USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1126 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: B 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: B 46 ASN :FLIP amide:sc= -1.96! C(o=-4.8!,f=-0.86!) USER MOD Set 2.2: B 48 GLN :FLIP amide:sc= 1.09 F(o=-3.6,f=-0.86) USER MOD Set 3.1: A 24 GLN : amide:sc= -0.456 X(o=-5.9,f=-6) USER MOD Set 3.2: A 69 ASN : amide:sc= -0.17 K(o=-5.9,f=-8.7!) USER MOD Set 3.3: B 29 LYS NZ :NH3+ -164:sc=-0.00262 (180deg=0) USER MOD Set 3.4: B 30 SER OG : rot -58:sc= -0.0509 USER MOD Set 3.5: B 34 HIS : no HE2:sc= -5.19! C(o=-5.9!,f=-12!) USER MOD Set 4.1: A 43 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: B 27 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.201) USER MOD Set 5.1: A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: B 24 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Set 6.1: A 46 ASN : amide:sc= -2.7! C(o=-2.7!,f=-3.1!) USER MOD Set 6.2: A 48 GLN : amide:sc= -0.0364 X(o=-2.7,f=-2.7) USER MOD Set 7.1: A 30 SER OG : rot 105:sc= -0.315 USER MOD Set 7.2: B 66 MET CE :methyl -136:sc= -3.73! (180deg=-10.9!) USER MOD Set 8.1: A 14 THR OG1 : rot 33:sc= -0.0679 USER MOD Set 8.2: A 53 ASN :FLIP amide:sc= -3.03! C(o=-4.5!,f=-3.1!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 HIS :FLIP no HD1:sc= -0.694 F(o=-1.5,f=-0.69) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -3.71! C(o=-3.7!,f=-4.8!) USER MOD Single : A 25 SER OG : rot 180:sc= -0.583 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 HIS : no HD1:sc= -4.57! C(o=-4.6!,f=-5.7!) USER MOD Single : A 37 GLN : amide:sc= -0.83 X(o=-0.83,f=-0.38) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 156:sc= -1.82 (180deg=-3.49!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot -170:sc= -0.45 USER MOD Single : A 58 MET CE :methyl 158:sc= -0.499 (180deg=-2.06!) USER MOD Single : A 60 LYS NZ :NH3+ -133:sc= -0.252 (180deg=-1.36!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 MET CE :methyl -156:sc= -5.55! (180deg=-9.78!) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -1.98 K(o=-2,f=-6.5!) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 10 GLN : amide:sc= -0.0216 X(o=-0.022,f=0) USER MOD Single : B 13 GLN : amide:sc=-0.00403 X(o=-0.004,f=0) USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 16 GLN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : B 19 HIS : no HD1:sc= -0.797 X(o=-0.8,f=-0.65) USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 ASN : amide:sc= -2.65! C(o=-2.6!,f=-4.1!) USER MOD Single : B 25 SER OG : rot 180:sc= -1.19 USER MOD Single : B 37 GLN : amide:sc= -0.209 X(o=-0.21,f=0) USER MOD Single : B 38 THR OG1 : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= -0.246 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 ASN : amide:sc= -0.0352 X(o=-0.035,f=-0.24) USER MOD Single : B 56 SER OG : rot -120:sc= -0.324 USER MOD Single : B 58 MET CE :methyl -167:sc= -0.109 (180deg=-0.634) USER MOD Single : B 60 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0259) USER MOD Single : B 61 LYS NZ :NH3+ -162:sc= -0.201 (180deg=-0.571) USER MOD Single : B 69 ASN : amide:sc= -0.518 X(o=-0.52,f=-0.16) USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 SER OG : rot 180:sc= 0 USER MOD Single : B 73 ASN : amide:sc= -0.0159 X(o=-0.016,f=-0.38) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 5 -9.241 -16.624 -16.388 1.00 0.00 N ATOM 2 CA THR A 5 -10.101 -17.524 -15.639 1.00 0.00 C ATOM 3 C THR A 5 -9.319 -18.190 -14.506 1.00 0.00 C ATOM 4 O THR A 5 -9.855 -18.408 -13.421 1.00 0.00 O ATOM 5 CB THR A 5 -10.712 -18.522 -16.625 1.00 0.00 C ATOM 6 OG1 THR A 5 -11.252 -19.545 -15.792 1.00 0.00 O ATOM 7 CG2 THR A 5 -9.653 -19.243 -17.461 1.00 0.00 C ATOM 0 HA THR A 5 -10.914 -16.983 -15.155 1.00 0.00 H new ATOM 0 HB THR A 5 -11.404 -18.001 -17.287 1.00 0.00 H new ATOM 0 HG1 THR A 5 -11.670 -20.234 -16.349 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.140 -19.939 -18.144 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.082 -18.512 -18.034 1.00 0.00 H new ATOM 0 HG23 THR A 5 -8.981 -19.792 -16.802 1.00 0.00 H new ATOM 15 N GLU A 6 -8.062 -18.495 -14.797 1.00 0.00 N ATOM 16 CA GLU A 6 -7.201 -19.133 -13.816 1.00 0.00 C ATOM 17 C GLU A 6 -6.055 -18.195 -13.427 1.00 0.00 C ATOM 18 O GLU A 6 -4.968 -18.269 -13.996 1.00 0.00 O ATOM 19 CB GLU A 6 -6.664 -20.466 -14.341 1.00 0.00 C ATOM 20 CG GLU A 6 -6.235 -21.376 -13.188 1.00 0.00 C ATOM 21 CD GLU A 6 -5.158 -22.364 -13.641 1.00 0.00 C ATOM 22 OE1 GLU A 6 -5.550 -23.451 -14.118 1.00 0.00 O ATOM 23 OE2 GLU A 6 -3.968 -22.010 -13.501 1.00 0.00 O ATOM 0 H GLU A 6 -7.620 -18.312 -15.698 1.00 0.00 H new ATOM 0 HA GLU A 6 -7.792 -19.343 -12.925 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -7.431 -20.963 -14.935 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -5.816 -20.286 -15.002 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -5.855 -20.771 -12.364 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -7.099 -21.922 -12.810 1.00 0.00 H new ATOM 30 N LEU A 7 -6.339 -17.335 -12.460 1.00 0.00 N ATOM 31 CA LEU A 7 -5.347 -16.385 -11.988 1.00 0.00 C ATOM 32 C LEU A 7 -4.804 -16.849 -10.635 1.00 0.00 C ATOM 33 O LEU A 7 -5.408 -17.695 -9.978 1.00 0.00 O ATOM 34 CB LEU A 7 -5.929 -14.970 -11.965 1.00 0.00 C ATOM 35 CG LEU A 7 -6.406 -14.418 -13.309 1.00 0.00 C ATOM 36 CD1 LEU A 7 -7.863 -14.803 -13.574 1.00 0.00 C ATOM 37 CD2 LEU A 7 -6.189 -12.906 -13.390 1.00 0.00 C ATOM 0 H LEU A 7 -7.243 -17.277 -11.990 1.00 0.00 H new ATOM 0 HA LEU A 7 -4.501 -16.346 -12.674 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.769 -14.955 -11.270 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.173 -14.294 -11.565 1.00 0.00 H new ATOM 0 HG LEU A 7 -5.804 -14.872 -14.097 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -8.177 -14.398 -14.536 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -7.955 -15.889 -13.590 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -8.496 -14.397 -12.785 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.537 -12.540 -14.356 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -6.748 -12.415 -12.593 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -5.128 -12.684 -13.279 1.00 0.00 H new ATOM 49 N ARG A 8 -3.670 -16.276 -10.260 1.00 0.00 N ATOM 50 CA ARG A 8 -3.040 -16.621 -8.997 1.00 0.00 C ATOM 51 C ARG A 8 -2.575 -15.356 -8.273 1.00 0.00 C ATOM 52 O ARG A 8 -3.228 -14.317 -8.350 1.00 0.00 O ATOM 53 CB ARG A 8 -1.840 -17.546 -9.215 1.00 0.00 C ATOM 54 CG ARG A 8 -2.148 -18.601 -10.279 1.00 0.00 C ATOM 55 CD ARG A 8 -0.876 -19.337 -10.704 1.00 0.00 C ATOM 56 NE ARG A 8 -1.191 -20.747 -11.028 1.00 0.00 N ATOM 57 CZ ARG A 8 -1.573 -21.658 -10.123 1.00 0.00 C ATOM 58 NH1 ARG A 8 -1.690 -21.313 -8.833 1.00 0.00 N ATOM 59 NH2 ARG A 8 -1.839 -22.914 -10.507 1.00 0.00 N ATOM 0 H ARG A 8 -3.171 -15.575 -10.808 1.00 0.00 H new ATOM 0 HA ARG A 8 -3.780 -17.141 -8.388 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -0.974 -16.959 -9.520 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -1.579 -18.036 -8.277 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -2.873 -19.315 -9.889 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -2.605 -18.125 -11.147 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -0.434 -18.846 -11.571 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -0.137 -19.295 -9.904 1.00 0.00 H new ATOM 0 HE ARG A 8 -1.112 -21.043 -12.001 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -1.488 -20.357 -8.540 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -1.981 -22.007 -8.144 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -1.751 -23.177 -11.489 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -2.130 -23.607 -9.818 1.00 0.00 H new ATOM 73 N CYS A 9 -1.449 -15.485 -7.586 1.00 0.00 N ATOM 74 CA CYS A 9 -0.889 -14.365 -6.849 1.00 0.00 C ATOM 75 C CYS A 9 0.126 -13.658 -7.749 1.00 0.00 C ATOM 76 O CYS A 9 0.743 -14.285 -8.608 1.00 0.00 O ATOM 77 CB CYS A 9 -0.265 -14.814 -5.526 1.00 0.00 C ATOM 78 SG CYS A 9 -1.377 -15.781 -4.441 1.00 0.00 S ATOM 0 H CYS A 9 -0.909 -16.348 -7.524 1.00 0.00 H new ATOM 0 HA CYS A 9 -1.683 -13.668 -6.582 1.00 0.00 H new ATOM 0 HB2 CYS A 9 0.619 -15.413 -5.743 1.00 0.00 H new ATOM 0 HB3 CYS A 9 0.073 -13.932 -4.982 1.00 0.00 H new ATOM 83 N GLN A 10 0.268 -12.360 -7.520 1.00 0.00 N ATOM 84 CA GLN A 10 1.198 -11.561 -8.299 1.00 0.00 C ATOM 85 C GLN A 10 2.635 -11.819 -7.839 1.00 0.00 C ATOM 86 O GLN A 10 3.582 -11.316 -8.441 1.00 0.00 O ATOM 87 CB GLN A 10 0.852 -10.073 -8.207 1.00 0.00 C ATOM 88 CG GLN A 10 1.415 -9.304 -9.404 1.00 0.00 C ATOM 89 CD GLN A 10 2.073 -7.998 -8.957 1.00 0.00 C ATOM 90 OE1 GLN A 10 3.272 -7.805 -9.073 1.00 0.00 O ATOM 91 NE2 GLN A 10 1.224 -7.114 -8.441 1.00 0.00 N ATOM 0 H GLN A 10 -0.245 -11.843 -6.806 1.00 0.00 H new ATOM 0 HA GLN A 10 1.113 -11.857 -9.345 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -0.230 -9.949 -8.167 1.00 0.00 H new ATOM 0 HB3 GLN A 10 1.254 -9.659 -7.282 1.00 0.00 H new ATOM 0 HG2 GLN A 10 2.144 -9.922 -9.927 1.00 0.00 H new ATOM 0 HG3 GLN A 10 0.614 -9.088 -10.111 1.00 0.00 H new ATOM 0 HE21 GLN A 10 0.232 -7.340 -8.373 1.00 0.00 H new ATOM 0 HE22 GLN A 10 1.565 -6.210 -8.113 1.00 0.00 H new ATOM 100 N CYS A 11 2.750 -12.602 -6.777 1.00 0.00 N ATOM 101 CA CYS A 11 4.055 -12.933 -6.230 1.00 0.00 C ATOM 102 C CYS A 11 4.001 -14.365 -5.692 1.00 0.00 C ATOM 103 O CYS A 11 3.097 -14.714 -4.936 1.00 0.00 O ATOM 104 CB CYS A 11 4.487 -11.935 -5.154 1.00 0.00 C ATOM 105 SG CYS A 11 6.141 -11.196 -5.413 1.00 0.00 S ATOM 0 H CYS A 11 1.961 -13.017 -6.281 1.00 0.00 H new ATOM 0 HA CYS A 11 4.808 -12.869 -7.015 1.00 0.00 H new ATOM 0 HB2 CYS A 11 3.750 -11.133 -5.105 1.00 0.00 H new ATOM 0 HB3 CYS A 11 4.476 -12.438 -4.187 1.00 0.00 H new ATOM 110 N LEU A 12 4.982 -15.155 -6.105 1.00 0.00 N ATOM 111 CA LEU A 12 5.058 -16.541 -5.674 1.00 0.00 C ATOM 112 C LEU A 12 5.917 -16.631 -4.411 1.00 0.00 C ATOM 113 O LEU A 12 5.842 -17.613 -3.674 1.00 0.00 O ATOM 114 CB LEU A 12 5.549 -17.431 -6.817 1.00 0.00 C ATOM 115 CG LEU A 12 4.921 -17.171 -8.187 1.00 0.00 C ATOM 116 CD1 LEU A 12 5.878 -17.565 -9.313 1.00 0.00 C ATOM 117 CD2 LEU A 12 3.568 -17.874 -8.313 1.00 0.00 C ATOM 0 H LEU A 12 5.730 -14.862 -6.733 1.00 0.00 H new ATOM 0 HA LEU A 12 4.068 -16.914 -5.413 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.629 -17.311 -6.906 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.365 -18.471 -6.546 1.00 0.00 H new ATOM 0 HG LEU A 12 4.738 -16.101 -8.280 1.00 0.00 H new ATOM 0 HD11 LEU A 12 5.407 -17.370 -10.276 1.00 0.00 H new ATOM 0 HD12 LEU A 12 6.795 -16.981 -9.233 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.116 -18.626 -9.234 1.00 0.00 H new ATOM 0 HD21 LEU A 12 3.143 -17.673 -9.297 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.703 -18.948 -8.189 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.892 -17.503 -7.543 1.00 0.00 H new ATOM 129 N GLN A 13 6.713 -15.594 -4.200 1.00 0.00 N ATOM 130 CA GLN A 13 7.586 -15.544 -3.039 1.00 0.00 C ATOM 131 C GLN A 13 7.517 -14.164 -2.382 1.00 0.00 C ATOM 132 O GLN A 13 6.906 -13.244 -2.924 1.00 0.00 O ATOM 133 CB GLN A 13 9.025 -15.899 -3.419 1.00 0.00 C ATOM 134 CG GLN A 13 9.752 -16.565 -2.249 1.00 0.00 C ATOM 135 CD GLN A 13 10.212 -17.976 -2.623 1.00 0.00 C ATOM 136 OE1 GLN A 13 11.376 -18.229 -2.885 1.00 0.00 O ATOM 137 NE2 GLN A 13 9.235 -18.879 -2.632 1.00 0.00 N ATOM 0 H GLN A 13 6.772 -14.781 -4.813 1.00 0.00 H new ATOM 0 HA GLN A 13 7.242 -16.286 -2.318 1.00 0.00 H new ATOM 0 HB2 GLN A 13 9.023 -16.568 -4.279 1.00 0.00 H new ATOM 0 HB3 GLN A 13 9.559 -14.997 -3.718 1.00 0.00 H new ATOM 0 HG2 GLN A 13 10.613 -15.962 -1.960 1.00 0.00 H new ATOM 0 HG3 GLN A 13 9.091 -16.611 -1.384 1.00 0.00 H new ATOM 0 HE21 GLN A 13 8.281 -18.600 -2.403 1.00 0.00 H new ATOM 0 HE22 GLN A 13 9.440 -19.850 -2.868 1.00 0.00 H new ATOM 146 N THR A 14 8.151 -14.063 -1.223 1.00 0.00 N ATOM 147 CA THR A 14 8.169 -12.811 -0.486 1.00 0.00 C ATOM 148 C THR A 14 9.377 -12.761 0.452 1.00 0.00 C ATOM 149 O THR A 14 10.010 -13.784 0.708 1.00 0.00 O ATOM 150 CB THR A 14 6.830 -12.670 0.240 1.00 0.00 C ATOM 151 OG1 THR A 14 6.624 -13.946 0.839 1.00 0.00 O ATOM 152 CG2 THR A 14 5.653 -12.518 -0.726 1.00 0.00 C ATOM 0 H THR A 14 8.656 -14.828 -0.776 1.00 0.00 H new ATOM 0 HA THR A 14 8.283 -11.959 -1.157 1.00 0.00 H new ATOM 0 HB THR A 14 6.867 -11.807 0.905 1.00 0.00 H new ATOM 0 HG1 THR A 14 7.489 -14.332 1.092 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.727 -12.422 -0.159 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.798 -11.628 -1.339 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.595 -13.396 -1.369 1.00 0.00 H new ATOM 160 N LEU A 15 9.659 -11.561 0.938 1.00 0.00 N ATOM 161 CA LEU A 15 10.780 -11.365 1.842 1.00 0.00 C ATOM 162 C LEU A 15 10.274 -11.382 3.286 1.00 0.00 C ATOM 163 O LEU A 15 9.067 -11.401 3.524 1.00 0.00 O ATOM 164 CB LEU A 15 11.548 -10.094 1.475 1.00 0.00 C ATOM 165 CG LEU A 15 12.252 -10.104 0.116 1.00 0.00 C ATOM 166 CD1 LEU A 15 12.143 -8.740 -0.568 1.00 0.00 C ATOM 167 CD2 LEU A 15 13.705 -10.562 0.254 1.00 0.00 C ATOM 0 H LEU A 15 9.131 -10.715 0.723 1.00 0.00 H new ATOM 0 HA LEU A 15 11.495 -12.182 1.745 1.00 0.00 H new ATOM 0 HB2 LEU A 15 10.853 -9.255 1.496 1.00 0.00 H new ATOM 0 HB3 LEU A 15 12.295 -9.909 2.247 1.00 0.00 H new ATOM 0 HG LEU A 15 11.747 -10.827 -0.525 1.00 0.00 H new ATOM 0 HD11 LEU A 15 12.651 -8.774 -1.532 1.00 0.00 H new ATOM 0 HD12 LEU A 15 11.093 -8.492 -0.721 1.00 0.00 H new ATOM 0 HD13 LEU A 15 12.607 -7.980 0.060 1.00 0.00 H new ATOM 0 HD21 LEU A 15 14.182 -10.560 -0.726 1.00 0.00 H new ATOM 0 HD22 LEU A 15 14.239 -9.883 0.919 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.731 -11.570 0.668 1.00 0.00 H new ATOM 179 N GLN A 16 11.222 -11.376 4.211 1.00 0.00 N ATOM 180 CA GLN A 16 10.887 -11.391 5.625 1.00 0.00 C ATOM 181 C GLN A 16 11.030 -9.988 6.219 1.00 0.00 C ATOM 182 O GLN A 16 10.660 -9.756 7.369 1.00 0.00 O ATOM 183 CB GLN A 16 11.755 -12.398 6.383 1.00 0.00 C ATOM 184 CG GLN A 16 11.750 -12.104 7.885 1.00 0.00 C ATOM 185 CD GLN A 16 12.264 -13.306 8.680 1.00 0.00 C ATOM 186 OE1 GLN A 16 13.449 -13.458 8.928 1.00 0.00 O ATOM 187 NE2 GLN A 16 11.309 -14.148 9.065 1.00 0.00 N ATOM 0 H GLN A 16 12.222 -11.361 4.009 1.00 0.00 H new ATOM 0 HA GLN A 16 9.848 -11.705 5.729 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.386 -13.408 6.205 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.777 -12.361 6.005 1.00 0.00 H new ATOM 0 HG2 GLN A 16 12.373 -11.234 8.091 1.00 0.00 H new ATOM 0 HG3 GLN A 16 10.739 -11.856 8.207 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.336 -13.960 8.823 1.00 0.00 H new ATOM 0 HE22 GLN A 16 11.550 -14.981 9.602 1.00 0.00 H new ATOM 196 N GLY A 17 11.566 -9.088 5.407 1.00 0.00 N ATOM 197 CA GLY A 17 11.762 -7.714 5.838 1.00 0.00 C ATOM 198 C GLY A 17 13.063 -7.142 5.272 1.00 0.00 C ATOM 199 O GLY A 17 14.138 -7.371 5.824 1.00 0.00 O ATOM 0 H GLY A 17 11.870 -9.284 4.453 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.920 -7.103 5.512 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.785 -7.670 6.927 1.00 0.00 H new ATOM 203 N ILE A 18 12.923 -6.409 4.178 1.00 0.00 N ATOM 204 CA ILE A 18 14.074 -5.802 3.531 1.00 0.00 C ATOM 205 C ILE A 18 14.338 -4.430 4.152 1.00 0.00 C ATOM 206 O ILE A 18 13.426 -3.800 4.686 1.00 0.00 O ATOM 207 CB ILE A 18 13.877 -5.763 2.014 1.00 0.00 C ATOM 208 CG1 ILE A 18 14.227 -7.111 1.380 1.00 0.00 C ATOM 209 CG2 ILE A 18 14.667 -4.612 1.388 1.00 0.00 C ATOM 210 CD1 ILE A 18 15.708 -7.441 1.577 1.00 0.00 C ATOM 0 H ILE A 18 12.030 -6.221 3.723 1.00 0.00 H new ATOM 0 HA ILE A 18 14.967 -6.405 3.698 1.00 0.00 H new ATOM 0 HB ILE A 18 12.822 -5.577 1.811 1.00 0.00 H new ATOM 0 HG12 ILE A 18 13.614 -7.896 1.823 1.00 0.00 H new ATOM 0 HG13 ILE A 18 13.994 -7.088 0.315 1.00 0.00 H new ATOM 0 HG21 ILE A 18 14.510 -4.607 0.309 1.00 0.00 H new ATOM 0 HG22 ILE A 18 14.327 -3.666 1.809 1.00 0.00 H new ATOM 0 HG23 ILE A 18 15.728 -4.742 1.599 1.00 0.00 H new ATOM 0 HD11 ILE A 18 15.930 -8.404 1.117 1.00 0.00 H new ATOM 0 HD12 ILE A 18 16.318 -6.667 1.112 1.00 0.00 H new ATOM 0 HD13 ILE A 18 15.932 -7.488 2.643 1.00 0.00 H new ATOM 222 N HIS A 19 15.590 -4.006 4.063 1.00 0.00 N ATOM 223 CA HIS A 19 15.986 -2.720 4.610 1.00 0.00 C ATOM 224 C HIS A 19 15.016 -1.638 4.130 1.00 0.00 C ATOM 225 O HIS A 19 14.633 -1.616 2.961 1.00 0.00 O ATOM 226 CB HIS A 19 17.443 -2.406 4.262 1.00 0.00 C ATOM 227 CG HIS A 19 18.220 -1.769 5.390 1.00 0.00 C ATOM 228 ND1 HIS A 19 18.000 -0.616 6.083 1.00 0.00 N flip ATOM 229 CD2 HIS A 19 19.371 -2.329 5.917 1.00 0.00 C flip ATOM 230 CE1 HIS A 19 18.963 -0.478 6.986 1.00 0.00 C flip ATOM 231 NE2 HIS A 19 19.814 -1.539 6.884 1.00 0.00 N flip ATOM 0 H HIS A 19 16.344 -4.531 3.620 1.00 0.00 H new ATOM 0 HA HIS A 19 15.932 -2.752 5.698 1.00 0.00 H new ATOM 0 HB2 HIS A 19 17.942 -3.329 3.966 1.00 0.00 H new ATOM 0 HB3 HIS A 19 17.465 -1.741 3.399 1.00 0.00 H new ATOM 0 HD2 HIS A 19 19.830 -3.252 5.595 1.00 0.00 H new ATOM 0 HE1 HIS A 19 19.057 0.339 7.686 1.00 0.00 H new ATOM 0 HE2 HIS A 19 20.646 -1.697 7.453 1.00 0.00 H new ATOM 239 N LEU A 20 14.647 -0.766 5.057 1.00 0.00 N ATOM 240 CA LEU A 20 13.730 0.316 4.743 1.00 0.00 C ATOM 241 C LEU A 20 14.505 1.465 4.095 1.00 0.00 C ATOM 242 O LEU A 20 13.941 2.523 3.822 1.00 0.00 O ATOM 243 CB LEU A 20 12.944 0.731 5.989 1.00 0.00 C ATOM 244 CG LEU A 20 11.880 1.811 5.783 1.00 0.00 C ATOM 245 CD1 LEU A 20 10.787 1.328 4.827 1.00 0.00 C ATOM 246 CD2 LEU A 20 11.306 2.277 7.122 1.00 0.00 C ATOM 0 H LEU A 20 14.967 -0.787 6.025 1.00 0.00 H new ATOM 0 HA LEU A 20 12.985 -0.015 4.019 1.00 0.00 H new ATOM 0 HB2 LEU A 20 12.459 -0.155 6.400 1.00 0.00 H new ATOM 0 HB3 LEU A 20 13.651 1.084 6.739 1.00 0.00 H new ATOM 0 HG LEU A 20 12.355 2.675 5.318 1.00 0.00 H new ATOM 0 HD11 LEU A 20 10.043 2.114 4.698 1.00 0.00 H new ATOM 0 HD12 LEU A 20 11.230 1.085 3.861 1.00 0.00 H new ATOM 0 HD13 LEU A 20 10.308 0.440 5.240 1.00 0.00 H new ATOM 0 HD21 LEU A 20 10.552 3.045 6.947 1.00 0.00 H new ATOM 0 HD22 LEU A 20 10.850 1.431 7.637 1.00 0.00 H new ATOM 0 HD23 LEU A 20 12.106 2.688 7.738 1.00 0.00 H new ATOM 258 N LYS A 21 15.787 1.218 3.868 1.00 0.00 N ATOM 259 CA LYS A 21 16.645 2.218 3.257 1.00 0.00 C ATOM 260 C LYS A 21 16.569 2.089 1.735 1.00 0.00 C ATOM 261 O LYS A 21 16.978 2.994 1.010 1.00 0.00 O ATOM 262 CB LYS A 21 18.068 2.115 3.812 1.00 0.00 C ATOM 263 CG LYS A 21 18.757 0.841 3.320 1.00 0.00 C ATOM 264 CD LYS A 21 19.755 1.154 2.203 1.00 0.00 C ATOM 265 CE LYS A 21 20.915 0.156 2.208 1.00 0.00 C ATOM 266 NZ LYS A 21 22.172 0.824 2.613 1.00 0.00 N ATOM 0 H LYS A 21 16.252 0.339 4.097 1.00 0.00 H new ATOM 0 HA LYS A 21 16.300 3.221 3.510 1.00 0.00 H new ATOM 0 HB2 LYS A 21 18.646 2.987 3.505 1.00 0.00 H new ATOM 0 HB3 LYS A 21 18.038 2.119 4.902 1.00 0.00 H new ATOM 0 HG2 LYS A 21 19.274 0.359 4.150 1.00 0.00 H new ATOM 0 HG3 LYS A 21 18.009 0.136 2.957 1.00 0.00 H new ATOM 0 HD2 LYS A 21 19.248 1.123 1.239 1.00 0.00 H new ATOM 0 HD3 LYS A 21 20.141 2.166 2.328 1.00 0.00 H new ATOM 0 HE2 LYS A 21 20.695 -0.663 2.893 1.00 0.00 H new ATOM 0 HE3 LYS A 21 21.031 -0.280 1.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 22.949 0.133 2.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 22.389 1.590 1.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 22.063 1.219 3.569 1.00 0.00 H new ATOM 280 N ASN A 22 16.042 0.955 1.295 1.00 0.00 N ATOM 281 CA ASN A 22 15.906 0.696 -0.128 1.00 0.00 C ATOM 282 C ASN A 22 14.459 0.952 -0.554 1.00 0.00 C ATOM 283 O ASN A 22 14.210 1.660 -1.528 1.00 0.00 O ATOM 284 CB ASN A 22 16.246 -0.759 -0.458 1.00 0.00 C ATOM 285 CG ASN A 22 17.688 -0.888 -0.951 1.00 0.00 C ATOM 286 OD1 ASN A 22 18.197 -0.057 -1.685 1.00 0.00 O ATOM 287 ND2 ASN A 22 18.317 -1.973 -0.508 1.00 0.00 N ATOM 0 H ASN A 22 15.704 0.206 1.899 1.00 0.00 H new ATOM 0 HA ASN A 22 16.593 1.356 -0.657 1.00 0.00 H new ATOM 0 HB2 ASN A 22 16.104 -1.379 0.427 1.00 0.00 H new ATOM 0 HB3 ASN A 22 15.563 -1.132 -1.221 1.00 0.00 H new ATOM 0 HD21 ASN A 22 19.284 -2.149 -0.781 1.00 0.00 H new ATOM 0 HD22 ASN A 22 17.832 -2.629 0.104 1.00 0.00 H new ATOM 294 N ILE A 23 13.542 0.361 0.198 1.00 0.00 N ATOM 295 CA ILE A 23 12.126 0.516 -0.088 1.00 0.00 C ATOM 296 C ILE A 23 11.795 2.004 -0.214 1.00 0.00 C ATOM 297 O ILE A 23 12.115 2.792 0.675 1.00 0.00 O ATOM 298 CB ILE A 23 11.284 -0.215 0.959 1.00 0.00 C ATOM 299 CG1 ILE A 23 11.053 -1.673 0.557 1.00 0.00 C ATOM 300 CG2 ILE A 23 9.969 0.523 1.218 1.00 0.00 C ATOM 301 CD1 ILE A 23 11.427 -2.622 1.698 1.00 0.00 C ATOM 0 H ILE A 23 13.752 -0.226 1.005 1.00 0.00 H new ATOM 0 HA ILE A 23 11.878 0.052 -1.043 1.00 0.00 H new ATOM 0 HB ILE A 23 11.839 -0.224 1.897 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.007 -1.818 0.286 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.646 -1.909 -0.326 1.00 0.00 H new ATOM 0 HG21 ILE A 23 9.389 -0.018 1.966 1.00 0.00 H new ATOM 0 HG22 ILE A 23 10.182 1.529 1.581 1.00 0.00 H new ATOM 0 HG23 ILE A 23 9.398 0.585 0.292 1.00 0.00 H new ATOM 0 HD11 ILE A 23 11.253 -3.652 1.386 1.00 0.00 H new ATOM 0 HD12 ILE A 23 12.480 -2.491 1.950 1.00 0.00 H new ATOM 0 HD13 ILE A 23 10.815 -2.399 2.572 1.00 0.00 H new ATOM 313 N GLN A 24 11.159 2.345 -1.325 1.00 0.00 N ATOM 314 CA GLN A 24 10.782 3.725 -1.578 1.00 0.00 C ATOM 315 C GLN A 24 9.258 3.863 -1.601 1.00 0.00 C ATOM 316 O GLN A 24 8.729 4.964 -1.457 1.00 0.00 O ATOM 317 CB GLN A 24 11.398 4.231 -2.884 1.00 0.00 C ATOM 318 CG GLN A 24 11.870 5.679 -2.742 1.00 0.00 C ATOM 319 CD GLN A 24 10.688 6.650 -2.793 1.00 0.00 C ATOM 320 OE1 GLN A 24 10.305 7.254 -1.805 1.00 0.00 O ATOM 321 NE2 GLN A 24 10.135 6.765 -3.997 1.00 0.00 N ATOM 0 H GLN A 24 10.895 1.689 -2.060 1.00 0.00 H new ATOM 0 HA GLN A 24 11.171 4.342 -0.768 1.00 0.00 H new ATOM 0 HB2 GLN A 24 12.239 3.596 -3.164 1.00 0.00 H new ATOM 0 HB3 GLN A 24 10.665 4.161 -3.687 1.00 0.00 H new ATOM 0 HG2 GLN A 24 12.404 5.800 -1.800 1.00 0.00 H new ATOM 0 HG3 GLN A 24 12.574 5.915 -3.540 1.00 0.00 H new ATOM 0 HE21 GLN A 24 10.506 6.230 -4.782 1.00 0.00 H new ATOM 0 HE22 GLN A 24 9.340 7.389 -4.136 1.00 0.00 H new ATOM 330 N SER A 25 8.596 2.730 -1.783 1.00 0.00 N ATOM 331 CA SER A 25 7.144 2.711 -1.827 1.00 0.00 C ATOM 332 C SER A 25 6.625 1.344 -1.374 1.00 0.00 C ATOM 333 O SER A 25 7.368 0.364 -1.371 1.00 0.00 O ATOM 334 CB SER A 25 6.630 3.035 -3.231 1.00 0.00 C ATOM 335 OG SER A 25 7.652 3.582 -4.060 1.00 0.00 O ATOM 0 H SER A 25 9.038 1.819 -1.902 1.00 0.00 H new ATOM 0 HA SER A 25 6.772 3.478 -1.148 1.00 0.00 H new ATOM 0 HB2 SER A 25 6.236 2.129 -3.691 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.803 3.742 -3.160 1.00 0.00 H new ATOM 0 HG SER A 25 7.285 3.774 -4.948 1.00 0.00 H new ATOM 341 N VAL A 26 5.353 1.323 -1.004 1.00 0.00 N ATOM 342 CA VAL A 26 4.726 0.093 -0.551 1.00 0.00 C ATOM 343 C VAL A 26 3.386 -0.086 -1.268 1.00 0.00 C ATOM 344 O VAL A 26 2.671 0.886 -1.506 1.00 0.00 O ATOM 345 CB VAL A 26 4.590 0.105 0.973 1.00 0.00 C ATOM 346 CG1 VAL A 26 3.714 -1.052 1.455 1.00 0.00 C ATOM 347 CG2 VAL A 26 5.964 0.070 1.646 1.00 0.00 C ATOM 0 H VAL A 26 4.740 2.138 -1.009 1.00 0.00 H new ATOM 0 HA VAL A 26 5.347 -0.767 -0.802 1.00 0.00 H new ATOM 0 HB VAL A 26 4.101 1.036 1.258 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.634 -1.020 2.542 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.721 -0.964 1.015 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.162 -1.998 1.152 1.00 0.00 H new ATOM 0 HG21 VAL A 26 5.839 0.079 2.729 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.491 -0.837 1.349 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.541 0.942 1.340 1.00 0.00 H new ATOM 357 N LYS A 27 3.088 -1.335 -1.594 1.00 0.00 N ATOM 358 CA LYS A 27 1.848 -1.654 -2.280 1.00 0.00 C ATOM 359 C LYS A 27 1.286 -2.965 -1.725 1.00 0.00 C ATOM 360 O LYS A 27 1.987 -3.974 -1.679 1.00 0.00 O ATOM 361 CB LYS A 27 2.061 -1.669 -3.795 1.00 0.00 C ATOM 362 CG LYS A 27 0.770 -1.311 -4.534 1.00 0.00 C ATOM 363 CD LYS A 27 -0.237 -2.461 -4.466 1.00 0.00 C ATOM 364 CE LYS A 27 -0.593 -2.962 -5.867 1.00 0.00 C ATOM 365 NZ LYS A 27 0.470 -3.852 -6.385 1.00 0.00 N ATOM 0 H LYS A 27 3.684 -2.138 -1.396 1.00 0.00 H new ATOM 0 HA LYS A 27 1.101 -0.882 -2.095 1.00 0.00 H new ATOM 0 HB2 LYS A 27 2.846 -0.961 -4.062 1.00 0.00 H new ATOM 0 HB3 LYS A 27 2.402 -2.656 -4.108 1.00 0.00 H new ATOM 0 HG2 LYS A 27 0.333 -0.414 -4.096 1.00 0.00 H new ATOM 0 HG3 LYS A 27 0.995 -1.081 -5.575 1.00 0.00 H new ATOM 0 HD2 LYS A 27 0.179 -3.279 -3.878 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -1.140 -2.128 -3.954 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -1.542 -3.498 -5.838 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -0.726 -2.115 -6.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 0.212 -4.183 -7.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 1.368 -3.330 -6.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.577 -4.670 -5.751 1.00 0.00 H new ATOM 379 N VAL A 28 0.026 -2.907 -1.318 1.00 0.00 N ATOM 380 CA VAL A 28 -0.638 -4.076 -0.769 1.00 0.00 C ATOM 381 C VAL A 28 -1.787 -4.486 -1.692 1.00 0.00 C ATOM 382 O VAL A 28 -2.752 -3.740 -1.856 1.00 0.00 O ATOM 383 CB VAL A 28 -1.093 -3.795 0.664 1.00 0.00 C ATOM 384 CG1 VAL A 28 -2.148 -4.808 1.113 1.00 0.00 C ATOM 385 CG2 VAL A 28 0.097 -3.780 1.625 1.00 0.00 C ATOM 0 H VAL A 28 -0.552 -2.068 -1.358 1.00 0.00 H new ATOM 0 HA VAL A 28 0.053 -4.918 -0.717 1.00 0.00 H new ATOM 0 HB VAL A 28 -1.550 -2.805 0.682 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.454 -4.586 2.135 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.014 -4.748 0.454 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.729 -5.813 1.071 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.255 -3.578 2.637 1.00 0.00 H new ATOM 0 HG22 VAL A 28 0.596 -4.749 1.601 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.799 -3.003 1.323 1.00 0.00 H new ATOM 395 N LYS A 29 -1.646 -5.669 -2.271 1.00 0.00 N ATOM 396 CA LYS A 29 -2.661 -6.187 -3.173 1.00 0.00 C ATOM 397 C LYS A 29 -3.341 -7.396 -2.529 1.00 0.00 C ATOM 398 O LYS A 29 -2.921 -8.533 -2.738 1.00 0.00 O ATOM 399 CB LYS A 29 -2.055 -6.481 -4.548 1.00 0.00 C ATOM 400 CG LYS A 29 -3.144 -6.563 -5.620 1.00 0.00 C ATOM 401 CD LYS A 29 -3.743 -7.969 -5.687 1.00 0.00 C ATOM 402 CE LYS A 29 -3.475 -8.615 -7.048 1.00 0.00 C ATOM 403 NZ LYS A 29 -4.627 -8.412 -7.954 1.00 0.00 N ATOM 0 H LYS A 29 -0.844 -6.284 -2.133 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.436 -5.440 -3.344 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -1.340 -5.700 -4.809 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.503 -7.420 -4.513 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -3.929 -5.839 -5.402 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -2.725 -6.296 -6.590 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -3.317 -8.587 -4.897 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.817 -7.919 -5.509 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -2.577 -8.185 -7.491 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -3.289 -9.681 -6.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -4.428 -8.857 -8.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -5.477 -8.843 -7.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.787 -7.393 -8.090 1.00 0.00 H new ATOM 417 N SER A 30 -4.381 -7.109 -1.759 1.00 0.00 N ATOM 418 CA SER A 30 -5.123 -8.159 -1.083 1.00 0.00 C ATOM 419 C SER A 30 -5.457 -9.282 -2.068 1.00 0.00 C ATOM 420 O SER A 30 -5.224 -9.148 -3.268 1.00 0.00 O ATOM 421 CB SER A 30 -6.404 -7.609 -0.452 1.00 0.00 C ATOM 422 OG SER A 30 -6.334 -7.593 0.971 1.00 0.00 O ATOM 0 H SER A 30 -4.727 -6.165 -1.589 1.00 0.00 H new ATOM 0 HA SER A 30 -4.498 -8.559 -0.284 1.00 0.00 H new ATOM 0 HB2 SER A 30 -6.583 -6.598 -0.818 1.00 0.00 H new ATOM 0 HB3 SER A 30 -7.253 -8.216 -0.766 1.00 0.00 H new ATOM 0 HG SER A 30 -6.203 -6.673 1.282 1.00 0.00 H new ATOM 428 N PRO A 31 -6.011 -10.391 -1.509 1.00 0.00 N ATOM 429 CA PRO A 31 -6.379 -11.536 -2.325 1.00 0.00 C ATOM 430 C PRO A 31 -7.656 -11.255 -3.119 1.00 0.00 C ATOM 431 O PRO A 31 -8.270 -10.201 -2.963 1.00 0.00 O ATOM 432 CB PRO A 31 -6.530 -12.686 -1.343 1.00 0.00 C ATOM 433 CG PRO A 31 -6.699 -12.046 0.026 1.00 0.00 C ATOM 434 CD PRO A 31 -6.301 -10.583 -0.091 1.00 0.00 C ATOM 0 HA PRO A 31 -5.631 -11.772 -3.082 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -7.392 -13.304 -1.594 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -5.655 -13.336 -1.365 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -7.731 -12.135 0.364 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -6.077 -12.553 0.764 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -7.105 -9.926 0.241 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -5.430 -10.359 0.525 1.00 0.00 H new ATOM 442 N GLY A 32 -8.018 -12.218 -3.954 1.00 0.00 N ATOM 443 CA GLY A 32 -9.211 -12.088 -4.774 1.00 0.00 C ATOM 444 C GLY A 32 -9.843 -13.455 -5.044 1.00 0.00 C ATOM 445 O GLY A 32 -9.619 -14.405 -4.295 1.00 0.00 O ATOM 0 H GLY A 32 -7.506 -13.091 -4.080 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -9.932 -11.443 -4.273 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -8.956 -11.608 -5.719 1.00 0.00 H new ATOM 449 N PRO A 33 -10.639 -13.513 -6.145 1.00 0.00 N ATOM 450 CA PRO A 33 -11.304 -14.748 -6.523 1.00 0.00 C ATOM 451 C PRO A 33 -10.314 -15.736 -7.145 1.00 0.00 C ATOM 452 O PRO A 33 -10.699 -16.828 -7.558 1.00 0.00 O ATOM 453 CB PRO A 33 -12.403 -14.325 -7.484 1.00 0.00 C ATOM 454 CG PRO A 33 -12.021 -12.935 -7.968 1.00 0.00 C ATOM 455 CD PRO A 33 -10.926 -12.408 -7.055 1.00 0.00 C ATOM 0 HA PRO A 33 -11.723 -15.279 -5.668 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -12.481 -15.021 -8.319 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -13.373 -14.313 -6.987 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -11.672 -12.973 -9.000 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -12.886 -12.273 -7.948 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -10.040 -12.122 -7.623 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -11.256 -11.523 -6.511 1.00 0.00 H new ATOM 463 N HIS A 34 -9.059 -15.316 -7.190 1.00 0.00 N ATOM 464 CA HIS A 34 -8.011 -16.150 -7.754 1.00 0.00 C ATOM 465 C HIS A 34 -6.985 -16.488 -6.671 1.00 0.00 C ATOM 466 O HIS A 34 -6.718 -17.660 -6.408 1.00 0.00 O ATOM 467 CB HIS A 34 -7.382 -15.479 -8.977 1.00 0.00 C ATOM 468 CG HIS A 34 -7.310 -13.974 -8.883 1.00 0.00 C ATOM 469 ND1 HIS A 34 -8.436 -13.169 -8.861 1.00 0.00 N ATOM 470 CD2 HIS A 34 -6.236 -13.136 -8.804 1.00 0.00 C ATOM 471 CE1 HIS A 34 -8.045 -11.906 -8.774 1.00 0.00 C ATOM 472 NE2 HIS A 34 -6.682 -11.887 -8.740 1.00 0.00 N ATOM 0 H HIS A 34 -8.744 -14.409 -6.845 1.00 0.00 H new ATOM 0 HA HIS A 34 -8.439 -17.089 -8.106 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -6.375 -15.873 -9.117 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -7.956 -15.750 -9.863 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -5.199 -13.438 -8.795 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -8.693 -11.043 -8.737 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -6.101 -11.051 -8.676 1.00 0.00 H new ATOM 480 N CYS A 35 -6.438 -15.441 -6.071 1.00 0.00 N ATOM 481 CA CYS A 35 -5.448 -15.612 -5.022 1.00 0.00 C ATOM 482 C CYS A 35 -6.131 -15.378 -3.673 1.00 0.00 C ATOM 483 O CYS A 35 -6.629 -14.285 -3.407 1.00 0.00 O ATOM 484 CB CYS A 35 -4.246 -14.686 -5.221 1.00 0.00 C ATOM 485 SG CYS A 35 -2.961 -14.806 -3.924 1.00 0.00 S ATOM 0 H CYS A 35 -6.662 -14.471 -6.292 1.00 0.00 H new ATOM 0 HA CYS A 35 -5.051 -16.627 -5.056 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -3.790 -14.908 -6.186 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -4.602 -13.657 -5.266 1.00 0.00 H new ATOM 490 N ALA A 36 -6.133 -16.422 -2.857 1.00 0.00 N ATOM 491 CA ALA A 36 -6.747 -16.343 -1.543 1.00 0.00 C ATOM 492 C ALA A 36 -5.685 -15.959 -0.511 1.00 0.00 C ATOM 493 O ALA A 36 -5.829 -16.257 0.674 1.00 0.00 O ATOM 494 CB ALA A 36 -7.423 -17.676 -1.215 1.00 0.00 C ATOM 0 H ALA A 36 -5.719 -17.327 -3.081 1.00 0.00 H new ATOM 0 HA ALA A 36 -7.518 -15.573 -1.525 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.884 -17.617 -0.229 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.188 -17.889 -1.961 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -6.679 -18.472 -1.221 1.00 0.00 H new ATOM 500 N GLN A 37 -4.643 -15.302 -0.998 1.00 0.00 N ATOM 501 CA GLN A 37 -3.557 -14.874 -0.133 1.00 0.00 C ATOM 502 C GLN A 37 -3.148 -13.438 -0.466 1.00 0.00 C ATOM 503 O GLN A 37 -3.444 -12.940 -1.551 1.00 0.00 O ATOM 504 CB GLN A 37 -2.362 -15.823 -0.241 1.00 0.00 C ATOM 505 CG GLN A 37 -2.815 -17.283 -0.179 1.00 0.00 C ATOM 506 CD GLN A 37 -3.039 -17.727 1.268 1.00 0.00 C ATOM 507 OE1 GLN A 37 -2.156 -17.666 2.107 1.00 0.00 O ATOM 508 NE2 GLN A 37 -4.267 -18.177 1.512 1.00 0.00 N ATOM 0 H GLN A 37 -4.528 -15.055 -1.981 1.00 0.00 H new ATOM 0 HA GLN A 37 -3.908 -14.902 0.898 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -1.833 -15.642 -1.176 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -1.659 -15.622 0.567 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -3.737 -17.406 -0.748 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -2.065 -17.920 -0.647 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -4.959 -18.201 0.763 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -4.516 -18.498 2.448 1.00 0.00 H new ATOM 517 N THR A 38 -2.474 -12.812 0.488 1.00 0.00 N ATOM 518 CA THR A 38 -2.022 -11.443 0.310 1.00 0.00 C ATOM 519 C THR A 38 -0.633 -11.419 -0.333 1.00 0.00 C ATOM 520 O THR A 38 0.125 -12.380 -0.214 1.00 0.00 O ATOM 521 CB THR A 38 -2.073 -10.746 1.671 1.00 0.00 C ATOM 522 OG1 THR A 38 -3.269 -11.241 2.269 1.00 0.00 O ATOM 523 CG2 THR A 38 -2.313 -9.240 1.550 1.00 0.00 C ATOM 0 H THR A 38 -2.230 -13.228 1.387 1.00 0.00 H new ATOM 0 HA THR A 38 -2.673 -10.898 -0.374 1.00 0.00 H new ATOM 0 HB THR A 38 -1.139 -10.922 2.204 1.00 0.00 H new ATOM 0 HG1 THR A 38 -3.380 -10.842 3.157 1.00 0.00 H new ATOM 0 HG21 THR A 38 -2.340 -8.795 2.545 1.00 0.00 H new ATOM 0 HG22 THR A 38 -1.507 -8.788 0.972 1.00 0.00 H new ATOM 0 HG23 THR A 38 -3.263 -9.062 1.047 1.00 0.00 H new ATOM 531 N GLU A 39 -0.343 -10.311 -0.999 1.00 0.00 N ATOM 532 CA GLU A 39 0.941 -10.150 -1.660 1.00 0.00 C ATOM 533 C GLU A 39 1.405 -8.695 -1.569 1.00 0.00 C ATOM 534 O GLU A 39 1.108 -7.889 -2.449 1.00 0.00 O ATOM 535 CB GLU A 39 0.869 -10.613 -3.116 1.00 0.00 C ATOM 536 CG GLU A 39 -0.490 -10.276 -3.733 1.00 0.00 C ATOM 537 CD GLU A 39 -1.255 -11.549 -4.102 1.00 0.00 C ATOM 538 OE1 GLU A 39 -1.972 -12.058 -3.214 1.00 0.00 O ATOM 539 OE2 GLU A 39 -1.105 -11.984 -5.265 1.00 0.00 O ATOM 0 H GLU A 39 -0.975 -9.516 -1.095 1.00 0.00 H new ATOM 0 HA GLU A 39 1.672 -10.777 -1.150 1.00 0.00 H new ATOM 0 HB2 GLU A 39 1.662 -10.136 -3.692 1.00 0.00 H new ATOM 0 HB3 GLU A 39 1.039 -11.688 -3.168 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -1.077 -9.686 -3.029 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.348 -9.662 -4.622 1.00 0.00 H new ATOM 546 N VAL A 40 2.127 -8.404 -0.497 1.00 0.00 N ATOM 547 CA VAL A 40 2.636 -7.060 -0.280 1.00 0.00 C ATOM 548 C VAL A 40 3.854 -6.829 -1.177 1.00 0.00 C ATOM 549 O VAL A 40 4.831 -7.573 -1.107 1.00 0.00 O ATOM 550 CB VAL A 40 2.939 -6.848 1.205 1.00 0.00 C ATOM 551 CG1 VAL A 40 3.506 -5.449 1.455 1.00 0.00 C ATOM 552 CG2 VAL A 40 1.694 -7.097 2.059 1.00 0.00 C ATOM 0 H VAL A 40 2.372 -9.076 0.231 1.00 0.00 H new ATOM 0 HA VAL A 40 1.885 -6.319 -0.554 1.00 0.00 H new ATOM 0 HB VAL A 40 3.697 -7.573 1.499 1.00 0.00 H new ATOM 0 HG11 VAL A 40 3.712 -5.325 2.518 1.00 0.00 H new ATOM 0 HG12 VAL A 40 4.429 -5.324 0.889 1.00 0.00 H new ATOM 0 HG13 VAL A 40 2.781 -4.700 1.136 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.936 -6.940 3.110 1.00 0.00 H new ATOM 0 HG22 VAL A 40 0.905 -6.407 1.761 1.00 0.00 H new ATOM 0 HG23 VAL A 40 1.353 -8.122 1.915 1.00 0.00 H new ATOM 562 N ILE A 41 3.755 -5.796 -2.000 1.00 0.00 N ATOM 563 CA ILE A 41 4.836 -5.458 -2.910 1.00 0.00 C ATOM 564 C ILE A 41 5.346 -4.051 -2.589 1.00 0.00 C ATOM 565 O ILE A 41 4.559 -3.114 -2.469 1.00 0.00 O ATOM 566 CB ILE A 41 4.389 -5.633 -4.363 1.00 0.00 C ATOM 567 CG1 ILE A 41 3.361 -6.759 -4.488 1.00 0.00 C ATOM 568 CG2 ILE A 41 5.590 -5.848 -5.285 1.00 0.00 C ATOM 569 CD1 ILE A 41 3.894 -8.058 -3.879 1.00 0.00 C ATOM 0 H ILE A 41 2.943 -5.182 -2.056 1.00 0.00 H new ATOM 0 HA ILE A 41 5.675 -6.141 -2.775 1.00 0.00 H new ATOM 0 HB ILE A 41 3.900 -4.713 -4.683 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.437 -6.470 -3.987 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.117 -6.919 -5.538 1.00 0.00 H new ATOM 0 HG21 ILE A 41 5.244 -5.969 -6.311 1.00 0.00 H new ATOM 0 HG22 ILE A 41 6.253 -4.985 -5.226 1.00 0.00 H new ATOM 0 HG23 ILE A 41 6.130 -6.743 -4.976 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.144 -8.842 -3.981 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.804 -8.357 -4.399 1.00 0.00 H new ATOM 0 HD13 ILE A 41 4.114 -7.901 -2.823 1.00 0.00 H new ATOM 581 N ALA A 42 6.661 -3.949 -2.460 1.00 0.00 N ATOM 582 CA ALA A 42 7.286 -2.673 -2.155 1.00 0.00 C ATOM 583 C ALA A 42 8.228 -2.285 -3.297 1.00 0.00 C ATOM 584 O ALA A 42 8.938 -3.133 -3.836 1.00 0.00 O ATOM 585 CB ALA A 42 8.008 -2.766 -0.810 1.00 0.00 C ATOM 0 H ALA A 42 7.311 -4.729 -2.561 1.00 0.00 H new ATOM 0 HA ALA A 42 6.534 -1.889 -2.067 1.00 0.00 H new ATOM 0 HB1 ALA A 42 8.477 -1.809 -0.582 1.00 0.00 H new ATOM 0 HB2 ALA A 42 7.290 -3.014 -0.028 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.772 -3.541 -0.860 1.00 0.00 H new ATOM 591 N THR A 43 8.204 -1.004 -3.632 1.00 0.00 N ATOM 592 CA THR A 43 9.047 -0.494 -4.700 1.00 0.00 C ATOM 593 C THR A 43 10.395 -0.032 -4.142 1.00 0.00 C ATOM 594 O THR A 43 10.448 0.631 -3.107 1.00 0.00 O ATOM 595 CB THR A 43 8.277 0.614 -5.422 1.00 0.00 C ATOM 596 OG1 THR A 43 7.237 -0.076 -6.109 1.00 0.00 O ATOM 597 CG2 THR A 43 9.096 1.263 -6.540 1.00 0.00 C ATOM 0 H THR A 43 7.614 -0.304 -3.183 1.00 0.00 H new ATOM 0 HA THR A 43 9.281 -1.274 -5.425 1.00 0.00 H new ATOM 0 HB THR A 43 7.977 1.376 -4.702 1.00 0.00 H new ATOM 0 HG1 THR A 43 6.688 0.568 -6.603 1.00 0.00 H new ATOM 0 HG21 THR A 43 8.504 2.042 -7.020 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.001 1.702 -6.120 1.00 0.00 H new ATOM 0 HG23 THR A 43 9.368 0.508 -7.278 1.00 0.00 H new ATOM 605 N LEU A 44 11.451 -0.402 -4.851 1.00 0.00 N ATOM 606 CA LEU A 44 12.795 -0.035 -4.439 1.00 0.00 C ATOM 607 C LEU A 44 13.108 1.377 -4.937 1.00 0.00 C ATOM 608 O LEU A 44 12.585 1.808 -5.964 1.00 0.00 O ATOM 609 CB LEU A 44 13.804 -1.088 -4.901 1.00 0.00 C ATOM 610 CG LEU A 44 14.793 -1.580 -3.843 1.00 0.00 C ATOM 611 CD1 LEU A 44 15.441 -2.899 -4.268 1.00 0.00 C ATOM 612 CD2 LEU A 44 15.835 -0.505 -3.525 1.00 0.00 C ATOM 0 H LEU A 44 11.403 -0.952 -5.708 1.00 0.00 H new ATOM 0 HA LEU A 44 12.868 -0.014 -3.352 1.00 0.00 H new ATOM 0 HB2 LEU A 44 13.253 -1.948 -5.282 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.371 -0.677 -5.736 1.00 0.00 H new ATOM 0 HG LEU A 44 14.241 -1.775 -2.924 1.00 0.00 H new ATOM 0 HD11 LEU A 44 16.140 -3.226 -3.498 1.00 0.00 H new ATOM 0 HD12 LEU A 44 14.669 -3.657 -4.403 1.00 0.00 H new ATOM 0 HD13 LEU A 44 15.977 -2.755 -5.206 1.00 0.00 H new ATOM 0 HD21 LEU A 44 16.526 -0.880 -2.770 1.00 0.00 H new ATOM 0 HD22 LEU A 44 16.388 -0.255 -4.431 1.00 0.00 H new ATOM 0 HD23 LEU A 44 15.334 0.387 -3.148 1.00 0.00 H new ATOM 624 N LYS A 45 13.960 2.060 -4.187 1.00 0.00 N ATOM 625 CA LYS A 45 14.350 3.415 -4.539 1.00 0.00 C ATOM 626 C LYS A 45 15.316 3.371 -5.724 1.00 0.00 C ATOM 627 O LYS A 45 15.718 4.412 -6.241 1.00 0.00 O ATOM 628 CB LYS A 45 14.907 4.147 -3.317 1.00 0.00 C ATOM 629 CG LYS A 45 15.875 5.255 -3.737 1.00 0.00 C ATOM 630 CD LYS A 45 15.154 6.338 -4.542 1.00 0.00 C ATOM 631 CE LYS A 45 15.113 7.659 -3.771 1.00 0.00 C ATOM 632 NZ LYS A 45 14.158 7.572 -2.644 1.00 0.00 N ATOM 0 H LYS A 45 14.392 1.700 -3.336 1.00 0.00 H new ATOM 0 HA LYS A 45 13.481 3.991 -4.857 1.00 0.00 H new ATOM 0 HB2 LYS A 45 14.087 4.575 -2.740 1.00 0.00 H new ATOM 0 HB3 LYS A 45 15.420 3.438 -2.666 1.00 0.00 H new ATOM 0 HG2 LYS A 45 16.332 5.698 -2.852 1.00 0.00 H new ATOM 0 HG3 LYS A 45 16.682 4.830 -4.334 1.00 0.00 H new ATOM 0 HD2 LYS A 45 15.661 6.485 -5.496 1.00 0.00 H new ATOM 0 HD3 LYS A 45 14.138 6.013 -4.768 1.00 0.00 H new ATOM 0 HE2 LYS A 45 16.108 7.898 -3.395 1.00 0.00 H new ATOM 0 HE3 LYS A 45 14.822 8.469 -4.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 14.417 8.267 -1.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 13.197 7.772 -2.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 14.188 6.616 -2.237 1.00 0.00 H new ATOM 646 N ASN A 46 15.662 2.155 -6.120 1.00 0.00 N ATOM 647 CA ASN A 46 16.575 1.961 -7.234 1.00 0.00 C ATOM 648 C ASN A 46 15.771 1.645 -8.497 1.00 0.00 C ATOM 649 O ASN A 46 16.322 1.613 -9.596 1.00 0.00 O ATOM 650 CB ASN A 46 17.524 0.790 -6.972 1.00 0.00 C ATOM 651 CG ASN A 46 17.748 -0.029 -8.245 1.00 0.00 C ATOM 652 OD1 ASN A 46 18.283 0.445 -9.233 1.00 0.00 O ATOM 653 ND2 ASN A 46 17.309 -1.282 -8.166 1.00 0.00 N ATOM 0 H ASN A 46 15.326 1.294 -5.689 1.00 0.00 H new ATOM 0 HA ASN A 46 17.156 2.875 -7.356 1.00 0.00 H new ATOM 0 HB2 ASN A 46 18.479 1.166 -6.604 1.00 0.00 H new ATOM 0 HB3 ASN A 46 17.112 0.150 -6.192 1.00 0.00 H new ATOM 0 HD21 ASN A 46 17.412 -1.910 -8.964 1.00 0.00 H new ATOM 0 HD22 ASN A 46 16.870 -1.615 -7.308 1.00 0.00 H new ATOM 660 N GLY A 47 14.480 1.419 -8.297 1.00 0.00 N ATOM 661 CA GLY A 47 13.595 1.107 -9.406 1.00 0.00 C ATOM 662 C GLY A 47 13.149 -0.356 -9.356 1.00 0.00 C ATOM 663 O GLY A 47 12.293 -0.775 -10.134 1.00 0.00 O ATOM 0 H GLY A 47 14.027 1.446 -7.384 1.00 0.00 H new ATOM 0 HA2 GLY A 47 12.722 1.759 -9.374 1.00 0.00 H new ATOM 0 HA3 GLY A 47 14.105 1.304 -10.349 1.00 0.00 H new ATOM 667 N GLN A 48 13.749 -1.093 -8.433 1.00 0.00 N ATOM 668 CA GLN A 48 13.424 -2.500 -8.271 1.00 0.00 C ATOM 669 C GLN A 48 12.221 -2.663 -7.339 1.00 0.00 C ATOM 670 O GLN A 48 11.583 -1.680 -6.965 1.00 0.00 O ATOM 671 CB GLN A 48 14.630 -3.285 -7.752 1.00 0.00 C ATOM 672 CG GLN A 48 15.428 -3.891 -8.908 1.00 0.00 C ATOM 673 CD GLN A 48 16.415 -4.945 -8.401 1.00 0.00 C ATOM 674 OE1 GLN A 48 16.042 -5.964 -7.844 1.00 0.00 O ATOM 675 NE2 GLN A 48 17.691 -4.642 -8.623 1.00 0.00 N ATOM 0 H GLN A 48 14.458 -0.742 -7.790 1.00 0.00 H new ATOM 0 HA GLN A 48 13.160 -2.907 -9.247 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.273 -2.627 -7.167 1.00 0.00 H new ATOM 0 HB3 GLN A 48 14.293 -4.077 -7.084 1.00 0.00 H new ATOM 0 HG2 GLN A 48 14.746 -4.343 -9.628 1.00 0.00 H new ATOM 0 HG3 GLN A 48 15.969 -3.104 -9.433 1.00 0.00 H new ATOM 0 HE21 GLN A 48 17.934 -3.771 -9.095 1.00 0.00 H new ATOM 0 HE22 GLN A 48 18.427 -5.281 -8.321 1.00 0.00 H new ATOM 684 N LYS A 49 11.949 -3.912 -6.990 1.00 0.00 N ATOM 685 CA LYS A 49 10.835 -4.216 -6.108 1.00 0.00 C ATOM 686 C LYS A 49 11.207 -5.399 -5.213 1.00 0.00 C ATOM 687 O LYS A 49 11.913 -6.311 -5.643 1.00 0.00 O ATOM 688 CB LYS A 49 9.556 -4.437 -6.918 1.00 0.00 C ATOM 689 CG LYS A 49 9.264 -3.237 -7.822 1.00 0.00 C ATOM 690 CD LYS A 49 7.941 -3.420 -8.567 1.00 0.00 C ATOM 691 CE LYS A 49 8.150 -3.351 -10.081 1.00 0.00 C ATOM 692 NZ LYS A 49 7.402 -4.434 -10.757 1.00 0.00 N ATOM 0 H LYS A 49 12.481 -4.725 -7.302 1.00 0.00 H new ATOM 0 HA LYS A 49 10.628 -3.371 -5.451 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.656 -5.337 -7.524 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.717 -4.600 -6.242 1.00 0.00 H new ATOM 0 HG2 LYS A 49 9.225 -2.327 -7.223 1.00 0.00 H new ATOM 0 HG3 LYS A 49 10.075 -3.112 -8.539 1.00 0.00 H new ATOM 0 HD2 LYS A 49 7.499 -4.380 -8.301 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.236 -2.648 -8.258 1.00 0.00 H new ATOM 0 HE2 LYS A 49 7.818 -2.383 -10.456 1.00 0.00 H new ATOM 0 HE3 LYS A 49 9.212 -3.435 -10.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 7.555 -4.373 -11.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 7.738 -5.356 -10.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 6.387 -4.336 -10.551 1.00 0.00 H new ATOM 706 N ALA A 50 10.716 -5.347 -3.983 1.00 0.00 N ATOM 707 CA ALA A 50 10.989 -6.403 -3.023 1.00 0.00 C ATOM 708 C ALA A 50 9.673 -6.865 -2.393 1.00 0.00 C ATOM 709 O ALA A 50 9.045 -6.120 -1.642 1.00 0.00 O ATOM 710 CB ALA A 50 11.989 -5.900 -1.981 1.00 0.00 C ATOM 0 H ALA A 50 10.131 -4.590 -3.629 1.00 0.00 H new ATOM 0 HA ALA A 50 11.439 -7.264 -3.517 1.00 0.00 H new ATOM 0 HB1 ALA A 50 12.194 -6.692 -1.261 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.916 -5.611 -2.476 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.571 -5.037 -1.462 1.00 0.00 H new ATOM 716 N CYS A 51 9.296 -8.092 -2.721 1.00 0.00 N ATOM 717 CA CYS A 51 8.067 -8.663 -2.197 1.00 0.00 C ATOM 718 C CYS A 51 8.257 -8.920 -0.700 1.00 0.00 C ATOM 719 O CYS A 51 9.292 -9.435 -0.282 1.00 0.00 O ATOM 720 CB CYS A 51 7.667 -9.934 -2.948 1.00 0.00 C ATOM 721 SG CYS A 51 6.448 -9.682 -4.289 1.00 0.00 S ATOM 0 H CYS A 51 9.820 -8.707 -3.343 1.00 0.00 H new ATOM 0 HA CYS A 51 7.246 -7.961 -2.343 1.00 0.00 H new ATOM 0 HB2 CYS A 51 8.564 -10.386 -3.372 1.00 0.00 H new ATOM 0 HB3 CYS A 51 7.257 -10.648 -2.233 1.00 0.00 H new ATOM 726 N LEU A 52 7.240 -8.549 0.065 1.00 0.00 N ATOM 727 CA LEU A 52 7.282 -8.734 1.506 1.00 0.00 C ATOM 728 C LEU A 52 6.216 -9.751 1.917 1.00 0.00 C ATOM 729 O LEU A 52 5.328 -10.077 1.130 1.00 0.00 O ATOM 730 CB LEU A 52 7.156 -7.387 2.222 1.00 0.00 C ATOM 731 CG LEU A 52 8.195 -6.328 1.846 1.00 0.00 C ATOM 732 CD1 LEU A 52 7.707 -4.926 2.219 1.00 0.00 C ATOM 733 CD2 LEU A 52 9.554 -6.647 2.471 1.00 0.00 C ATOM 0 H LEU A 52 6.383 -8.122 -0.286 1.00 0.00 H new ATOM 0 HA LEU A 52 8.246 -9.142 1.810 1.00 0.00 H new ATOM 0 HB2 LEU A 52 6.164 -6.982 2.020 1.00 0.00 H new ATOM 0 HB3 LEU A 52 7.217 -7.562 3.296 1.00 0.00 H new ATOM 0 HG LEU A 52 8.326 -6.347 0.764 1.00 0.00 H new ATOM 0 HD11 LEU A 52 8.463 -4.192 1.942 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.780 -4.710 1.688 1.00 0.00 H new ATOM 0 HD13 LEU A 52 7.530 -4.876 3.293 1.00 0.00 H new ATOM 0 HD21 LEU A 52 10.274 -5.879 2.188 1.00 0.00 H new ATOM 0 HD22 LEU A 52 9.458 -6.672 3.556 1.00 0.00 H new ATOM 0 HD23 LEU A 52 9.900 -7.617 2.114 1.00 0.00 H new ATOM 745 N ASN A 53 6.339 -10.224 3.148 1.00 0.00 N ATOM 746 CA ASN A 53 5.397 -11.198 3.673 1.00 0.00 C ATOM 747 C ASN A 53 4.506 -10.526 4.720 1.00 0.00 C ATOM 748 O ASN A 53 5.000 -10.006 5.719 1.00 0.00 O ATOM 749 CB ASN A 53 6.126 -12.361 4.349 1.00 0.00 C ATOM 750 CG ASN A 53 5.218 -13.587 4.461 1.00 0.00 C ATOM 751 OD1 ASN A 53 5.260 -14.184 5.649 1.00 0.00 O flip ATOM 752 ND2 ASN A 53 4.524 -13.965 3.532 1.00 0.00 N flip ATOM 0 H ASN A 53 7.077 -9.951 3.797 1.00 0.00 H new ATOM 0 HA ASN A 53 4.806 -11.579 2.840 1.00 0.00 H new ATOM 0 HB2 ASN A 53 7.019 -12.616 3.778 1.00 0.00 H new ATOM 0 HB3 ASN A 53 6.458 -12.058 5.342 1.00 0.00 H new ATOM 0 HD21 ASN A 53 4.539 -13.460 2.646 1.00 0.00 H new ATOM 0 HD22 ASN A 53 3.928 -14.786 3.641 1.00 0.00 H new ATOM 759 N PRO A 54 3.174 -10.560 4.447 1.00 0.00 N ATOM 760 CA PRO A 54 2.209 -9.961 5.354 1.00 0.00 C ATOM 761 C PRO A 54 2.013 -10.830 6.598 1.00 0.00 C ATOM 762 O PRO A 54 1.245 -10.476 7.492 1.00 0.00 O ATOM 763 CB PRO A 54 0.940 -9.806 4.532 1.00 0.00 C ATOM 764 CG PRO A 54 1.095 -10.743 3.345 1.00 0.00 C ATOM 765 CD PRO A 54 2.553 -11.168 3.274 1.00 0.00 C ATOM 0 HA PRO A 54 2.538 -8.996 5.741 1.00 0.00 H new ATOM 0 HB2 PRO A 54 0.060 -10.064 5.121 1.00 0.00 H new ATOM 0 HB3 PRO A 54 0.812 -8.775 4.202 1.00 0.00 H new ATOM 0 HG2 PRO A 54 0.449 -11.613 3.459 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.798 -10.244 2.423 1.00 0.00 H new ATOM 0 HD2 PRO A 54 2.650 -12.253 3.292 1.00 0.00 H new ATOM 0 HD3 PRO A 54 3.022 -10.821 2.353 1.00 0.00 H new ATOM 773 N ALA A 55 2.719 -11.950 6.616 1.00 0.00 N ATOM 774 CA ALA A 55 2.632 -12.872 7.735 1.00 0.00 C ATOM 775 C ALA A 55 3.812 -12.634 8.680 1.00 0.00 C ATOM 776 O ALA A 55 3.951 -13.320 9.691 1.00 0.00 O ATOM 777 CB ALA A 55 2.586 -14.309 7.211 1.00 0.00 C ATOM 0 H ALA A 55 3.355 -12.240 5.873 1.00 0.00 H new ATOM 0 HA ALA A 55 1.716 -12.702 8.301 1.00 0.00 H new ATOM 0 HB1 ALA A 55 2.521 -15.001 8.051 1.00 0.00 H new ATOM 0 HB2 ALA A 55 1.714 -14.434 6.569 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.490 -14.517 6.639 1.00 0.00 H new ATOM 783 N SER A 56 4.632 -11.659 8.317 1.00 0.00 N ATOM 784 CA SER A 56 5.795 -11.321 9.119 1.00 0.00 C ATOM 785 C SER A 56 5.526 -10.047 9.921 1.00 0.00 C ATOM 786 O SER A 56 4.834 -9.146 9.448 1.00 0.00 O ATOM 787 CB SER A 56 7.037 -11.144 8.242 1.00 0.00 C ATOM 788 OG SER A 56 8.154 -10.671 8.989 1.00 0.00 O ATOM 0 H SER A 56 4.514 -11.092 7.477 1.00 0.00 H new ATOM 0 HA SER A 56 5.985 -12.143 9.809 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.290 -12.096 7.775 1.00 0.00 H new ATOM 0 HB3 SER A 56 6.816 -10.443 7.437 1.00 0.00 H new ATOM 0 HG SER A 56 8.874 -10.416 8.375 1.00 0.00 H new ATOM 794 N PRO A 57 6.101 -10.010 11.153 1.00 0.00 N ATOM 795 CA PRO A 57 5.930 -8.861 12.025 1.00 0.00 C ATOM 796 C PRO A 57 6.784 -7.682 11.554 1.00 0.00 C ATOM 797 O PRO A 57 6.310 -6.549 11.502 1.00 0.00 O ATOM 798 CB PRO A 57 6.314 -9.357 13.410 1.00 0.00 C ATOM 799 CG PRO A 57 7.127 -10.623 13.188 1.00 0.00 C ATOM 800 CD PRO A 57 6.926 -11.059 11.746 1.00 0.00 C ATOM 0 HA PRO A 57 4.909 -8.480 12.022 1.00 0.00 H new ATOM 0 HB2 PRO A 57 6.896 -8.608 13.946 1.00 0.00 H new ATOM 0 HB3 PRO A 57 5.428 -9.562 14.011 1.00 0.00 H new ATOM 0 HG2 PRO A 57 8.183 -10.439 13.387 1.00 0.00 H new ATOM 0 HG3 PRO A 57 6.806 -11.408 13.873 1.00 0.00 H new ATOM 0 HD2 PRO A 57 7.879 -11.156 11.225 1.00 0.00 H new ATOM 0 HD3 PRO A 57 6.433 -12.029 11.691 1.00 0.00 H new ATOM 808 N MET A 58 8.029 -7.991 11.221 1.00 0.00 N ATOM 809 CA MET A 58 8.954 -6.972 10.756 1.00 0.00 C ATOM 810 C MET A 58 8.430 -6.294 9.488 1.00 0.00 C ATOM 811 O MET A 58 8.775 -5.148 9.204 1.00 0.00 O ATOM 812 CB MET A 58 10.315 -7.609 10.469 1.00 0.00 C ATOM 813 CG MET A 58 11.390 -6.540 10.268 1.00 0.00 C ATOM 814 SD MET A 58 11.605 -5.600 11.771 1.00 0.00 S ATOM 815 CE MET A 58 11.810 -6.931 12.942 1.00 0.00 C ATOM 0 H MET A 58 8.418 -8.933 11.264 1.00 0.00 H new ATOM 0 HA MET A 58 9.054 -6.216 11.535 1.00 0.00 H new ATOM 0 HB2 MET A 58 10.596 -8.262 11.295 1.00 0.00 H new ATOM 0 HB3 MET A 58 10.247 -8.234 9.578 1.00 0.00 H new ATOM 0 HG2 MET A 58 12.332 -7.009 9.985 1.00 0.00 H new ATOM 0 HG3 MET A 58 11.106 -5.876 9.452 1.00 0.00 H new ATOM 0 HE1 MET A 58 12.329 -6.561 13.826 1.00 0.00 H new ATOM 0 HE2 MET A 58 10.832 -7.316 13.230 1.00 0.00 H new ATOM 0 HE3 MET A 58 12.394 -7.730 12.486 1.00 0.00 H new ATOM 825 N VAL A 59 7.605 -7.032 8.759 1.00 0.00 N ATOM 826 CA VAL A 59 7.030 -6.517 7.528 1.00 0.00 C ATOM 827 C VAL A 59 5.979 -5.458 7.865 1.00 0.00 C ATOM 828 O VAL A 59 5.556 -4.699 6.994 1.00 0.00 O ATOM 829 CB VAL A 59 6.472 -7.668 6.689 1.00 0.00 C ATOM 830 CG1 VAL A 59 5.510 -7.150 5.618 1.00 0.00 C ATOM 831 CG2 VAL A 59 7.602 -8.487 6.061 1.00 0.00 C ATOM 0 H VAL A 59 7.321 -7.982 8.997 1.00 0.00 H new ATOM 0 HA VAL A 59 7.796 -6.033 6.922 1.00 0.00 H new ATOM 0 HB VAL A 59 5.911 -8.325 7.353 1.00 0.00 H new ATOM 0 HG11 VAL A 59 5.128 -7.989 5.036 1.00 0.00 H new ATOM 0 HG12 VAL A 59 4.679 -6.631 6.096 1.00 0.00 H new ATOM 0 HG13 VAL A 59 6.037 -6.461 4.958 1.00 0.00 H new ATOM 0 HG21 VAL A 59 7.178 -9.299 5.470 1.00 0.00 H new ATOM 0 HG22 VAL A 59 8.203 -7.845 5.417 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.232 -8.902 6.848 1.00 0.00 H new ATOM 841 N LYS A 60 5.587 -5.441 9.130 1.00 0.00 N ATOM 842 CA LYS A 60 4.592 -4.488 9.593 1.00 0.00 C ATOM 843 C LYS A 60 5.299 -3.274 10.200 1.00 0.00 C ATOM 844 O LYS A 60 4.650 -2.372 10.727 1.00 0.00 O ATOM 845 CB LYS A 60 3.605 -5.164 10.546 1.00 0.00 C ATOM 846 CG LYS A 60 3.173 -6.530 10.009 1.00 0.00 C ATOM 847 CD LYS A 60 2.216 -6.376 8.825 1.00 0.00 C ATOM 848 CE LYS A 60 0.841 -5.891 9.290 1.00 0.00 C ATOM 849 NZ LYS A 60 0.717 -4.428 9.101 1.00 0.00 N ATOM 0 H LYS A 60 5.940 -6.072 9.849 1.00 0.00 H new ATOM 0 HA LYS A 60 3.994 -4.125 8.757 1.00 0.00 H new ATOM 0 HB2 LYS A 60 4.065 -5.284 11.527 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.730 -4.528 10.680 1.00 0.00 H new ATOM 0 HG2 LYS A 60 4.051 -7.098 9.700 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.688 -7.100 10.802 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.631 -5.669 8.107 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.113 -7.331 8.309 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.059 -6.404 8.730 1.00 0.00 H new ATOM 0 HE3 LYS A 60 0.697 -6.142 10.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 0.328 -3.998 9.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 1.654 -4.023 8.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 0.081 -4.234 8.301 1.00 0.00 H new ATOM 863 N LYS A 61 6.621 -3.291 10.107 1.00 0.00 N ATOM 864 CA LYS A 61 7.423 -2.204 10.640 1.00 0.00 C ATOM 865 C LYS A 61 8.161 -1.510 9.493 1.00 0.00 C ATOM 866 O LYS A 61 8.672 -0.403 9.659 1.00 0.00 O ATOM 867 CB LYS A 61 8.348 -2.713 11.747 1.00 0.00 C ATOM 868 CG LYS A 61 7.542 -3.253 12.930 1.00 0.00 C ATOM 869 CD LYS A 61 8.082 -2.712 14.255 1.00 0.00 C ATOM 870 CE LYS A 61 7.305 -3.288 15.440 1.00 0.00 C ATOM 871 NZ LYS A 61 6.069 -2.509 15.677 1.00 0.00 N ATOM 0 H LYS A 61 7.156 -4.041 9.670 1.00 0.00 H new ATOM 0 HA LYS A 61 6.785 -1.455 11.109 1.00 0.00 H new ATOM 0 HB2 LYS A 61 8.994 -3.498 11.354 1.00 0.00 H new ATOM 0 HB3 LYS A 61 8.997 -1.905 12.083 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.494 -2.973 12.819 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.582 -4.342 12.935 1.00 0.00 H new ATOM 0 HD2 LYS A 61 9.138 -2.964 14.351 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.012 -1.624 14.264 1.00 0.00 H new ATOM 0 HE2 LYS A 61 7.053 -4.330 15.245 1.00 0.00 H new ATOM 0 HE3 LYS A 61 7.929 -3.272 16.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 5.553 -2.913 16.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 6.316 -1.520 15.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 5.468 -2.545 14.829 1.00 0.00 H new ATOM 885 N ILE A 62 8.192 -2.188 8.356 1.00 0.00 N ATOM 886 CA ILE A 62 8.859 -1.651 7.182 1.00 0.00 C ATOM 887 C ILE A 62 7.833 -0.932 6.303 1.00 0.00 C ATOM 888 O ILE A 62 8.201 -0.151 5.427 1.00 0.00 O ATOM 889 CB ILE A 62 9.630 -2.753 6.452 1.00 0.00 C ATOM 890 CG1 ILE A 62 10.609 -3.454 7.396 1.00 0.00 C ATOM 891 CG2 ILE A 62 10.329 -2.201 5.208 1.00 0.00 C ATOM 892 CD1 ILE A 62 10.810 -4.916 6.990 1.00 0.00 C ATOM 0 H ILE A 62 7.766 -3.105 8.222 1.00 0.00 H new ATOM 0 HA ILE A 62 9.605 -0.912 7.472 1.00 0.00 H new ATOM 0 HB ILE A 62 8.916 -3.503 6.113 1.00 0.00 H new ATOM 0 HG12 ILE A 62 11.567 -2.934 7.384 1.00 0.00 H new ATOM 0 HG13 ILE A 62 10.233 -3.405 8.418 1.00 0.00 H new ATOM 0 HG21 ILE A 62 10.870 -3.004 4.708 1.00 0.00 H new ATOM 0 HG22 ILE A 62 9.586 -1.785 4.528 1.00 0.00 H new ATOM 0 HG23 ILE A 62 11.030 -1.420 5.501 1.00 0.00 H new ATOM 0 HD11 ILE A 62 11.510 -5.391 7.677 1.00 0.00 H new ATOM 0 HD12 ILE A 62 9.854 -5.439 7.027 1.00 0.00 H new ATOM 0 HD13 ILE A 62 11.209 -4.961 5.977 1.00 0.00 H new ATOM 904 N ILE A 63 6.568 -1.222 6.567 1.00 0.00 N ATOM 905 CA ILE A 63 5.487 -0.613 5.811 1.00 0.00 C ATOM 906 C ILE A 63 4.992 0.632 6.549 1.00 0.00 C ATOM 907 O ILE A 63 4.929 1.716 5.972 1.00 0.00 O ATOM 908 CB ILE A 63 4.387 -1.638 5.529 1.00 0.00 C ATOM 909 CG1 ILE A 63 4.812 -2.610 4.426 1.00 0.00 C ATOM 910 CG2 ILE A 63 3.062 -0.945 5.204 1.00 0.00 C ATOM 911 CD1 ILE A 63 4.126 -3.967 4.597 1.00 0.00 C ATOM 0 H ILE A 63 6.267 -1.871 7.294 1.00 0.00 H new ATOM 0 HA ILE A 63 5.843 -0.285 4.835 1.00 0.00 H new ATOM 0 HB ILE A 63 4.229 -2.227 6.433 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.561 -2.192 3.451 1.00 0.00 H new ATOM 0 HG13 ILE A 63 5.894 -2.740 4.448 1.00 0.00 H new ATOM 0 HG21 ILE A 63 2.297 -1.696 5.008 1.00 0.00 H new ATOM 0 HG22 ILE A 63 2.757 -0.329 6.050 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.187 -0.316 4.323 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.445 -4.639 3.800 1.00 0.00 H new ATOM 0 HD12 ILE A 63 4.399 -4.393 5.562 1.00 0.00 H new ATOM 0 HD13 ILE A 63 3.045 -3.837 4.550 1.00 0.00 H new ATOM 923 N GLU A 64 4.654 0.436 7.815 1.00 0.00 N ATOM 924 CA GLU A 64 4.167 1.529 8.639 1.00 0.00 C ATOM 925 C GLU A 64 5.180 2.677 8.650 1.00 0.00 C ATOM 926 O GLU A 64 4.798 3.846 8.679 1.00 0.00 O ATOM 927 CB GLU A 64 3.864 1.053 10.060 1.00 0.00 C ATOM 928 CG GLU A 64 2.698 0.062 10.069 1.00 0.00 C ATOM 929 CD GLU A 64 2.700 -0.777 11.349 1.00 0.00 C ATOM 930 OE1 GLU A 64 3.466 -0.410 12.266 1.00 0.00 O ATOM 931 OE2 GLU A 64 1.936 -1.766 11.381 1.00 0.00 O ATOM 0 H GLU A 64 4.708 -0.465 8.291 1.00 0.00 H new ATOM 0 HA GLU A 64 3.235 1.895 8.208 1.00 0.00 H new ATOM 0 HB2 GLU A 64 4.750 0.582 10.486 1.00 0.00 H new ATOM 0 HB3 GLU A 64 3.623 1.909 10.691 1.00 0.00 H new ATOM 0 HG2 GLU A 64 1.756 0.603 9.986 1.00 0.00 H new ATOM 0 HG3 GLU A 64 2.766 -0.593 9.201 1.00 0.00 H new ATOM 938 N LYS A 65 6.450 2.303 8.626 1.00 0.00 N ATOM 939 CA LYS A 65 7.520 3.286 8.633 1.00 0.00 C ATOM 940 C LYS A 65 7.575 3.983 7.272 1.00 0.00 C ATOM 941 O LYS A 65 7.896 5.168 7.190 1.00 0.00 O ATOM 942 CB LYS A 65 8.843 2.635 9.044 1.00 0.00 C ATOM 943 CG LYS A 65 8.926 2.473 10.563 1.00 0.00 C ATOM 944 CD LYS A 65 10.357 2.160 11.004 1.00 0.00 C ATOM 945 CE LYS A 65 10.726 2.945 12.264 1.00 0.00 C ATOM 946 NZ LYS A 65 11.850 3.868 11.989 1.00 0.00 N ATOM 0 H LYS A 65 6.763 1.332 8.602 1.00 0.00 H new ATOM 0 HA LYS A 65 7.325 4.056 9.379 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.937 1.660 8.565 1.00 0.00 H new ATOM 0 HB3 LYS A 65 9.676 3.244 8.694 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.584 3.387 11.049 1.00 0.00 H new ATOM 0 HG3 LYS A 65 8.260 1.672 10.884 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.457 1.091 11.194 1.00 0.00 H new ATOM 0 HD3 LYS A 65 11.051 2.407 10.201 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.862 3.509 12.614 1.00 0.00 H new ATOM 0 HE3 LYS A 65 11.001 2.255 13.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 12.088 4.393 12.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 12.678 3.323 11.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 11.575 4.538 11.243 1.00 0.00 H new ATOM 960 N MET A 66 7.256 3.219 6.238 1.00 0.00 N ATOM 961 CA MET A 66 7.264 3.749 4.885 1.00 0.00 C ATOM 962 C MET A 66 6.276 4.909 4.744 1.00 0.00 C ATOM 963 O MET A 66 6.556 5.888 4.054 1.00 0.00 O ATOM 964 CB MET A 66 6.893 2.639 3.899 1.00 0.00 C ATOM 965 CG MET A 66 8.054 2.341 2.948 1.00 0.00 C ATOM 966 SD MET A 66 8.508 3.818 2.055 1.00 0.00 S ATOM 967 CE MET A 66 6.988 4.126 1.173 1.00 0.00 C ATOM 0 H MET A 66 6.990 2.237 6.310 1.00 0.00 H new ATOM 0 HA MET A 66 8.265 4.121 4.667 1.00 0.00 H new ATOM 0 HB2 MET A 66 6.626 1.735 4.447 1.00 0.00 H new ATOM 0 HB3 MET A 66 6.015 2.936 3.325 1.00 0.00 H new ATOM 0 HG2 MET A 66 8.910 1.970 3.511 1.00 0.00 H new ATOM 0 HG3 MET A 66 7.769 1.556 2.248 1.00 0.00 H new ATOM 0 HE1 MET A 66 7.198 4.715 0.280 1.00 0.00 H new ATOM 0 HE2 MET A 66 6.536 3.177 0.884 1.00 0.00 H new ATOM 0 HE3 MET A 66 6.299 4.675 1.815 1.00 0.00 H new ATOM 977 N LEU A 67 5.140 4.760 5.410 1.00 0.00 N ATOM 978 CA LEU A 67 4.109 5.783 5.367 1.00 0.00 C ATOM 979 C LEU A 67 4.598 7.026 6.113 1.00 0.00 C ATOM 980 O LEU A 67 4.027 8.106 5.968 1.00 0.00 O ATOM 981 CB LEU A 67 2.784 5.230 5.897 1.00 0.00 C ATOM 982 CG LEU A 67 1.987 4.354 4.928 1.00 0.00 C ATOM 983 CD1 LEU A 67 2.835 3.184 4.423 1.00 0.00 C ATOM 984 CD2 LEU A 67 0.679 3.881 5.565 1.00 0.00 C ATOM 0 H LEU A 67 4.911 3.947 5.982 1.00 0.00 H new ATOM 0 HA LEU A 67 3.914 6.084 4.338 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.989 4.649 6.796 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.157 6.070 6.197 1.00 0.00 H new ATOM 0 HG LEU A 67 1.722 4.958 4.060 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.245 2.577 3.736 1.00 0.00 H new ATOM 0 HD12 LEU A 67 3.714 3.568 3.905 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.151 2.572 5.268 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.132 3.260 4.855 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.900 3.300 6.460 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.072 4.745 5.834 1.00 0.00 H new ATOM 996 N LYS A 68 5.650 6.832 6.894 1.00 0.00 N ATOM 997 CA LYS A 68 6.223 7.924 7.663 1.00 0.00 C ATOM 998 C LYS A 68 7.497 8.415 6.972 1.00 0.00 C ATOM 999 O LYS A 68 7.831 9.597 7.046 1.00 0.00 O ATOM 1000 CB LYS A 68 6.437 7.501 9.117 1.00 0.00 C ATOM 1001 CG LYS A 68 7.444 8.420 9.813 1.00 0.00 C ATOM 1002 CD LYS A 68 6.935 8.847 11.191 1.00 0.00 C ATOM 1003 CE LYS A 68 7.475 7.924 12.286 1.00 0.00 C ATOM 1004 NZ LYS A 68 8.285 8.691 13.258 1.00 0.00 N ATOM 0 H LYS A 68 6.121 5.935 7.011 1.00 0.00 H new ATOM 0 HA LYS A 68 5.533 8.767 7.699 1.00 0.00 H new ATOM 0 HB2 LYS A 68 5.487 7.526 9.651 1.00 0.00 H new ATOM 0 HB3 LYS A 68 6.794 6.472 9.151 1.00 0.00 H new ATOM 0 HG2 LYS A 68 8.399 7.906 9.918 1.00 0.00 H new ATOM 0 HG3 LYS A 68 7.622 9.302 9.198 1.00 0.00 H new ATOM 0 HD2 LYS A 68 7.240 9.874 11.393 1.00 0.00 H new ATOM 0 HD3 LYS A 68 5.845 8.830 11.201 1.00 0.00 H new ATOM 0 HE2 LYS A 68 6.647 7.436 12.799 1.00 0.00 H new ATOM 0 HE3 LYS A 68 8.082 7.136 11.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 8.643 8.049 13.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 9.086 9.137 12.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 7.695 9.427 13.697 1.00 0.00 H new ATOM 1018 N ASN A 69 8.172 7.484 6.315 1.00 0.00 N ATOM 1019 CA ASN A 69 9.402 7.807 5.611 1.00 0.00 C ATOM 1020 C ASN A 69 10.438 8.320 6.613 1.00 0.00 C ATOM 1021 O ASN A 69 11.336 7.581 7.015 1.00 0.00 O ATOM 1022 CB ASN A 69 9.168 8.904 4.570 1.00 0.00 C ATOM 1023 CG ASN A 69 10.495 9.411 4.001 1.00 0.00 C ATOM 1024 OD1 ASN A 69 10.925 10.524 4.258 1.00 0.00 O ATOM 1025 ND2 ASN A 69 11.117 8.536 3.217 1.00 0.00 N ATOM 0 H ASN A 69 7.891 6.505 6.255 1.00 0.00 H new ATOM 0 HA ASN A 69 9.752 6.904 5.111 1.00 0.00 H new ATOM 0 HB2 ASN A 69 8.546 8.518 3.763 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.623 9.731 5.024 1.00 0.00 H new ATOM 0 HD21 ASN A 69 12.010 8.780 2.789 1.00 0.00 H new ATOM 0 HD22 ASN A 69 10.701 7.621 3.044 1.00 0.00 H new ATOM 1032 N GLY A 70 10.280 9.581 6.987 1.00 0.00 N ATOM 1033 CA GLY A 70 11.191 10.200 7.935 1.00 0.00 C ATOM 1034 C GLY A 70 11.614 11.592 7.459 1.00 0.00 C ATOM 1035 O GLY A 70 10.787 12.498 7.367 1.00 0.00 O ATOM 0 H GLY A 70 9.535 10.191 6.651 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.711 10.276 8.910 1.00 0.00 H new ATOM 0 HA3 GLY A 70 12.072 9.571 8.062 1.00 0.00 H new ATOM 1039 N LYS A 71 12.900 11.717 7.168 1.00 0.00 N ATOM 1040 CA LYS A 71 13.443 12.983 6.704 1.00 0.00 C ATOM 1041 C LYS A 71 13.048 13.196 5.241 1.00 0.00 C ATOM 1042 O LYS A 71 12.365 14.165 4.914 1.00 0.00 O ATOM 1043 CB LYS A 71 14.952 13.040 6.949 1.00 0.00 C ATOM 1044 CG LYS A 71 15.273 13.848 8.208 1.00 0.00 C ATOM 1045 CD LYS A 71 16.306 13.125 9.075 1.00 0.00 C ATOM 1046 CE LYS A 71 16.118 13.469 10.554 1.00 0.00 C ATOM 1047 NZ LYS A 71 16.382 12.283 11.399 1.00 0.00 N ATOM 0 H LYS A 71 13.582 10.963 7.244 1.00 0.00 H new ATOM 0 HA LYS A 71 13.020 13.811 7.272 1.00 0.00 H new ATOM 0 HB2 LYS A 71 15.346 12.029 7.051 1.00 0.00 H new ATOM 0 HB3 LYS A 71 15.447 13.489 6.088 1.00 0.00 H new ATOM 0 HG2 LYS A 71 15.652 14.830 7.927 1.00 0.00 H new ATOM 0 HG3 LYS A 71 14.361 14.011 8.782 1.00 0.00 H new ATOM 0 HD2 LYS A 71 16.214 12.048 8.934 1.00 0.00 H new ATOM 0 HD3 LYS A 71 17.311 13.404 8.758 1.00 0.00 H new ATOM 0 HE2 LYS A 71 16.791 14.279 10.834 1.00 0.00 H new ATOM 0 HE3 LYS A 71 15.102 13.826 10.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 16.250 12.533 12.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 15.723 11.521 11.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 17.359 11.960 11.249 1.00 0.00 H new ATOM 1061 N SER A 72 13.496 12.275 4.401 1.00 0.00 N ATOM 1062 CA SER A 72 13.198 12.350 2.981 1.00 0.00 C ATOM 1063 C SER A 72 13.811 11.151 2.253 1.00 0.00 C ATOM 1064 O SER A 72 13.113 10.427 1.545 1.00 0.00 O ATOM 1065 CB SER A 72 13.714 13.658 2.378 1.00 0.00 C ATOM 1066 OG SER A 72 12.807 14.200 1.423 1.00 0.00 O ATOM 0 H SER A 72 14.063 11.473 4.676 1.00 0.00 H new ATOM 0 HA SER A 72 12.115 12.327 2.857 1.00 0.00 H new ATOM 0 HB2 SER A 72 13.879 14.384 3.174 1.00 0.00 H new ATOM 0 HB3 SER A 72 14.679 13.482 1.902 1.00 0.00 H new ATOM 0 HG SER A 72 13.172 15.035 1.062 1.00 0.00 H new ATOM 1072 N ASN A 73 15.109 10.980 2.453 1.00 0.00 N ATOM 1073 CA ASN A 73 15.824 9.882 1.825 1.00 0.00 C ATOM 1074 C ASN A 73 17.241 9.808 2.398 1.00 0.00 C ATOM 1075 O ASN A 73 17.514 9.001 3.285 1.00 0.00 O ATOM 1076 CB ASN A 73 15.936 10.090 0.313 1.00 0.00 C ATOM 1077 CG ASN A 73 16.072 11.575 -0.027 1.00 0.00 C ATOM 1078 OD1 ASN A 73 15.134 12.349 0.068 1.00 0.00 O ATOM 1079 ND2 ASN A 73 17.290 11.929 -0.428 1.00 0.00 N ATOM 0 H ASN A 73 15.684 11.583 3.041 1.00 0.00 H new ATOM 0 HA ASN A 73 15.272 8.963 2.023 1.00 0.00 H new ATOM 0 HB2 ASN A 73 16.799 9.545 -0.070 1.00 0.00 H new ATOM 0 HB3 ASN A 73 15.055 9.679 -0.180 1.00 0.00 H new ATOM 0 HD21 ASN A 73 17.483 12.899 -0.678 1.00 0.00 H new ATOM 0 HD22 ASN A 73 18.031 11.231 -0.485 1.00 0.00 H new TER 1086 ASN A 73 ATOM 1087 N THR B 5 14.860 14.922 -12.412 1.00 0.00 N ATOM 1088 CA THR B 5 15.449 16.081 -11.764 1.00 0.00 C ATOM 1089 C THR B 5 14.365 16.925 -11.091 1.00 0.00 C ATOM 1090 O THR B 5 14.454 17.223 -9.901 1.00 0.00 O ATOM 1091 CB THR B 5 16.254 16.851 -12.813 1.00 0.00 C ATOM 1092 OG1 THR B 5 16.688 18.022 -12.128 1.00 0.00 O ATOM 1093 CG2 THR B 5 15.378 17.386 -13.947 1.00 0.00 C ATOM 0 HA THR B 5 16.128 15.784 -10.965 1.00 0.00 H new ATOM 0 HB THR B 5 17.026 16.201 -13.226 1.00 0.00 H new ATOM 0 HG1 THR B 5 17.219 18.578 -12.735 1.00 0.00 H new ATOM 0 HG21 THR B 5 15.999 17.924 -14.663 1.00 0.00 H new ATOM 0 HG22 THR B 5 14.883 16.554 -14.448 1.00 0.00 H new ATOM 0 HG23 THR B 5 14.627 18.062 -13.539 1.00 0.00 H new ATOM 1101 N GLU B 6 13.365 17.287 -11.882 1.00 0.00 N ATOM 1102 CA GLU B 6 12.265 18.090 -11.378 1.00 0.00 C ATOM 1103 C GLU B 6 10.970 17.275 -11.373 1.00 0.00 C ATOM 1104 O GLU B 6 10.179 17.354 -12.312 1.00 0.00 O ATOM 1105 CB GLU B 6 12.102 19.373 -12.197 1.00 0.00 C ATOM 1106 CG GLU B 6 11.373 20.449 -11.391 1.00 0.00 C ATOM 1107 CD GLU B 6 12.340 21.193 -10.467 1.00 0.00 C ATOM 1108 OE1 GLU B 6 13.054 22.077 -10.988 1.00 0.00 O ATOM 1109 OE2 GLU B 6 12.344 20.860 -9.263 1.00 0.00 O ATOM 0 H GLU B 6 13.294 17.038 -12.869 1.00 0.00 H new ATOM 0 HA GLU B 6 12.493 18.379 -10.352 1.00 0.00 H new ATOM 0 HB2 GLU B 6 13.082 19.742 -12.500 1.00 0.00 H new ATOM 0 HB3 GLU B 6 11.546 19.158 -13.110 1.00 0.00 H new ATOM 0 HG2 GLU B 6 10.897 21.156 -12.070 1.00 0.00 H new ATOM 0 HG3 GLU B 6 10.580 19.991 -10.800 1.00 0.00 H new ATOM 1116 N LEU B 7 10.795 16.510 -10.306 1.00 0.00 N ATOM 1117 CA LEU B 7 9.610 15.680 -10.167 1.00 0.00 C ATOM 1118 C LEU B 7 8.699 16.276 -9.091 1.00 0.00 C ATOM 1119 O LEU B 7 9.109 17.168 -8.350 1.00 0.00 O ATOM 1120 CB LEU B 7 10.002 14.225 -9.904 1.00 0.00 C ATOM 1121 CG LEU B 7 10.751 13.517 -11.035 1.00 0.00 C ATOM 1122 CD1 LEU B 7 12.256 13.772 -10.939 1.00 0.00 C ATOM 1123 CD2 LEU B 7 10.423 12.023 -11.058 1.00 0.00 C ATOM 0 H LEU B 7 11.453 16.447 -9.530 1.00 0.00 H new ATOM 0 HA LEU B 7 9.041 15.669 -11.097 1.00 0.00 H new ATOM 0 HB2 LEU B 7 10.622 14.193 -9.008 1.00 0.00 H new ATOM 0 HB3 LEU B 7 9.096 13.659 -9.685 1.00 0.00 H new ATOM 0 HG LEU B 7 10.413 13.935 -11.983 1.00 0.00 H new ATOM 0 HD11 LEU B 7 12.765 13.258 -11.754 1.00 0.00 H new ATOM 0 HD12 LEU B 7 12.449 14.843 -11.009 1.00 0.00 H new ATOM 0 HD13 LEU B 7 12.628 13.398 -9.985 1.00 0.00 H new ATOM 0 HD21 LEU B 7 10.968 11.543 -11.871 1.00 0.00 H new ATOM 0 HD22 LEU B 7 10.715 11.572 -10.110 1.00 0.00 H new ATOM 0 HD23 LEU B 7 9.352 11.888 -11.210 1.00 0.00 H new ATOM 1135 N ARG B 8 7.480 15.759 -9.040 1.00 0.00 N ATOM 1136 CA ARG B 8 6.508 16.228 -8.067 1.00 0.00 C ATOM 1137 C ARG B 8 5.845 15.042 -7.364 1.00 0.00 C ATOM 1138 O ARG B 8 6.490 14.025 -7.113 1.00 0.00 O ATOM 1139 CB ARG B 8 5.430 17.084 -8.735 1.00 0.00 C ATOM 1140 CG ARG B 8 6.051 18.081 -9.715 1.00 0.00 C ATOM 1141 CD ARG B 8 5.300 18.080 -11.048 1.00 0.00 C ATOM 1142 NE ARG B 8 6.110 18.756 -12.086 1.00 0.00 N ATOM 1143 CZ ARG B 8 6.331 20.077 -12.125 1.00 0.00 C ATOM 1144 NH1 ARG B 8 5.803 20.872 -11.185 1.00 0.00 N ATOM 1145 NH2 ARG B 8 7.078 20.603 -13.105 1.00 0.00 N ATOM 0 H ARG B 8 7.143 15.020 -9.657 1.00 0.00 H new ATOM 0 HA ARG B 8 7.039 16.837 -7.335 1.00 0.00 H new ATOM 0 HB2 ARG B 8 4.725 16.441 -9.262 1.00 0.00 H new ATOM 0 HB3 ARG B 8 4.864 17.621 -7.974 1.00 0.00 H new ATOM 0 HG2 ARG B 8 6.031 19.082 -9.283 1.00 0.00 H new ATOM 0 HG3 ARG B 8 7.098 17.827 -9.883 1.00 0.00 H new ATOM 0 HD2 ARG B 8 5.085 17.056 -11.353 1.00 0.00 H new ATOM 0 HD3 ARG B 8 4.342 18.587 -10.935 1.00 0.00 H new ATOM 0 HE ARG B 8 6.526 18.180 -12.818 1.00 0.00 H new ATOM 0 HH11 ARG B 8 5.233 20.472 -10.440 1.00 0.00 H new ATOM 0 HH12 ARG B 8 5.971 21.878 -11.214 1.00 0.00 H new ATOM 0 HH21 ARG B 8 7.479 19.998 -13.822 1.00 0.00 H new ATOM 0 HH22 ARG B 8 7.246 21.609 -13.134 1.00 0.00 H new ATOM 1159 N CYS B 9 4.565 15.211 -7.067 1.00 0.00 N ATOM 1160 CA CYS B 9 3.807 14.167 -6.398 1.00 0.00 C ATOM 1161 C CYS B 9 3.046 13.371 -7.460 1.00 0.00 C ATOM 1162 O CYS B 9 2.916 13.815 -8.600 1.00 0.00 O ATOM 1163 CB CYS B 9 2.870 14.742 -5.335 1.00 0.00 C ATOM 1164 SG CYS B 9 3.684 15.201 -3.761 1.00 0.00 S ATOM 0 H CYS B 9 4.033 16.056 -7.277 1.00 0.00 H new ATOM 0 HA CYS B 9 4.488 13.503 -5.866 1.00 0.00 H new ATOM 0 HB2 CYS B 9 2.378 15.624 -5.744 1.00 0.00 H new ATOM 0 HB3 CYS B 9 2.090 14.010 -5.124 1.00 0.00 H new ATOM 1169 N GLN B 10 2.563 12.208 -7.048 1.00 0.00 N ATOM 1170 CA GLN B 10 1.818 11.346 -7.950 1.00 0.00 C ATOM 1171 C GLN B 10 0.326 11.390 -7.615 1.00 0.00 C ATOM 1172 O GLN B 10 -0.460 10.620 -8.165 1.00 0.00 O ATOM 1173 CB GLN B 10 2.349 9.912 -7.901 1.00 0.00 C ATOM 1174 CG GLN B 10 2.331 9.272 -9.290 1.00 0.00 C ATOM 1175 CD GLN B 10 1.537 7.964 -9.282 1.00 0.00 C ATOM 1176 OE1 GLN B 10 0.563 7.795 -9.997 1.00 0.00 O ATOM 1177 NE2 GLN B 10 2.006 7.052 -8.436 1.00 0.00 N ATOM 0 H GLN B 10 2.673 11.843 -6.102 1.00 0.00 H new ATOM 0 HA GLN B 10 1.953 11.714 -8.967 1.00 0.00 H new ATOM 0 HB2 GLN B 10 3.366 9.910 -7.509 1.00 0.00 H new ATOM 0 HB3 GLN B 10 1.743 9.319 -7.216 1.00 0.00 H new ATOM 0 HG2 GLN B 10 1.890 9.964 -10.007 1.00 0.00 H new ATOM 0 HG3 GLN B 10 3.352 9.079 -9.619 1.00 0.00 H new ATOM 0 HE21 GLN B 10 2.826 7.259 -7.866 1.00 0.00 H new ATOM 0 HE22 GLN B 10 1.545 6.145 -8.357 1.00 0.00 H new ATOM 1186 N CYS B 11 -0.019 12.299 -6.715 1.00 0.00 N ATOM 1187 CA CYS B 11 -1.403 12.453 -6.300 1.00 0.00 C ATOM 1188 C CYS B 11 -1.743 13.945 -6.307 1.00 0.00 C ATOM 1189 O CYS B 11 -1.186 14.716 -5.526 1.00 0.00 O ATOM 1190 CB CYS B 11 -1.658 11.816 -4.933 1.00 0.00 C ATOM 1191 SG CYS B 11 -2.541 10.214 -4.985 1.00 0.00 S ATOM 0 H CYS B 11 0.636 12.936 -6.262 1.00 0.00 H new ATOM 0 HA CYS B 11 -2.055 11.929 -6.999 1.00 0.00 H new ATOM 0 HB2 CYS B 11 -0.701 11.671 -4.431 1.00 0.00 H new ATOM 0 HB3 CYS B 11 -2.235 12.513 -4.325 1.00 0.00 H new ATOM 1196 N LEU B 12 -2.655 14.308 -7.197 1.00 0.00 N ATOM 1197 CA LEU B 12 -3.075 15.693 -7.315 1.00 0.00 C ATOM 1198 C LEU B 12 -4.220 15.960 -6.336 1.00 0.00 C ATOM 1199 O LEU B 12 -4.422 17.095 -5.905 1.00 0.00 O ATOM 1200 CB LEU B 12 -3.419 16.026 -8.768 1.00 0.00 C ATOM 1201 CG LEU B 12 -2.410 15.562 -9.820 1.00 0.00 C ATOM 1202 CD1 LEU B 12 -3.078 15.397 -11.187 1.00 0.00 C ATOM 1203 CD2 LEU B 12 -1.207 16.506 -9.880 1.00 0.00 C ATOM 0 H LEU B 12 -3.115 13.666 -7.843 1.00 0.00 H new ATOM 0 HA LEU B 12 -2.259 16.363 -7.042 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -4.387 15.583 -9.002 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -3.533 17.106 -8.855 1.00 0.00 H new ATOM 0 HG LEU B 12 -2.036 14.582 -9.525 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.338 15.066 -11.916 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -3.874 14.656 -11.116 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -3.499 16.351 -11.504 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -0.505 16.153 -10.636 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -1.545 17.510 -10.139 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -0.713 16.528 -8.908 1.00 0.00 H new ATOM 1215 N GLN B 13 -4.940 14.896 -6.012 1.00 0.00 N ATOM 1216 CA GLN B 13 -6.059 15.001 -5.092 1.00 0.00 C ATOM 1217 C GLN B 13 -6.030 13.847 -4.088 1.00 0.00 C ATOM 1218 O GLN B 13 -5.151 12.988 -4.148 1.00 0.00 O ATOM 1219 CB GLN B 13 -7.389 15.037 -5.847 1.00 0.00 C ATOM 1220 CG GLN B 13 -8.469 15.742 -5.023 1.00 0.00 C ATOM 1221 CD GLN B 13 -9.377 16.586 -5.918 1.00 0.00 C ATOM 1222 OE1 GLN B 13 -9.863 16.145 -6.947 1.00 0.00 O ATOM 1223 NE2 GLN B 13 -9.579 17.823 -5.471 1.00 0.00 N ATOM 0 H GLN B 13 -4.770 13.956 -6.371 1.00 0.00 H new ATOM 0 HA GLN B 13 -5.966 15.938 -4.543 1.00 0.00 H new ATOM 0 HB2 GLN B 13 -7.257 15.553 -6.798 1.00 0.00 H new ATOM 0 HB3 GLN B 13 -7.708 14.021 -6.077 1.00 0.00 H new ATOM 0 HG2 GLN B 13 -9.065 15.002 -4.489 1.00 0.00 H new ATOM 0 HG3 GLN B 13 -8.001 16.377 -4.271 1.00 0.00 H new ATOM 0 HE21 GLN B 13 -9.142 18.129 -4.602 1.00 0.00 H new ATOM 0 HE22 GLN B 13 -10.171 18.465 -5.998 1.00 0.00 H new ATOM 1232 N THR B 14 -7.002 13.864 -3.187 1.00 0.00 N ATOM 1233 CA THR B 14 -7.099 12.829 -2.171 1.00 0.00 C ATOM 1234 C THR B 14 -8.532 12.732 -1.645 1.00 0.00 C ATOM 1235 O THR B 14 -9.319 13.665 -1.798 1.00 0.00 O ATOM 1236 CB THR B 14 -6.071 13.139 -1.081 1.00 0.00 C ATOM 1237 OG1 THR B 14 -6.072 14.562 -0.997 1.00 0.00 O ATOM 1238 CG2 THR B 14 -4.643 12.792 -1.507 1.00 0.00 C ATOM 0 H THR B 14 -7.729 14.578 -3.139 1.00 0.00 H new ATOM 0 HA THR B 14 -6.870 11.846 -2.583 1.00 0.00 H new ATOM 0 HB THR B 14 -6.324 12.587 -0.176 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.433 14.850 -0.312 1.00 0.00 H new ATOM 0 HG21 THR B 14 -3.953 13.031 -0.697 1.00 0.00 H new ATOM 0 HG22 THR B 14 -4.580 11.728 -1.735 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.377 13.369 -2.393 1.00 0.00 H new ATOM 1246 N LEU B 15 -8.828 11.593 -1.035 1.00 0.00 N ATOM 1247 CA LEU B 15 -10.153 11.362 -0.485 1.00 0.00 C ATOM 1248 C LEU B 15 -10.071 11.347 1.043 1.00 0.00 C ATOM 1249 O LEU B 15 -9.103 11.841 1.621 1.00 0.00 O ATOM 1250 CB LEU B 15 -10.766 10.092 -1.079 1.00 0.00 C ATOM 1251 CG LEU B 15 -10.796 10.014 -2.607 1.00 0.00 C ATOM 1252 CD1 LEU B 15 -10.520 8.589 -3.089 1.00 0.00 C ATOM 1253 CD2 LEU B 15 -12.116 10.560 -3.158 1.00 0.00 C ATOM 0 H LEU B 15 -8.173 10.821 -0.910 1.00 0.00 H new ATOM 0 HA LEU B 15 -10.826 12.173 -0.761 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -10.211 9.233 -0.702 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -11.787 9.998 -0.710 1.00 0.00 H new ATOM 0 HG LEU B 15 -9.998 10.646 -2.997 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -10.547 8.562 -4.178 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -9.536 8.272 -2.742 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -11.279 7.916 -2.690 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -12.112 10.493 -4.246 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -12.946 9.974 -2.762 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -12.232 11.602 -2.859 1.00 0.00 H new ATOM 1265 N GLN B 16 -11.099 10.777 1.654 1.00 0.00 N ATOM 1266 CA GLN B 16 -11.155 10.691 3.103 1.00 0.00 C ATOM 1267 C GLN B 16 -11.042 9.234 3.554 1.00 0.00 C ATOM 1268 O GLN B 16 -11.078 8.945 4.749 1.00 0.00 O ATOM 1269 CB GLN B 16 -12.435 11.334 3.641 1.00 0.00 C ATOM 1270 CG GLN B 16 -12.668 10.950 5.104 1.00 0.00 C ATOM 1271 CD GLN B 16 -13.510 12.009 5.821 1.00 0.00 C ATOM 1272 OE1 GLN B 16 -14.475 12.535 5.291 1.00 0.00 O ATOM 1273 NE2 GLN B 16 -13.091 12.290 7.051 1.00 0.00 N ATOM 0 H GLN B 16 -11.900 10.370 1.172 1.00 0.00 H new ATOM 0 HA GLN B 16 -10.310 11.244 3.513 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -12.367 12.418 3.552 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -13.286 11.018 3.038 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -13.171 9.984 5.155 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -11.710 10.837 5.611 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -12.275 11.812 7.434 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -13.585 12.984 7.612 1.00 0.00 H new ATOM 1282 N GLY B 17 -10.906 8.353 2.573 1.00 0.00 N ATOM 1283 CA GLY B 17 -10.787 6.933 2.854 1.00 0.00 C ATOM 1284 C GLY B 17 -11.644 6.109 1.891 1.00 0.00 C ATOM 1285 O GLY B 17 -11.225 5.047 1.434 1.00 0.00 O ATOM 0 H GLY B 17 -10.876 8.596 1.583 1.00 0.00 H new ATOM 0 HA2 GLY B 17 -9.744 6.628 2.770 1.00 0.00 H new ATOM 0 HA3 GLY B 17 -11.095 6.735 3.881 1.00 0.00 H new ATOM 1289 N ILE B 18 -12.829 6.631 1.610 1.00 0.00 N ATOM 1290 CA ILE B 18 -13.749 5.958 0.709 1.00 0.00 C ATOM 1291 C ILE B 18 -14.010 4.539 1.220 1.00 0.00 C ATOM 1292 O ILE B 18 -13.281 4.040 2.076 1.00 0.00 O ATOM 1293 CB ILE B 18 -13.225 6.008 -0.727 1.00 0.00 C ATOM 1294 CG1 ILE B 18 -13.581 7.338 -1.395 1.00 0.00 C ATOM 1295 CG2 ILE B 18 -13.725 4.809 -1.535 1.00 0.00 C ATOM 1296 CD1 ILE B 18 -15.030 7.334 -1.886 1.00 0.00 C ATOM 0 H ILE B 18 -13.173 7.513 1.991 1.00 0.00 H new ATOM 0 HA ILE B 18 -14.710 6.472 0.691 1.00 0.00 H new ATOM 0 HB ILE B 18 -12.137 5.944 -0.696 1.00 0.00 H new ATOM 0 HG12 ILE B 18 -13.435 8.155 -0.688 1.00 0.00 H new ATOM 0 HG13 ILE B 18 -12.909 7.519 -2.234 1.00 0.00 H new ATOM 0 HG21 ILE B 18 -13.338 4.869 -2.552 1.00 0.00 H new ATOM 0 HG22 ILE B 18 -13.379 3.886 -1.069 1.00 0.00 H new ATOM 0 HG23 ILE B 18 -14.815 4.816 -1.560 1.00 0.00 H new ATOM 0 HD11 ILE B 18 -15.257 8.291 -2.357 1.00 0.00 H new ATOM 0 HD12 ILE B 18 -15.166 6.531 -2.611 1.00 0.00 H new ATOM 0 HD13 ILE B 18 -15.700 7.177 -1.041 1.00 0.00 H new ATOM 1308 N HIS B 19 -15.051 3.930 0.673 1.00 0.00 N ATOM 1309 CA HIS B 19 -15.417 2.579 1.062 1.00 0.00 C ATOM 1310 C HIS B 19 -14.294 1.613 0.681 1.00 0.00 C ATOM 1311 O HIS B 19 -13.623 1.804 -0.332 1.00 0.00 O ATOM 1312 CB HIS B 19 -16.767 2.186 0.459 1.00 0.00 C ATOM 1313 CG HIS B 19 -17.702 1.509 1.433 1.00 0.00 C ATOM 1314 ND1 HIS B 19 -18.934 2.036 1.780 1.00 0.00 N ATOM 1315 CD2 HIS B 19 -17.572 0.343 2.129 1.00 0.00 C ATOM 1316 CE1 HIS B 19 -19.510 1.216 2.646 1.00 0.00 C ATOM 1317 NE2 HIS B 19 -18.664 0.168 2.862 1.00 0.00 N ATOM 0 H HIS B 19 -15.653 4.347 -0.037 1.00 0.00 H new ATOM 0 HA HIS B 19 -15.540 2.530 2.144 1.00 0.00 H new ATOM 0 HB2 HIS B 19 -17.252 3.080 0.067 1.00 0.00 H new ATOM 0 HB3 HIS B 19 -16.595 1.520 -0.387 1.00 0.00 H new ATOM 0 HD2 HIS B 19 -16.724 -0.325 2.090 1.00 0.00 H new ATOM 0 HE1 HIS B 19 -20.480 1.353 3.101 1.00 0.00 H new ATOM 0 HE2 HIS B 19 -18.842 -0.620 3.484 1.00 0.00 H new ATOM 1325 N LEU B 20 -14.124 0.595 1.512 1.00 0.00 N ATOM 1326 CA LEU B 20 -13.093 -0.401 1.274 1.00 0.00 C ATOM 1327 C LEU B 20 -13.680 -1.549 0.450 1.00 0.00 C ATOM 1328 O LEU B 20 -13.035 -2.580 0.269 1.00 0.00 O ATOM 1329 CB LEU B 20 -12.468 -0.851 2.596 1.00 0.00 C ATOM 1330 CG LEU B 20 -11.508 -2.040 2.514 1.00 0.00 C ATOM 1331 CD1 LEU B 20 -10.508 -1.859 1.371 1.00 0.00 C ATOM 1332 CD2 LEU B 20 -10.810 -2.275 3.855 1.00 0.00 C ATOM 0 H LEU B 20 -14.683 0.438 2.351 1.00 0.00 H new ATOM 0 HA LEU B 20 -12.277 0.027 0.691 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -11.932 -0.006 3.028 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -13.272 -1.105 3.287 1.00 0.00 H new ATOM 0 HG LEU B 20 -12.090 -2.935 2.294 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -9.838 -2.718 1.335 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -11.046 -1.778 0.426 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -9.927 -0.952 1.536 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -10.134 -3.125 3.769 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -10.242 -1.386 4.130 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -11.556 -2.481 4.622 1.00 0.00 H new ATOM 1344 N LYS B 21 -14.897 -1.331 -0.027 1.00 0.00 N ATOM 1345 CA LYS B 21 -15.578 -2.334 -0.828 1.00 0.00 C ATOM 1346 C LYS B 21 -15.174 -2.170 -2.294 1.00 0.00 C ATOM 1347 O LYS B 21 -15.304 -3.102 -3.086 1.00 0.00 O ATOM 1348 CB LYS B 21 -17.089 -2.270 -0.595 1.00 0.00 C ATOM 1349 CG LYS B 21 -17.689 -1.015 -1.233 1.00 0.00 C ATOM 1350 CD LYS B 21 -18.961 -1.352 -2.014 1.00 0.00 C ATOM 1351 CE LYS B 21 -18.685 -1.396 -3.519 1.00 0.00 C ATOM 1352 NZ LYS B 21 -19.856 -0.901 -4.275 1.00 0.00 N ATOM 0 H LYS B 21 -15.429 -0.474 0.126 1.00 0.00 H new ATOM 0 HA LYS B 21 -15.274 -3.336 -0.524 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -17.563 -3.158 -1.014 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -17.296 -2.273 0.475 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -17.917 -0.282 -0.459 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -16.959 -0.557 -1.900 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -19.350 -2.315 -1.684 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -19.729 -0.608 -1.803 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -17.811 -0.788 -3.752 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -18.454 -2.417 -3.823 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -19.652 -0.938 -5.294 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -20.682 -1.497 -4.066 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -20.059 0.081 -3.998 1.00 0.00 H new ATOM 1366 N ASN B 22 -14.691 -0.977 -2.612 1.00 0.00 N ATOM 1367 CA ASN B 22 -14.267 -0.680 -3.970 1.00 0.00 C ATOM 1368 C ASN B 22 -12.750 -0.849 -4.074 1.00 0.00 C ATOM 1369 O ASN B 22 -12.246 -1.353 -5.076 1.00 0.00 O ATOM 1370 CB ASN B 22 -14.610 0.763 -4.350 1.00 0.00 C ATOM 1371 CG ASN B 22 -15.883 0.819 -5.196 1.00 0.00 C ATOM 1372 OD1 ASN B 22 -15.990 0.205 -6.245 1.00 0.00 O ATOM 1373 ND2 ASN B 22 -16.840 1.588 -4.683 1.00 0.00 N ATOM 0 H ASN B 22 -14.584 -0.206 -1.953 1.00 0.00 H new ATOM 0 HA ASN B 22 -14.785 -1.363 -4.643 1.00 0.00 H new ATOM 0 HB2 ASN B 22 -14.743 1.359 -3.447 1.00 0.00 H new ATOM 0 HB3 ASN B 22 -13.781 1.204 -4.904 1.00 0.00 H new ATOM 0 HD21 ASN B 22 -17.729 1.691 -5.173 1.00 0.00 H new ATOM 0 HD22 ASN B 22 -16.685 2.075 -3.800 1.00 0.00 H new ATOM 1380 N ILE B 23 -12.065 -0.417 -3.026 1.00 0.00 N ATOM 1381 CA ILE B 23 -10.616 -0.514 -2.987 1.00 0.00 C ATOM 1382 C ILE B 23 -10.202 -1.977 -3.164 1.00 0.00 C ATOM 1383 O ILE B 23 -10.718 -2.858 -2.478 1.00 0.00 O ATOM 1384 CB ILE B 23 -10.070 0.129 -1.711 1.00 0.00 C ATOM 1385 CG1 ILE B 23 -9.945 1.646 -1.872 1.00 0.00 C ATOM 1386 CG2 ILE B 23 -8.745 -0.514 -1.296 1.00 0.00 C ATOM 1387 CD1 ILE B 23 -10.441 2.373 -0.621 1.00 0.00 C ATOM 0 H ILE B 23 -12.487 0.001 -2.197 1.00 0.00 H new ATOM 0 HA ILE B 23 -10.175 0.045 -3.812 1.00 0.00 H new ATOM 0 HB ILE B 23 -10.782 -0.052 -0.906 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -8.905 1.911 -2.062 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -10.520 1.972 -2.738 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -8.379 -0.038 -0.386 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -8.898 -1.578 -1.113 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -8.013 -0.385 -2.093 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -10.341 3.449 -0.762 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -11.488 2.125 -0.447 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -9.848 2.063 0.239 1.00 0.00 H new ATOM 1399 N GLN B 24 -9.276 -2.189 -4.087 1.00 0.00 N ATOM 1400 CA GLN B 24 -8.788 -3.530 -4.363 1.00 0.00 C ATOM 1401 C GLN B 24 -7.326 -3.662 -3.929 1.00 0.00 C ATOM 1402 O GLN B 24 -6.860 -4.760 -3.631 1.00 0.00 O ATOM 1403 CB GLN B 24 -8.954 -3.880 -5.842 1.00 0.00 C ATOM 1404 CG GLN B 24 -9.525 -5.290 -6.011 1.00 0.00 C ATOM 1405 CD GLN B 24 -8.722 -6.088 -7.040 1.00 0.00 C ATOM 1406 OE1 GLN B 24 -9.094 -6.213 -8.195 1.00 0.00 O ATOM 1407 NE2 GLN B 24 -7.602 -6.619 -6.557 1.00 0.00 N ATOM 0 H GLN B 24 -8.851 -1.455 -4.653 1.00 0.00 H new ATOM 0 HA GLN B 24 -9.384 -4.238 -3.787 1.00 0.00 H new ATOM 0 HB2 GLN B 24 -9.615 -3.156 -6.319 1.00 0.00 H new ATOM 0 HB3 GLN B 24 -7.990 -3.811 -6.346 1.00 0.00 H new ATOM 0 HG2 GLN B 24 -9.511 -5.809 -5.052 1.00 0.00 H new ATOM 0 HG3 GLN B 24 -10.567 -5.229 -6.326 1.00 0.00 H new ATOM 0 HE21 GLN B 24 -7.350 -6.475 -5.579 1.00 0.00 H new ATOM 0 HE22 GLN B 24 -6.995 -7.170 -7.164 1.00 0.00 H new ATOM 1416 N SER B 25 -6.644 -2.526 -3.907 1.00 0.00 N ATOM 1417 CA SER B 25 -5.245 -2.501 -3.514 1.00 0.00 C ATOM 1418 C SER B 25 -4.870 -1.108 -3.004 1.00 0.00 C ATOM 1419 O SER B 25 -5.589 -0.140 -3.246 1.00 0.00 O ATOM 1420 CB SER B 25 -4.339 -2.902 -4.680 1.00 0.00 C ATOM 1421 OG SER B 25 -5.081 -3.156 -5.870 1.00 0.00 O ATOM 0 H SER B 25 -7.034 -1.617 -4.155 1.00 0.00 H new ATOM 0 HA SER B 25 -5.101 -3.225 -2.712 1.00 0.00 H new ATOM 0 HB2 SER B 25 -3.615 -2.108 -4.866 1.00 0.00 H new ATOM 0 HB3 SER B 25 -3.772 -3.793 -4.409 1.00 0.00 H new ATOM 0 HG SER B 25 -4.467 -3.407 -6.591 1.00 0.00 H new ATOM 1427 N VAL B 26 -3.744 -1.051 -2.308 1.00 0.00 N ATOM 1428 CA VAL B 26 -3.264 0.207 -1.762 1.00 0.00 C ATOM 1429 C VAL B 26 -1.822 0.439 -2.218 1.00 0.00 C ATOM 1430 O VAL B 26 -1.009 -0.484 -2.211 1.00 0.00 O ATOM 1431 CB VAL B 26 -3.418 0.209 -0.240 1.00 0.00 C ATOM 1432 CG1 VAL B 26 -2.661 1.382 0.386 1.00 0.00 C ATOM 1433 CG2 VAL B 26 -4.894 0.232 0.163 1.00 0.00 C ATOM 0 H VAL B 26 -3.150 -1.856 -2.110 1.00 0.00 H new ATOM 0 HA VAL B 26 -3.861 1.039 -2.137 1.00 0.00 H new ATOM 0 HB VAL B 26 -2.981 -0.714 0.141 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -2.787 1.360 1.468 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -1.602 1.303 0.142 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -3.055 2.320 -0.006 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -4.974 0.233 1.250 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -5.366 1.129 -0.237 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -5.394 -0.650 -0.237 1.00 0.00 H new ATOM 1443 N LYS B 27 -1.549 1.677 -2.602 1.00 0.00 N ATOM 1444 CA LYS B 27 -0.219 2.042 -3.060 1.00 0.00 C ATOM 1445 C LYS B 27 0.281 3.243 -2.256 1.00 0.00 C ATOM 1446 O LYS B 27 -0.322 4.315 -2.294 1.00 0.00 O ATOM 1447 CB LYS B 27 -0.218 2.271 -4.573 1.00 0.00 C ATOM 1448 CG LYS B 27 1.178 2.656 -5.068 1.00 0.00 C ATOM 1449 CD LYS B 27 2.254 1.801 -4.395 1.00 0.00 C ATOM 1450 CE LYS B 27 3.571 1.868 -5.170 1.00 0.00 C ATOM 1451 NZ LYS B 27 3.621 0.809 -6.202 1.00 0.00 N ATOM 0 H LYS B 27 -2.226 2.440 -2.605 1.00 0.00 H new ATOM 0 HA LYS B 27 0.482 1.226 -2.884 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -0.552 1.366 -5.082 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -0.928 3.059 -4.826 1.00 0.00 H new ATOM 0 HG2 LYS B 27 1.232 2.530 -6.149 1.00 0.00 H new ATOM 0 HG3 LYS B 27 1.363 3.710 -4.860 1.00 0.00 H new ATOM 0 HD2 LYS B 27 2.411 2.146 -3.373 1.00 0.00 H new ATOM 0 HD3 LYS B 27 1.916 0.767 -4.334 1.00 0.00 H new ATOM 0 HE2 LYS B 27 3.674 2.846 -5.640 1.00 0.00 H new ATOM 0 HE3 LYS B 27 4.410 1.754 -4.483 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 4.339 1.052 -6.914 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 3.867 -0.098 -5.757 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 2.692 0.728 -6.662 1.00 0.00 H new ATOM 1465 N VAL B 28 1.378 3.024 -1.546 1.00 0.00 N ATOM 1466 CA VAL B 28 1.966 4.076 -0.733 1.00 0.00 C ATOM 1467 C VAL B 28 3.298 4.506 -1.350 1.00 0.00 C ATOM 1468 O VAL B 28 4.245 3.722 -1.401 1.00 0.00 O ATOM 1469 CB VAL B 28 2.102 3.603 0.715 1.00 0.00 C ATOM 1470 CG1 VAL B 28 3.178 4.403 1.454 1.00 0.00 C ATOM 1471 CG2 VAL B 28 0.760 3.684 1.447 1.00 0.00 C ATOM 0 H VAL B 28 1.875 2.134 -1.517 1.00 0.00 H new ATOM 0 HA VAL B 28 1.319 4.953 -0.715 1.00 0.00 H new ATOM 0 HB VAL B 28 2.412 2.558 0.698 1.00 0.00 H new ATOM 0 HG11 VAL B 28 3.255 4.047 2.481 1.00 0.00 H new ATOM 0 HG12 VAL B 28 4.137 4.273 0.952 1.00 0.00 H new ATOM 0 HG13 VAL B 28 2.909 5.459 1.455 1.00 0.00 H new ATOM 0 HG21 VAL B 28 0.885 3.342 2.474 1.00 0.00 H new ATOM 0 HG22 VAL B 28 0.408 4.716 1.448 1.00 0.00 H new ATOM 0 HG23 VAL B 28 0.030 3.052 0.940 1.00 0.00 H new ATOM 1481 N LYS B 29 3.330 5.751 -1.803 1.00 0.00 N ATOM 1482 CA LYS B 29 4.531 6.295 -2.414 1.00 0.00 C ATOM 1483 C LYS B 29 5.033 7.475 -1.580 1.00 0.00 C ATOM 1484 O LYS B 29 4.742 8.629 -1.893 1.00 0.00 O ATOM 1485 CB LYS B 29 4.275 6.643 -3.881 1.00 0.00 C ATOM 1486 CG LYS B 29 5.571 6.585 -4.693 1.00 0.00 C ATOM 1487 CD LYS B 29 6.400 7.855 -4.492 1.00 0.00 C ATOM 1488 CE LYS B 29 6.852 8.433 -5.835 1.00 0.00 C ATOM 1489 NZ LYS B 29 7.937 9.420 -5.636 1.00 0.00 N ATOM 0 H LYS B 29 2.543 6.399 -1.759 1.00 0.00 H new ATOM 0 HA LYS B 29 5.326 5.549 -2.422 1.00 0.00 H new ATOM 0 HB2 LYS B 29 3.547 5.949 -4.301 1.00 0.00 H new ATOM 0 HB3 LYS B 29 3.842 7.641 -3.951 1.00 0.00 H new ATOM 0 HG2 LYS B 29 6.154 5.714 -4.393 1.00 0.00 H new ATOM 0 HG3 LYS B 29 5.337 6.463 -5.750 1.00 0.00 H new ATOM 0 HD2 LYS B 29 5.811 8.597 -3.953 1.00 0.00 H new ATOM 0 HD3 LYS B 29 7.271 7.631 -3.877 1.00 0.00 H new ATOM 0 HE2 LYS B 29 7.198 7.630 -6.485 1.00 0.00 H new ATOM 0 HE3 LYS B 29 6.008 8.907 -6.336 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 8.047 9.994 -6.497 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 7.700 10.039 -4.835 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 8.828 8.921 -5.436 1.00 0.00 H new ATOM 1503 N SER B 30 5.777 7.146 -0.534 1.00 0.00 N ATOM 1504 CA SER B 30 6.322 8.164 0.347 1.00 0.00 C ATOM 1505 C SER B 30 6.959 9.284 -0.478 1.00 0.00 C ATOM 1506 O SER B 30 7.053 9.183 -1.700 1.00 0.00 O ATOM 1507 CB SER B 30 7.347 7.567 1.313 1.00 0.00 C ATOM 1508 OG SER B 30 8.685 7.845 0.910 1.00 0.00 O ATOM 0 H SER B 30 6.015 6.188 -0.277 1.00 0.00 H new ATOM 0 HA SER B 30 5.505 8.577 0.938 1.00 0.00 H new ATOM 0 HB2 SER B 30 7.179 7.967 2.313 1.00 0.00 H new ATOM 0 HB3 SER B 30 7.203 6.488 1.373 1.00 0.00 H new ATOM 0 HG SER B 30 8.833 7.498 0.006 1.00 0.00 H new ATOM 1514 N PRO B 31 7.393 10.353 0.242 1.00 0.00 N ATOM 1515 CA PRO B 31 8.019 11.491 -0.411 1.00 0.00 C ATOM 1516 C PRO B 31 9.449 11.157 -0.841 1.00 0.00 C ATOM 1517 O PRO B 31 9.975 10.101 -0.492 1.00 0.00 O ATOM 1518 CB PRO B 31 7.953 12.615 0.610 1.00 0.00 C ATOM 1519 CG PRO B 31 7.716 11.945 1.954 1.00 0.00 C ATOM 1520 CD PRO B 31 7.298 10.508 1.691 1.00 0.00 C ATOM 0 HA PRO B 31 7.513 11.778 -1.333 1.00 0.00 H new ATOM 0 HB2 PRO B 31 8.879 13.190 0.618 1.00 0.00 H new ATOM 0 HB3 PRO B 31 7.148 13.311 0.373 1.00 0.00 H new ATOM 0 HG2 PRO B 31 8.621 11.974 2.560 1.00 0.00 H new ATOM 0 HG3 PRO B 31 6.942 12.472 2.512 1.00 0.00 H new ATOM 0 HD2 PRO B 31 7.951 9.805 2.208 1.00 0.00 H new ATOM 0 HD3 PRO B 31 6.284 10.320 2.044 1.00 0.00 H new ATOM 1528 N GLY B 32 10.037 12.077 -1.592 1.00 0.00 N ATOM 1529 CA GLY B 32 11.395 11.893 -2.073 1.00 0.00 C ATOM 1530 C GLY B 32 12.123 13.235 -2.185 1.00 0.00 C ATOM 1531 O GLY B 32 11.741 14.208 -1.537 1.00 0.00 O ATOM 0 H GLY B 32 9.598 12.952 -1.879 1.00 0.00 H new ATOM 0 HA2 GLY B 32 11.939 11.235 -1.395 1.00 0.00 H new ATOM 0 HA3 GLY B 32 11.377 11.403 -3.046 1.00 0.00 H new ATOM 1535 N PRO B 33 13.186 13.243 -3.033 1.00 0.00 N ATOM 1536 CA PRO B 33 13.971 14.449 -3.238 1.00 0.00 C ATOM 1537 C PRO B 33 13.218 15.450 -4.116 1.00 0.00 C ATOM 1538 O PRO B 33 13.737 16.521 -4.428 1.00 0.00 O ATOM 1539 CB PRO B 33 15.271 13.970 -3.864 1.00 0.00 C ATOM 1540 CG PRO B 33 14.983 12.582 -4.412 1.00 0.00 C ATOM 1541 CD PRO B 33 13.667 12.109 -3.817 1.00 0.00 C ATOM 0 HA PRO B 33 14.166 14.987 -2.310 1.00 0.00 H new ATOM 0 HB2 PRO B 33 15.594 14.644 -4.658 1.00 0.00 H new ATOM 0 HB3 PRO B 33 16.072 13.940 -3.126 1.00 0.00 H new ATOM 0 HG2 PRO B 33 14.923 12.606 -5.500 1.00 0.00 H new ATOM 0 HG3 PRO B 33 15.788 11.895 -4.152 1.00 0.00 H new ATOM 0 HD2 PRO B 33 12.955 11.836 -4.596 1.00 0.00 H new ATOM 0 HD3 PRO B 33 13.809 11.227 -3.192 1.00 0.00 H new ATOM 1549 N HIS B 34 12.006 15.067 -4.490 1.00 0.00 N ATOM 1550 CA HIS B 34 11.176 15.918 -5.325 1.00 0.00 C ATOM 1551 C HIS B 34 9.958 16.390 -4.528 1.00 0.00 C ATOM 1552 O HIS B 34 9.717 17.590 -4.409 1.00 0.00 O ATOM 1553 CB HIS B 34 10.794 15.201 -6.622 1.00 0.00 C ATOM 1554 CG HIS B 34 10.630 13.707 -6.471 1.00 0.00 C ATOM 1555 ND1 HIS B 34 11.683 12.865 -6.161 1.00 0.00 N ATOM 1556 CD2 HIS B 34 9.525 12.916 -6.591 1.00 0.00 C ATOM 1557 CE1 HIS B 34 11.221 11.624 -6.101 1.00 0.00 C ATOM 1558 NE2 HIS B 34 9.884 11.658 -6.368 1.00 0.00 N ATOM 0 H HIS B 34 11.579 14.178 -4.230 1.00 0.00 H new ATOM 0 HA HIS B 34 11.739 16.804 -5.620 1.00 0.00 H new ATOM 0 HB2 HIS B 34 9.862 15.623 -6.998 1.00 0.00 H new ATOM 0 HB3 HIS B 34 11.559 15.398 -7.373 1.00 0.00 H new ATOM 0 HD1 HIS B 34 12.650 13.150 -6.005 1.00 0.00 H new ATOM 0 HD2 HIS B 34 8.527 13.256 -6.827 1.00 0.00 H new ATOM 0 HE1 HIS B 34 11.802 10.741 -5.879 1.00 0.00 H new ATOM 1566 N CYS B 35 9.223 15.421 -4.002 1.00 0.00 N ATOM 1567 CA CYS B 35 8.037 15.722 -3.220 1.00 0.00 C ATOM 1568 C CYS B 35 8.327 15.382 -1.757 1.00 0.00 C ATOM 1569 O CYS B 35 8.715 14.258 -1.442 1.00 0.00 O ATOM 1570 CB CYS B 35 6.808 14.978 -3.746 1.00 0.00 C ATOM 1571 SG CYS B 35 5.462 16.055 -4.359 1.00 0.00 S ATOM 0 H CYS B 35 9.427 14.427 -4.102 1.00 0.00 H new ATOM 0 HA CYS B 35 7.802 16.783 -3.306 1.00 0.00 H new ATOM 0 HB2 CYS B 35 7.120 14.315 -4.553 1.00 0.00 H new ATOM 0 HB3 CYS B 35 6.415 14.347 -2.949 1.00 0.00 H new ATOM 1576 N ALA B 36 8.128 16.373 -0.901 1.00 0.00 N ATOM 1577 CA ALA B 36 8.363 16.193 0.522 1.00 0.00 C ATOM 1578 C ALA B 36 7.040 15.865 1.216 1.00 0.00 C ATOM 1579 O ALA B 36 6.889 16.098 2.414 1.00 0.00 O ATOM 1580 CB ALA B 36 9.025 17.448 1.093 1.00 0.00 C ATOM 0 H ALA B 36 7.806 17.304 -1.165 1.00 0.00 H new ATOM 0 HA ALA B 36 9.042 15.358 0.696 1.00 0.00 H new ATOM 0 HB1 ALA B 36 9.201 17.313 2.160 1.00 0.00 H new ATOM 0 HB2 ALA B 36 9.975 17.620 0.587 1.00 0.00 H new ATOM 0 HB3 ALA B 36 8.371 18.306 0.939 1.00 0.00 H new ATOM 1586 N GLN B 37 6.115 15.329 0.433 1.00 0.00 N ATOM 1587 CA GLN B 37 4.809 14.967 0.957 1.00 0.00 C ATOM 1588 C GLN B 37 4.433 13.552 0.514 1.00 0.00 C ATOM 1589 O GLN B 37 4.954 13.050 -0.481 1.00 0.00 O ATOM 1590 CB GLN B 37 3.745 15.978 0.525 1.00 0.00 C ATOM 1591 CG GLN B 37 4.252 17.412 0.690 1.00 0.00 C ATOM 1592 CD GLN B 37 4.423 18.093 -0.669 1.00 0.00 C ATOM 1593 OE1 GLN B 37 3.479 18.291 -1.417 1.00 0.00 O ATOM 1594 NE2 GLN B 37 5.677 18.439 -0.947 1.00 0.00 N ATOM 0 H GLN B 37 6.244 15.137 -0.560 1.00 0.00 H new ATOM 0 HA GLN B 37 4.859 14.985 2.046 1.00 0.00 H new ATOM 0 HB2 GLN B 37 3.473 15.802 -0.516 1.00 0.00 H new ATOM 0 HB3 GLN B 37 2.842 15.837 1.119 1.00 0.00 H new ATOM 0 HG2 GLN B 37 3.551 17.981 1.300 1.00 0.00 H new ATOM 0 HG3 GLN B 37 5.204 17.406 1.220 1.00 0.00 H new ATOM 0 HE21 GLN B 37 6.420 18.244 -0.276 1.00 0.00 H new ATOM 0 HE22 GLN B 37 5.895 18.899 -1.831 1.00 0.00 H new ATOM 1603 N THR B 38 3.530 12.948 1.273 1.00 0.00 N ATOM 1604 CA THR B 38 3.078 11.601 0.971 1.00 0.00 C ATOM 1605 C THR B 38 1.970 11.634 -0.084 1.00 0.00 C ATOM 1606 O THR B 38 1.368 12.680 -0.325 1.00 0.00 O ATOM 1607 CB THR B 38 2.649 10.941 2.282 1.00 0.00 C ATOM 1608 OG1 THR B 38 3.760 11.142 3.152 1.00 0.00 O ATOM 1609 CG2 THR B 38 2.539 9.419 2.164 1.00 0.00 C ATOM 0 H THR B 38 3.099 13.367 2.097 1.00 0.00 H new ATOM 0 HA THR B 38 3.879 11.003 0.537 1.00 0.00 H new ATOM 0 HB THR B 38 1.689 11.351 2.597 1.00 0.00 H new ATOM 0 HG1 THR B 38 3.566 10.746 4.027 1.00 0.00 H new ATOM 0 HG21 THR B 38 2.231 9.001 3.123 1.00 0.00 H new ATOM 0 HG22 THR B 38 1.800 9.165 1.404 1.00 0.00 H new ATOM 0 HG23 THR B 38 3.507 9.005 1.882 1.00 0.00 H new ATOM 1617 N GLU B 39 1.734 10.477 -0.685 1.00 0.00 N ATOM 1618 CA GLU B 39 0.709 10.360 -1.708 1.00 0.00 C ATOM 1619 C GLU B 39 0.228 8.912 -1.815 1.00 0.00 C ATOM 1620 O GLU B 39 0.755 8.137 -2.611 1.00 0.00 O ATOM 1621 CB GLU B 39 1.220 10.870 -3.057 1.00 0.00 C ATOM 1622 CG GLU B 39 2.724 10.626 -3.201 1.00 0.00 C ATOM 1623 CD GLU B 39 3.511 11.924 -3.009 1.00 0.00 C ATOM 1624 OE1 GLU B 39 3.083 12.725 -2.150 1.00 0.00 O ATOM 1625 OE2 GLU B 39 4.522 12.086 -3.726 1.00 0.00 O ATOM 0 H GLU B 39 2.235 9.612 -0.483 1.00 0.00 H new ATOM 0 HA GLU B 39 -0.138 10.982 -1.419 1.00 0.00 H new ATOM 0 HB2 GLU B 39 0.687 10.368 -3.865 1.00 0.00 H new ATOM 0 HB3 GLU B 39 1.010 11.936 -3.150 1.00 0.00 H new ATOM 0 HG2 GLU B 39 3.048 9.888 -2.467 1.00 0.00 H new ATOM 0 HG3 GLU B 39 2.936 10.210 -4.186 1.00 0.00 H new ATOM 1632 N VAL B 40 -0.767 8.590 -1.001 1.00 0.00 N ATOM 1633 CA VAL B 40 -1.324 7.248 -0.995 1.00 0.00 C ATOM 1634 C VAL B 40 -2.262 7.084 -2.193 1.00 0.00 C ATOM 1635 O VAL B 40 -3.092 7.952 -2.458 1.00 0.00 O ATOM 1636 CB VAL B 40 -2.011 6.974 0.345 1.00 0.00 C ATOM 1637 CG1 VAL B 40 -2.448 5.511 0.447 1.00 0.00 C ATOM 1638 CG2 VAL B 40 -1.105 7.359 1.515 1.00 0.00 C ATOM 0 H VAL B 40 -1.202 9.235 -0.341 1.00 0.00 H new ATOM 0 HA VAL B 40 -0.533 6.505 -1.098 1.00 0.00 H new ATOM 0 HB VAL B 40 -2.905 7.595 0.397 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -2.933 5.342 1.408 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -3.147 5.283 -0.357 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -1.575 4.864 0.363 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -1.618 7.154 2.455 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -0.185 6.777 1.469 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -0.866 8.421 1.456 1.00 0.00 H new ATOM 1648 N ILE B 41 -2.097 5.966 -2.883 1.00 0.00 N ATOM 1649 CA ILE B 41 -2.919 5.677 -4.047 1.00 0.00 C ATOM 1650 C ILE B 41 -3.580 4.308 -3.872 1.00 0.00 C ATOM 1651 O ILE B 41 -2.908 3.279 -3.921 1.00 0.00 O ATOM 1652 CB ILE B 41 -2.094 5.802 -5.329 1.00 0.00 C ATOM 1653 CG1 ILE B 41 -1.292 7.106 -5.341 1.00 0.00 C ATOM 1654 CG2 ILE B 41 -2.982 5.665 -6.568 1.00 0.00 C ATOM 1655 CD1 ILE B 41 0.205 6.829 -5.188 1.00 0.00 C ATOM 0 H ILE B 41 -1.407 5.249 -2.659 1.00 0.00 H new ATOM 0 HA ILE B 41 -3.721 6.409 -4.139 1.00 0.00 H new ATOM 0 HB ILE B 41 -1.376 4.982 -5.354 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -1.473 7.640 -6.274 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -1.631 7.753 -4.532 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -2.371 5.758 -7.466 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -3.470 4.690 -6.560 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -3.739 6.449 -6.562 1.00 0.00 H new ATOM 0 HD11 ILE B 41 0.752 7.771 -5.200 1.00 0.00 H new ATOM 0 HD12 ILE B 41 0.385 6.316 -4.243 1.00 0.00 H new ATOM 0 HD13 ILE B 41 0.545 6.202 -6.012 1.00 0.00 H new ATOM 1667 N ALA B 42 -4.889 4.341 -3.671 1.00 0.00 N ATOM 1668 CA ALA B 42 -5.649 3.115 -3.489 1.00 0.00 C ATOM 1669 C ALA B 42 -6.231 2.677 -4.834 1.00 0.00 C ATOM 1670 O ALA B 42 -6.860 3.472 -5.531 1.00 0.00 O ATOM 1671 CB ALA B 42 -6.730 3.338 -2.429 1.00 0.00 C ATOM 0 H ALA B 42 -5.443 5.197 -3.630 1.00 0.00 H new ATOM 0 HA ALA B 42 -5.004 2.312 -3.133 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -7.300 2.419 -2.292 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -6.262 3.619 -1.485 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -7.399 4.135 -2.754 1.00 0.00 H new ATOM 1677 N THR B 43 -6.002 1.413 -5.158 1.00 0.00 N ATOM 1678 CA THR B 43 -6.497 0.859 -6.407 1.00 0.00 C ATOM 1679 C THR B 43 -7.960 0.437 -6.260 1.00 0.00 C ATOM 1680 O THR B 43 -8.360 -0.078 -5.217 1.00 0.00 O ATOM 1681 CB THR B 43 -5.571 -0.289 -6.814 1.00 0.00 C ATOM 1682 OG1 THR B 43 -4.358 0.358 -7.185 1.00 0.00 O ATOM 1683 CG2 THR B 43 -6.030 -0.984 -8.098 1.00 0.00 C ATOM 0 H THR B 43 -5.480 0.757 -4.577 1.00 0.00 H new ATOM 0 HA THR B 43 -6.485 1.604 -7.203 1.00 0.00 H new ATOM 0 HB THR B 43 -5.519 -1.018 -6.005 1.00 0.00 H new ATOM 0 HG1 THR B 43 -3.700 -0.314 -7.461 1.00 0.00 H new ATOM 0 HG21 THR B 43 -5.339 -1.790 -8.342 1.00 0.00 H new ATOM 0 HG22 THR B 43 -7.029 -1.394 -7.952 1.00 0.00 H new ATOM 0 HG23 THR B 43 -6.050 -0.263 -8.915 1.00 0.00 H new ATOM 1691 N LEU B 44 -8.719 0.670 -7.321 1.00 0.00 N ATOM 1692 CA LEU B 44 -10.130 0.321 -7.324 1.00 0.00 C ATOM 1693 C LEU B 44 -10.301 -1.087 -7.899 1.00 0.00 C ATOM 1694 O LEU B 44 -9.496 -1.528 -8.718 1.00 0.00 O ATOM 1695 CB LEU B 44 -10.944 1.388 -8.057 1.00 0.00 C ATOM 1696 CG LEU B 44 -12.196 1.890 -7.334 1.00 0.00 C ATOM 1697 CD1 LEU B 44 -12.710 3.187 -7.964 1.00 0.00 C ATOM 1698 CD2 LEU B 44 -13.276 0.807 -7.291 1.00 0.00 C ATOM 0 H LEU B 44 -8.383 1.096 -8.185 1.00 0.00 H new ATOM 0 HA LEU B 44 -10.520 0.300 -6.306 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -10.295 2.241 -8.253 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.244 0.987 -9.025 1.00 0.00 H new ATOM 0 HG LEU B 44 -11.927 2.117 -6.303 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -13.600 3.522 -7.432 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -11.938 3.954 -7.899 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -12.958 3.010 -9.010 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -14.155 1.190 -6.772 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -13.549 0.525 -8.308 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -12.894 -0.067 -6.763 1.00 0.00 H new ATOM 1710 N LYS B 45 -11.354 -1.752 -7.448 1.00 0.00 N ATOM 1711 CA LYS B 45 -11.641 -3.100 -7.908 1.00 0.00 C ATOM 1712 C LYS B 45 -12.182 -3.042 -9.338 1.00 0.00 C ATOM 1713 O LYS B 45 -12.409 -4.078 -9.962 1.00 0.00 O ATOM 1714 CB LYS B 45 -12.572 -3.814 -6.926 1.00 0.00 C ATOM 1715 CG LYS B 45 -12.741 -5.287 -7.304 1.00 0.00 C ATOM 1716 CD LYS B 45 -14.017 -5.500 -8.122 1.00 0.00 C ATOM 1717 CE LYS B 45 -15.137 -6.073 -7.251 1.00 0.00 C ATOM 1718 NZ LYS B 45 -15.901 -7.098 -7.998 1.00 0.00 N ATOM 0 H LYS B 45 -12.019 -1.382 -6.769 1.00 0.00 H new ATOM 0 HA LYS B 45 -10.729 -3.696 -7.936 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -12.169 -3.738 -5.916 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -13.545 -3.323 -6.919 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -11.877 -5.620 -7.878 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -12.778 -5.896 -6.401 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -14.337 -4.553 -8.556 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -13.813 -6.178 -8.951 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -14.715 -6.512 -6.347 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -15.805 -5.272 -6.934 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -16.657 -7.477 -7.393 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -16.320 -6.668 -8.847 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -15.263 -7.870 -8.279 1.00 0.00 H new ATOM 1732 N ASN B 46 -12.373 -1.821 -9.815 1.00 0.00 N ATOM 1733 CA ASN B 46 -12.884 -1.615 -11.160 1.00 0.00 C ATOM 1734 C ASN B 46 -11.718 -1.307 -12.102 1.00 0.00 C ATOM 1735 O ASN B 46 -11.895 -1.256 -13.318 1.00 0.00 O ATOM 1736 CB ASN B 46 -13.853 -0.432 -11.205 1.00 0.00 C ATOM 1737 CG ASN B 46 -13.658 0.388 -12.483 1.00 0.00 C ATOM 1738 OD1 ASN B 46 -13.231 1.629 -12.269 1.00 0.00 O flip ATOM 1739 ND2 ASN B 46 -13.881 -0.076 -13.589 1.00 0.00 N flip ATOM 0 H ASN B 46 -12.183 -0.964 -9.295 1.00 0.00 H new ATOM 0 HA ASN B 46 -13.407 -2.522 -11.465 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -14.879 -0.796 -11.155 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -13.697 0.204 -10.333 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -14.207 -1.038 -13.682 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -13.741 0.498 -14.421 1.00 0.00 H new ATOM 1746 N GLY B 47 -10.552 -1.110 -11.504 1.00 0.00 N ATOM 1747 CA GLY B 47 -9.358 -0.809 -12.274 1.00 0.00 C ATOM 1748 C GLY B 47 -8.930 0.647 -12.076 1.00 0.00 C ATOM 1749 O GLY B 47 -7.837 1.037 -12.483 1.00 0.00 O ATOM 0 H GLY B 47 -10.409 -1.153 -10.495 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -8.549 -1.474 -11.972 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -9.546 -0.996 -13.331 1.00 0.00 H new ATOM 1753 N GLN B 48 -9.814 1.410 -11.450 1.00 0.00 N ATOM 1754 CA GLN B 48 -9.542 2.814 -11.193 1.00 0.00 C ATOM 1755 C GLN B 48 -8.688 2.967 -9.933 1.00 0.00 C ATOM 1756 O GLN B 48 -8.226 1.977 -9.368 1.00 0.00 O ATOM 1757 CB GLN B 48 -10.842 3.612 -11.075 1.00 0.00 C ATOM 1758 CG GLN B 48 -11.316 4.094 -12.447 1.00 0.00 C ATOM 1759 CD GLN B 48 -12.662 4.814 -12.340 1.00 0.00 C ATOM 1760 OE1 GLN B 48 -12.576 6.138 -12.439 1.00 0.00 O flip ATOM 1761 NE2 GLN B 48 -13.708 4.209 -12.179 1.00 0.00 N flip ATOM 0 H GLN B 48 -10.719 1.082 -11.113 1.00 0.00 H new ATOM 0 HA GLN B 48 -8.983 3.216 -12.038 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -11.613 2.992 -10.617 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -10.689 4.468 -10.418 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -10.573 4.766 -12.877 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -11.407 3.244 -13.124 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -13.703 3.191 -12.111 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -14.588 4.721 -12.112 1.00 0.00 H new ATOM 1770 N LYS B 49 -8.504 4.215 -9.529 1.00 0.00 N ATOM 1771 CA LYS B 49 -7.714 4.511 -8.346 1.00 0.00 C ATOM 1772 C LYS B 49 -8.308 5.726 -7.632 1.00 0.00 C ATOM 1773 O LYS B 49 -8.795 6.653 -8.277 1.00 0.00 O ATOM 1774 CB LYS B 49 -6.238 4.674 -8.714 1.00 0.00 C ATOM 1775 CG LYS B 49 -5.724 3.450 -9.475 1.00 0.00 C ATOM 1776 CD LYS B 49 -4.239 3.597 -9.811 1.00 0.00 C ATOM 1777 CE LYS B 49 -3.583 2.229 -10.008 1.00 0.00 C ATOM 1778 NZ LYS B 49 -2.108 2.350 -9.961 1.00 0.00 N ATOM 0 H LYS B 49 -8.889 5.034 -10.000 1.00 0.00 H new ATOM 0 HA LYS B 49 -7.753 3.678 -7.644 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -6.108 5.567 -9.325 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -5.648 4.818 -7.809 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -5.878 2.553 -8.875 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -6.297 3.321 -10.393 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -4.125 4.193 -10.717 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -3.733 4.135 -9.010 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -3.922 1.541 -9.233 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -3.889 1.807 -10.965 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -1.678 1.413 -10.096 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -1.788 2.990 -10.716 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -1.820 2.733 -9.038 1.00 0.00 H new ATOM 1792 N ALA B 50 -8.247 5.683 -6.309 1.00 0.00 N ATOM 1793 CA ALA B 50 -8.773 6.770 -5.500 1.00 0.00 C ATOM 1794 C ALA B 50 -7.702 7.224 -4.506 1.00 0.00 C ATOM 1795 O ALA B 50 -7.367 6.496 -3.573 1.00 0.00 O ATOM 1796 CB ALA B 50 -10.057 6.314 -4.805 1.00 0.00 C ATOM 0 H ALA B 50 -7.842 4.913 -5.777 1.00 0.00 H new ATOM 0 HA ALA B 50 -9.027 7.626 -6.125 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -10.452 7.129 -4.198 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.795 6.030 -5.555 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.841 5.458 -4.166 1.00 0.00 H new ATOM 1802 N CYS B 51 -7.195 8.426 -4.740 1.00 0.00 N ATOM 1803 CA CYS B 51 -6.169 8.986 -3.877 1.00 0.00 C ATOM 1804 C CYS B 51 -6.763 9.165 -2.478 1.00 0.00 C ATOM 1805 O CYS B 51 -7.882 9.654 -2.332 1.00 0.00 O ATOM 1806 CB CYS B 51 -5.616 10.300 -4.434 1.00 0.00 C ATOM 1807 SG CYS B 51 -4.279 10.108 -5.668 1.00 0.00 S ATOM 0 H CYS B 51 -7.476 9.027 -5.515 1.00 0.00 H new ATOM 0 HA CYS B 51 -5.321 8.303 -3.826 1.00 0.00 H new ATOM 0 HB2 CYS B 51 -6.434 10.858 -4.889 1.00 0.00 H new ATOM 0 HB3 CYS B 51 -5.243 10.901 -3.605 1.00 0.00 H new ATOM 1812 N LEU B 52 -5.987 8.758 -1.484 1.00 0.00 N ATOM 1813 CA LEU B 52 -6.422 8.866 -0.102 1.00 0.00 C ATOM 1814 C LEU B 52 -5.580 9.927 0.611 1.00 0.00 C ATOM 1815 O LEU B 52 -4.541 10.345 0.103 1.00 0.00 O ATOM 1816 CB LEU B 52 -6.391 7.496 0.579 1.00 0.00 C ATOM 1817 CG LEU B 52 -7.251 6.407 -0.066 1.00 0.00 C ATOM 1818 CD1 LEU B 52 -6.807 5.016 0.391 1.00 0.00 C ATOM 1819 CD2 LEU B 52 -8.737 6.652 0.202 1.00 0.00 C ATOM 0 H LEU B 52 -5.059 8.353 -1.609 1.00 0.00 H new ATOM 0 HA LEU B 52 -7.460 9.196 -0.054 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -5.358 7.148 0.604 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -6.711 7.619 1.614 1.00 0.00 H new ATOM 0 HG LEU B 52 -7.107 6.452 -1.146 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -7.434 4.260 -0.082 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -5.767 4.854 0.107 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -6.903 4.941 1.474 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -9.326 5.864 -0.267 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -8.918 6.649 1.277 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -9.027 7.617 -0.212 1.00 0.00 H new ATOM 1831 N ASN B 53 -6.060 10.330 1.778 1.00 0.00 N ATOM 1832 CA ASN B 53 -5.365 11.334 2.567 1.00 0.00 C ATOM 1833 C ASN B 53 -4.526 10.640 3.641 1.00 0.00 C ATOM 1834 O ASN B 53 -5.068 10.083 4.594 1.00 0.00 O ATOM 1835 CB ASN B 53 -6.355 12.266 3.268 1.00 0.00 C ATOM 1836 CG ASN B 53 -5.712 13.621 3.571 1.00 0.00 C ATOM 1837 OD1 ASN B 53 -5.116 14.258 2.718 1.00 0.00 O ATOM 1838 ND2 ASN B 53 -5.865 14.024 4.828 1.00 0.00 N ATOM 0 H ASN B 53 -6.922 9.980 2.197 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.737 11.917 1.894 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -7.233 12.409 2.639 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -6.698 11.807 4.195 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -5.472 14.916 5.129 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -6.376 13.442 5.492 1.00 0.00 H new ATOM 1845 N PRO B 54 -3.181 10.698 3.446 1.00 0.00 N ATOM 1846 CA PRO B 54 -2.261 10.082 4.388 1.00 0.00 C ATOM 1847 C PRO B 54 -2.147 10.914 5.667 1.00 0.00 C ATOM 1848 O PRO B 54 -1.043 11.185 6.139 1.00 0.00 O ATOM 1849 CB PRO B 54 -0.946 9.967 3.634 1.00 0.00 C ATOM 1850 CG PRO B 54 -1.046 10.939 2.470 1.00 0.00 C ATOM 1851 CD PRO B 54 -2.503 11.349 2.329 1.00 0.00 C ATOM 0 HA PRO B 54 -2.598 9.102 4.726 1.00 0.00 H new ATOM 0 HB2 PRO B 54 -0.103 10.216 4.279 1.00 0.00 H new ATOM 0 HB3 PRO B 54 -0.787 8.949 3.280 1.00 0.00 H new ATOM 0 HG2 PRO B 54 -0.419 11.813 2.647 1.00 0.00 H new ATOM 0 HG3 PRO B 54 -0.690 10.472 1.551 1.00 0.00 H new ATOM 0 HD2 PRO B 54 -2.616 12.432 2.374 1.00 0.00 H new ATOM 0 HD3 PRO B 54 -2.915 11.025 1.373 1.00 0.00 H new ATOM 1859 N ALA B 55 -3.302 11.297 6.191 1.00 0.00 N ATOM 1860 CA ALA B 55 -3.345 12.093 7.406 1.00 0.00 C ATOM 1861 C ALA B 55 -4.762 12.060 7.981 1.00 0.00 C ATOM 1862 O ALA B 55 -5.195 13.012 8.629 1.00 0.00 O ATOM 1863 CB ALA B 55 -2.872 13.515 7.102 1.00 0.00 C ATOM 0 H ALA B 55 -4.215 11.071 5.797 1.00 0.00 H new ATOM 0 HA ALA B 55 -2.674 11.681 8.159 1.00 0.00 H new ATOM 0 HB1 ALA B 55 -2.904 14.112 8.013 1.00 0.00 H new ATOM 0 HB2 ALA B 55 -1.850 13.485 6.724 1.00 0.00 H new ATOM 0 HB3 ALA B 55 -3.524 13.963 6.352 1.00 0.00 H new ATOM 1869 N SER B 56 -5.446 10.954 7.724 1.00 0.00 N ATOM 1870 CA SER B 56 -6.805 10.785 8.208 1.00 0.00 C ATOM 1871 C SER B 56 -6.907 9.510 9.048 1.00 0.00 C ATOM 1872 O SER B 56 -6.205 8.534 8.788 1.00 0.00 O ATOM 1873 CB SER B 56 -7.801 10.738 7.048 1.00 0.00 C ATOM 1874 OG SER B 56 -9.069 10.228 7.453 1.00 0.00 O ATOM 0 H SER B 56 -5.084 10.166 7.187 1.00 0.00 H new ATOM 0 HA SER B 56 -7.055 11.644 8.831 1.00 0.00 H new ATOM 0 HB2 SER B 56 -7.927 11.740 6.638 1.00 0.00 H new ATOM 0 HB3 SER B 56 -7.398 10.115 6.249 1.00 0.00 H new ATOM 0 HG SER B 56 -9.277 9.422 6.936 1.00 0.00 H new ATOM 1880 N PRO B 57 -7.810 9.561 10.063 1.00 0.00 N ATOM 1881 CA PRO B 57 -8.012 8.421 10.942 1.00 0.00 C ATOM 1882 C PRO B 57 -8.812 7.322 10.240 1.00 0.00 C ATOM 1883 O PRO B 57 -8.874 6.192 10.720 1.00 0.00 O ATOM 1884 CB PRO B 57 -8.723 8.987 12.161 1.00 0.00 C ATOM 1885 CG PRO B 57 -9.305 10.321 11.723 1.00 0.00 C ATOM 1886 CD PRO B 57 -8.659 10.700 10.401 1.00 0.00 C ATOM 0 HA PRO B 57 -7.077 7.940 11.229 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -9.508 8.312 12.504 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -8.030 9.117 12.992 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -10.387 10.247 11.612 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -9.113 11.086 12.475 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -9.409 10.877 9.630 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -8.075 11.616 10.494 1.00 0.00 H new ATOM 1894 N MET B 58 -9.405 7.693 9.115 1.00 0.00 N ATOM 1895 CA MET B 58 -10.198 6.753 8.341 1.00 0.00 C ATOM 1896 C MET B 58 -9.376 6.150 7.201 1.00 0.00 C ATOM 1897 O MET B 58 -9.696 5.072 6.703 1.00 0.00 O ATOM 1898 CB MET B 58 -11.421 7.469 7.766 1.00 0.00 C ATOM 1899 CG MET B 58 -12.700 6.675 8.038 1.00 0.00 C ATOM 1900 SD MET B 58 -13.518 7.312 9.492 1.00 0.00 S ATOM 1901 CE MET B 58 -12.577 6.486 10.764 1.00 0.00 C ATOM 0 H MET B 58 -9.352 8.632 8.721 1.00 0.00 H new ATOM 0 HA MET B 58 -10.516 5.945 9.001 1.00 0.00 H new ATOM 0 HB2 MET B 58 -11.505 8.463 8.206 1.00 0.00 H new ATOM 0 HB3 MET B 58 -11.295 7.606 6.692 1.00 0.00 H new ATOM 0 HG2 MET B 58 -13.367 6.739 7.178 1.00 0.00 H new ATOM 0 HG3 MET B 58 -12.460 5.621 8.178 1.00 0.00 H new ATOM 0 HE1 MET B 58 -13.092 6.585 11.720 1.00 0.00 H new ATOM 0 HE2 MET B 58 -12.475 5.430 10.514 1.00 0.00 H new ATOM 0 HE3 MET B 58 -11.588 6.938 10.837 1.00 0.00 H new ATOM 1911 N VAL B 59 -8.333 6.873 6.819 1.00 0.00 N ATOM 1912 CA VAL B 59 -7.462 6.422 5.747 1.00 0.00 C ATOM 1913 C VAL B 59 -6.398 5.484 6.319 1.00 0.00 C ATOM 1914 O VAL B 59 -5.601 4.916 5.574 1.00 0.00 O ATOM 1915 CB VAL B 59 -6.867 7.627 5.016 1.00 0.00 C ATOM 1916 CG1 VAL B 59 -5.614 7.229 4.232 1.00 0.00 C ATOM 1917 CG2 VAL B 59 -7.903 8.280 4.098 1.00 0.00 C ATOM 0 H VAL B 59 -8.072 7.768 7.233 1.00 0.00 H new ATOM 0 HA VAL B 59 -8.028 5.856 5.007 1.00 0.00 H new ATOM 0 HB VAL B 59 -6.574 8.362 5.766 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -5.211 8.104 3.722 1.00 0.00 H new ATOM 0 HG12 VAL B 59 -4.866 6.833 4.919 1.00 0.00 H new ATOM 0 HG13 VAL B 59 -5.872 6.467 3.497 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -7.453 9.134 3.591 1.00 0.00 H new ATOM 0 HG22 VAL B 59 -8.241 7.555 3.358 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -8.753 8.617 4.691 1.00 0.00 H new ATOM 1927 N LYS B 60 -6.420 5.350 7.637 1.00 0.00 N ATOM 1928 CA LYS B 60 -5.467 4.491 8.318 1.00 0.00 C ATOM 1929 C LYS B 60 -6.187 3.242 8.829 1.00 0.00 C ATOM 1930 O LYS B 60 -5.580 2.393 9.481 1.00 0.00 O ATOM 1931 CB LYS B 60 -4.730 5.267 9.411 1.00 0.00 C ATOM 1932 CG LYS B 60 -5.718 5.919 10.381 1.00 0.00 C ATOM 1933 CD LYS B 60 -6.569 4.863 11.088 1.00 0.00 C ATOM 1934 CE LYS B 60 -7.070 5.378 12.439 1.00 0.00 C ATOM 1935 NZ LYS B 60 -5.992 5.312 13.451 1.00 0.00 N ATOM 0 H LYS B 60 -7.083 5.822 8.251 1.00 0.00 H new ATOM 0 HA LYS B 60 -4.696 4.154 7.625 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -4.069 4.594 9.957 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -4.101 6.033 8.957 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -5.174 6.507 11.120 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -6.365 6.609 9.838 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -7.418 4.594 10.459 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -5.982 3.956 11.235 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -7.418 6.406 12.337 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -7.923 4.784 12.768 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -6.385 5.519 14.391 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -5.575 4.359 13.452 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -5.257 6.012 13.222 1.00 0.00 H new ATOM 1949 N LYS B 61 -7.472 3.169 8.515 1.00 0.00 N ATOM 1950 CA LYS B 61 -8.282 2.038 8.935 1.00 0.00 C ATOM 1951 C LYS B 61 -8.744 1.261 7.701 1.00 0.00 C ATOM 1952 O LYS B 61 -9.157 0.107 7.809 1.00 0.00 O ATOM 1953 CB LYS B 61 -9.430 2.505 9.833 1.00 0.00 C ATOM 1954 CG LYS B 61 -8.911 2.946 11.203 1.00 0.00 C ATOM 1955 CD LYS B 61 -9.597 2.168 12.326 1.00 0.00 C ATOM 1956 CE LYS B 61 -9.145 2.671 13.698 1.00 0.00 C ATOM 1957 NZ LYS B 61 -9.904 3.883 14.081 1.00 0.00 N ATOM 0 H LYS B 61 -7.972 3.875 7.975 1.00 0.00 H new ATOM 0 HA LYS B 61 -7.692 1.352 9.542 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -9.956 3.332 9.356 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -10.151 1.697 9.956 1.00 0.00 H new ATOM 0 HG2 LYS B 61 -7.833 2.791 11.254 1.00 0.00 H new ATOM 0 HG3 LYS B 61 -9.086 4.014 11.336 1.00 0.00 H new ATOM 0 HD2 LYS B 61 -10.678 2.270 12.236 1.00 0.00 H new ATOM 0 HD3 LYS B 61 -9.368 1.107 12.230 1.00 0.00 H new ATOM 0 HE2 LYS B 61 -9.293 1.891 14.445 1.00 0.00 H new ATOM 0 HE3 LYS B 61 -8.078 2.894 13.677 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 -9.399 4.383 14.841 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 -9.997 4.510 13.256 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 -10.850 3.609 14.416 1.00 0.00 H new ATOM 1971 N ILE B 62 -8.659 1.924 6.557 1.00 0.00 N ATOM 1972 CA ILE B 62 -9.063 1.309 5.304 1.00 0.00 C ATOM 1973 C ILE B 62 -7.862 0.595 4.681 1.00 0.00 C ATOM 1974 O ILE B 62 -8.026 -0.258 3.810 1.00 0.00 O ATOM 1975 CB ILE B 62 -9.708 2.346 4.382 1.00 0.00 C ATOM 1976 CG1 ILE B 62 -10.908 3.011 5.060 1.00 0.00 C ATOM 1977 CG2 ILE B 62 -10.082 1.725 3.035 1.00 0.00 C ATOM 1978 CD1 ILE B 62 -11.070 4.458 4.592 1.00 0.00 C ATOM 0 H ILE B 62 -8.316 2.881 6.472 1.00 0.00 H new ATOM 0 HA ILE B 62 -9.828 0.553 5.480 1.00 0.00 H new ATOM 0 HB ILE B 62 -8.976 3.129 4.183 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -11.815 2.449 4.836 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -10.778 2.987 6.142 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -10.538 2.483 2.399 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -9.185 1.338 2.551 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -10.789 0.911 3.194 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -11.930 4.907 5.089 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -10.172 5.023 4.840 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -11.224 4.476 3.513 1.00 0.00 H new ATOM 1990 N ILE B 63 -6.682 0.970 5.151 1.00 0.00 N ATOM 1991 CA ILE B 63 -5.454 0.376 4.651 1.00 0.00 C ATOM 1992 C ILE B 63 -5.110 -0.856 5.490 1.00 0.00 C ATOM 1993 O ILE B 63 -5.022 -1.965 4.964 1.00 0.00 O ATOM 1994 CB ILE B 63 -4.335 1.419 4.603 1.00 0.00 C ATOM 1995 CG1 ILE B 63 -4.565 2.417 3.467 1.00 0.00 C ATOM 1996 CG2 ILE B 63 -2.963 0.747 4.508 1.00 0.00 C ATOM 1997 CD1 ILE B 63 -3.814 3.725 3.726 1.00 0.00 C ATOM 0 H ILE B 63 -6.550 1.678 5.873 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.586 0.036 3.624 1.00 0.00 H new ATOM 0 HB ILE B 63 -4.353 1.983 5.535 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -4.232 1.983 2.524 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.631 2.619 3.366 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -2.186 1.510 4.475 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -2.809 0.109 5.378 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -2.916 0.142 3.602 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.994 4.417 2.903 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -4.166 4.169 4.657 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -2.746 3.522 3.802 1.00 0.00 H new ATOM 2009 N GLU B 64 -4.925 -0.622 6.781 1.00 0.00 N ATOM 2010 CA GLU B 64 -4.593 -1.699 7.698 1.00 0.00 C ATOM 2011 C GLU B 64 -5.545 -2.879 7.497 1.00 0.00 C ATOM 2012 O GLU B 64 -5.132 -4.035 7.577 1.00 0.00 O ATOM 2013 CB GLU B 64 -4.620 -1.213 9.148 1.00 0.00 C ATOM 2014 CG GLU B 64 -3.500 -0.204 9.410 1.00 0.00 C ATOM 2015 CD GLU B 64 -3.835 0.689 10.606 1.00 0.00 C ATOM 2016 OE1 GLU B 64 -4.744 0.298 11.369 1.00 0.00 O ATOM 2017 OE2 GLU B 64 -3.173 1.743 10.730 1.00 0.00 O ATOM 0 H GLU B 64 -4.999 0.299 7.214 1.00 0.00 H new ATOM 0 HA GLU B 64 -3.579 -2.035 7.481 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -5.585 -0.754 9.363 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -4.513 -2.063 9.822 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -2.566 -0.733 9.597 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -3.346 0.412 8.524 1.00 0.00 H new ATOM 2024 N LYS B 65 -6.802 -2.548 7.240 1.00 0.00 N ATOM 2025 CA LYS B 65 -7.816 -3.566 7.027 1.00 0.00 C ATOM 2026 C LYS B 65 -7.540 -4.286 5.705 1.00 0.00 C ATOM 2027 O LYS B 65 -7.727 -5.497 5.604 1.00 0.00 O ATOM 2028 CB LYS B 65 -9.216 -2.954 7.114 1.00 0.00 C ATOM 2029 CG LYS B 65 -9.546 -2.542 8.550 1.00 0.00 C ATOM 2030 CD LYS B 65 -9.776 -3.770 9.434 1.00 0.00 C ATOM 2031 CE LYS B 65 -9.021 -3.641 10.758 1.00 0.00 C ATOM 2032 NZ LYS B 65 -9.739 -4.358 11.836 1.00 0.00 N ATOM 0 H LYS B 65 -7.141 -1.588 7.174 1.00 0.00 H new ATOM 0 HA LYS B 65 -7.773 -4.318 7.815 1.00 0.00 H new ATOM 0 HB2 LYS B 65 -9.278 -2.085 6.459 1.00 0.00 H new ATOM 0 HB3 LYS B 65 -9.954 -3.674 6.760 1.00 0.00 H new ATOM 0 HG2 LYS B 65 -8.731 -1.944 8.957 1.00 0.00 H new ATOM 0 HG3 LYS B 65 -10.436 -1.913 8.556 1.00 0.00 H new ATOM 0 HD2 LYS B 65 -10.842 -3.888 9.629 1.00 0.00 H new ATOM 0 HD3 LYS B 65 -9.447 -4.667 8.909 1.00 0.00 H new ATOM 0 HE2 LYS B 65 -8.015 -4.047 10.651 1.00 0.00 H new ATOM 0 HE3 LYS B 65 -8.914 -2.589 11.022 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 -9.213 -4.260 12.728 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 -10.690 -3.953 11.949 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 -9.819 -5.365 11.590 1.00 0.00 H new ATOM 2046 N MET B 66 -7.100 -3.509 4.726 1.00 0.00 N ATOM 2047 CA MET B 66 -6.797 -4.058 3.415 1.00 0.00 C ATOM 2048 C MET B 66 -5.753 -5.171 3.515 1.00 0.00 C ATOM 2049 O MET B 66 -5.841 -6.175 2.809 1.00 0.00 O ATOM 2050 CB MET B 66 -6.273 -2.945 2.505 1.00 0.00 C ATOM 2051 CG MET B 66 -7.201 -2.734 1.307 1.00 0.00 C ATOM 2052 SD MET B 66 -7.397 -4.265 0.410 1.00 0.00 S ATOM 2053 CE MET B 66 -5.770 -4.415 -0.308 1.00 0.00 C ATOM 0 H MET B 66 -6.946 -2.505 4.814 1.00 0.00 H new ATOM 0 HA MET B 66 -7.711 -4.480 2.998 1.00 0.00 H new ATOM 0 HB2 MET B 66 -6.188 -2.017 3.071 1.00 0.00 H new ATOM 0 HB3 MET B 66 -5.272 -3.198 2.154 1.00 0.00 H new ATOM 0 HG2 MET B 66 -8.172 -2.376 1.648 1.00 0.00 H new ATOM 0 HG3 MET B 66 -6.791 -1.967 0.649 1.00 0.00 H new ATOM 0 HE1 MET B 66 -5.859 -4.714 -1.352 1.00 0.00 H new ATOM 0 HE2 MET B 66 -5.256 -3.456 -0.248 1.00 0.00 H new ATOM 0 HE3 MET B 66 -5.200 -5.167 0.237 1.00 0.00 H new ATOM 2063 N LEU B 67 -4.788 -4.956 4.397 1.00 0.00 N ATOM 2064 CA LEU B 67 -3.727 -5.929 4.598 1.00 0.00 C ATOM 2065 C LEU B 67 -4.310 -7.185 5.249 1.00 0.00 C ATOM 2066 O LEU B 67 -3.677 -8.240 5.248 1.00 0.00 O ATOM 2067 CB LEU B 67 -2.572 -5.308 5.386 1.00 0.00 C ATOM 2068 CG LEU B 67 -1.673 -4.343 4.610 1.00 0.00 C ATOM 2069 CD1 LEU B 67 -2.507 -3.347 3.801 1.00 0.00 C ATOM 2070 CD2 LEU B 67 -0.688 -3.639 5.545 1.00 0.00 C ATOM 0 H LEU B 67 -4.718 -4.122 4.981 1.00 0.00 H new ATOM 0 HA LEU B 67 -3.302 -6.232 3.641 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -2.987 -4.777 6.243 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -1.952 -6.114 5.780 1.00 0.00 H new ATOM 0 HG LEU B 67 -1.084 -4.922 3.899 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -1.844 -2.673 3.259 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -3.133 -3.888 3.092 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -3.139 -2.769 4.475 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -0.061 -2.959 4.968 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -1.240 -3.074 6.296 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -0.060 -4.381 6.038 1.00 0.00 H new ATOM 2082 N LYS B 68 -5.510 -7.031 5.788 1.00 0.00 N ATOM 2083 CA LYS B 68 -6.186 -8.140 6.441 1.00 0.00 C ATOM 2084 C LYS B 68 -7.242 -8.715 5.496 1.00 0.00 C ATOM 2085 O LYS B 68 -7.566 -9.900 5.569 1.00 0.00 O ATOM 2086 CB LYS B 68 -6.746 -7.703 7.796 1.00 0.00 C ATOM 2087 CG LYS B 68 -6.202 -8.583 8.923 1.00 0.00 C ATOM 2088 CD LYS B 68 -7.312 -8.967 9.903 1.00 0.00 C ATOM 2089 CE LYS B 68 -7.186 -8.182 11.211 1.00 0.00 C ATOM 2090 NZ LYS B 68 -8.498 -7.627 11.611 1.00 0.00 N ATOM 0 H LYS B 68 -6.032 -6.155 5.786 1.00 0.00 H new ATOM 0 HA LYS B 68 -5.480 -8.942 6.657 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -6.483 -6.662 7.984 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -7.834 -7.759 7.779 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -5.756 -9.484 8.502 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -5.411 -8.053 9.453 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -8.284 -8.773 9.451 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -7.265 -10.036 10.110 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -6.805 -8.833 11.998 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -6.465 -7.374 11.089 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -8.394 -7.098 12.500 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -8.847 -6.989 10.867 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -9.176 -8.403 11.747 1.00 0.00 H new ATOM 2104 N ASN B 69 -7.750 -7.850 4.630 1.00 0.00 N ATOM 2105 CA ASN B 69 -8.763 -8.258 3.671 1.00 0.00 C ATOM 2106 C ASN B 69 -10.009 -8.730 4.423 1.00 0.00 C ATOM 2107 O ASN B 69 -10.994 -7.999 4.519 1.00 0.00 O ATOM 2108 CB ASN B 69 -8.266 -9.417 2.805 1.00 0.00 C ATOM 2109 CG ASN B 69 -9.401 -9.989 1.952 1.00 0.00 C ATOM 2110 OD1 ASN B 69 -9.868 -9.380 1.005 1.00 0.00 O ATOM 2111 ND2 ASN B 69 -9.816 -11.192 2.341 1.00 0.00 N ATOM 0 H ASN B 69 -7.479 -6.868 4.572 1.00 0.00 H new ATOM 0 HA ASN B 69 -8.989 -7.403 3.034 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -7.458 -9.073 2.159 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -7.854 -10.200 3.441 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -10.569 -11.659 1.836 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -9.381 -11.647 3.144 1.00 0.00 H new ATOM 2118 N GLY B 70 -9.926 -9.949 4.936 1.00 0.00 N ATOM 2119 CA GLY B 70 -11.035 -10.527 5.676 1.00 0.00 C ATOM 2120 C GLY B 70 -12.344 -10.391 4.896 1.00 0.00 C ATOM 2121 O GLY B 70 -12.337 -10.347 3.667 1.00 0.00 O ATOM 0 H GLY B 70 -9.108 -10.552 4.854 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -10.834 -11.580 5.876 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -11.130 -10.031 6.642 1.00 0.00 H new ATOM 2125 N LYS B 71 -13.437 -10.329 5.643 1.00 0.00 N ATOM 2126 CA LYS B 71 -14.751 -10.199 5.037 1.00 0.00 C ATOM 2127 C LYS B 71 -14.916 -8.781 4.487 1.00 0.00 C ATOM 2128 O LYS B 71 -14.951 -8.582 3.273 1.00 0.00 O ATOM 2129 CB LYS B 71 -15.841 -10.603 6.031 1.00 0.00 C ATOM 2130 CG LYS B 71 -16.414 -11.980 5.687 1.00 0.00 C ATOM 2131 CD LYS B 71 -17.083 -12.616 6.907 1.00 0.00 C ATOM 2132 CE LYS B 71 -16.102 -13.514 7.664 1.00 0.00 C ATOM 2133 NZ LYS B 71 -16.761 -14.775 8.071 1.00 0.00 N ATOM 0 H LYS B 71 -13.439 -10.366 6.662 1.00 0.00 H new ATOM 0 HA LYS B 71 -14.851 -10.882 4.194 1.00 0.00 H new ATOM 0 HB2 LYS B 71 -15.430 -10.618 7.040 1.00 0.00 H new ATOM 0 HB3 LYS B 71 -16.639 -9.861 6.023 1.00 0.00 H new ATOM 0 HG2 LYS B 71 -17.139 -11.884 4.879 1.00 0.00 H new ATOM 0 HG3 LYS B 71 -15.617 -12.629 5.325 1.00 0.00 H new ATOM 0 HD2 LYS B 71 -17.454 -11.835 7.571 1.00 0.00 H new ATOM 0 HD3 LYS B 71 -17.946 -13.201 6.589 1.00 0.00 H new ATOM 0 HE2 LYS B 71 -15.241 -13.734 7.033 1.00 0.00 H new ATOM 0 HE3 LYS B 71 -15.727 -12.992 8.545 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 -16.081 -15.372 8.583 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 -17.569 -14.561 8.690 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 -17.097 -15.280 7.226 1.00 0.00 H new ATOM 2147 N SER B 72 -15.014 -7.831 5.405 1.00 0.00 N ATOM 2148 CA SER B 72 -15.175 -6.438 5.027 1.00 0.00 C ATOM 2149 C SER B 72 -16.641 -6.150 4.699 1.00 0.00 C ATOM 2150 O SER B 72 -17.232 -5.219 5.243 1.00 0.00 O ATOM 2151 CB SER B 72 -14.284 -6.085 3.834 1.00 0.00 C ATOM 2152 OG SER B 72 -13.567 -4.871 4.043 1.00 0.00 O ATOM 0 H SER B 72 -14.985 -7.999 6.411 1.00 0.00 H new ATOM 0 HA SER B 72 -14.870 -5.818 5.870 1.00 0.00 H new ATOM 0 HB2 SER B 72 -13.578 -6.897 3.656 1.00 0.00 H new ATOM 0 HB3 SER B 72 -14.898 -5.994 2.938 1.00 0.00 H new ATOM 0 HG SER B 72 -13.009 -4.682 3.260 1.00 0.00 H new ATOM 2158 N ASN B 73 -17.186 -6.968 3.810 1.00 0.00 N ATOM 2159 CA ASN B 73 -18.572 -6.813 3.402 1.00 0.00 C ATOM 2160 C ASN B 73 -19.471 -6.855 4.640 1.00 0.00 C ATOM 2161 O ASN B 73 -19.135 -7.497 5.634 1.00 0.00 O ATOM 2162 CB ASN B 73 -19.001 -7.946 2.467 1.00 0.00 C ATOM 2163 CG ASN B 73 -18.114 -7.994 1.222 1.00 0.00 C ATOM 2164 OD1 ASN B 73 -17.026 -8.546 1.225 1.00 0.00 O ATOM 2165 ND2 ASN B 73 -18.638 -7.389 0.160 1.00 0.00 N ATOM 0 H ASN B 73 -16.693 -7.740 3.361 1.00 0.00 H new ATOM 0 HA ASN B 73 -18.666 -5.860 2.881 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -18.946 -8.898 2.994 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -20.041 -7.805 2.172 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -18.124 -7.368 -0.721 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -19.554 -6.946 0.226 1.00 0.00 H new TER 2172 ASN B 73