.00 0.84 H new ATOM 0 HD3 LYS A 119 -12.573 6.590 5.769 1.00 0.84 H new ATOM 0 HE2 LYS A 119 -14.290 6.430 3.951 1.00 1.04 H new ATOM 0 HE3 LYS A 119 -14.293 4.687 4.132 1.00 1.04 H new ATOM 0 HZ1 LYS A 119 -16.097 5.698 5.357 1.00 1.69 H new ATOM 0 HZ2 LYS A 119 -15.012 4.954 6.430 1.00 1.69 H new ATOM 0 HZ3 LYS A 119 -15.009 6.643 6.255 1.00 1.69 H new ATOM 773 N LEU A 120 -9.478 6.806 1.289 1.00 0.23 N ATOM 774 CA LEU A 120 -9.535 7.914 0.360 1.00 0.26 C ATOM 775 C LEU A 120 -10.979 8.220 0.007 1.00 0.34 C ATOM 776 O LEU A 120 -11.796 7.315 -0.157 1.00 0.37 O ATOM 777 CB LEU A 120 -8.718 7.609 -0.905 1.00 0.24 C ATOM 778 CG LEU A 120 -7.206 7.432 -0.692 1.00 0.20 C ATOM 779 CD1 LEU A 120 -6.657 8.518 0.217 1.00 0.25 C ATOM 780 CD2 LEU A 120 -6.884 6.056 -0.138 1.00 0.21 C ATOM 0 H LEU A 120 -9.467 5.886 0.849 1.00 0.23 H new ATOM 0 HA LEU A 120 -9.097 8.791 0.836 1.00 0.26 H new ATOM 0 HB2 LEU A 120 -9.112 6.700 -1.360 1.00 0.24 H new ATOM 0 HB3 LEU A 120 -8.874 8.417 -1.620 1.00 0.24 H new ATOM 0 HG LEU A 120 -6.722 7.522 -1.665 1.00 0.20 H new ATOM 0 HD11 LEU A 120 -5.585 8.372 0.353 1.00 0.25 H new ATOM 0 HD12 LEU A 120 -6.836 9.494 -0.234 1.00 0.25 H new ATOM 0 HD13 LEU A 120 -7.155 8.469 1.185 1.00 0.25 H new ATOM 0 HD21 LEU A 120 -5.807 5.963 0.001 1.00 0.21 H new ATOM 0 HD22 LEU A 120 -7.387 5.923 0.820 1.00 0.21 H new ATOM 0 HD23 LEU A 120 -7.227 5.293 -0.837 1.00 0.21 H new ATOM 792 N GLU A 121 -11.287 9.502 -0.099 1.00 0.46 N ATOM 793 CA GLU A 121 -12.654 9.949 -0.326 1.00 0.57 C ATOM 794 C GLU A 121 -13.044 9.829 -1.797 1.00 0.58 C ATOM 795 O GLU A 121 -14.194 10.067 -2.164 1.00 0.69 O ATOM 796 CB GLU A 121 -12.818 11.394 0.142 1.00 0.70 C ATOM 797 CG GLU A 121 -12.562 11.591 1.629 1.00 0.80 C ATOM 798 CD GLU A 121 -12.585 13.049 2.026 1.00 1.63 C ATOM 799 OE1 GLU A 121 -11.545 13.728 1.873 1.00 2.36 O ATOM 800 OE2 GLU A 121 -13.638 13.527 2.495 1.00 2.22 O ATOM 0 H GLU A 121 -10.605 10.257 -0.031 1.00 0.46 H new ATOM 0 HA GLU A 121 -13.317 9.304 0.251 1.00 0.57 H new ATOM 0 HB2 GLU A 121 -12.134 12.029 -0.422 1.00 0.70 H new ATOM 0 HB3 GLU A 121 -13.829 11.729 -0.091 1.00 0.70 H new ATOM 0 HG2 GLU A 121 -13.316 11.049 2.200 1.00 0.80 H new ATOM 0 HG3 GLU A 121 -11.595 11.161 1.889 1.00 0.80 H new ATOM 807 N ASN A 122 -12.082 9.469 -2.634 1.00 0.53 N ATOM 808 CA ASN A 122 -12.338 9.264 -4.051 1.00 0.60 C ATOM 809 C ASN A 122 -11.209 8.442 -4.655 1.00 0.62 C ATOM 810 O ASN A 122 -10.113 8.380 -4.097 1.00 1.22 O ATOM 811 CB ASN A 122 -12.472 10.607 -4.791 1.00 0.73 C ATOM 812 CG ASN A 122 -11.136 11.268 -5.066 1.00 1.03 C ATOM 813 OD1 ASN A 122 -10.522 11.034 -6.103 1.00 1.16 O ATOM 814 ND2 ASN A 122 -10.678 12.102 -4.149 1.00 1.87 N ATOM 0 H ASN A 122 -11.114 9.312 -2.354 1.00 0.53 H new ATOM 0 HA ASN A 122 -13.280 8.727 -4.160 1.00 0.60 H new ATOM 0 HB2 ASN A 122 -12.992 10.445 -5.735 1.00 0.73 H new ATOM 0 HB3 ASN A 122 -13.090 11.282 -4.199 1.00 0.73 H new ATOM 0 HD21 ASN A 122 -9.786 12.576 -4.291 1.00 1.87 H new ATOM 0 HD22 ASN A 122 -11.216 12.272 -3.299 1.00 1.87 H new ATOM 821 N ALA A 123 -11.485 7.799 -5.778 1.00 0.67 N ATOM 822 CA ALA A 123 -10.491 6.993 -6.468 1.00 0.66 C ATOM 823 C ALA A 123 -10.238 7.551 -7.863 1.00 0.71 C ATOM 824 O ALA A 123 -9.978 6.813 -8.814 1.00 0.90 O ATOM 825 CB ALA A 123 -10.952 5.546 -6.538 1.00 0.69 C ATOM 0 H ALA A 123 -12.397 7.820 -6.234 1.00 0.67 H new ATOM 0 HA ALA A 123 -9.554 7.029 -5.912 1.00 0.66 H new ATOM 0 HB1 ALA A 123 -10.201 4.950 -7.057 1.00 0.69 H new ATOM 0 HB2 ALA A 123 -11.089 5.159 -5.528 1.00 0.69 H new ATOM 0 HB3 ALA A 123 -11.896 5.491 -7.079 1.00 0.69 H new ATOM 831 N ARG A 124 -10.317 8.868 -7.964 1.00 0.72 N ATOM 832 CA ARG A 124 -10.192 9.560 -9.241 1.00 0.83 C ATOM 833 C ARG A 124 -8.982 10.488 -9.240 1.00 0.75 C ATOM 834 O ARG A 124 -8.177 10.485 -10.170 1.00 0.86 O ATOM 835 CB ARG A 124 -11.460 10.371 -9.514 1.00 1.08 C ATOM 836 CG ARG A 124 -12.708 9.522 -9.691 1.00 1.37 C ATOM 837 CD ARG A 124 -13.968 10.372 -9.684 1.00 1.63 C ATOM 838 NE ARG A 124 -13.932 11.426 -10.695 1.00 2.28 N ATOM 839 CZ ARG A 124 -15.004 12.096 -11.114 1.00 2.84 C ATOM 840 NH1 ARG A 124 -16.207 11.807 -10.630 1.00 2.76 N ATOM 841 NH2 ARG A 124 -14.870 13.058 -12.019 1.00 3.84 N ATOM 0 H ARG A 124 -10.469 9.487 -7.168 1.00 0.72 H new ATOM 0 HA ARG A 124 -10.056 8.815 -10.025 1.00 0.83 H new ATOM 0 HB2 ARG A 124 -11.619 11.066 -8.690 1.00 1.08 H new ATOM 0 HB3 ARG A 124 -11.310 10.970 -10.412 1.00 1.08 H new ATOM 0 HG2 ARG A 124 -12.645 8.972 -10.630 1.00 1.37 H new ATOM 0 HG3 ARG A 124 -12.762 8.783 -8.892 1.00 1.37 H new ATOM 0 HD2 ARG A 124 -14.835 9.734 -9.858 1.00 1.63 H new ATOM 0 HD3 ARG A 124 -14.095 10.821 -8.699 1.00 1.63 H new ATOM 0 HE ARG A 124 -13.029 11.664 -11.106 1.00 2.28 H new ATOM 0 HH11 ARG A 124 -16.313 11.069 -9.934 1.00 2.76 H new ATOM 0 HH12 ARG A 124 -17.025 12.323 -10.954 1.00 2.76 H new ATOM 0 HH21 ARG A 124 -13.948 13.283 -12.392 1.00 3.84 H new ATOM 0 HH22 ARG A 124 -15.690 13.573 -12.342 1.00 3.84 H new ATOM 855 N LYS A 125 -8.875 11.282 -8.189 1.00 0.75 N ATOM 856 CA LYS A 125 -7.796 12.242 -8.037 1.00 0.68 C ATOM 857 C LYS A 125 -6.589 11.576 -7.394 1.00 0.55 C ATOM 858 O LYS A 125 -6.712 10.489 -6.823 1.00 0.53 O ATOM 859 CB LYS A 125 -8.268 13.417 -7.168 1.00 0.79 C ATOM 860 CG LYS A 125 -9.415 14.217 -7.772 1.00 0.93 C ATOM 861 CD LYS A 125 -9.009 14.861 -9.087 1.00 1.64 C ATOM 862 CE LYS A 125 -10.121 15.726 -9.658 1.00 1.90 C ATOM 863 NZ LYS A 125 -9.694 16.425 -10.899 1.00 2.26 N ATOM 0 H LYS A 125 -9.537 11.279 -7.413 1.00 0.75 H new ATOM 0 HA LYS A 125 -7.510 12.614 -9.021 1.00 0.68 H new ATOM 0 HB2 LYS A 125 -8.579 13.034 -6.196 1.00 0.79 H new ATOM 0 HB3 LYS A 125 -7.426 14.086 -6.992 1.00 0.79 H new ATOM 0 HG2 LYS A 125 -10.271 13.562 -7.935 1.00 0.93 H new ATOM 0 HG3 LYS A 125 -9.732 14.988 -7.070 1.00 0.93 H new ATOM 0 HD2 LYS A 125 -8.117 15.469 -8.934 1.00 1.64 H new ATOM 0 HD3 LYS A 125 -8.746 14.085 -9.806 1.00 1.64 H new ATOM 0 HE2 LYS A 125 -10.991 15.105 -9.871 1.00 1.90 H new ATOM 0 HE3 LYS A 125 -10.428 16.461 -8.914 1.00 1.90 H new ATOM 0 HZ1 LYS A 125 -10.479 17.005 -11.258 1.00 2.26 H new ATOM 0 HZ2 LYS A 125 -8.879 17.037 -10.690 1.00 2.26 H new ATOM 0 HZ3 LYS A 125 -9.425 15.723 -11.618 1.00 2.26 H new ATOM 877 N PRO A 126 -5.398 12.193 -7.509 1.00 0.51 N ATOM 878 CA PRO A 126 -4.206 11.735 -6.798 1.00 0.45 C ATOM 879 C PRO A 126 -4.500 11.560 -5.314 1.00 0.39 C ATOM 880 O PRO A 126 -4.965 12.492 -4.652 1.00 0.47 O ATOM 881 CB PRO A 126 -3.184 12.861 -7.013 1.00 0.51 C ATOM 882 CG PRO A 126 -3.952 13.995 -7.609 1.00 0.59 C ATOM 883 CD PRO A 126 -5.110 13.374 -8.333 1.00 0.60 C ATOM 0 HA PRO A 126 -3.850 10.770 -7.159 1.00 0.45 H new ATOM 0 HB2 PRO A 126 -2.720 13.154 -6.071 1.00 0.51 H new ATOM 0 HB3 PRO A 126 -2.381 12.540 -7.677 1.00 0.51 H new ATOM 0 HG2 PRO A 126 -4.298 14.681 -6.836 1.00 0.59 H new ATOM 0 HG3 PRO A 126 -3.329 14.572 -8.292 1.00 0.59 H new ATOM 0 HD2 PRO A 126 -5.964 14.049 -8.389 1.00 0.60 H new ATOM 0 HD3 PRO A 126 -4.851 13.102 -9.356 1.00 0.60 H new ATOM 891 N LEU A 127 -4.245 10.365 -4.805 1.00 0.32 N ATOM 892 CA LEU A 127 -4.614 10.018 -3.440 1.00 0.26 C ATOM 893 C LEU A 127 -3.846 10.856 -2.430 1.00 0.29 C ATOM 894 O LEU A 127 -2.740 11.327 -2.705 1.00 0.37 O ATOM 895 CB LEU A 127 -4.390 8.530 -3.195 1.00 0.24 C ATOM 896 CG LEU A 127 -5.080 7.599 -4.199 1.00 0.26 C ATOM 897 CD1 LEU A 127 -4.937 6.156 -3.764 1.00 0.26 C ATOM 898 CD2 LEU A 127 -6.550 7.969 -4.373 1.00 0.27 C ATOM 0 H LEU A 127 -3.782 9.615 -5.319 1.00 0.32 H new ATOM 0 HA LEU A 127 -5.674 10.236 -3.308 1.00 0.26 H new ATOM 0 HB2 LEU A 127 -3.319 8.331 -3.214 1.00 0.24 H new ATOM 0 HB3 LEU A 127 -4.742 8.285 -2.193 1.00 0.24 H new ATOM 0 HG LEU A 127 -4.591 7.720 -5.166 1.00 0.26 H new ATOM 0 HD11 LEU A 127 -5.432 5.507 -4.487 1.00 0.26 H new ATOM 0 HD12 LEU A 127 -3.880 5.896 -3.707 1.00 0.26 H new ATOM 0 HD13 LEU A 127 -5.396 6.024 -2.784 1.00 0.26 H new ATOM 0 HD21 LEU A 127 -7.013 7.292 -5.091 1.00 0.27 H new ATOM 0 HD22 LEU A 127 -7.062 7.887 -3.414 1.00 0.27 H new ATOM 0 HD23 LEU A 127 -6.627 8.993 -4.739 1.00 0.27 H new ATOM 910 N LYS A 128 -4.443 11.033 -1.259 1.00 0.29 N ATOM 911 CA LYS A 128 -3.959 12.005 -0.290 1.00 0.36 C ATOM 912 C LYS A 128 -3.928 11.446 1.130 1.00 0.26 C ATOM 913 O LYS A 128 -4.571 10.445 1.449 1.00 0.23 O ATOM 914 CB LYS A 128 -4.868 13.231 -0.327 1.00 0.51 C ATOM 915 CG LYS A 128 -4.998 13.839 -1.710 1.00 1.10 C ATOM 916 CD LYS A 128 -6.077 14.901 -1.756 1.00 1.37 C ATOM 917 CE LYS A 128 -6.221 15.475 -3.154 1.00 1.80 C ATOM 918 NZ LYS A 128 -7.212 16.579 -3.201 1.00 2.27 N ATOM 0 H LYS A 128 -5.267 10.513 -0.957 1.00 0.29 H new ATOM 0 HA LYS A 128 -2.936 12.265 -0.561 1.00 0.36 H new ATOM 0 HB2 LYS A 128 -5.858 12.952 0.034 1.00 0.51 H new ATOM 0 HB3 LYS A 128 -4.479 13.984 0.358 1.00 0.51 H new ATOM 0 HG2 LYS A 128 -4.044 14.276 -2.006 1.00 1.10 H new ATOM 0 HG3 LYS A 128 -5.228 13.055 -2.432 1.00 1.10 H new ATOM 0 HD2 LYS A 128 -7.027 14.473 -1.436 1.00 1.37 H new ATOM 0 HD3 LYS A 128 -5.835 15.700 -1.055 1.00 1.37 H new ATOM 0 HE2 LYS A 128 -5.253 15.841 -3.497 1.00 1.80 H new ATOM 0 HE3 LYS A 128 -6.525 14.685 -3.841 1.00 1.80 H new ATOM 0 HZ1 LYS A 128 -7.280 16.943 -4.173 1.00 2.27 H new ATOM 0 HZ2 LYS A 128 -8.141 16.224 -2.898 1.00 2.27 H new ATOM 0 HZ3 LYS A 128 -6.910 17.344 -2.565 1.00 2.27 H new ATOM 932 N ASP A 129 -3.155 12.115 1.964 1.00 0.32 N ATOM 933 CA ASP A 129 -3.071 11.827 3.391 1.00 0.39 C ATOM 934 C ASP A 129 -4.252 12.431 4.143 1.00 0.45 C ATOM 935 O ASP A 129 -5.000 13.241 3.594 1.00 0.51 O ATOM 936 CB ASP A 129 -1.768 12.375 3.972 1.00 0.59 C ATOM 937 CG ASP A 129 -0.565 11.530 3.620 1.00 1.00 C ATOM 938 OD1 ASP A 129 -0.061 11.640 2.485 1.00 1.56 O ATOM 939 OD2 ASP A 129 -0.104 10.758 4.488 1.00 1.88 O ATOM 0 H ASP A 129 -2.557 12.887 1.669 1.00 0.32 H new ATOM 0 HA ASP A 129 -3.094 10.744 3.511 1.00 0.39 H new ATOM 0 HB2 ASP A 129 -1.612 13.390 3.607 1.00 0.59 H new ATOM 0 HB3 ASP A 129 -1.857 12.437 5.057 1.00 0.59 H new ATOM 944 N GLY A 130 -4.418 12.027 5.396 1.00 0.51 N ATOM 945 CA GLY A 130 -5.458 12.603 6.230 1.00 0.62 C ATOM 946 C GLY A 130 -6.358 11.568 6.876 1.00 0.60 C ATOM 947 O GLY A 130 -6.865 11.791 7.976 1.00 0.75 O ATOM 0 H GLY A 130 -3.852 11.311 5.851 1.00 0.51 H new ATOM 0 HA2 GLY A 130 -4.994 13.207 7.010 1.00 0.62 H new ATOM 0 HA3 GLY A 130 -6.067 13.275 5.625 1.00 0.62 H new ATOM 951 N ASN A 131 -6.572 10.444 6.213 1.00 0.47 N ATOM 952 CA ASN A 131 -7.293 9.330 6.822 1.00 0.46 C ATOM 953 C ASN A 131 -6.429 8.081 6.817 1.00 0.40 C ATOM 954 O ASN A 131 -6.204 7.486 5.768 1.00 0.46 O ATOM 955 CB ASN A 131 -8.607 9.034 6.089 1.00 0.51 C ATOM 956 CG ASN A 131 -9.768 9.924 6.507 1.00 1.32 C ATOM 957 OD1 ASN A 131 -10.916 9.480 6.527 1.00 2.28 O ATOM 958 ND2 ASN A 131 -9.494 11.176 6.828 1.00 1.45 N ATOM 0 H ASN A 131 -6.260 10.275 5.257 1.00 0.47 H new ATOM 0 HA ASN A 131 -7.528 9.618 7.847 1.00 0.46 H new ATOM 0 HB2 ASN A 131 -8.445 9.146 5.017 1.00 0.51 H new ATOM 0 HB3 ASN A 131 -8.881 7.993 6.263 1.00 0.51 H new ATOM 0 HD21 ASN A 131 -10.246 11.808 7.103 1.00 1.45 H new ATOM 0 HD22 ASN A 131 -8.531 11.510 6.800 1.00 1.45 H new ATOM 965 N VAL A 132 -5.938 7.688 7.984 1.00 0.36 N ATOM 966 CA VAL A 132 -5.124 6.485 8.100 1.00 0.31 C ATOM 967 C VAL A 132 -5.835 5.440 8.956 1.00 0.28 C ATOM 968 O VAL A 132 -6.454 5.760 9.975 1.00 0.35 O ATOM 969 CB VAL A 132 -3.719 6.783 8.678 1.00 0.35 C ATOM 970 CG1 VAL A 132 -3.814 7.416 10.053 1.00 0.73 C ATOM 971 CG2 VAL A 132 -2.874 5.517 8.731 1.00 0.71 C ATOM 0 H VAL A 132 -6.088 8.183 8.863 1.00 0.36 H new ATOM 0 HA VAL A 132 -4.986 6.092 7.093 1.00 0.31 H new ATOM 0 HB VAL A 132 -3.232 7.495 8.011 1.00 0.35 H new ATOM 0 HG11 VAL A 132 -2.812 7.613 10.433 1.00 0.73 H new ATOM 0 HG12 VAL A 132 -4.367 8.353 9.985 1.00 0.73 H new ATOM 0 HG13 VAL A 132 -4.332 6.737 10.731 1.00 0.73 H new ATOM 0 HG21 VAL A 132 -1.892 5.752 9.141 1.00 0.71 H new ATOM 0 HG22 VAL A 132 -3.364 4.779 9.365 1.00 0.71 H new ATOM 0 HG23 VAL A 132 -2.760 5.113 7.725 1.00 0.71 H new ATOM 981 N ILE A 133 -5.767 4.198 8.512 1.00 0.23 N ATOM 982 CA ILE A 133 -6.447 3.102 9.177 1.00 0.26 C ATOM 983 C ILE A 133 -5.436 2.104 9.731 1.00 0.28 C ATOM 984 O ILE A 133 -5.449 1.772 10.915 1.00 0.38 O ATOM 985 CB ILE A 133 -7.383 2.371 8.192 1.00 0.31 C ATOM 986 CG1 ILE A 133 -8.261 3.373 7.431 1.00 0.34 C ATOM 987 CG2 ILE A 133 -8.244 1.350 8.923 1.00 0.38 C ATOM 988 CD1 ILE A 133 -9.212 4.162 8.308 1.00 0.35 C ATOM 0 H ILE A 133 -5.241 3.922 7.683 1.00 0.23 H new ATOM 0 HA ILE A 133 -7.033 3.519 9.996 1.00 0.26 H new ATOM 0 HB ILE A 133 -6.765 1.840 7.468 1.00 0.31 H new ATOM 0 HG12 ILE A 133 -7.616 4.070 6.896 1.00 0.34 H new ATOM 0 HG13 ILE A 133 -8.840 2.834 6.681 1.00 0.34 H new ATOM 0 HG21 ILE A 133 -8.896 0.846 8.209 1.00 0.38 H new ATOM 0 HG22 ILE A 133 -7.603 0.615 9.410 1.00 0.38 H new ATOM 0 HG23 ILE A 133 -8.850 1.856 9.674 1.00 0.38 H new ATOM 0 HD11 ILE A 133 -9.794 4.846 7.690 1.00 0.35 H new ATOM 0 HD12 ILE A 133 -9.885 3.477 8.823 1.00 0.35 H new ATOM 0 HD13 ILE A 133 -8.642 4.732 9.042 1.00 0.35 H new ATOM 1000 N GLU A 134 -4.545 1.656 8.858 1.00 0.25 N ATOM 1001 CA GLU A 134 -3.557 0.642 9.196 1.00 0.30 C ATOM 1002 C GLU A 134 -2.176 1.168 8.835 1.00 0.23 C ATOM 1003 O GLU A 134 -2.065 2.135 8.083 1.00 0.21 O ATOM 1004 CB GLU A 134 -3.830 -0.654 8.419 1.00 0.43 C ATOM 1005 CG GLU A 134 -5.251 -1.188 8.550 1.00 0.63 C ATOM 1006 CD GLU A 134 -5.515 -1.879 9.873 1.00 0.74 C ATOM 1007 OE1 GLU A 134 -5.986 -1.213 10.814 1.00 1.50 O ATOM 1008 OE2 GLU A 134 -5.270 -3.097 9.970 1.00 1.42 O ATOM 0 H GLU A 134 -4.487 1.986 7.895 1.00 0.25 H new ATOM 0 HA GLU A 134 -3.613 0.425 10.263 1.00 0.30 H new ATOM 0 HB2 GLU A 134 -3.617 -0.481 7.364 1.00 0.43 H new ATOM 0 HB3 GLU A 134 -3.135 -1.421 8.762 1.00 0.43 H new ATOM 0 HG2 GLU A 134 -5.953 -0.363 8.433 1.00 0.63 H new ATOM 0 HG3 GLU A 134 -5.444 -1.889 7.738 1.00 0.63 H new ATOM 1015 N LYS A 135 -1.131 0.543 9.359 1.00 0.28 N ATOM 1016 CA LYS A 135 0.238 0.960 9.062 1.00 0.25 C ATOM 1017 C LYS A 135 1.248 -0.051 9.587 1.00 0.27 C ATOM 1018 O LYS A 135 0.971 -0.783 10.536 1.00 0.34 O ATOM 1019 CB LYS A 135 0.521 2.344 9.660 1.00 0.32 C ATOM 1020 CG LYS A 135 0.094 2.479 11.110 1.00 0.56 C ATOM 1021 CD LYS A 135 0.384 3.867 11.650 1.00 0.62 C ATOM 1022 CE LYS A 135 -0.086 4.012 13.088 1.00 0.74 C ATOM 1023 NZ LYS A 135 0.555 3.021 13.996 1.00 1.53 N ATOM 0 H LYS A 135 -1.202 -0.254 9.992 1.00 0.28 H new ATOM 0 HA LYS A 135 0.341 1.014 7.978 1.00 0.25 H new ATOM 0 HB2 LYS A 135 1.588 2.552 9.584 1.00 0.32 H new ATOM 0 HB3 LYS A 135 0.006 3.099 9.067 1.00 0.32 H new ATOM 0 HG2 LYS A 135 -0.972 2.269 11.197 1.00 0.56 H new ATOM 0 HG3 LYS A 135 0.615 1.736 11.714 1.00 0.56 H new ATOM 0 HD2 LYS A 135 1.454 4.065 11.594 1.00 0.62 H new ATOM 0 HD3 LYS A 135 -0.111 4.612 11.027 1.00 0.62 H new ATOM 0 HE2 LYS A 135 0.135 5.020 13.440 1.00 0.74 H new ATOM 0 HE3 LYS A 135 -1.168 3.891 13.128 1.00 0.74 H new ATOM 0 HZ1 LYS A 135 0.366 3.283 14.985 1.00 1.53 H new ATOM 0 HZ2 LYS A 135 0.166 2.075 13.808 1.00 1.53 H new ATOM 0 HZ3 LYS A 135 1.582 3.012 13.831 1.00 1.53 H new ATOM 1037 N GLY A 136 2.411 -0.094 8.956 1.00 0.30 N ATOM 1038 CA GLY A 136 3.456 -1.000 9.384 1.00 0.38 C ATOM 1039 C GLY A 136 4.651 -0.966 8.461 1.00 0.34 C ATOM 1040 O GLY A 136 4.964 0.076 7.879 1.00 0.29 O ATOM 0 H GLY A 136 2.651 0.485 8.151 1.00 0.30 H new ATOM 0 HA2 GLY A 136 3.771 -0.738 10.394 1.00 0.38 H new ATOM 0 HA3 GLY A 136 3.060 -2.015 9.427 1.00 0.38 H new ATOM 1044 N PHE A 137 5.304 -2.108 8.305 1.00 0.38 N ATOM 1045 CA PHE A 137 6.486 -2.210 7.462 1.00 0.32 C ATOM 1046 C PHE A 137 6.290 -3.281 6.389 1.00 0.33 C ATOM 1047 O PHE A 137 5.493 -4.207 6.556 1.00 0.46 O ATOM 1048 CB PHE A 137 7.720 -2.534 8.306 1.00 0.42 C ATOM 1049 CG PHE A 137 8.053 -1.481 9.332 1.00 1.07 C ATOM 1050 CD1 PHE A 137 8.746 -0.333 8.972 1.00 2.05 C ATOM 1051 CD2 PHE A 137 7.679 -1.643 10.657 1.00 1.81 C ATOM 1052 CE1 PHE A 137 9.056 0.630 9.914 1.00 2.86 C ATOM 1053 CE2 PHE A 137 7.986 -0.683 11.601 1.00 2.60 C ATOM 1054 CZ PHE A 137 8.675 0.454 11.230 1.00 2.93 C ATOM 0 H PHE A 137 5.033 -2.983 8.755 1.00 0.38 H new ATOM 0 HA PHE A 137 6.639 -1.248 6.972 1.00 0.32 H new ATOM 0 HB2 PHE A 137 7.561 -3.485 8.814 1.00 0.42 H new ATOM 0 HB3 PHE A 137 8.576 -2.666 7.644 1.00 0.42 H new ATOM 0 HD1 PHE A 137 9.046 -0.191 7.944 1.00 2.05 H new ATOM 0 HD2 PHE A 137 7.141 -2.531 10.955 1.00 1.81 H new ATOM 0 HE1 PHE A 137 9.595 1.519 9.621 1.00 2.86 H new ATOM 0 HE2 PHE A 137 7.687 -0.822 12.629 1.00 2.60 H new ATOM 0 HZ PHE A 137 8.916 1.205 11.968 1.00 2.93 H new ATOM 1064 N VAL A 138 7.020 -3.135 5.290 1.00 0.27 N ATOM 1065 CA VAL A 138 6.882 -4.012 4.126 1.00 0.41 C ATOM 1066 C VAL A 138 7.722 -5.289 4.265 1.00 0.70 C ATOM 1067 O VAL A 138 7.700 -6.155 3.392 1.00 1.41 O ATOM 1068 CB VAL A 138 7.252 -3.262 2.816 1.00 0.53 C ATOM 1069 CG1 VAL A 138 6.981 -4.115 1.588 1.00 0.76 C ATOM 1070 CG2 VAL A 138 6.486 -1.953 2.709 1.00 0.48 C ATOM 0 H VAL A 138 7.725 -2.407 5.177 1.00 0.27 H new ATOM 0 HA VAL A 138 5.835 -4.309 4.075 1.00 0.41 H new ATOM 0 HB VAL A 138 8.320 -3.050 2.857 1.00 0.53 H new ATOM 0 HG11 VAL A 138 7.252 -3.558 0.691 1.00 0.76 H new ATOM 0 HG12 VAL A 138 7.574 -5.028 1.641 1.00 0.76 H new ATOM 0 HG13 VAL A 138 5.922 -4.372 1.550 1.00 0.76 H new ATOM 0 HG21 VAL A 138 6.761 -1.445 1.785 1.00 0.48 H new ATOM 0 HG22 VAL A 138 5.415 -2.157 2.706 1.00 0.48 H new ATOM 0 HG23 VAL A 138 6.732 -1.317 3.559 1.00 0.48 H new ATOM 1080 N SER A 139 8.466 -5.400 5.357 1.00 0.32 N ATOM 1081 CA SER A 139 9.358 -6.538 5.581 1.00 0.51 C ATOM 1082 C SER A 139 8.592 -7.863 5.774 1.00 0.39 C ATOM 1083 O SER A 139 8.529 -8.412 6.876 1.00 1.13 O ATOM 1084 CB SER A 139 10.245 -6.245 6.791 1.00 1.03 C ATOM 1085 OG SER A 139 9.501 -5.598 7.812 1.00 1.68 O ATOM 0 H SER A 139 8.471 -4.711 6.110 1.00 0.32 H new ATOM 0 HA SER A 139 9.972 -6.667 4.690 1.00 0.51 H new ATOM 0 HB2 SER A 139 10.665 -7.175 7.174 1.00 1.03 H new ATOM 0 HB3 SER A 139 11.083 -5.616 6.490 1.00 1.03 H new ATOM 0 HG SER A 139 9.765 -5.955 8.686 1.00 1.68 H new ATOM 1091 N ASN A 140 8.008 -8.359 4.690 1.00 0.51 N ATOM 1092 CA ASN A 140 7.351 -9.659 4.670 1.00 0.34 C ATOM 1093 C ASN A 140 7.650 -10.349 3.346 1.00 0.27 C ATOM 1094 O ASN A 140 7.063 -10.022 2.312 1.00 0.37 O ATOM 1095 CB ASN A 140 5.838 -9.507 4.860 1.00 0.37 C ATOM 1096 CG ASN A 140 5.092 -10.834 4.835 1.00 0.38 C ATOM 1097 OD1 ASN A 140 3.945 -10.903 4.392 1.00 0.94 O ATOM 1098 ND2 ASN A 140 5.715 -11.890 5.332 1.00 0.88 N ATOM 0 H ASN A 140 7.977 -7.868 3.796 1.00 0.51 H new ATOM 0 HA ASN A 140 7.733 -10.264 5.492 1.00 0.34 H new ATOM 0 HB2 ASN A 140 5.646 -9.008 5.810 1.00 0.37 H new ATOM 0 HB3 ASN A 140 5.443 -8.861 4.076 1.00 0.37 H new ATOM 0 HD21 ASN A 140 5.245 -12.795 5.356 1.00 0.88 H new ATOM 0 HD22 ASN A 140 6.665 -11.799 5.691 1.00 0.88 H new ATOM 1105 N GLN A 141 8.578 -11.288 3.385 1.00 0.35 N ATOM 1106 CA GLN A 141 9.059 -11.952 2.185 1.00 0.32 C ATOM 1107 C GLN A 141 8.116 -13.077 1.770 1.00 0.30 C ATOM 1108 O GLN A 141 8.144 -14.162 2.348 1.00 0.36 O ATOM 1109 CB GLN A 141 10.450 -12.532 2.439 1.00 0.39 C ATOM 1110 CG GLN A 141 11.249 -12.800 1.177 1.00 0.39 C ATOM 1111 CD GLN A 141 11.900 -11.544 0.641 1.00 0.52 C ATOM 1112 OE1 GLN A 141 13.027 -11.218 1.007 1.00 0.69 O ATOM 1113 NE2 GLN A 141 11.203 -10.827 -0.224 1.00 0.63 N ATOM 0 H GLN A 141 9.019 -11.612 4.246 1.00 0.35 H new ATOM 0 HA GLN A 141 9.102 -11.216 1.382 1.00 0.32 H new ATOM 0 HB2 GLN A 141 11.010 -11.842 3.071 1.00 0.39 H new ATOM 0 HB3 GLN A 141 10.348 -13.463 2.996 1.00 0.39 H new ATOM 0 HG2 GLN A 141 12.016 -13.546 1.385 1.00 0.39 H new ATOM 0 HG3 GLN A 141 10.593 -13.222 0.415 1.00 0.39 H new ATOM 0 HE21 GLN A 141 10.270 -11.131 -0.504 1.00 0.63 H new ATOM 0 HE22 GLN A 141 11.598 -9.970 -0.612 1.00 0.63 H new ATOM 1122 N ILE A 142 7.274 -12.818 0.781 1.00 0.25 N ATOM 1123 CA ILE A 142 6.416 -13.865 0.234 1.00 0.27 C ATOM 1124 C ILE A 142 7.103 -14.551 -0.940 1.00 0.30 C ATOM 1125 O ILE A 142 6.734 -15.658 -1.341 1.00 0.37 O ATOM 1126 CB ILE A 142 5.035 -13.330 -0.204 1.00 0.27 C ATOM 1127 CG1 ILE A 142 5.172 -12.231 -1.263 1.00 0.24 C ATOM 1128 CG2 ILE A 142 4.277 -12.812 1.009 1.00 0.29 C ATOM 1129 CD1 ILE A 142 3.865 -11.880 -1.943 1.00 0.26 C ATOM 0 H ILE A 142 7.165 -11.903 0.343 1.00 0.25 H new ATOM 0 HA ILE A 142 6.246 -14.586 1.033 1.00 0.27 H new ATOM 0 HB ILE A 142 4.475 -14.150 -0.654 1.00 0.27 H new ATOM 0 HG12 ILE A 142 5.581 -11.335 -0.795 1.00 0.24 H new ATOM 0 HG13 ILE A 142 5.890 -12.552 -2.018 1.00 0.24 H new ATOM 0 HG21 ILE A 142 3.303 -12.435 0.696 1.00 0.29 H new ATOM 0 HG22 ILE A 142 4.140 -13.622 1.725 1.00 0.29 H new ATOM 0 HG23 ILE A 142 4.844 -12.007 1.476 1.00 0.29 H new ATOM 0 HD11 ILE A 142 4.037 -11.096 -2.680 1.00 0.26 H new ATOM 0 HD12 ILE A 142 3.465 -12.764 -2.440 1.00 0.26 H new ATOM 0 HD13 ILE A 142 3.151 -11.528 -1.199 1.00 0.26 H new ATOM 1141 N GLY A 143 8.107 -13.880 -1.475 1.00 0.28 N ATOM 1142 CA GLY A 143 8.930 -14.440 -2.523 1.00 0.34 C ATOM 1143 C GLY A 143 10.288 -13.791 -2.486 1.00 0.40 C ATOM 1144 O GLY A 143 10.417 -12.722 -1.904 1.00 0.53 O ATOM 0 H GLY A 143 8.371 -12.936 -1.194 1.00 0.28 H new ATOM 0 HA2 GLY A 143 9.025 -15.518 -2.390 1.00 0.34 H new ATOM 0 HA3 GLY A 143 8.463 -14.278 -3.494 1.00 0.34 H new ATOM 1148 N ASP A 144 11.288 -14.408 -3.102 1.00 0.48 N ATOM 1149 CA ASP A 144 12.672 -13.931 -3.000 1.00 0.56 C ATOM 1150 C ASP A 144 12.792 -12.446 -3.333 1.00 0.48 C ATOM 1151 O ASP A 144 13.485 -11.699 -2.643 1.00 0.56 O ATOM 1152 CB ASP A 144 13.589 -14.741 -3.918 1.00 0.70 C ATOM 1153 CG ASP A 144 15.036 -14.293 -3.828 1.00 1.63 C ATOM 1154 OD1 ASP A 144 15.474 -13.493 -4.679 1.00 2.49 O ATOM 1155 OD2 ASP A 144 15.747 -14.747 -2.907 1.00 2.30 O ATOM 0 H ASP A 144 11.172 -15.241 -3.679 1.00 0.48 H new ATOM 0 HA ASP A 144 12.981 -14.069 -1.964 1.00 0.56 H new ATOM 0 HB2 ASP A 144 13.521 -15.797 -3.656 1.00 0.70 H new ATOM 0 HB3 ASP A 144 13.245 -14.645 -4.948 1.00 0.70 H new ATOM 1160 N SER A 145 12.109 -12.018 -4.378 1.00 0.38 N ATOM 1161 CA SER A 145 12.149 -10.624 -4.784 1.00 0.35 C ATOM 1162 C SER A 145 10.782 -9.974 -4.617 1.00 0.31 C ATOM 1163 O SER A 145 10.470 -8.983 -5.277 1.00 0.36 O ATOM 1164 CB SER A 145 12.616 -10.524 -6.238 1.00 0.38 C ATOM 1165 OG SER A 145 11.938 -11.467 -7.056 1.00 1.08 O ATOM 0 H SER A 145 11.521 -12.613 -4.961 1.00 0.38 H new ATOM 0 HA SER A 145 12.855 -10.092 -4.146 1.00 0.35 H new ATOM 0 HB2 SER A 145 12.436 -9.516 -6.613 1.00 0.38 H new ATOM 0 HB3 SER A 145 13.691 -10.697 -6.291 1.00 0.38 H new ATOM 0 HG SER A 145 12.252 -11.383 -7.981 1.00 1.08 H new ATOM 1171 N LEU A 146 9.975 -10.517 -3.714 1.00 0.27 N ATOM 1172 CA LEU A 146 8.602 -10.075 -3.576 1.00 0.22 C ATOM 1173 C LEU A 146 8.234 -9.884 -2.107 1.00 0.21 C ATOM 1174 O LEU A 146 8.404 -10.791 -1.285 1.00 0.23 O ATOM 1175 CB LEU A 146 7.673 -11.099 -4.225 1.00 0.23 C ATOM 1176 CG LEU A 146 6.348 -10.548 -4.730 1.00 0.23 C ATOM 1177 CD1 LEU A 146 6.576 -9.599 -5.894 1.00 0.26 C ATOM 1178 CD2 LEU A 146 5.425 -11.681 -5.139 1.00 0.27 C ATOM 0 H LEU A 146 10.250 -11.260 -3.072 1.00 0.27 H new ATOM 0 HA LEU A 146 8.491 -9.113 -4.076 1.00 0.22 H new ATOM 0 HB2 LEU A 146 8.197 -11.562 -5.061 1.00 0.23 H new ATOM 0 HB3 LEU A 146 7.467 -11.888 -3.502 1.00 0.23 H new ATOM 0 HG LEU A 146 5.874 -9.992 -3.921 1.00 0.23 H new ATOM 0 HD11 LEU A 146 5.618 -9.214 -6.243 1.00 0.26 H new ATOM 0 HD12 LEU A 146 7.204 -8.769 -5.569 1.00 0.26 H new ATOM 0 HD13 LEU A 146 7.070 -10.132 -6.706 1.00 0.26 H new ATOM 0 HD21 LEU A 146 4.481 -11.270 -5.498 1.00 0.27 H new ATOM 0 HD22 LEU A 146 5.893 -12.263 -5.933 1.00 0.27 H new ATOM 0 HD23 LEU A 146 5.237 -12.325 -4.280 1.00 0.27 H new ATOM 1190 N TYR A 147 7.737 -8.702 -1.782 1.00 0.18 N ATOM 1191 CA TYR A 147 7.327 -8.382 -0.424 1.00 0.18 C ATOM 1192 C TYR A 147 5.833 -8.089 -0.388 1.00 0.16 C ATOM 1193 O TYR A 147 5.269 -7.616 -1.370 1.00 0.19 O ATOM 1194 CB TYR A 147 8.107 -7.178 0.107 1.00 0.19 C ATOM 1195 CG TYR A 147 9.556 -7.467 0.440 1.00 0.23 C ATOM 1196 CD1 TYR A 147 9.946 -7.742 1.746 1.00 1.21 C ATOM 1197 CD2 TYR A 147 10.537 -7.458 -0.545 1.00 1.10 C ATOM 1198 CE1 TYR A 147 11.266 -8.001 2.059 1.00 1.24 C ATOM 1199 CE2 TYR A 147 11.860 -7.717 -0.239 1.00 1.10 C ATOM 1200 CZ TYR A 147 12.219 -7.987 1.065 1.00 0.36 C ATOM 1201 OH TYR A 147 13.534 -8.253 1.373 1.00 0.43 O ATOM 0 H TYR A 147 7.607 -7.941 -2.448 1.00 0.18 H new ATOM 0 HA TYR A 147 7.541 -9.241 0.213 1.00 0.18 H new ATOM 0 HB2 TYR A 147 8.070 -6.381 -0.635 1.00 0.19 H new ATOM 0 HB3 TYR A 147 7.609 -6.804 1.002 1.00 0.19 H new ATOM 0 HD1 TYR A 147 9.203 -7.753 2.530 1.00 1.21 H new ATOM 0 HD2 TYR A 147 10.261 -7.245 -1.567 1.00 1.10 H new ATOM 0 HE1 TYR A 147 11.550 -8.214 3.079 1.00 1.24 H new ATOM 0 HE2 TYR A 147 12.609 -7.708 -1.017 1.00 1.10 H new ATOM 0 HH TYR A 147 13.686 -9.221 1.351 1.00 0.43 H new ATOM 1211 N LYS A 148 5.197 -8.367 0.737 1.00 0.17 N ATOM 1212 CA LYS A 148 3.755 -8.188 0.857 1.00 0.18 C ATOM 1213 C LYS A 148 3.385 -7.472 2.150 1.00 0.19 C ATOM 1214 O LYS A 148 4.005 -7.682 3.191 1.00 0.28 O ATOM 1215 CB LYS A 148 3.057 -9.547 0.801 1.00 0.26 C ATOM 1216 CG LYS A 148 1.543 -9.485 0.951 1.00 0.34 C ATOM 1217 CD LYS A 148 0.931 -10.874 0.927 1.00 0.50 C ATOM 1218 CE LYS A 148 -0.550 -10.848 1.281 1.00 0.62 C ATOM 1219 NZ LYS A 148 -1.134 -12.213 1.327 1.00 0.84 N ATOM 0 H LYS A 148 5.652 -8.717 1.580 1.00 0.17 H new ATOM 0 HA LYS A 148 3.424 -7.569 0.023 1.00 0.18 H new ATOM 0 HB2 LYS A 148 3.296 -10.025 -0.149 1.00 0.26 H new ATOM 0 HB3 LYS A 148 3.462 -10.182 1.589 1.00 0.26 H new ATOM 0 HG2 LYS A 148 1.288 -8.989 1.887 1.00 0.34 H new ATOM 0 HG3 LYS A 148 1.120 -8.884 0.146 1.00 0.34 H new ATOM 0 HD2 LYS A 148 1.060 -11.310 -0.063 1.00 0.50 H new ATOM 0 HD3 LYS A 148 1.461 -11.517 1.630 1.00 0.50 H new ATOM 0 HE2 LYS A 148 -0.683 -10.364 2.248 1.00 0.62 H new ATOM 0 HE3 LYS A 148 -1.088 -10.248 0.547 1.00 0.62 H new ATOM 0 HZ1 LYS A 148 -2.143 -12.151 1.571 1.00 0.84 H new ATOM 0 HZ2 LYS A 148 -1.030 -12.667 0.397 1.00 0.84 H new ATOM 0 HZ3 LYS A 148 -0.638 -12.779 2.045 1.00 0.84 H new ATOM 1233 N ILE A 149 2.372 -6.626 2.069 1.00 0.15 N ATOM 1234 CA ILE A 149 1.834 -5.942 3.231 1.00 0.18 C ATOM 1235 C ILE A 149 0.330 -6.146 3.300 1.00 0.22 C ATOM 1236 O ILE A 149 -0.339 -6.148 2.269 1.00 0.35 O ATOM 1237 CB ILE A 149 2.156 -4.436 3.201 1.00 0.18 C ATOM 1238 CG1 ILE A 149 1.743 -3.805 1.865 1.00 0.19 C ATOM 1239 CG2 ILE A 149 3.634 -4.230 3.450 1.00 0.19 C ATOM 1240 CD1 ILE A 149 2.058 -2.327 1.765 1.00 0.20 C ATOM 0 H ILE A 149 1.900 -6.394 1.195 1.00 0.15 H new ATOM 0 HA ILE A 149 2.304 -6.368 4.118 1.00 0.18 H new ATOM 0 HB ILE A 149 1.585 -3.943 3.988 1.00 0.18 H new ATOM 0 HG12 ILE A 149 2.248 -4.330 1.054 1.00 0.19 H new ATOM 0 HG13 ILE A 149 0.672 -3.950 1.721 1.00 0.19 H new ATOM 0 HG21 ILE A 149 3.861 -3.164 3.429 1.00 0.19 H new ATOM 0 HG22 ILE A 149 3.899 -4.638 4.425 1.00 0.19 H new ATOM 0 HG23 ILE A 149 4.208 -4.739 2.676 1.00 0.19 H new ATOM 0 HD11 ILE A 149 1.737 -1.952 0.793 1.00 0.20 H new ATOM 0 HD12 ILE A 149 1.532 -1.789 2.553 1.00 0.20 H new ATOM 0 HD13 ILE A 149 3.132 -2.175 1.876 1.00 0.20 H new ATOM 1252 N GLU A 150 -0.198 -6.340 4.499 1.00 0.24 N ATOM 1253 CA GLU A 150 -1.619 -6.592 4.661 1.00 0.27 C ATOM 1254 C GLU A 150 -2.164 -5.890 5.897 1.00 0.24 C ATOM 1255 O GLU A 150 -1.426 -5.594 6.840 1.00 0.31 O ATOM 1256 CB GLU A 150 -1.901 -8.102 4.733 1.00 0.40 C ATOM 1257 CG GLU A 150 -1.544 -8.769 6.060 1.00 1.08 C ATOM 1258 CD GLU A 150 -0.066 -8.713 6.402 1.00 1.55 C ATOM 1259 OE1 GLU A 150 0.755 -9.262 5.637 1.00 2.03 O ATOM 1260 OE2 GLU A 150 0.282 -8.134 7.452 1.00 2.30 O ATOM 0 H GLU A 150 0.334 -6.328 5.369 1.00 0.24 H new ATOM 0 HA GLU A 150 -2.130 -6.186 3.788 1.00 0.27 H new ATOM 0 HB2 GLU A 150 -2.960 -8.267 4.535 1.00 0.40 H new ATOM 0 HB3 GLU A 150 -1.347 -8.597 3.935 1.00 0.40 H new ATOM 0 HG2 GLU A 150 -2.110 -8.290 6.859 1.00 1.08 H new ATOM 0 HG3 GLU A 150 -1.859 -9.812 6.027 1.00 1.08 H new ATOM 1267 N THR A 151 -3.457 -5.611 5.869 1.00 0.21 N ATOM 1268 CA THR A 151 -4.131 -4.976 6.985 1.00 0.23 C ATOM 1269 C THR A 151 -4.459 -6.013 8.053 1.00 0.24 C ATOM 1270 O THR A 151 -4.673 -7.187 7.750 1.00 0.27 O ATOM 1271 CB THR A 151 -5.421 -4.277 6.512 1.00 0.25 C ATOM 1272 OG1 THR A 151 -6.368 -5.239 6.031 1.00 0.25 O ATOM 1273 CG2 THR A 151 -5.110 -3.287 5.402 1.00 0.29 C ATOM 0 H THR A 151 -4.064 -5.818 5.076 1.00 0.21 H new ATOM 0 HA THR A 151 -3.467 -4.224 7.410 1.00 0.23 H new ATOM 0 HB THR A 151 -5.848 -3.747 7.363 1.00 0.25 H new ATOM 0 HG1 THR A 151 -7.127 -5.288 6.649 1.00 0.25 H new ATOM 0 HG21 THR A 151 -6.031 -2.802 5.079 1.00 0.29 H new ATOM 0 HG22 THR A 151 -4.413 -2.534 5.771 1.00 0.29 H new ATOM 0 HG23 THR A 151 -4.663 -3.814 4.559 1.00 0.29 H new ATOM 1281 N LYS A 152 -4.486 -5.577 9.304 1.00 0.31 N ATOM 1282 CA LYS A 152 -4.676 -6.484 10.422 1.00 0.38 C ATOM 1283 C LYS A 152 -6.155 -6.785 10.634 1.00 0.39 C ATOM 1284 O LYS A 152 -6.514 -7.839 11.160 1.00 0.51 O ATOM 1285 CB LYS A 152 -4.059 -5.893 11.695 1.00 0.48 C ATOM 1286 CG LYS A 152 -4.159 -6.804 12.909 1.00 0.80 C ATOM 1287 CD LYS A 152 -3.410 -6.237 14.103 1.00 1.02 C ATOM 1288 CE LYS A 152 -3.555 -7.136 15.321 1.00 1.99 C ATOM 1289 NZ LYS A 152 -2.709 -6.680 16.454 1.00 2.42 N ATOM 0 H LYS A 152 -4.378 -4.598 9.569 1.00 0.31 H new ATOM 0 HA LYS A 152 -4.171 -7.422 10.192 1.00 0.38 H new ATOM 0 HB2 LYS A 152 -3.009 -5.668 11.507 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -4.552 -4.948 11.921 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -5.207 -6.946 13.172 1.00 0.80 H new ATOM 0 HG3 LYS A 152 -3.757 -7.786 12.661 1.00 0.80 H new ATOM 0 HD2 LYS A 152 -2.355 -6.125 13.854 1.00 1.02 H new ATOM 0 HD3 LYS A 152 -3.790 -5.242 14.335 1.00 1.02 H new ATOM 0 HE2 LYS A 152 -4.599 -7.157 15.634 1.00 1.99 H new ATOM 0 HE3 LYS A 152 -3.282 -8.157 15.053 1.00 1.99 H new ATOM 0 HZ1 LYS A 152 -2.838 -7.320 17.263 1.00 2.42 H new ATOM 0 HZ2 LYS A 152 -1.710 -6.684 16.165 1.00 2.42 H new ATOM 0 HZ3 LYS A 152 -2.986 -5.716 16.728 1.00 2.42 H new ATOM 1303 N LYS A 153 -7.014 -5.866 10.215 1.00 0.37 N ATOM 1304 CA LYS A 153 -8.449 -6.055 10.373 1.00 0.43 C ATOM 1305 C LYS A 153 -9.188 -5.821 9.061 1.00 0.40 C ATOM 1306 O LYS A 153 -8.656 -5.208 8.132 1.00 0.40 O ATOM 1307 CB LYS A 153 -9.001 -5.122 11.458 1.00 0.51 C ATOM 1308 CG LYS A 153 -8.830 -3.633 11.171 1.00 0.57 C ATOM 1309 CD LYS A 153 -9.591 -2.795 12.189 1.00 0.66 C ATOM 1310 CE LYS A 153 -9.374 -1.300 11.991 1.00 0.69 C ATOM 1311 NZ LYS A 153 -8.010 -0.868 12.401 1.00 1.29 N ATOM 0 H LYS A 153 -6.746 -4.990 9.767 1.00 0.37 H new ATOM 0 HA LYS A 153 -8.612 -7.089 10.677 1.00 0.43 H new ATOM 0 HB2 LYS A 153 -10.062 -5.332 11.592 1.00 0.51 H new ATOM 0 HB3 LYS A 153 -8.508 -5.354 12.402 1.00 0.51 H new ATOM 0 HG2 LYS A 153 -7.772 -3.372 11.197 1.00 0.57 H new ATOM 0 HG3 LYS A 153 -9.189 -3.408 10.167 1.00 0.57 H new ATOM 0 HD2 LYS A 153 -10.656 -3.018 12.115 1.00 0.66 H new ATOM 0 HD3 LYS A 153 -9.276 -3.075 13.194 1.00 0.66 H new ATOM 0 HE2 LYS A 153 -9.533 -1.048 10.943 1.00 0.69 H new ATOM 0 HE3 LYS A 153 -10.116 -0.748 12.568 1.00 0.69 H new ATOM 0 HZ1 LYS A 153 -7.958 0.171 12.394 1.00 1.29 H new ATOM 0 HZ2 LYS A 153 -7.808 -1.218 13.359 1.00 1.29 H new ATOM 0 HZ3 LYS A 153 -7.309 -1.255 11.737 1.00 1.29 H new ATOM 1325 N LYS A 154 -10.408 -6.341 8.995 1.00 0.43 N ATOM 1326 CA LYS A 154 -11.300 -6.097 7.872 1.00 0.44 C ATOM 1327 C LYS A 154 -12.024 -4.777 8.107 1.00 0.53 C ATOM 1328 O LYS A 154 -12.848 -4.670 9.019 1.00 0.67 O ATOM 1329 CB LYS A 154 -12.324 -7.231 7.750 1.00 0.44 C ATOM 1330 CG LYS A 154 -11.709 -8.622 7.669 1.00 0.47 C ATOM 1331 CD LYS A 154 -12.779 -9.699 7.748 1.00 0.54 C ATOM 1332 CE LYS A 154 -12.178 -11.097 7.704 1.00 0.66 C ATOM 1333 NZ LYS A 154 -11.199 -11.325 8.800 1.00 1.41 N ATOM 0 H LYS A 154 -10.804 -6.942 9.718 1.00 0.43 H new ATOM 0 HA LYS A 154 -10.722 -6.052 6.949 1.00 0.44 H new ATOM 0 HB2 LYS A 154 -12.996 -7.192 8.607 1.00 0.44 H new ATOM 0 HB3 LYS A 154 -12.932 -7.062 6.861 1.00 0.44 H new ATOM 0 HG2 LYS A 154 -11.154 -8.724 6.736 1.00 0.47 H new ATOM 0 HG3 LYS A 154 -10.994 -8.755 8.481 1.00 0.47 H new ATOM 0 HD2 LYS A 154 -13.350 -9.578 8.669 1.00 0.54 H new ATOM 0 HD3 LYS A 154 -13.479 -9.578 6.921 1.00 0.54 H new ATOM 0 HE2 LYS A 154 -12.976 -11.836 7.774 1.00 0.66 H new ATOM 0 HE3 LYS A 154 -11.686 -11.249 6.743 1.00 0.66 H new ATOM 0 HZ1 LYS A 154 -11.350 -12.269 9.210 1.00 1.41 H new ATOM 0 HZ2 LYS A 154 -10.233 -11.263 8.421 1.00 1.41 H new ATOM 0 HZ3 LYS A 154 -11.328 -10.603 9.537 1.00 1.41 H new ATOM 1347 N MET A 155 -11.712 -3.773 7.304 1.00 0.61 N ATOM 1348 CA MET A 155 -12.235 -2.432 7.530 1.00 0.76 C ATOM 1349 C MET A 155 -13.674 -2.285 7.049 1.00 0.62 C ATOM 1350 O MET A 155 -14.321 -3.261 6.660 1.00 0.57 O ATOM 1351 CB MET A 155 -11.344 -1.369 6.875 1.00 1.01 C ATOM 1352 CG MET A 155 -10.977 -1.649 5.424 1.00 1.22 C ATOM 1353 SD MET A 155 -9.797 -3.003 5.247 1.00 0.95 S ATOM 1354 CE MET A 155 -8.525 -2.492 6.402 1.00 0.80 C ATOM 0 H MET A 155 -11.101 -3.859 6.492 1.00 0.61 H new ATOM 0 HA MET A 155 -12.230 -2.275 8.609 1.00 0.76 H new ATOM 0 HB2 MET A 155 -11.853 -0.406 6.927 1.00 1.01 H new ATOM 0 HB3 MET A 155 -10.426 -1.276 7.456 1.00 1.01 H new ATOM 0 HG2 MET A 155 -11.882 -1.887 4.865 1.00 1.22 H new ATOM 0 HG3 MET A 155 -10.556 -0.747 4.980 1.00 1.22 H new ATOM 0 HE1 MET A 155 -7.571 -2.933 6.112 1.00 0.80 H new ATOM 0 HE2 MET A 155 -8.440 -1.405 6.393 1.00 0.80 H new ATOM 0 HE3 MET A 155 -8.789 -2.827 7.405 1.00 0.80 H new ATOM 1364 N LYS A 156 -14.159 -1.055 7.087 1.00 0.65 N ATOM 1365 CA LYS A 156 -15.545 -0.747 6.775 1.00 0.59 C ATOM 1366 C LYS A 156 -15.692 -0.453 5.277 1.00 0.44 C ATOM 1367 O LYS A 156 -14.714 -0.558 4.538 1.00 0.42 O ATOM 1368 CB LYS A 156 -15.984 0.447 7.634 1.00 0.72 C ATOM 1369 CG LYS A 156 -15.754 0.240 9.124 1.00 1.28 C ATOM 1370 CD LYS A 156 -16.453 -1.015 9.627 1.00 1.79 C ATOM 1371 CE LYS A 156 -16.163 -1.271 11.095 1.00 2.54 C ATOM 1372 NZ LYS A 156 -16.749 -2.558 11.555 1.00 3.40 N ATOM 0 H LYS A 156 -13.600 -0.239 7.336 1.00 0.65 H new ATOM 0 HA LYS A 156 -16.187 -1.598 7.002 1.00 0.59 H new ATOM 0 HB2 LYS A 156 -15.442 1.336 7.311 1.00 0.72 H new ATOM 0 HB3 LYS A 156 -17.043 0.639 7.461 1.00 0.72 H new ATOM 0 HG2 LYS A 156 -14.685 0.166 9.321 1.00 1.28 H new ATOM 0 HG3 LYS A 156 -16.120 1.107 9.674 1.00 1.28 H new ATOM 0 HD2 LYS A 156 -17.529 -0.916 9.481 1.00 1.79 H new ATOM 0 HD3 LYS A 156 -16.129 -1.873 9.037 1.00 1.79 H new ATOM 0 HE2 LYS A 156 -15.085 -1.284 11.256 1.00 2.54 H new ATOM 0 HE3 LYS A 156 -16.565 -0.453 11.693 1.00 2.54 H new ATOM 0 HZ1 LYS A 156 -16.530 -2.699 12.562 1.00 3.40 H new ATOM 0 HZ2 LYS A 156 -17.781 -2.536 11.424 1.00 3.40 H new ATOM 0 HZ3 LYS A 156 -16.346 -3.341 11.001 1.00 3.40 H new ATOM 1386 N PRO A 157 -16.904 -0.119 4.784 1.00 0.46 N ATOM 1387 CA PRO A 157 -17.090 0.214 3.375 1.00 0.41 C ATOM 1388 C PRO A 157 -16.461 1.558 3.020 1.00 0.37 C ATOM 1389 O PRO A 157 -16.602 2.537 3.758 1.00 0.46 O ATOM 1390 CB PRO A 157 -18.612 0.276 3.187 1.00 0.52 C ATOM 1391 CG PRO A 157 -19.208 -0.233 4.459 1.00 0.63 C ATOM 1392 CD PRO A 157 -18.171 -0.045 5.527 1.00 0.63 C ATOM 0 HA PRO A 157 -16.611 -0.521 2.728 1.00 0.41 H new ATOM 0 HB2 PRO A 157 -18.938 1.296 2.985 1.00 0.52 H new ATOM 0 HB3 PRO A 157 -18.925 -0.333 2.339 1.00 0.52 H new ATOM 0 HG2 PRO A 157 -20.119 0.312 4.704 1.00 0.63 H new ATOM 0 HG3 PRO A 157 -19.481 -1.284 4.365 1.00 0.63 H new ATOM 0 HD2 PRO A 157 -18.285 0.913 6.034 1.00 0.63 H new ATOM 0 HD3 PRO A 157 -18.235 -0.820 6.291 1.00 0.63 H new ATOM 1400 N GLY A 158 -15.768 1.604 1.893 1.00 0.32 N ATOM 1401 CA GLY A 158 -15.159 2.839 1.449 1.00 0.33 C ATOM 1402 C GLY A 158 -14.004 2.595 0.506 1.00 0.27 C ATOM 1403 O GLY A 158 -13.791 1.470 0.063 1.00 0.27 O ATOM 0 H GLY A 158 -15.616 0.806 1.277 1.00 0.32 H new ATOM 0 HA2 GLY A 158 -15.909 3.454 0.952 1.00 0.33 H new ATOM 0 HA3 GLY A 158 -14.808 3.401 2.314 1.00 0.33 H new ATOM 1407 N ILE A 159 -13.253 3.640 0.202 1.00 0.29 N ATOM 1408 CA ILE A 159 -12.116 3.524 -0.696 1.00 0.26 C ATOM 1409 C ILE A 159 -10.829 3.538 0.111 1.00 0.21 C ATOM 1410 O ILE A 159 -10.624 4.415 0.942 1.00 0.24 O ATOM 1411 CB ILE A 159 -12.094 4.668 -1.733 1.00 0.30 C ATOM 1412 CG1 ILE A 159 -13.435 4.736 -2.471 1.00 0.40 C ATOM 1413 CG2 ILE A 159 -10.946 4.471 -2.718 1.00 0.29 C ATOM 1414 CD1 ILE A 159 -13.552 5.903 -3.423 1.00 0.44 C ATOM 0 H ILE A 159 -13.410 4.580 0.565 1.00 0.29 H new ATOM 0 HA ILE A 159 -12.206 2.582 -1.238 1.00 0.26 H new ATOM 0 HB ILE A 159 -11.937 5.612 -1.212 1.00 0.30 H new ATOM 0 HG12 ILE A 159 -13.579 3.810 -3.028 1.00 0.40 H new ATOM 0 HG13 ILE A 159 -14.239 4.796 -1.738 1.00 0.40 H new ATOM 0 HG21 ILE A 159 -10.944 5.286 -3.442 1.00 0.29 H new ATOM 0 HG22 ILE A 159 -10.000 4.464 -2.177 1.00 0.29 H new ATOM 0 HG23 ILE A 159 -11.073 3.522 -3.239 1.00 0.29 H new ATOM 0 HD11 ILE A 159 -14.529 5.882 -3.906 1.00 0.44 H new ATOM 0 HD12 ILE A 159 -13.441 6.836 -2.870 1.00 0.44 H new ATOM 0 HD13 ILE A 159 -12.771 5.835 -4.180 1.00 0.44 H new ATOM 1426 N TYR A 160 -9.981 2.552 -0.110 1.00 0.18 N ATOM 1427 CA TYR A 160 -8.744 2.438 0.642 1.00 0.17 C ATOM 1428 C TYR A 160 -7.569 2.244 -0.299 1.00 0.16 C ATOM 1429 O TYR A 160 -7.737 1.770 -1.420 1.00 0.19 O ATOM 1430 CB TYR A 160 -8.820 1.268 1.631 1.00 0.21 C ATOM 1431 CG TYR A 160 -9.924 1.402 2.667 1.00 0.23 C ATOM 1432 CD1 TYR A 160 -11.223 0.993 2.389 1.00 1.20 C ATOM 1433 CD2 TYR A 160 -9.665 1.938 3.923 1.00 1.24 C ATOM 1434 CE1 TYR A 160 -12.229 1.113 3.329 1.00 1.23 C ATOM 1435 CE2 TYR A 160 -10.669 2.061 4.867 1.00 1.24 C ATOM 1436 CZ TYR A 160 -11.946 1.648 4.566 1.00 0.35 C ATOM 1437 OH TYR A 160 -12.943 1.765 5.509 1.00 0.43 O ATOM 0 H TYR A 160 -10.125 1.818 -0.804 1.00 0.18 H new ATOM 0 HA TYR A 160 -8.599 3.361 1.203 1.00 0.17 H new ATOM 0 HB2 TYR A 160 -8.970 0.344 1.073 1.00 0.21 H new ATOM 0 HB3 TYR A 160 -7.863 1.178 2.145 1.00 0.21 H new ATOM 0 HD1 TYR A 160 -11.450 0.574 1.420 1.00 1.20 H new ATOM 0 HD2 TYR A 160 -8.664 2.264 4.166 1.00 1.24 H new ATOM 0 HE1 TYR A 160 -13.232 0.789 3.095 1.00 1.23 H new ATOM 0 HE2 TYR A 160 -10.451 2.480 5.838 1.00 1.24 H new ATOM 0 HH TYR A 160 -13.541 0.991 5.450 1.00 0.43 H new ATOM 1447 N ALA A 161 -6.387 2.632 0.156 1.00 0.14 N ATOM 1448 CA ALA A 161 -5.165 2.450 -0.611 1.00 0.14 C ATOM 1449 C ALA A 161 -3.958 2.446 0.311 1.00 0.14 C ATOM 1450 O ALA A 161 -4.021 2.953 1.434 1.00 0.14 O ATOM 1451 CB ALA A 161 -5.019 3.544 -1.651 1.00 0.14 C ATOM 0 H ALA A 161 -6.249 3.079 1.062 1.00 0.14 H new ATOM 0 HA ALA A 161 -5.223 1.489 -1.122 1.00 0.14 H new ATOM 0 HB1 ALA A 161 -4.099 3.390 -2.214 1.00 0.14 H new ATOM 0 HB2 ALA A 161 -5.870 3.515 -2.331 1.00 0.14 H new ATOM 0 HB3 ALA A 161 -4.983 4.514 -1.156 1.00 0.14 H new ATOM 1457 N PHE A 162 -2.864 1.879 -0.165 1.00 0.14 N ATOM 1458 CA PHE A 162 -1.639 1.805 0.614 1.00 0.15 C ATOM 1459 C PHE A 162 -0.674 2.904 0.201 1.00 0.15 C ATOM 1460 O PHE A 162 -0.379 3.063 -0.983 1.00 0.15 O ATOM 1461 CB PHE A 162 -0.960 0.443 0.434 1.00 0.17 C ATOM 1462 CG PHE A 162 -1.725 -0.711 1.022 1.00 0.18 C ATOM 1463 CD1 PHE A 162 -1.532 -1.084 2.342 1.00 1.13 C ATOM 1464 CD2 PHE A 162 -2.629 -1.429 0.256 1.00 1.15 C ATOM 1465 CE1 PHE A 162 -2.224 -2.148 2.887 1.00 1.13 C ATOM 1466 CE2 PHE A 162 -3.325 -2.494 0.796 1.00 1.16 C ATOM 1467 CZ PHE A 162 -3.122 -2.854 2.113 1.00 0.24 C ATOM 0 H PHE A 162 -2.798 1.460 -1.093 1.00 0.14 H new ATOM 0 HA PHE A 162 -1.906 1.935 1.663 1.00 0.15 H new ATOM 0 HB2 PHE A 162 -0.812 0.261 -0.631 1.00 0.17 H new ATOM 0 HB3 PHE A 162 0.029 0.479 0.891 1.00 0.17 H new ATOM 0 HD1 PHE A 162 -0.831 -0.535 2.953 1.00 1.13 H new ATOM 0 HD2 PHE A 162 -2.792 -1.153 -0.775 1.00 1.15 H new ATOM 0 HE1 PHE A 162 -2.062 -2.427 3.918 1.00 1.13 H new ATOM 0 HE2 PHE A 162 -4.027 -3.044 0.188 1.00 1.16 H new ATOM 0 HZ PHE A 162 -3.665 -3.686 2.537 1.00 0.24 H new ATOM 1477 N LYS A 163 -0.198 3.665 1.174 1.00 0.16 N ATOM 1478 CA LYS A 163 0.816 4.676 0.919 1.00 0.18 C ATOM 1479 C LYS A 163 2.144 4.216 1.481 1.00 0.20 C ATOM 1480 O LYS A 163 2.314 4.149 2.699 1.00 0.23 O ATOM 1481 CB LYS A 163 0.459 6.027 1.559 1.00 0.23 C ATOM 1482 CG LYS A 163 1.502 7.107 1.265 1.00 0.31 C ATOM 1483 CD LYS A 163 1.299 8.368 2.105 1.00 0.45 C ATOM 1484 CE LYS A 163 2.453 9.348 1.910 1.00 0.74 C ATOM 1485 NZ LYS A 163 2.325 10.556 2.767 1.00 1.28 N ATOM 0 H LYS A 163 -0.497 3.602 2.147 1.00 0.16 H new ATOM 0 HA LYS A 163 0.874 4.811 -0.161 1.00 0.18 H new ATOM 0 HB2 LYS A 163 -0.513 6.355 1.190 1.00 0.23 H new ATOM 0 HB3 LYS A 163 0.365 5.901 2.638 1.00 0.23 H new ATOM 0 HG2 LYS A 163 2.498 6.706 1.454 1.00 0.31 H new ATOM 0 HG3 LYS A 163 1.460 7.369 0.208 1.00 0.31 H new ATOM 0 HD2 LYS A 163 0.360 8.847 1.827 1.00 0.45 H new ATOM 0 HD3 LYS A 163 1.220 8.099 3.158 1.00 0.45 H new ATOM 0 HE2 LYS A 163 3.394 8.846 2.134 1.00 0.74 H new ATOM 0 HE3 LYS A 163 2.495 9.651 0.864 1.00 0.74 H new ATOM 0 HZ1 LYS A 163 3.224 11.079 2.767 1.00 1.28 H new ATOM 0 HZ2 LYS A 163 1.569 11.167 2.396 1.00 1.28 H new ATOM 0 HZ3 LYS A 163 2.092 10.269 3.739 1.00 1.28 H new ATOM 1499 N VAL A 164 3.075 3.884 0.611 1.00 0.22 N ATOM 1500 CA VAL A 164 4.418 3.581 1.054 1.00 0.26 C ATOM 1501 C VAL A 164 5.308 4.783 0.751 1.00 0.33 C ATOM 1502 O VAL A 164 5.361 5.268 -0.380 1.00 0.34 O ATOM 1503 CB VAL A 164 4.979 2.271 0.425 1.00 0.28 C ATOM 1504 CG1 VAL A 164 3.950 1.156 0.513 1.00 0.27 C ATOM 1505 CG2 VAL A 164 5.422 2.458 -1.016 1.00 0.29 C ATOM 0 H VAL A 164 2.928 3.818 -0.396 1.00 0.22 H new ATOM 0 HA VAL A 164 4.401 3.396 2.128 1.00 0.26 H new ATOM 0 HB VAL A 164 5.863 1.998 1.002 1.00 0.28 H new ATOM 0 HG11 VAL A 164 4.358 0.248 0.069 1.00 0.27 H new ATOM 0 HG12 VAL A 164 3.704 0.970 1.558 1.00 0.27 H new ATOM 0 HG13 VAL A 164 3.049 1.449 -0.025 1.00 0.27 H new ATOM 0 HG21 VAL A 164 5.804 1.514 -1.405 1.00 0.29 H new ATOM 0 HG22 VAL A 164 4.573 2.781 -1.619 1.00 0.29 H new ATOM 0 HG23 VAL A 164 6.207 3.213 -1.060 1.00 0.29 H new ATOM 1515 N TYR A 165 5.954 5.313 1.771 1.00 0.45 N ATOM 1516 CA TYR A 165 6.765 6.505 1.594 1.00 0.57 C ATOM 1517 C TYR A 165 8.225 6.206 1.863 1.00 0.70 C ATOM 1518 O TYR A 165 8.868 6.848 2.694 1.00 1.67 O ATOM 1519 CB TYR A 165 6.256 7.670 2.457 1.00 0.62 C ATOM 1520 CG TYR A 165 5.848 7.301 3.870 1.00 0.63 C ATOM 1521 CD1 TYR A 165 6.776 7.287 4.904 1.00 1.30 C ATOM 1522 CD2 TYR A 165 4.525 6.994 4.175 1.00 1.38 C ATOM 1523 CE1 TYR A 165 6.402 6.978 6.197 1.00 1.31 C ATOM 1524 CE2 TYR A 165 4.146 6.679 5.465 1.00 1.45 C ATOM 1525 CZ TYR A 165 5.086 6.673 6.471 1.00 0.79 C ATOM 1526 OH TYR A 165 4.707 6.370 7.760 1.00 0.93 O ATOM 0 H TYR A 165 5.935 4.943 2.722 1.00 0.45 H new ATOM 0 HA TYR A 165 6.675 6.819 0.554 1.00 0.57 H new ATOM 0 HB2 TYR A 165 7.036 8.430 2.509 1.00 0.62 H new ATOM 0 HB3 TYR A 165 5.401 8.124 1.957 1.00 0.62 H new ATOM 0 HD1 TYR A 165 7.809 7.522 4.693 1.00 1.30 H new ATOM 0 HD2 TYR A 165 3.783 7.002 3.390 1.00 1.38 H new ATOM 0 HE1 TYR A 165 7.136 6.975 6.989 1.00 1.31 H new ATOM 0 HE2 TYR A 165 3.116 6.438 5.684 1.00 1.45 H new ATOM 0 HH TYR A 165 3.746 6.180 7.782 1.00 0.93 H new ATOM 1536 N LYS A 166 8.730 5.208 1.138 1.00 0.48 N ATOM 1537 CA LYS A 166 10.138 4.825 1.185 1.00 0.49 C ATOM 1538 C LYS A 166 10.464 4.196 2.554 1.00 0.46 C ATOM 1539 O LYS A 166 9.575 4.052 3.397 1.00 0.55 O ATOM 1540 CB LYS A 166 11.037 6.050 0.909 1.00 0.57 C ATOM 1541 CG LYS A 166 10.588 6.964 -0.236 1.00 0.71 C ATOM 1542 CD LYS A 166 10.691 6.317 -1.618 1.00 0.94 C ATOM 1543 CE LYS A 166 9.422 5.572 -2.006 1.00 1.35 C ATOM 1544 NZ LYS A 166 9.452 5.134 -3.428 1.00 1.53 N ATOM 0 H LYS A 166 8.171 4.642 0.500 1.00 0.48 H new ATOM 0 HA LYS A 166 10.334 4.084 0.410 1.00 0.49 H new ATOM 0 HB2 LYS A 166 11.098 6.645 1.820 1.00 0.57 H new ATOM 0 HB3 LYS A 166 12.045 5.696 0.692 1.00 0.57 H new ATOM 0 HG2 LYS A 166 9.555 7.267 -0.063 1.00 0.71 H new ATOM 0 HG3 LYS A 166 11.193 7.871 -0.223 1.00 0.71 H new ATOM 0 HD2 LYS A 166 10.899 7.086 -2.362 1.00 0.94 H new ATOM 0 HD3 LYS A 166 11.533 5.625 -1.630 1.00 0.94 H new ATOM 0 HE2 LYS A 166 9.299 4.703 -1.360 1.00 1.35 H new ATOM 0 HE3 LYS A 166 8.558 6.216 -1.842 1.00 1.35 H new ATOM 0 HZ1 LYS A 166 8.550 5.377 -3.885 1.00 1.53 H new ATOM 0 HZ2 LYS A 166 10.231 5.613 -3.923 1.00 1.53 H new ATOM 0 HZ3 LYS A 166 9.596 4.105 -3.471 1.00 1.53 H new ATOM 1558 N PRO A 167 11.720 3.765 2.788 1.00 0.44 N ATOM 1559 CA PRO A 167 12.148 3.277 4.106 1.00 0.47 C ATOM 1560 C PRO A 167 12.019 4.357 5.171 1.00 0.47 C ATOM 1561 O PRO A 167 12.368 5.513 4.934 1.00 0.50 O ATOM 1562 CB PRO A 167 13.622 2.908 3.895 1.00 0.58 C ATOM 1563 CG PRO A 167 13.749 2.702 2.426 1.00 0.60 C ATOM 1564 CD PRO A 167 12.815 3.692 1.805 1.00 0.49 C ATOM 0 HA PRO A 167 11.539 2.443 4.455 1.00 0.47 H new ATOM 0 HB2 PRO A 167 14.283 3.701 4.243 1.00 0.58 H new ATOM 0 HB3 PRO A 167 13.888 2.006 4.447 1.00 0.58 H new ATOM 0 HG2 PRO A 167 14.774 2.866 2.093 1.00 0.60 H new ATOM 0 HG3 PRO A 167 13.483 1.682 2.148 1.00 0.60 H new ATOM 0 HD2 PRO A 167 13.292 4.661 1.657 1.00 0.49 H new ATOM 0 HD3 PRO A 167 12.462 3.359 0.829 1.00 0.49 H new ATOM 1572 N ALA A 168 11.492 3.984 6.330 1.00 0.53 N ATOM 1573 CA ALA A 168 11.370 4.920 7.440 1.00 0.64 C ATOM 1574 C ALA A 168 12.740 5.480 7.804 1.00 0.71 C ATOM 1575 O ALA A 168 13.669 4.722 8.087 1.00 0.76 O ATOM 1576 CB ALA A 168 10.739 4.248 8.648 1.00 0.72 C ATOM 0 H ALA A 168 11.144 3.045 6.525 1.00 0.53 H new ATOM 0 HA ALA A 168 10.722 5.739 7.129 1.00 0.64 H new ATOM 0 HB1 ALA A 168 10.659 4.967 9.463 1.00 0.72 H new ATOM 0 HB2 ALA A 168 9.745 3.885 8.385 1.00 0.72 H new ATOM 0 HB3 ALA A 168 11.360 3.409 8.963 1.00 0.72 H new ATOM 1582 N GLY A 169 12.869 6.799 7.775 1.00 0.82 N ATOM 1583 CA GLY A 169 14.149 7.420 8.046 1.00 0.95 C ATOM 1584 C GLY A 169 14.794 7.980 6.792 1.00 0.96 C ATOM 1585 O GLY A 169 15.776 8.715 6.867 1.00 1.14 O ATOM 0 H GLY A 169 12.111 7.449 7.569 1.00 0.82 H new ATOM 0 HA2 GLY A 169 14.015 8.222 8.772 1.00 0.95 H new ATOM 0 HA3 GLY A 169 14.817 6.688 8.500 1.00 0.95 H new ATOM 1589 N TYR A 170 14.251 7.621 5.637 1.00 0.80 N ATOM 1590 CA TYR A 170 14.740 8.135 4.363 1.00 0.82 C ATOM 1591 C TYR A 170 14.320 9.597 4.203 1.00 0.86 C ATOM 1592 O TYR A 170 13.167 9.941 4.469 1.00 0.89 O ATOM 1593 CB TYR A 170 14.175 7.284 3.215 1.00 0.83 C ATOM 1594 CG TYR A 170 14.702 7.645 1.837 1.00 0.91 C ATOM 1595 CD1 TYR A 170 15.806 6.993 1.296 1.00 1.15 C ATOM 1596 CD2 TYR A 170 14.091 8.634 1.074 1.00 1.74 C ATOM 1597 CE1 TYR A 170 16.281 7.319 0.040 1.00 1.21 C ATOM 1598 CE2 TYR A 170 14.563 8.963 -0.180 1.00 1.82 C ATOM 1599 CZ TYR A 170 15.656 8.304 -0.692 1.00 1.11 C ATOM 1600 OH TYR A 170 16.125 8.632 -1.943 1.00 1.24 O ATOM 0 H TYR A 170 13.468 6.973 5.555 1.00 0.80 H new ATOM 0 HA TYR A 170 15.828 8.080 4.339 1.00 0.82 H new ATOM 0 HB2 TYR A 170 14.401 6.236 3.412 1.00 0.83 H new ATOM 0 HB3 TYR A 170 13.089 7.380 3.210 1.00 0.83 H new ATOM 0 HD1 TYR A 170 16.299 6.220 1.867 1.00 1.15 H new ATOM 0 HD2 TYR A 170 13.231 9.154 1.470 1.00 1.74 H new ATOM 0 HE1 TYR A 170 17.139 6.803 -0.366 1.00 1.21 H new ATOM 0 HE2 TYR A 170 14.076 9.735 -0.757 1.00 1.82 H new ATOM 0 HH TYR A 170 15.571 9.345 -2.324 1.00 1.24 H new ATOM 1610 N PRO A 171 15.244 10.489 3.801 1.00 0.97 N ATOM 1611 CA PRO A 171 14.919 11.906 3.590 1.00 1.10 C ATOM 1612 C PRO A 171 13.846 12.098 2.517 1.00 1.07 C ATOM 1613 O PRO A 171 14.052 11.764 1.348 1.00 1.05 O ATOM 1614 CB PRO A 171 16.250 12.526 3.134 1.00 1.25 C ATOM 1615 CG PRO A 171 17.091 11.375 2.696 1.00 1.31 C ATOM 1616 CD PRO A 171 16.666 10.206 3.537 1.00 1.07 C ATOM 0 HA PRO A 171 14.513 12.366 4.491 1.00 1.10 H new ATOM 0 HB2 PRO A 171 16.096 13.233 2.319 1.00 1.25 H new ATOM 0 HB3 PRO A 171 16.727 13.075 3.946 1.00 1.25 H new ATOM 0 HG2 PRO A 171 16.945 11.166 1.636 1.00 1.31 H new ATOM 0 HG3 PRO A 171 18.150 11.591 2.835 1.00 1.31 H new ATOM 0 HD2 PRO A 171 16.799 9.261 3.011 1.00 1.07 H new ATOM 0 HD3 PRO A 171 17.243 10.141 4.460 1.00 1.07 H new ATOM 1624 N ALA A 172 12.708 12.646 2.919 1.00 1.22 N ATOM 1625 CA ALA A 172 11.594 12.854 2.007 1.00 1.31 C ATOM 1626 C ALA A 172 11.744 14.180 1.274 1.00 1.40 C ATOM 1627 O ALA A 172 12.035 15.206 1.892 1.00 1.67 O ATOM 1628 CB ALA A 172 10.274 12.809 2.766 1.00 1.60 C ATOM 0 H ALA A 172 12.532 12.955 3.875 1.00 1.22 H new ATOM 0 HA ALA A 172 11.597 12.053 1.268 1.00 1.31 H new ATOM 0 HB1 ALA A 172 9.449 12.966 2.071 1.00 1.60 H new ATOM 0 HB2 ALA A 172 10.164 11.837 3.246 1.00 1.60 H new ATOM 0 HB3 ALA A 172 10.264 13.592 3.524 1.00 1.60 H new ATOM 1634 N ASN A 173 11.556 14.158 -0.039 1.00 1.38 N ATOM 1635 CA ASN A 173 11.686 15.367 -0.849 1.00 1.53 C ATOM 1636 C ASN A 173 10.315 15.946 -1.168 1.00 1.91 C ATOM 1637 O ASN A 173 10.200 17.011 -1.777 1.00 2.60 O ATOM 1638 CB ASN A 173 12.438 15.075 -2.155 1.00 1.89 C ATOM 1639 CG ASN A 173 11.643 14.216 -3.125 1.00 2.51 C ATOM 1640 OD1 ASN A 173 10.822 13.392 -2.725 1.00 2.97 O ATOM 1641 ND2 ASN A 173 11.881 14.409 -4.411 1.00 3.18 N ATOM 0 H ASN A 173 11.314 13.320 -0.567 1.00 1.38 H new ATOM 0 HA ASN A 173 12.257 16.094 -0.271 1.00 1.53 H new ATOM 0 HB2 ASN A 173 12.692 16.018 -2.639 1.00 1.89 H new ATOM 0 HB3 ASN A 173 13.377 14.574 -1.921 1.00 1.89 H new ATOM 0 HD21 ASN A 173 11.376 13.865 -5.110 1.00 3.18 H new ATOM 0 HD22 ASN A 173 12.570 15.102 -4.704 1.00 3.18 H new ATOM 1648 N GLY A 174 9.279 15.229 -0.764 1.00 2.02 N ATOM 1649 CA GLY A 174 7.925 15.677 -1.020 1.00 2.69 C ATOM 1650 C GLY A 174 7.252 14.870 -2.109 1.00 2.26 C ATOM 1651 O GLY A 174 6.038 14.928 -2.277 1.00 2.93 O ATOM 0 H GLY A 174 9.350 14.344 -0.263 1.00 2.02 H new ATOM 0 HA2 GLY A 174 7.341 15.605 -0.103 1.00 2.69 H new ATOM 0 HA3 GLY A 174 7.940 16.729 -1.306 1.00 2.69 H new ATOM 1655 N SER A 175 8.047 14.111 -2.844 1.00 1.44 N ATOM 1656 CA SER A 175 7.532 13.254 -3.898 1.00 1.23 C ATOM 1657 C SER A 175 7.983 11.822 -3.654 1.00 0.94 C ATOM 1658 O SER A 175 8.055 11.003 -4.567 1.00 1.36 O ATOM 1659 CB SER A 175 8.021 13.751 -5.259 1.00 1.79 C ATOM 1660 OG SER A 175 7.679 15.116 -5.447 1.00 2.26 O ATOM 0 H SER A 175 9.060 14.071 -2.728 1.00 1.44 H new ATOM 0 HA SER A 175 6.442 13.284 -3.893 1.00 1.23 H new ATOM 0 HB2 SER A 175 9.102 13.629 -5.330 1.00 1.79 H new ATOM 0 HB3 SER A 175 7.579 13.148 -6.052 1.00 1.79 H new ATOM 0 HG SER A 175 8.002 15.416 -6.322 1.00 2.26 H new ATOM 1666 N THR A 176 8.266 11.534 -2.396 1.00 0.64 N ATOM 1667 CA THR A 176 8.766 10.236 -1.986 1.00 0.90 C ATOM 1668 C THR A 176 7.624 9.286 -1.631 1.00 0.80 C ATOM 1669 O THR A 176 7.836 8.226 -1.045 1.00 1.05 O ATOM 1670 CB THR A 176 9.722 10.390 -0.791 1.00 1.30 C ATOM 1671 OG1 THR A 176 9.426 11.612 -0.096 1.00 1.49 O ATOM 1672 CG2 THR A 176 11.171 10.399 -1.254 1.00 1.76 C ATOM 0 H THR A 176 8.155 12.197 -1.628 1.00 0.64 H new ATOM 0 HA THR A 176 9.310 9.805 -2.826 1.00 0.90 H new ATOM 0 HB THR A 176 9.582 9.542 -0.121 1.00 1.30 H new ATOM 0 HG1 THR A 176 8.757 11.439 0.599 1.00 1.49 H new ATOM 0 HG21 THR A 176 11.828 10.509 -0.391 1.00 1.76 H new ATOM 0 HG22 THR A 176 11.396 9.462 -1.764 1.00 1.76 H new ATOM 0 HG23 THR A 176 11.329 11.232 -1.939 1.00 1.76 H new ATOM 1680 N PHE A 177 6.409 9.676 -1.981 1.00 0.52 N ATOM 1681 CA PHE A 177 5.238 8.862 -1.697 1.00 0.45 C ATOM 1682 C PHE A 177 4.912 7.961 -2.885 1.00 0.41 C ATOM 1683 O PHE A 177 5.161 8.324 -4.037 1.00 0.50 O ATOM 1684 CB PHE A 177 4.029 9.754 -1.366 1.00 0.49 C ATOM 1685 CG PHE A 177 3.674 10.750 -2.448 1.00 0.55 C ATOM 1686 CD1 PHE A 177 4.174 12.044 -2.412 1.00 1.37 C ATOM 1687 CD2 PHE A 177 2.838 10.392 -3.500 1.00 1.31 C ATOM 1688 CE1 PHE A 177 3.849 12.955 -3.399 1.00 1.46 C ATOM 1689 CE2 PHE A 177 2.513 11.302 -4.487 1.00 1.38 C ATOM 1690 CZ PHE A 177 3.019 12.585 -4.436 1.00 0.86 C ATOM 0 H PHE A 177 6.208 10.552 -2.463 1.00 0.52 H new ATOM 0 HA PHE A 177 5.459 8.236 -0.833 1.00 0.45 H new ATOM 0 HB2 PHE A 177 3.164 9.118 -1.176 1.00 0.49 H new ATOM 0 HB3 PHE A 177 4.234 10.296 -0.443 1.00 0.49 H new ATOM 0 HD1 PHE A 177 4.825 12.343 -1.603 1.00 1.37 H new ATOM 0 HD2 PHE A 177 2.438 9.390 -3.546 1.00 1.31 H new ATOM 0 HE1 PHE A 177 4.246 13.959 -3.358 1.00 1.46 H new ATOM 0 HE2 PHE A 177 1.863 11.010 -5.298 1.00 1.38 H new ATOM 0 HZ PHE A 177 2.765 13.298 -5.207 1.00 0.86 H new ATOM 1700 N GLU A 178 4.386 6.779 -2.600 1.00 0.34 N ATOM 1701 CA GLU A 178 3.915 5.879 -3.636 1.00 0.32 C ATOM 1702 C GLU A 178 2.593 5.259 -3.200 1.00 0.28 C ATOM 1703 O GLU A 178 2.521 4.590 -2.165 1.00 0.28 O ATOM 1704 CB GLU A 178 4.947 4.783 -3.912 1.00 0.37 C ATOM 1705 CG GLU A 178 4.588 3.890 -5.088 1.00 0.40 C ATOM 1706 CD GLU A 178 4.685 4.603 -6.423 1.00 1.20 C ATOM 1707 OE1 GLU A 178 5.586 4.257 -7.219 1.00 1.91 O ATOM 1708 OE2 GLU A 178 3.856 5.502 -6.692 1.00 1.96 O ATOM 0 H GLU A 178 4.275 6.421 -1.651 1.00 0.34 H new ATOM 0 HA GLU A 178 3.767 6.444 -4.557 1.00 0.32 H new ATOM 0 HB2 GLU A 178 5.915 5.247 -4.101 1.00 0.37 H new ATOM 0 HB3 GLU A 178 5.058 4.167 -3.020 1.00 0.37 H new ATOM 0 HG2 GLU A 178 5.250 3.024 -5.095 1.00 0.40 H new ATOM 0 HG3 GLU A 178 3.573 3.514 -4.956 1.00 0.40 H new ATOM 1715 N TRP A 179 1.546 5.511 -3.968 1.00 0.28 N ATOM 1716 CA TRP A 179 0.229 4.987 -3.651 1.00 0.26 C ATOM 1717 C TRP A 179 -0.069 3.729 -4.450 1.00 0.27 C ATOM 1718 O TRP A 179 0.283 3.624 -5.630 1.00 0.38 O ATOM 1719 CB TRP A 179 -0.858 6.023 -3.945 1.00 0.27 C ATOM 1720 CG TRP A 179 -0.868 7.192 -3.011 1.00 0.27 C ATOM 1721 CD1 TRP A 179 -0.304 8.415 -3.222 1.00 0.32 C ATOM 1722 CD2 TRP A 179 -1.489 7.253 -1.722 1.00 0.24 C ATOM 1723 NE1 TRP A 179 -0.544 9.234 -2.150 1.00 0.32 N ATOM 1724 CE2 TRP A 179 -1.265 8.547 -1.217 1.00 0.27 C ATOM 1725 CE3 TRP A 179 -2.216 6.344 -0.947 1.00 0.20 C ATOM 1726 CZ2 TRP A 179 -1.737 8.957 0.023 1.00 0.27 C ATOM 1727 CZ3 TRP A 179 -2.684 6.752 0.287 1.00 0.21 C ATOM 1728 CH2 TRP A 179 -2.444 8.051 0.760 1.00 0.24 C ATOM 0 H TRP A 179 1.583 6.076 -4.816 1.00 0.28 H new ATOM 0 HA TRP A 179 0.229 4.748 -2.587 1.00 0.26 H new ATOM 0 HB2 TRP A 179 -0.728 6.389 -4.964 1.00 0.27 H new ATOM 0 HB3 TRP A 179 -1.831 5.533 -3.904 1.00 0.27 H new ATOM 0 HD1 TRP A 179 0.251 8.697 -4.105 1.00 0.32 H new ATOM 0 HE1 TRP A 179 -0.234 10.202 -2.063 1.00 0.32 H new ATOM 0 HE3 TRP A 179 -2.408 5.344 -1.306 1.00 0.20 H new ATOM 0 HZ2 TRP A 179 -1.552 9.955 0.391 1.00 0.27 H new ATOM 0 HZ3 TRP A 179 -3.244 6.060 0.898 1.00 0.21 H new ATOM 0 HH2 TRP A 179 -2.827 8.340 1.728 1.00 0.24 H new ATOM 1739 N SER A 180 -0.714 2.777 -3.796 1.00 0.23 N ATOM 1740 CA SER A 180 -1.235 1.604 -4.472 1.00 0.28 C ATOM 1741 C SER A 180 -2.542 1.975 -5.158 1.00 0.28 C ATOM 1742 O SER A 180 -2.998 3.118 -5.054 1.00 0.36 O ATOM 1743 CB SER A 180 -1.465 0.463 -3.470 1.00 0.33 C ATOM 1744 OG SER A 180 -1.766 -0.754 -4.126 1.00 1.06 O ATOM 0 H SER A 180 -0.889 2.796 -2.791 1.00 0.23 H new ATOM 0 HA SER A 180 -0.514 1.260 -5.214 1.00 0.28 H new ATOM 0 HB2 SER A 180 -0.575 0.334 -2.854 1.00 0.33 H new ATOM 0 HB3 SER A 180 -2.282 0.727 -2.799 1.00 0.33 H new ATOM 0 HG SER A 180 -1.905 -1.459 -3.460 1.00 1.06 H new ATOM 1750 N GLU A 181 -3.143 1.029 -5.854 1.00 0.31 N ATOM 1751 CA GLU A 181 -4.430 1.271 -6.484 1.00 0.38 C ATOM 1752 C GLU A 181 -5.486 1.496 -5.411 1.00 0.34 C ATOM 1753 O GLU A 181 -5.408 0.904 -4.335 1.00 0.49 O ATOM 1754 CB GLU A 181 -4.843 0.094 -7.365 1.00 0.56 C ATOM 1755 CG GLU A 181 -3.868 -0.213 -8.487 1.00 0.74 C ATOM 1756 CD GLU A 181 -4.418 -1.244 -9.444 1.00 1.38 C ATOM 1757 OE1 GLU A 181 -4.909 -0.853 -10.524 1.00 2.12 O ATOM 1758 OE2 GLU A 181 -4.376 -2.449 -9.118 1.00 1.91 O ATOM 0 H GLU A 181 -2.766 0.092 -5.998 1.00 0.31 H new ATOM 0 HA GLU A 181 -4.342 2.156 -7.114 1.00 0.38 H new ATOM 0 HB2 GLU A 181 -4.952 -0.793 -6.740 1.00 0.56 H new ATOM 0 HB3 GLU A 181 -5.822 0.303 -7.796 1.00 0.56 H new ATOM 0 HG2 GLU A 181 -3.641 0.703 -9.032 1.00 0.74 H new ATOM 0 HG3 GLU A 181 -2.930 -0.573 -8.065 1.00 0.74 H new ATOM 1765 N PRO A 182 -6.470 2.367 -5.664 1.00 0.29 N ATOM 1766 CA PRO A 182 -7.553 2.597 -4.725 1.00 0.26 C ATOM 1767 C PRO A 182 -8.627 1.523 -4.850 1.00 0.28 C ATOM 1768 O PRO A 182 -9.305 1.422 -5.875 1.00 0.32 O ATOM 1769 CB PRO A 182 -8.113 3.970 -5.133 1.00 0.29 C ATOM 1770 CG PRO A 182 -7.344 4.404 -6.347 1.00 0.35 C ATOM 1771 CD PRO A 182 -6.617 3.192 -6.866 1.00 0.39 C ATOM 0 HA PRO A 182 -7.216 2.566 -3.689 1.00 0.26 H new ATOM 0 HB2 PRO A 182 -9.179 3.904 -5.353 1.00 0.29 H new ATOM 0 HB3 PRO A 182 -7.998 4.691 -4.324 1.00 0.29 H new ATOM 0 HG2 PRO A 182 -8.016 4.805 -7.106 1.00 0.35 H new ATOM 0 HG3 PRO A 182 -6.640 5.197 -6.094 1.00 0.35 H new ATOM 0 HD2 PRO A 182 -7.186 2.680 -7.642 1.00 0.39 H new ATOM 0 HD3 PRO A 182 -5.651 3.453 -7.299 1.00 0.39 H new ATOM 1779 N MET A 183 -8.770 0.711 -3.816 1.00 0.28 N ATOM 1780 CA MET A 183 -9.794 -0.318 -3.800 1.00 0.30 C ATOM 1781 C MET A 183 -10.980 0.134 -2.976 1.00 0.26 C ATOM 1782 O MET A 183 -10.829 0.602 -1.848 1.00 0.25 O ATOM 1783 CB MET A 183 -9.264 -1.659 -3.273 1.00 0.34 C ATOM 1784 CG MET A 183 -8.468 -1.573 -1.982 1.00 0.29 C ATOM 1785 SD MET A 183 -6.765 -1.056 -2.261 1.00 0.31 S ATOM 1786 CE MET A 183 -6.142 -1.030 -0.588 1.00 0.27 C ATOM 0 H MET A 183 -8.190 0.745 -2.978 1.00 0.28 H new ATOM 0 HA MET A 183 -10.108 -0.476 -4.832 1.00 0.30 H new ATOM 0 HB2 MET A 183 -10.109 -2.330 -3.117 1.00 0.34 H new ATOM 0 HB3 MET A 183 -8.635 -2.111 -4.040 1.00 0.34 H new ATOM 0 HG2 MET A 183 -8.953 -0.869 -1.305 1.00 0.29 H new ATOM 0 HG3 MET A 183 -8.474 -2.545 -1.489 1.00 0.29 H new ATOM 0 HE1 MET A 183 -5.166 -0.545 -0.571 1.00 0.27 H new ATOM 0 HE2 MET A 183 -6.833 -0.478 0.049 1.00 0.27 H new ATOM 0 HE3 MET A 183 -6.046 -2.051 -0.220 1.00 0.27 H new ATOM 1796 N ARG A 184 -12.161 0.002 -3.548 1.00 0.28 N ATOM 1797 CA ARG A 184 -13.373 0.412 -2.875 1.00 0.29 C ATOM 1798 C ARG A 184 -14.116 -0.803 -2.358 1.00 0.31 C ATOM 1799 O ARG A 184 -14.729 -1.546 -3.130 1.00 0.39 O ATOM 1800 CB ARG A 184 -14.265 1.218 -3.819 1.00 0.35 C ATOM 1801 CG ARG A 184 -15.551 1.704 -3.172 1.00 1.17 C ATOM 1802 CD ARG A 184 -16.488 2.329 -4.191 1.00 1.16 C ATOM 1803 NE ARG A 184 -17.713 2.825 -3.570 1.00 1.88 N ATOM 1804 CZ ARG A 184 -18.897 2.872 -4.181 1.00 2.24 C ATOM 1805 NH1 ARG A 184 -19.029 2.428 -5.425 1.00 1.94 N ATOM 1806 NH2 ARG A 184 -19.953 3.359 -3.540 1.00 3.32 N ATOM 0 H ARG A 184 -12.305 -0.387 -4.480 1.00 0.28 H new ATOM 0 HA ARG A 184 -13.105 1.047 -2.031 1.00 0.29 H new ATOM 0 HB2 ARG A 184 -13.706 2.078 -4.188 1.00 0.35 H new ATOM 0 HB3 ARG A 184 -14.513 0.604 -4.685 1.00 0.35 H new ATOM 0 HG2 ARG A 184 -16.051 0.868 -2.682 1.00 1.17 H new ATOM 0 HG3 ARG A 184 -15.316 2.434 -2.397 1.00 1.17 H new ATOM 0 HD2 ARG A 184 -15.979 3.149 -4.697 1.00 1.16 H new ATOM 0 HD3 ARG A 184 -16.740 1.592 -4.953 1.00 1.16 H new ATOM 0 HE ARG A 184 -17.659 3.157 -2.607 1.00 1.88 H new ATOM 0 HH11 ARG A 184 -18.222 2.048 -5.919 1.00 1.94 H new ATOM 0 HH12 ARG A 184 -19.938 2.467 -5.887 1.00 1.94 H new ATOM 0 HH21 ARG A 184 -19.857 3.696 -2.582 1.00 3.32 H new ATOM 0 HH22 ARG A 184 -20.860 3.396 -4.006 1.00 3.32 H new ATOM 1820 N LEU A 185 -14.047 -1.007 -1.055 1.00 0.28 N ATOM 1821 CA LEU A 185 -14.733 -2.115 -0.430 1.00 0.32 C ATOM 1822 C LEU A 185 -16.154 -1.705 -0.118 1.00 0.36 C ATOM 1823 O LEU A 185 -16.412 -1.039 0.881 1.00 0.51 O ATOM 1824 CB LEU A 185 -14.049 -2.547 0.869 1.00 0.36 C ATOM 1825 CG LEU A 185 -12.542 -2.787 0.796 1.00 0.46 C ATOM 1826 CD1 LEU A 185 -12.060 -3.384 2.107 1.00 0.75 C ATOM 1827 CD2 LEU A 185 -12.188 -3.695 -0.371 1.00 0.74 C ATOM 0 H LEU A 185 -13.521 -0.417 -0.411 1.00 0.28 H new ATOM 0 HA LEU A 185 -14.712 -2.956 -1.123 1.00 0.32 H new ATOM 0 HB2 LEU A 185 -14.237 -1.784 1.624 1.00 0.36 H new ATOM 0 HB3 LEU A 185 -14.525 -3.464 1.217 1.00 0.36 H new ATOM 0 HG LEU A 185 -12.042 -1.832 0.632 1.00 0.46 H new ATOM 0 HD11 LEU A 185 -10.985 -3.555 2.055 1.00 0.75 H new ATOM 0 HD12 LEU A 185 -12.279 -2.695 2.923 1.00 0.75 H new ATOM 0 HD13 LEU A 185 -12.570 -4.331 2.285 1.00 0.75 H new ATOM 0 HD21 LEU A 185 -11.109 -3.848 -0.398 1.00 0.74 H new ATOM 0 HD22 LEU A 185 -12.688 -4.656 -0.249 1.00 0.74 H new ATOM 0 HD23 LEU A 185 -12.513 -3.233 -1.303 1.00 0.74 H new ATOM 1839 N ALA A 186 -17.065 -2.072 -0.985 1.00 0.57 N ATOM 1840 CA ALA A 186 -18.466 -1.828 -0.742 1.00 0.77 C ATOM 1841 C ALA A 186 -19.020 -2.953 0.115 1.00 1.02 C ATOM 1842 O ALA A 186 -18.432 -4.034 0.176 1.00 1.53 O ATOM 1843 CB ALA A 186 -19.218 -1.716 -2.059 1.00 1.00 C ATOM 0 H ALA A 186 -16.861 -2.542 -1.867 1.00 0.57 H new ATOM 0 HA ALA A 186 -18.592 -0.884 -0.211 1.00 0.77 H new ATOM 0 HB1 ALA A 186 -20.274 -1.532 -1.861 1.00 1.00 H new ATOM 0 HB2 ALA A 186 -18.809 -0.891 -2.642 1.00 1.00 H new ATOM 0 HB3 ALA A 186 -19.111 -2.645 -2.619 1.00 1.00 H new ATOM 1849 N LYS A 187 -20.119 -2.708 0.799 1.00 0.89 N ATOM 1850 CA LYS A 187 -20.735 -3.739 1.614 1.00 1.11 C ATOM 1851 C LYS A 187 -22.245 -3.700 1.471 1.00 1.49 C ATOM 1852 O LYS A 187 -22.889 -2.713 1.829 1.00 1.61 O ATOM 1853 CB LYS A 187 -20.344 -3.596 3.086 1.00 1.11 C ATOM 1854 CG LYS A 187 -18.873 -3.860 3.361 1.00 1.17 C ATOM 1855 CD LYS A 187 -18.588 -3.896 4.851 1.00 1.45 C ATOM 1856 CE LYS A 187 -17.113 -4.122 5.130 1.00 1.82 C ATOM 1857 NZ LYS A 187 -16.837 -4.240 6.587 1.00 2.78 N ATOM 0 H LYS A 187 -20.603 -1.810 0.808 1.00 0.89 H new ATOM 0 HA LYS A 187 -20.369 -4.702 1.258 1.00 1.11 H new ATOM 0 HB2 LYS A 187 -20.591 -2.589 3.421 1.00 1.11 H new ATOM 0 HB3 LYS A 187 -20.944 -4.286 3.680 1.00 1.11 H new ATOM 0 HG2 LYS A 187 -18.581 -4.808 2.910 1.00 1.17 H new ATOM 0 HG3 LYS A 187 -18.268 -3.084 2.892 1.00 1.17 H new ATOM 0 HD2 LYS A 187 -18.906 -2.958 5.306 1.00 1.45 H new ATOM 0 HD3 LYS A 187 -19.173 -4.690 5.315 1.00 1.45 H new ATOM 0 HE2 LYS A 187 -16.782 -5.028 4.623 1.00 1.82 H new ATOM 0 HE3 LYS A 187 -16.534 -3.296 4.716 1.00 1.82 H new ATOM 0 HZ1 LYS A 187 -15.820 -4.105 6.760 1.00 2.78 H new ATOM 0 HZ2 LYS A 187 -17.375 -3.515 7.102 1.00 2.78 H new ATOM 0 HZ3 LYS A 187 -17.122 -5.183 6.919 1.00 2.78 H new ATOM 1871 N CYS A 188 -22.796 -4.768 0.927 1.00 1.82 N ATOM 1872 CA CYS A 188 -24.230 -4.898 0.776 1.00 2.29 C ATOM 1873 C CYS A 188 -24.719 -6.091 1.582 1.00 2.51 C ATOM 1874 O CYS A 188 -24.294 -7.224 1.350 1.00 2.68 O ATOM 1875 CB CYS A 188 -24.581 -5.064 -0.705 1.00 2.71 C ATOM 1876 SG CYS A 188 -23.577 -6.307 -1.555 1.00 3.14 S ATOM 0 H CYS A 188 -22.264 -5.566 0.579 1.00 1.82 H new ATOM 0 HA CYS A 188 -24.722 -3.999 1.148 1.00 2.29 H new ATOM 0 HB2 CYS A 188 -25.633 -5.338 -0.792 1.00 2.71 H new ATOM 0 HB3 CYS A 188 -24.459 -4.105 -1.208 1.00 2.71 H new ATOM 0 HG CYS A 188 -23.407 -7.334 -0.777 1.00 3.14 H new ATOM 1882 N ASP A 189 -25.596 -5.840 2.537 1.00 2.70 N ATOM 1883 CA ASP A 189 -26.117 -6.907 3.374 1.00 3.08 C ATOM 1884 C ASP A 189 -27.450 -7.402 2.825 1.00 3.61 C ATOM 1885 O ASP A 189 -28.524 -6.951 3.220 1.00 3.87 O ATOM 1886 CB ASP A 189 -26.234 -6.458 4.842 1.00 3.12 C ATOM 1887 CG ASP A 189 -27.173 -5.284 5.055 1.00 3.50 C ATOM 1888 OD1 ASP A 189 -28.196 -5.460 5.748 1.00 3.76 O ATOM 1889 OD2 ASP A 189 -26.886 -4.176 4.550 1.00 4.05 O ATOM 0 H ASP A 189 -25.961 -4.912 2.752 1.00 2.70 H new ATOM 0 HA ASP A 189 -25.414 -7.740 3.354 1.00 3.08 H new ATOM 0 HB2 ASP A 189 -26.579 -7.300 5.442 1.00 3.12 H new ATOM 0 HB3 ASP A 189 -25.244 -6.189 5.209 1.00 3.12 H new ATOM 1894 N GLU A 190 -27.364 -8.324 1.885 1.00 3.97 N ATOM 1895 CA GLU A 190 -28.545 -8.901 1.279 1.00 4.63 C ATOM 1896 C GLU A 190 -28.573 -10.396 1.551 1.00 5.25 C ATOM 1897 O GLU A 190 -29.287 -10.817 2.482 1.00 5.64 O ATOM 1898 CB GLU A 190 -28.562 -8.631 -0.227 1.00 4.83 C ATOM 1899 CG GLU A 190 -29.883 -8.977 -0.893 1.00 5.57 C ATOM 1900 CD GLU A 190 -31.021 -8.098 -0.414 1.00 5.94 C ATOM 1901 OE1 GLU A 190 -31.042 -6.904 -0.774 1.00 6.06 O ATOM 1902 OE2 GLU A 190 -31.901 -8.597 0.320 1.00 6.43 O ATOM 1903 OXT GLU A 190 -27.850 -11.138 0.855 1.00 5.62 O ATOM 0 H GLU A 190 -26.483 -8.690 1.524 1.00 3.97 H new ATOM 0 HA GLU A 190 -29.432 -8.440 1.715 1.00 4.63 H new ATOM 0 HB2 GLU A 190 -28.342 -7.578 -0.401 1.00 4.83 H new ATOM 0 HB3 GLU A 190 -27.765 -9.205 -0.700 1.00 4.83 H new ATOM 0 HG2 GLU A 190 -29.779 -8.875 -1.973 1.00 5.57 H new ATOM 0 HG3 GLU A 190 -30.125 -10.021 -0.693 1.00 5.57 H new TER 1910 GLU A 190