USER MOD reduce.3.24.130724 H: found=0, std=0, add=1176, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1179 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 14 TYR OH : rot 36:sc= 1.28 USER MOD Set 1.2: B 68 SER OG : rot -142:sc= 0.0844 USER MOD Single : A 2 LYS NZ :NH3+ -113:sc= -0.744 (180deg=-2.05!) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= -1.71 USER MOD Single : A 21 HIS : no HD1:sc= -2.34 X(o=-2.3,f=-2.1) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 SER OG : rot -86:sc= -0.826 USER MOD Single : A 38 ASN : amide:sc= 0.276 X(o=0.28,f=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= -0.187 K(o=-0.19,f=-1.2) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot -100:sc= -0.36 USER MOD Single : A 55 ASN : amide:sc= -1.86 K(o=-1.9,f=-1.3) USER MOD Single : A 56 MET CE :methyl 157:sc= -1.31 (180deg=-1.81) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0538 USER MOD Single : A 62 LYS NZ :NH3+ -133:sc= 0.365 (180deg=-0.165) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.016 USER MOD Single : A 68 SER OG : rot 48:sc= -0.0932 USER MOD Single : A 69 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 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 MET CE :methyl -177:sc= -1.41 (180deg=-1.42) USER MOD Single : A 77 GLN : amide:sc= -0.0286 K(o=-0.029,f=-0.53) USER MOD Single : B 1 THR N :NH3+ 144:sc= 0.405 (180deg=0.0102) USER MOD Single : B 1 THR OG1 : rot 180:sc= 0.143 USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 7 LYS NZ :NH3+ -161:sc= 0.0535 (180deg=0.0154) USER MOD Single : B 14 TYR OH : rot 13:sc= -0.537 USER MOD Single : B 20 SER OG : rot 180:sc= -0.482 USER MOD Single : B 21 HIS : no HD1:sc= -2.93 K(o=-2.9,f=-3.5!) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 GLN : amide:sc=-0.00562 X(o=-0.0056,f=-0.011) USER MOD Single : B 31 SER OG : rot -98:sc= 0.351 USER MOD Single : B 38 ASN : amide:sc= -0.0897 X(o=-0.09,f=0) USER MOD Single : B 40 GLN : amide:sc= 0 X(o=0,f=-0.0061) USER MOD Single : B 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 ASN : amide:sc= 0 X(o=0,f=0.00037) USER MOD Single : B 51 THR OG1 : rot 180:sc= -0.0022 USER MOD Single : B 53 THR OG1 : rot -120:sc= -0.146 USER MOD Single : B 55 ASN : amide:sc= -0.482 K(o=-0.48,f=-1.5) USER MOD Single : B 56 MET CE :methyl 143:sc= -1.05 (180deg=-2.79!) USER MOD Single : B 57 SER OG : rot 180:sc= 0.0464 USER MOD Single : B 59 THR OG1 : rot 180:sc= 0.0777 USER MOD Single : B 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 63 THR OG1 : rot 180:sc= 0.0189 USER MOD Single : B 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.014) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 MET CE :methyl 175:sc= -0.663 (180deg=-0.695) USER MOD Single : B 77 GLN : amide:sc= -0.0149 X(o=-0.015,f=0) USER MOD ----------------------------------------------------------------- ATOM 17 N LYS A 2 14.764 -2.613 4.815 1.00 0.00 N ATOM 18 CA LYS A 2 15.378 -1.318 5.099 1.00 0.00 C ATOM 19 C LYS A 2 16.259 -0.859 3.938 1.00 0.00 C ATOM 20 O LYS A 2 17.165 -1.578 3.511 1.00 0.00 O ATOM 21 CB LYS A 2 16.209 -1.389 6.382 1.00 0.00 C ATOM 22 CG LYS A 2 15.387 -1.683 7.627 1.00 0.00 C ATOM 23 CD LYS A 2 16.159 -1.353 8.896 1.00 0.00 C ATOM 24 CE LYS A 2 15.260 -0.732 9.955 1.00 0.00 C ATOM 25 NZ LYS A 2 14.799 0.633 9.568 1.00 0.00 N ATOM 0 HA LYS A 2 14.576 -0.592 5.232 1.00 0.00 H new ATOM 0 HB2 LYS A 2 16.970 -2.161 6.269 1.00 0.00 H new ATOM 0 HB3 LYS A 2 16.733 -0.443 6.518 1.00 0.00 H new ATOM 0 HG2 LYS A 2 14.464 -1.103 7.600 1.00 0.00 H new ATOM 0 HG3 LYS A 2 15.102 -2.735 7.636 1.00 0.00 H new ATOM 0 HD2 LYS A 2 16.614 -2.261 9.292 1.00 0.00 H new ATOM 0 HD3 LYS A 2 16.971 -0.666 8.660 1.00 0.00 H new ATOM 0 HE2 LYS A 2 14.394 -1.374 10.117 1.00 0.00 H new ATOM 0 HE3 LYS A 2 15.799 -0.678 10.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 15.219 1.336 10.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 15.094 0.835 8.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 13.762 0.681 9.633 1.00 0.00 H new ATOM 39 N VAL A 3 15.984 0.343 3.439 1.00 0.00 N ATOM 40 CA VAL A 3 16.740 0.917 2.329 1.00 0.00 C ATOM 41 C VAL A 3 17.700 1.996 2.827 1.00 0.00 C ATOM 42 O VAL A 3 17.283 2.948 3.489 1.00 0.00 O ATOM 43 CB VAL A 3 15.798 1.530 1.269 1.00 0.00 C ATOM 44 CG1 VAL A 3 16.574 1.949 0.030 1.00 0.00 C ATOM 45 CG2 VAL A 3 14.688 0.554 0.905 1.00 0.00 C ATOM 0 H VAL A 3 15.237 0.943 3.789 1.00 0.00 H new ATOM 0 HA VAL A 3 17.309 0.107 1.873 1.00 0.00 H new ATOM 0 HB VAL A 3 15.341 2.421 1.699 1.00 0.00 H new ATOM 0 HG11 VAL A 3 15.888 2.377 -0.701 1.00 0.00 H new ATOM 0 HG12 VAL A 3 17.323 2.692 0.304 1.00 0.00 H new ATOM 0 HG13 VAL A 3 17.067 1.078 -0.402 1.00 0.00 H new ATOM 0 HG21 VAL A 3 14.037 1.006 0.157 1.00 0.00 H new ATOM 0 HG22 VAL A 3 15.125 -0.359 0.501 1.00 0.00 H new ATOM 0 HG23 VAL A 3 14.107 0.315 1.796 1.00 0.00 H new ATOM 55 N THR A 4 18.985 1.840 2.511 1.00 0.00 N ATOM 56 CA THR A 4 19.998 2.804 2.935 1.00 0.00 C ATOM 57 C THR A 4 20.841 3.271 1.745 1.00 0.00 C ATOM 58 O THR A 4 21.655 2.515 1.212 1.00 0.00 O ATOM 59 CB THR A 4 20.897 2.196 4.022 1.00 0.00 C ATOM 60 OG1 THR A 4 20.236 1.136 4.699 1.00 0.00 O ATOM 61 CG2 THR A 4 21.331 3.199 5.069 1.00 0.00 C ATOM 0 H THR A 4 19.348 1.058 1.965 1.00 0.00 H new ATOM 0 HA THR A 4 19.486 3.672 3.351 1.00 0.00 H new ATOM 0 HB THR A 4 21.778 1.836 3.491 1.00 0.00 H new ATOM 0 HG1 THR A 4 20.830 0.765 5.385 1.00 0.00 H new ATOM 0 HG21 THR A 4 21.963 2.705 5.807 1.00 0.00 H new ATOM 0 HG22 THR A 4 21.891 4.004 4.592 1.00 0.00 H new ATOM 0 HG23 THR A 4 20.452 3.612 5.563 1.00 0.00 H new ATOM 69 N LEU A 5 20.634 4.525 1.336 1.00 0.00 N ATOM 70 CA LEU A 5 21.364 5.109 0.209 1.00 0.00 C ATOM 71 C LEU A 5 22.454 6.056 0.702 1.00 0.00 C ATOM 72 O LEU A 5 22.407 6.530 1.838 1.00 0.00 O ATOM 73 CB LEU A 5 20.409 5.870 -0.719 1.00 0.00 C ATOM 74 CG LEU A 5 19.501 5.001 -1.599 1.00 0.00 C ATOM 75 CD1 LEU A 5 20.322 4.199 -2.599 1.00 0.00 C ATOM 76 CD2 LEU A 5 18.647 4.075 -0.746 1.00 0.00 C ATOM 0 H LEU A 5 19.963 5.158 1.771 1.00 0.00 H new ATOM 0 HA LEU A 5 21.827 4.293 -0.346 1.00 0.00 H new ATOM 0 HB2 LEU A 5 19.780 6.519 -0.109 1.00 0.00 H new ATOM 0 HB3 LEU A 5 21.000 6.517 -1.367 1.00 0.00 H new ATOM 0 HG LEU A 5 18.838 5.664 -2.155 1.00 0.00 H new ATOM 0 HD11 LEU A 5 19.656 3.591 -3.211 1.00 0.00 H new ATOM 0 HD12 LEU A 5 20.883 4.880 -3.239 1.00 0.00 H new ATOM 0 HD13 LEU A 5 21.016 3.551 -2.064 1.00 0.00 H new ATOM 0 HD21 LEU A 5 18.011 3.469 -1.391 1.00 0.00 H new ATOM 0 HD22 LEU A 5 19.293 3.424 -0.157 1.00 0.00 H new ATOM 0 HD23 LEU A 5 18.024 4.668 -0.077 1.00 0.00 H new ATOM 88 N VAL A 6 23.433 6.335 -0.160 1.00 0.00 N ATOM 89 CA VAL A 6 24.528 7.236 0.191 1.00 0.00 C ATOM 90 C VAL A 6 24.710 8.318 -0.875 1.00 0.00 C ATOM 91 O VAL A 6 25.323 8.080 -1.917 1.00 0.00 O ATOM 92 CB VAL A 6 25.860 6.477 0.379 1.00 0.00 C ATOM 93 CG1 VAL A 6 26.918 7.397 0.971 1.00 0.00 C ATOM 94 CG2 VAL A 6 25.662 5.247 1.255 1.00 0.00 C ATOM 0 H VAL A 6 23.489 5.951 -1.103 1.00 0.00 H new ATOM 0 HA VAL A 6 24.259 7.702 1.139 1.00 0.00 H new ATOM 0 HB VAL A 6 26.205 6.142 -0.599 1.00 0.00 H new ATOM 0 HG11 VAL A 6 27.850 6.846 1.097 1.00 0.00 H new ATOM 0 HG12 VAL A 6 27.083 8.241 0.301 1.00 0.00 H new ATOM 0 HG13 VAL A 6 26.580 7.764 1.940 1.00 0.00 H new ATOM 0 HG21 VAL A 6 26.613 4.728 1.374 1.00 0.00 H new ATOM 0 HG22 VAL A 6 25.291 5.553 2.233 1.00 0.00 H new ATOM 0 HG23 VAL A 6 24.940 4.579 0.786 1.00 0.00 H new ATOM 104 N LYS A 7 24.175 9.506 -0.601 1.00 0.00 N ATOM 105 CA LYS A 7 24.277 10.635 -1.529 1.00 0.00 C ATOM 106 C LYS A 7 25.585 11.401 -1.322 1.00 0.00 C ATOM 107 O LYS A 7 26.060 11.545 -0.193 1.00 0.00 O ATOM 108 CB LYS A 7 23.083 11.577 -1.345 1.00 0.00 C ATOM 109 CG LYS A 7 22.943 12.623 -2.441 1.00 0.00 C ATOM 110 CD LYS A 7 22.621 13.995 -1.866 1.00 0.00 C ATOM 111 CE LYS A 7 21.122 14.182 -1.667 1.00 0.00 C ATOM 112 NZ LYS A 7 20.537 15.136 -2.653 1.00 0.00 N ATOM 0 H LYS A 7 23.665 9.714 0.258 1.00 0.00 H new ATOM 0 HA LYS A 7 24.270 10.241 -2.545 1.00 0.00 H new ATOM 0 HB2 LYS A 7 22.169 10.984 -1.304 1.00 0.00 H new ATOM 0 HB3 LYS A 7 23.178 12.083 -0.384 1.00 0.00 H new ATOM 0 HG2 LYS A 7 23.868 12.676 -3.015 1.00 0.00 H new ATOM 0 HG3 LYS A 7 22.156 12.323 -3.133 1.00 0.00 H new ATOM 0 HD2 LYS A 7 23.134 14.120 -0.912 1.00 0.00 H new ATOM 0 HD3 LYS A 7 22.999 14.768 -2.535 1.00 0.00 H new ATOM 0 HE2 LYS A 7 20.622 13.217 -1.757 1.00 0.00 H new ATOM 0 HE3 LYS A 7 20.934 14.546 -0.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 19.516 15.232 -2.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 20.994 16.064 -2.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 20.692 14.778 -3.617 1.00 0.00 H new ATOM 212 N GLU A 13 22.118 12.885 -7.286 1.00 0.00 N ATOM 213 CA GLU A 13 20.794 12.739 -6.686 1.00 0.00 C ATOM 214 C GLU A 13 20.394 11.268 -6.600 1.00 0.00 C ATOM 215 O GLU A 13 20.882 10.436 -7.367 1.00 0.00 O ATOM 216 CB GLU A 13 19.755 13.521 -7.494 1.00 0.00 C ATOM 217 CG GLU A 13 19.411 14.875 -6.892 1.00 0.00 C ATOM 218 CD GLU A 13 17.927 15.181 -6.957 1.00 0.00 C ATOM 219 OE1 GLU A 13 17.474 15.706 -7.994 1.00 0.00 O ATOM 220 OE2 GLU A 13 17.219 14.894 -5.968 1.00 0.00 O ATOM 0 HA GLU A 13 20.833 13.143 -5.675 1.00 0.00 H new ATOM 0 HB2 GLU A 13 20.130 13.667 -8.507 1.00 0.00 H new ATOM 0 HB3 GLU A 13 18.845 12.926 -7.573 1.00 0.00 H new ATOM 0 HG2 GLU A 13 19.738 14.900 -5.853 1.00 0.00 H new ATOM 0 HG3 GLU A 13 19.962 15.654 -7.419 1.00 0.00 H new ATOM 227 N TYR A 14 19.502 10.956 -5.659 1.00 0.00 N ATOM 228 CA TYR A 14 19.030 9.583 -5.464 1.00 0.00 C ATOM 229 C TYR A 14 18.329 9.052 -6.715 1.00 0.00 C ATOM 230 O TYR A 14 18.474 7.878 -7.062 1.00 0.00 O ATOM 231 CB TYR A 14 18.075 9.510 -4.270 1.00 0.00 C ATOM 232 CG TYR A 14 18.709 9.906 -2.955 1.00 0.00 C ATOM 233 CD1 TYR A 14 19.665 9.098 -2.351 1.00 0.00 C ATOM 234 CD2 TYR A 14 18.347 11.085 -2.318 1.00 0.00 C ATOM 235 CE1 TYR A 14 20.244 9.456 -1.150 1.00 0.00 C ATOM 236 CE2 TYR A 14 18.921 11.451 -1.115 1.00 0.00 C ATOM 237 CZ TYR A 14 19.868 10.634 -0.535 1.00 0.00 C ATOM 238 OH TYR A 14 20.441 10.996 0.665 1.00 0.00 O ATOM 0 H TYR A 14 19.091 11.636 -5.019 1.00 0.00 H new ATOM 0 HA TYR A 14 19.903 8.960 -5.267 1.00 0.00 H new ATOM 0 HB2 TYR A 14 17.220 10.159 -4.460 1.00 0.00 H new ATOM 0 HB3 TYR A 14 17.691 8.493 -4.186 1.00 0.00 H new ATOM 0 HD1 TYR A 14 19.960 8.175 -2.829 1.00 0.00 H new ATOM 0 HD2 TYR A 14 17.605 11.727 -2.770 1.00 0.00 H new ATOM 0 HE1 TYR A 14 20.987 8.818 -0.694 1.00 0.00 H new ATOM 0 HE2 TYR A 14 18.629 12.372 -0.632 1.00 0.00 H new ATOM 0 HH TYR A 14 21.383 10.726 0.672 1.00 0.00 H new ATOM 248 N GLY A 15 17.568 9.923 -7.384 1.00 0.00 N ATOM 249 CA GLY A 15 16.854 9.527 -8.588 1.00 0.00 C ATOM 250 C GLY A 15 15.668 8.622 -8.299 1.00 0.00 C ATOM 251 O GLY A 15 15.431 7.658 -9.028 1.00 0.00 O ATOM 0 H GLY A 15 17.435 10.897 -7.111 1.00 0.00 H new ATOM 0 HA2 GLY A 15 16.506 10.419 -9.108 1.00 0.00 H new ATOM 0 HA3 GLY A 15 17.541 9.014 -9.260 1.00 0.00 H new ATOM 255 N LEU A 16 14.919 8.932 -7.239 1.00 0.00 N ATOM 256 CA LEU A 16 13.751 8.136 -6.864 1.00 0.00 C ATOM 257 C LEU A 16 12.514 9.020 -6.714 1.00 0.00 C ATOM 258 O LEU A 16 12.529 10.005 -5.975 1.00 0.00 O ATOM 259 CB LEU A 16 14.013 7.367 -5.560 1.00 0.00 C ATOM 260 CG LEU A 16 14.564 8.202 -4.396 1.00 0.00 C ATOM 261 CD1 LEU A 16 13.433 8.707 -3.511 1.00 0.00 C ATOM 262 CD2 LEU A 16 15.554 7.388 -3.578 1.00 0.00 C ATOM 0 H LEU A 16 15.101 9.727 -6.627 1.00 0.00 H new ATOM 0 HA LEU A 16 13.567 7.417 -7.662 1.00 0.00 H new ATOM 0 HB2 LEU A 16 13.081 6.902 -5.240 1.00 0.00 H new ATOM 0 HB3 LEU A 16 14.716 6.561 -5.770 1.00 0.00 H new ATOM 0 HG LEU A 16 15.084 9.065 -4.812 1.00 0.00 H new ATOM 0 HD11 LEU A 16 13.847 9.296 -2.693 1.00 0.00 H new ATOM 0 HD12 LEU A 16 12.759 9.328 -4.101 1.00 0.00 H new ATOM 0 HD13 LEU A 16 12.882 7.859 -3.105 1.00 0.00 H new ATOM 0 HD21 LEU A 16 15.934 7.996 -2.757 1.00 0.00 H new ATOM 0 HD22 LEU A 16 15.055 6.506 -3.176 1.00 0.00 H new ATOM 0 HD23 LEU A 16 16.383 7.078 -4.214 1.00 0.00 H new ATOM 274 N ARG A 17 11.444 8.659 -7.420 1.00 0.00 N ATOM 275 CA ARG A 17 10.194 9.414 -7.365 1.00 0.00 C ATOM 276 C ARG A 17 9.370 8.993 -6.153 1.00 0.00 C ATOM 277 O ARG A 17 8.956 7.840 -6.046 1.00 0.00 O ATOM 278 CB ARG A 17 9.381 9.208 -8.646 1.00 0.00 C ATOM 279 CG ARG A 17 9.907 9.996 -9.835 1.00 0.00 C ATOM 280 CD ARG A 17 8.784 10.707 -10.575 1.00 0.00 C ATOM 281 NE ARG A 17 9.075 12.126 -10.791 1.00 0.00 N ATOM 282 CZ ARG A 17 8.150 13.047 -11.082 1.00 0.00 C ATOM 283 NH1 ARG A 17 6.869 12.705 -11.200 1.00 0.00 N ATOM 284 NH2 ARG A 17 8.508 14.313 -11.257 1.00 0.00 N ATOM 0 H ARG A 17 11.418 7.847 -8.037 1.00 0.00 H new ATOM 0 HA ARG A 17 10.440 10.472 -7.274 1.00 0.00 H new ATOM 0 HB2 ARG A 17 9.377 8.147 -8.897 1.00 0.00 H new ATOM 0 HB3 ARG A 17 8.346 9.495 -8.460 1.00 0.00 H new ATOM 0 HG2 ARG A 17 10.639 10.728 -9.493 1.00 0.00 H new ATOM 0 HG3 ARG A 17 10.425 9.323 -10.518 1.00 0.00 H new ATOM 0 HD2 ARG A 17 8.620 10.221 -11.537 1.00 0.00 H new ATOM 0 HD3 ARG A 17 7.859 10.610 -10.007 1.00 0.00 H new ATOM 0 HE ARG A 17 10.045 12.431 -10.715 1.00 0.00 H new ATOM 0 HH11 ARG A 17 6.586 11.734 -11.068 1.00 0.00 H new ATOM 0 HH12 ARG A 17 6.170 13.414 -11.422 1.00 0.00 H new ATOM 0 HH21 ARG A 17 9.488 14.583 -11.170 1.00 0.00 H new ATOM 0 HH22 ARG A 17 7.803 15.016 -11.479 1.00 0.00 H new ATOM 298 N LEU A 18 9.144 9.936 -5.241 1.00 0.00 N ATOM 299 CA LEU A 18 8.376 9.667 -4.030 1.00 0.00 C ATOM 300 C LEU A 18 6.920 10.103 -4.194 1.00 0.00 C ATOM 301 O LEU A 18 6.642 11.210 -4.660 1.00 0.00 O ATOM 302 CB LEU A 18 9.016 10.386 -2.836 1.00 0.00 C ATOM 303 CG LEU A 18 8.920 9.650 -1.496 1.00 0.00 C ATOM 304 CD1 LEU A 18 7.476 9.585 -1.024 1.00 0.00 C ATOM 305 CD2 LEU A 18 9.518 8.252 -1.607 1.00 0.00 C ATOM 0 H LEU A 18 9.483 10.895 -5.319 1.00 0.00 H new ATOM 0 HA LEU A 18 8.386 8.592 -3.848 1.00 0.00 H new ATOM 0 HB2 LEU A 18 10.068 10.561 -3.060 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.546 11.364 -2.728 1.00 0.00 H new ATOM 0 HG LEU A 18 9.495 10.207 -0.756 1.00 0.00 H new ATOM 0 HD11 LEU A 18 7.428 9.059 -0.071 1.00 0.00 H new ATOM 0 HD12 LEU A 18 7.088 10.596 -0.900 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.875 9.054 -1.762 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.440 7.746 -0.645 1.00 0.00 H new ATOM 0 HD22 LEU A 18 8.975 7.683 -2.362 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.567 8.327 -1.894 1.00 0.00 H new ATOM 317 N ALA A 19 5.996 9.222 -3.805 1.00 0.00 N ATOM 318 CA ALA A 19 4.566 9.507 -3.903 1.00 0.00 C ATOM 319 C ALA A 19 3.818 9.008 -2.667 1.00 0.00 C ATOM 320 O ALA A 19 4.361 8.242 -1.870 1.00 0.00 O ATOM 321 CB ALA A 19 3.990 8.880 -5.165 1.00 0.00 C ATOM 0 H ALA A 19 6.215 8.304 -3.419 1.00 0.00 H new ATOM 0 HA ALA A 19 4.438 10.588 -3.957 1.00 0.00 H new ATOM 0 HB1 ALA A 19 2.924 9.099 -5.226 1.00 0.00 H new ATOM 0 HB2 ALA A 19 4.496 9.291 -6.039 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.137 7.800 -5.135 1.00 0.00 H new ATOM 327 N SER A 20 2.567 9.446 -2.513 1.00 0.00 N ATOM 328 CA SER A 20 1.746 9.037 -1.375 1.00 0.00 C ATOM 329 C SER A 20 0.498 8.286 -1.835 1.00 0.00 C ATOM 330 O SER A 20 -0.026 8.537 -2.923 1.00 0.00 O ATOM 331 CB SER A 20 1.343 10.253 -0.535 1.00 0.00 C ATOM 332 OG SER A 20 0.564 11.168 -1.289 1.00 0.00 O ATOM 0 H SER A 20 2.102 10.082 -3.161 1.00 0.00 H new ATOM 0 HA SER A 20 2.345 8.365 -0.761 1.00 0.00 H new ATOM 0 HB2 SER A 20 0.778 9.924 0.337 1.00 0.00 H new ATOM 0 HB3 SER A 20 2.237 10.754 -0.164 1.00 0.00 H new ATOM 0 HG SER A 20 0.321 11.932 -0.726 1.00 0.00 H new ATOM 338 N HIS A 21 0.025 7.365 -0.999 1.00 0.00 N ATOM 339 CA HIS A 21 -1.162 6.576 -1.313 1.00 0.00 C ATOM 340 C HIS A 21 -2.294 6.876 -0.328 1.00 0.00 C ATOM 341 O HIS A 21 -2.103 7.612 0.641 1.00 0.00 O ATOM 342 CB HIS A 21 -0.828 5.085 -1.271 1.00 0.00 C ATOM 343 CG HIS A 21 -1.051 4.393 -2.577 1.00 0.00 C ATOM 344 ND1 HIS A 21 -2.055 3.474 -2.781 1.00 0.00 N ATOM 345 CD2 HIS A 21 -0.392 4.497 -3.750 1.00 0.00 C ATOM 346 CE1 HIS A 21 -2.002 3.038 -4.027 1.00 0.00 C ATOM 347 NE2 HIS A 21 -1.001 3.645 -4.638 1.00 0.00 N ATOM 0 H HIS A 21 0.447 7.147 -0.097 1.00 0.00 H new ATOM 0 HA HIS A 21 -1.492 6.846 -2.316 1.00 0.00 H new ATOM 0 HB2 HIS A 21 0.214 4.961 -0.975 1.00 0.00 H new ATOM 0 HB3 HIS A 21 -1.436 4.605 -0.505 1.00 0.00 H new ATOM 0 HD2 HIS A 21 0.457 5.133 -3.953 1.00 0.00 H new ATOM 0 HE1 HIS A 21 -2.664 2.309 -4.470 1.00 0.00 H new ATOM 0 HE2 HIS A 21 -0.725 3.504 -5.610 1.00 0.00 H new ATOM 356 N ILE A 22 -3.467 6.292 -0.576 1.00 0.00 N ATOM 357 CA ILE A 22 -4.625 6.492 0.296 1.00 0.00 C ATOM 358 C ILE A 22 -5.249 5.155 0.690 1.00 0.00 C ATOM 359 O ILE A 22 -5.402 4.261 -0.144 1.00 0.00 O ATOM 360 CB ILE A 22 -5.700 7.375 -0.377 1.00 0.00 C ATOM 361 CG1 ILE A 22 -5.085 8.687 -0.874 1.00 0.00 C ATOM 362 CG2 ILE A 22 -6.845 7.657 0.588 1.00 0.00 C ATOM 363 CD1 ILE A 22 -4.554 9.574 0.235 1.00 0.00 C ATOM 0 H ILE A 22 -3.640 5.678 -1.372 1.00 0.00 H new ATOM 0 HA ILE A 22 -4.264 7.001 1.189 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.098 6.833 -1.235 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -4.272 8.458 -1.564 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -5.837 9.238 -1.439 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -7.591 8.280 0.095 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.303 6.716 0.894 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -6.461 8.177 1.466 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -4.135 10.483 -0.196 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -5.367 9.835 0.913 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -3.778 9.042 0.786 1.00 0.00 H new ATOM 375 N PHE A 23 -5.605 5.026 1.967 1.00 0.00 N ATOM 376 CA PHE A 23 -6.211 3.797 2.478 1.00 0.00 C ATOM 377 C PHE A 23 -7.266 4.104 3.544 1.00 0.00 C ATOM 378 O PHE A 23 -7.419 5.252 3.968 1.00 0.00 O ATOM 379 CB PHE A 23 -5.130 2.879 3.057 1.00 0.00 C ATOM 380 CG PHE A 23 -4.567 3.371 4.360 1.00 0.00 C ATOM 381 CD1 PHE A 23 -3.738 4.479 4.393 1.00 0.00 C ATOM 382 CD2 PHE A 23 -4.882 2.737 5.550 1.00 0.00 C ATOM 383 CE1 PHE A 23 -3.232 4.946 5.589 1.00 0.00 C ATOM 384 CE2 PHE A 23 -4.376 3.198 6.750 1.00 0.00 C ATOM 385 CZ PHE A 23 -3.550 4.305 6.769 1.00 0.00 C ATOM 0 H PHE A 23 -5.484 5.758 2.667 1.00 0.00 H new ATOM 0 HA PHE A 23 -6.704 3.291 1.648 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -5.549 1.883 3.203 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -4.321 2.781 2.333 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -3.484 4.984 3.472 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -5.530 1.873 5.540 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -2.588 5.813 5.601 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -4.626 2.694 7.672 1.00 0.00 H new ATOM 0 HZ PHE A 23 -3.154 4.668 7.706 1.00 0.00 H new ATOM 395 N VAL A 24 -7.985 3.068 3.979 1.00 0.00 N ATOM 396 CA VAL A 24 -9.020 3.221 5.000 1.00 0.00 C ATOM 397 C VAL A 24 -8.483 2.838 6.381 1.00 0.00 C ATOM 398 O VAL A 24 -8.151 1.677 6.624 1.00 0.00 O ATOM 399 CB VAL A 24 -10.259 2.352 4.687 1.00 0.00 C ATOM 400 CG1 VAL A 24 -11.412 2.698 5.620 1.00 0.00 C ATOM 401 CG2 VAL A 24 -10.681 2.513 3.234 1.00 0.00 C ATOM 0 H VAL A 24 -7.869 2.113 3.639 1.00 0.00 H new ATOM 0 HA VAL A 24 -9.314 4.271 4.998 1.00 0.00 H new ATOM 0 HB VAL A 24 -9.988 1.309 4.850 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -12.273 2.074 5.381 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -11.110 2.521 6.652 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -11.679 3.747 5.495 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -11.555 1.892 3.038 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -10.927 3.557 3.040 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -9.864 2.206 2.582 1.00 0.00 H new ATOM 411 N LYS A 25 -8.405 3.819 7.279 1.00 0.00 N ATOM 412 CA LYS A 25 -7.913 3.585 8.636 1.00 0.00 C ATOM 413 C LYS A 25 -8.866 2.690 9.432 1.00 0.00 C ATOM 414 O LYS A 25 -8.421 1.837 10.203 1.00 0.00 O ATOM 415 CB LYS A 25 -7.703 4.915 9.367 1.00 0.00 C ATOM 416 CG LYS A 25 -6.877 4.791 10.640 1.00 0.00 C ATOM 417 CD LYS A 25 -5.825 5.888 10.735 1.00 0.00 C ATOM 418 CE LYS A 25 -5.266 6.012 12.146 1.00 0.00 C ATOM 419 NZ LYS A 25 -6.079 6.929 12.997 1.00 0.00 N ATOM 0 H LYS A 25 -8.676 4.784 7.091 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.956 3.069 8.556 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.212 5.616 8.693 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.675 5.340 9.616 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -7.535 4.841 11.508 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -6.390 3.816 10.665 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -5.013 5.675 10.039 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -6.263 6.839 10.432 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -5.231 5.026 12.609 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -4.240 6.378 12.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -5.661 6.982 13.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -6.092 7.878 12.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -7.052 6.567 13.066 1.00 0.00 H new ATOM 433 N GLU A 26 -10.175 2.891 9.249 1.00 0.00 N ATOM 434 CA GLU A 26 -11.183 2.101 9.959 1.00 0.00 C ATOM 435 C GLU A 26 -12.595 2.523 9.562 1.00 0.00 C ATOM 436 O GLU A 26 -12.780 3.443 8.762 1.00 0.00 O ATOM 437 CB GLU A 26 -11.004 2.255 11.473 1.00 0.00 C ATOM 438 CG GLU A 26 -11.023 0.938 12.231 1.00 0.00 C ATOM 439 CD GLU A 26 -10.415 1.053 13.618 1.00 0.00 C ATOM 440 OE1 GLU A 26 -10.749 2.020 14.339 1.00 0.00 O ATOM 441 OE2 GLU A 26 -9.603 0.178 13.983 1.00 0.00 O ATOM 0 H GLU A 26 -10.560 3.593 8.616 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.046 1.056 9.682 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.059 2.762 11.668 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.796 2.897 11.859 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -12.052 0.588 12.317 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -10.477 0.187 11.660 1.00 0.00 H new ATOM 448 N ILE A 27 -13.588 1.844 10.130 1.00 0.00 N ATOM 449 CA ILE A 27 -14.992 2.144 9.850 1.00 0.00 C ATOM 450 C ILE A 27 -15.781 2.330 11.146 1.00 0.00 C ATOM 451 O ILE A 27 -15.523 1.649 12.142 1.00 0.00 O ATOM 452 CB ILE A 27 -15.662 1.031 9.014 1.00 0.00 C ATOM 453 CG1 ILE A 27 -14.828 0.708 7.771 1.00 0.00 C ATOM 454 CG2 ILE A 27 -17.071 1.443 8.615 1.00 0.00 C ATOM 455 CD1 ILE A 27 -14.071 -0.597 7.874 1.00 0.00 C ATOM 0 H ILE A 27 -13.447 1.079 10.790 1.00 0.00 H new ATOM 0 HA ILE A 27 -15.004 3.071 9.276 1.00 0.00 H new ATOM 0 HB ILE A 27 -15.722 0.132 9.628 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -15.485 0.670 6.902 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -14.119 1.518 7.599 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -17.530 0.648 8.027 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -17.666 1.620 9.511 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -17.029 2.356 8.021 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -13.503 -0.761 6.959 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -13.388 -0.556 8.723 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -14.776 -1.416 8.015 1.00 0.00 H new ATOM 467 N SER A 28 -16.746 3.250 11.126 1.00 0.00 N ATOM 468 CA SER A 28 -17.576 3.521 12.296 1.00 0.00 C ATOM 469 C SER A 28 -18.750 2.545 12.374 1.00 0.00 C ATOM 470 O SER A 28 -19.141 1.943 11.371 1.00 0.00 O ATOM 471 CB SER A 28 -18.094 4.963 12.265 1.00 0.00 C ATOM 472 OG SER A 28 -18.401 5.423 13.569 1.00 0.00 O ATOM 0 H SER A 28 -16.971 3.820 10.310 1.00 0.00 H new ATOM 0 HA SER A 28 -16.957 3.386 13.183 1.00 0.00 H new ATOM 0 HB2 SER A 28 -17.344 5.613 11.814 1.00 0.00 H new ATOM 0 HB3 SER A 28 -18.983 5.020 11.637 1.00 0.00 H new ATOM 0 HG SER A 28 -18.728 6.346 13.522 1.00 0.00 H new ATOM 478 N GLN A 29 -19.303 2.392 13.577 1.00 0.00 N ATOM 479 CA GLN A 29 -20.429 1.488 13.799 1.00 0.00 C ATOM 480 C GLN A 29 -21.757 2.168 13.474 1.00 0.00 C ATOM 481 O GLN A 29 -21.930 3.362 13.728 1.00 0.00 O ATOM 482 CB GLN A 29 -20.435 0.996 15.248 1.00 0.00 C ATOM 483 CG GLN A 29 -19.278 0.066 15.583 1.00 0.00 C ATOM 484 CD GLN A 29 -19.725 -1.366 15.821 1.00 0.00 C ATOM 485 OE1 GLN A 29 -20.169 -2.050 14.898 1.00 0.00 O ATOM 486 NE2 GLN A 29 -19.609 -1.829 17.061 1.00 0.00 N ATOM 0 H GLN A 29 -18.988 2.884 14.413 1.00 0.00 H new ATOM 0 HA GLN A 29 -20.311 0.635 13.131 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -20.402 1.857 15.915 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -21.374 0.478 15.443 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -18.554 0.085 14.768 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -18.767 0.435 16.472 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -19.236 -1.229 17.797 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -19.893 -2.785 17.277 1.00 0.00 H new ATOM 495 N ASP A 30 -22.690 1.393 12.912 1.00 0.00 N ATOM 496 CA ASP A 30 -24.015 1.901 12.544 1.00 0.00 C ATOM 497 C ASP A 30 -23.918 3.043 11.525 1.00 0.00 C ATOM 498 O ASP A 30 -24.733 3.966 11.537 1.00 0.00 O ATOM 499 CB ASP A 30 -24.775 2.368 13.794 1.00 0.00 C ATOM 500 CG ASP A 30 -25.097 1.225 14.738 1.00 0.00 C ATOM 501 OD1 ASP A 30 -24.205 0.833 15.522 1.00 0.00 O ATOM 502 OD2 ASP A 30 -26.239 0.720 14.693 1.00 0.00 O ATOM 0 H ASP A 30 -22.550 0.405 12.701 1.00 0.00 H new ATOM 0 HA ASP A 30 -24.565 1.083 12.078 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -24.179 3.113 14.321 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -25.701 2.857 13.491 1.00 0.00 H new ATOM 507 N SER A 31 -22.922 2.971 10.641 1.00 0.00 N ATOM 508 CA SER A 31 -22.724 3.995 9.616 1.00 0.00 C ATOM 509 C SER A 31 -23.005 3.438 8.222 1.00 0.00 C ATOM 510 O SER A 31 -23.268 2.244 8.064 1.00 0.00 O ATOM 511 CB SER A 31 -21.293 4.539 9.681 1.00 0.00 C ATOM 512 OG SER A 31 -21.131 5.434 10.768 1.00 0.00 O ATOM 0 H SER A 31 -22.240 2.213 10.615 1.00 0.00 H new ATOM 0 HA SER A 31 -23.426 4.806 9.810 1.00 0.00 H new ATOM 0 HB2 SER A 31 -20.591 3.711 9.781 1.00 0.00 H new ATOM 0 HB3 SER A 31 -21.053 5.049 8.748 1.00 0.00 H new ATOM 0 HG SER A 31 -21.397 6.336 10.491 1.00 0.00 H new ATOM 518 N LEU A 32 -22.945 4.313 7.216 1.00 0.00 N ATOM 519 CA LEU A 32 -23.185 3.916 5.828 1.00 0.00 C ATOM 520 C LEU A 32 -22.259 2.772 5.419 1.00 0.00 C ATOM 521 O LEU A 32 -22.700 1.797 4.815 1.00 0.00 O ATOM 522 CB LEU A 32 -22.987 5.108 4.884 1.00 0.00 C ATOM 523 CG LEU A 32 -24.021 6.227 5.021 1.00 0.00 C ATOM 524 CD1 LEU A 32 -23.542 7.483 4.311 1.00 0.00 C ATOM 525 CD2 LEU A 32 -25.363 5.781 4.464 1.00 0.00 C ATOM 0 H LEU A 32 -22.732 5.303 7.338 1.00 0.00 H new ATOM 0 HA LEU A 32 -24.217 3.572 5.753 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -21.996 5.528 5.058 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -23.003 4.744 3.857 1.00 0.00 H new ATOM 0 HG LEU A 32 -24.145 6.455 6.080 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -24.289 8.269 4.418 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -22.602 7.814 4.752 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -23.391 7.268 3.253 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -26.087 6.589 4.569 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -25.253 5.527 3.410 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -25.712 4.907 5.013 1.00 0.00 H new ATOM 537 N ALA A 33 -20.975 2.896 5.765 1.00 0.00 N ATOM 538 CA ALA A 33 -19.982 1.868 5.445 1.00 0.00 C ATOM 539 C ALA A 33 -20.328 0.538 6.113 1.00 0.00 C ATOM 540 O ALA A 33 -20.263 -0.516 5.477 1.00 0.00 O ATOM 541 CB ALA A 33 -18.596 2.328 5.872 1.00 0.00 C ATOM 0 H ALA A 33 -20.599 3.700 6.268 1.00 0.00 H new ATOM 0 HA ALA A 33 -19.990 1.714 4.366 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -17.866 1.556 5.629 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -18.340 3.248 5.346 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -18.588 2.510 6.947 1.00 0.00 H new ATOM 547 N ALA A 34 -20.701 0.593 7.393 1.00 0.00 N ATOM 548 CA ALA A 34 -21.066 -0.608 8.141 1.00 0.00 C ATOM 549 C ALA A 34 -22.320 -1.254 7.553 1.00 0.00 C ATOM 550 O ALA A 34 -22.403 -2.479 7.439 1.00 0.00 O ATOM 551 CB ALA A 34 -21.272 -0.276 9.612 1.00 0.00 C ATOM 0 H ALA A 34 -20.758 1.457 7.932 1.00 0.00 H new ATOM 0 HA ALA A 34 -20.248 -1.323 8.060 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -21.543 -1.181 10.155 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -20.350 0.132 10.025 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -22.071 0.459 9.711 1.00 0.00 H new ATOM 557 N ARG A 35 -23.289 -0.421 7.167 1.00 0.00 N ATOM 558 CA ARG A 35 -24.534 -0.905 6.573 1.00 0.00 C ATOM 559 C ARG A 35 -24.287 -1.449 5.166 1.00 0.00 C ATOM 560 O ARG A 35 -24.811 -2.501 4.800 1.00 0.00 O ATOM 561 CB ARG A 35 -25.578 0.215 6.526 1.00 0.00 C ATOM 562 CG ARG A 35 -26.578 0.170 7.670 1.00 0.00 C ATOM 563 CD ARG A 35 -27.769 -0.716 7.338 1.00 0.00 C ATOM 564 NE ARG A 35 -27.603 -2.077 7.849 1.00 0.00 N ATOM 565 CZ ARG A 35 -27.816 -2.431 9.121 1.00 0.00 C ATOM 566 NH1 ARG A 35 -28.181 -1.522 10.024 1.00 0.00 N ATOM 567 NH2 ARG A 35 -27.659 -3.698 9.492 1.00 0.00 N ATOM 0 H ARG A 35 -23.234 0.594 7.256 1.00 0.00 H new ATOM 0 HA ARG A 35 -24.914 -1.714 7.197 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -25.066 1.177 6.541 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -26.118 0.156 5.581 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -26.087 -0.202 8.569 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -26.925 1.179 7.891 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -28.674 -0.279 7.760 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -27.905 -0.749 6.257 1.00 0.00 H new ATOM 0 HE ARG A 35 -27.306 -2.801 7.194 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -28.300 -0.547 9.747 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -28.341 -1.801 10.992 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -27.376 -4.399 8.807 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -27.821 -3.969 10.462 1.00 0.00 H new ATOM 581 N ASP A 36 -23.483 -0.723 4.385 1.00 0.00 N ATOM 582 CA ASP A 36 -23.156 -1.128 3.020 1.00 0.00 C ATOM 583 C ASP A 36 -22.353 -2.429 3.007 1.00 0.00 C ATOM 584 O ASP A 36 -22.577 -3.294 2.160 1.00 0.00 O ATOM 585 CB ASP A 36 -22.362 -0.030 2.310 1.00 0.00 C ATOM 586 CG ASP A 36 -23.254 0.912 1.526 1.00 0.00 C ATOM 587 OD1 ASP A 36 -23.891 1.788 2.149 1.00 0.00 O ATOM 588 OD2 ASP A 36 -23.314 0.777 0.288 1.00 0.00 O ATOM 0 H ASP A 36 -23.046 0.151 4.678 1.00 0.00 H new ATOM 0 HA ASP A 36 -24.095 -1.293 2.492 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -21.795 0.539 3.047 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -21.638 -0.487 1.635 1.00 0.00 H new ATOM 593 N GLY A 37 -21.410 -2.552 3.943 1.00 0.00 N ATOM 594 CA GLY A 37 -20.579 -3.743 4.017 1.00 0.00 C ATOM 595 C GLY A 37 -19.659 -3.887 2.816 1.00 0.00 C ATOM 596 O GLY A 37 -19.361 -5.003 2.388 1.00 0.00 O ATOM 0 H GLY A 37 -21.208 -1.846 4.651 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -19.980 -3.708 4.927 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -21.217 -4.624 4.089 1.00 0.00 H new ATOM 600 N ASN A 38 -19.211 -2.754 2.268 1.00 0.00 N ATOM 601 CA ASN A 38 -18.323 -2.763 1.105 1.00 0.00 C ATOM 602 C ASN A 38 -16.909 -2.317 1.477 1.00 0.00 C ATOM 603 O ASN A 38 -15.932 -2.781 0.887 1.00 0.00 O ATOM 604 CB ASN A 38 -18.887 -1.862 0.002 1.00 0.00 C ATOM 605 CG ASN A 38 -19.869 -2.593 -0.892 1.00 0.00 C ATOM 606 OD1 ASN A 38 -19.616 -2.790 -2.081 1.00 0.00 O ATOM 607 ND2 ASN A 38 -21.000 -3.002 -0.325 1.00 0.00 N ATOM 0 H ASN A 38 -19.448 -1.823 2.610 1.00 0.00 H new ATOM 0 HA ASN A 38 -18.265 -3.787 0.737 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -19.382 -1.003 0.455 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -18.067 -1.475 -0.603 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -21.697 -3.500 -0.879 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -21.170 -2.818 0.664 1.00 0.00 H new ATOM 614 N ILE A 39 -16.805 -1.414 2.454 1.00 0.00 N ATOM 615 CA ILE A 39 -15.511 -0.909 2.900 1.00 0.00 C ATOM 616 C ILE A 39 -14.976 -1.718 4.080 1.00 0.00 C ATOM 617 O ILE A 39 -15.710 -2.008 5.028 1.00 0.00 O ATOM 618 CB ILE A 39 -15.596 0.577 3.313 1.00 0.00 C ATOM 619 CG1 ILE A 39 -16.314 1.392 2.235 1.00 0.00 C ATOM 620 CG2 ILE A 39 -14.205 1.139 3.571 1.00 0.00 C ATOM 621 CD1 ILE A 39 -17.543 2.114 2.742 1.00 0.00 C ATOM 0 H ILE A 39 -17.604 -1.019 2.950 1.00 0.00 H new ATOM 0 HA ILE A 39 -14.830 -1.008 2.055 1.00 0.00 H new ATOM 0 HB ILE A 39 -16.171 0.646 4.236 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -15.619 2.122 1.820 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -16.603 0.728 1.421 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -14.284 2.187 3.861 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -13.728 0.576 4.373 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -13.606 1.058 2.664 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -18.001 2.671 1.925 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -18.257 1.388 3.131 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -17.258 2.804 3.536 1.00 0.00 H new ATOM 633 N GLN A 40 -13.690 -2.068 4.020 1.00 0.00 N ATOM 634 CA GLN A 40 -13.048 -2.833 5.085 1.00 0.00 C ATOM 635 C GLN A 40 -11.830 -2.086 5.624 1.00 0.00 C ATOM 636 O GLN A 40 -11.072 -1.492 4.854 1.00 0.00 O ATOM 637 CB GLN A 40 -12.622 -4.213 4.577 1.00 0.00 C ATOM 638 CG GLN A 40 -12.851 -5.329 5.587 1.00 0.00 C ATOM 639 CD GLN A 40 -11.964 -6.536 5.337 1.00 0.00 C ATOM 640 OE1 GLN A 40 -10.737 -6.436 5.369 1.00 0.00 O ATOM 641 NE2 GLN A 40 -12.581 -7.687 5.090 1.00 0.00 N ATOM 0 H GLN A 40 -13.073 -1.832 3.243 1.00 0.00 H new ATOM 0 HA GLN A 40 -13.771 -2.960 5.890 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -13.172 -4.441 3.664 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -11.565 -4.184 4.313 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -12.665 -4.948 6.591 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -13.896 -5.637 5.551 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -13.600 -7.726 5.073 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -12.035 -8.531 4.918 1.00 0.00 H new ATOM 650 N GLU A 41 -11.648 -2.117 6.945 1.00 0.00 N ATOM 651 CA GLU A 41 -10.516 -1.437 7.575 1.00 0.00 C ATOM 652 C GLU A 41 -9.194 -1.990 7.050 1.00 0.00 C ATOM 653 O GLU A 41 -8.981 -3.204 7.032 1.00 0.00 O ATOM 654 CB GLU A 41 -10.571 -1.569 9.102 1.00 0.00 C ATOM 655 CG GLU A 41 -10.692 -3.005 9.601 1.00 0.00 C ATOM 656 CD GLU A 41 -9.485 -3.448 10.406 1.00 0.00 C ATOM 657 OE1 GLU A 41 -9.365 -3.028 11.577 1.00 0.00 O ATOM 658 OE2 GLU A 41 -8.660 -4.215 9.867 1.00 0.00 O ATOM 0 H GLU A 41 -12.266 -2.602 7.596 1.00 0.00 H new ATOM 0 HA GLU A 41 -10.582 -0.380 7.319 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -9.672 -1.123 9.527 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -11.418 -0.994 9.475 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -11.587 -3.098 10.216 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -10.820 -3.672 8.749 1.00 0.00 H new ATOM 665 N GLY A 42 -8.317 -1.092 6.605 1.00 0.00 N ATOM 666 CA GLY A 42 -7.034 -1.508 6.067 1.00 0.00 C ATOM 667 C GLY A 42 -6.994 -1.469 4.547 1.00 0.00 C ATOM 668 O GLY A 42 -5.914 -1.404 3.955 1.00 0.00 O ATOM 0 H GLY A 42 -8.473 -0.084 6.608 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -6.251 -0.861 6.464 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.813 -2.520 6.406 1.00 0.00 H new ATOM 672 N ASP A 43 -8.174 -1.504 3.913 1.00 0.00 N ATOM 673 CA ASP A 43 -8.274 -1.471 2.455 1.00 0.00 C ATOM 674 C ASP A 43 -7.578 -0.238 1.879 1.00 0.00 C ATOM 675 O ASP A 43 -7.528 0.816 2.518 1.00 0.00 O ATOM 676 CB ASP A 43 -9.746 -1.489 2.021 1.00 0.00 C ATOM 677 CG ASP A 43 -10.290 -2.894 1.822 1.00 0.00 C ATOM 678 OD1 ASP A 43 -9.793 -3.831 2.485 1.00 0.00 O ATOM 679 OD2 ASP A 43 -11.219 -3.057 1.003 1.00 0.00 O ATOM 0 H ASP A 43 -9.073 -1.555 4.392 1.00 0.00 H new ATOM 0 HA ASP A 43 -7.774 -2.358 2.067 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -10.347 -0.976 2.772 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -9.852 -0.929 1.092 1.00 0.00 H new ATOM 684 N VAL A 44 -7.040 -0.381 0.669 1.00 0.00 N ATOM 685 CA VAL A 44 -6.341 0.714 0.002 1.00 0.00 C ATOM 686 C VAL A 44 -7.186 1.285 -1.137 1.00 0.00 C ATOM 687 O VAL A 44 -7.500 0.582 -2.099 1.00 0.00 O ATOM 688 CB VAL A 44 -4.977 0.253 -0.558 1.00 0.00 C ATOM 689 CG1 VAL A 44 -4.199 1.435 -1.112 1.00 0.00 C ATOM 690 CG2 VAL A 44 -4.165 -0.470 0.511 1.00 0.00 C ATOM 0 H VAL A 44 -7.075 -1.246 0.130 1.00 0.00 H new ATOM 0 HA VAL A 44 -6.171 1.489 0.749 1.00 0.00 H new ATOM 0 HB VAL A 44 -5.165 -0.448 -1.372 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.241 1.090 -1.502 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -4.770 1.903 -1.914 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -4.027 2.162 -0.318 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -3.209 -0.784 0.091 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.989 0.202 1.351 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.715 -1.345 0.856 1.00 0.00 H new ATOM 700 N VAL A 45 -7.551 2.563 -1.021 1.00 0.00 N ATOM 701 CA VAL A 45 -8.363 3.229 -2.039 1.00 0.00 C ATOM 702 C VAL A 45 -7.487 3.986 -3.039 1.00 0.00 C ATOM 703 O VAL A 45 -6.749 4.900 -2.664 1.00 0.00 O ATOM 704 CB VAL A 45 -9.368 4.218 -1.410 1.00 0.00 C ATOM 705 CG1 VAL A 45 -10.323 4.752 -2.468 1.00 0.00 C ATOM 706 CG2 VAL A 45 -10.141 3.565 -0.271 1.00 0.00 C ATOM 0 H VAL A 45 -7.297 3.157 -0.232 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.913 2.444 -2.558 1.00 0.00 H new ATOM 0 HB VAL A 45 -8.804 5.054 -0.997 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -11.024 5.448 -2.007 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -9.756 5.268 -3.243 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -10.873 3.923 -2.913 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -10.841 4.285 0.153 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -10.691 2.704 -0.651 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.444 3.238 0.501 1.00 0.00 H new ATOM 716 N LEU A 46 -7.586 3.608 -4.311 1.00 0.00 N ATOM 717 CA LEU A 46 -6.812 4.255 -5.369 1.00 0.00 C ATOM 718 C LEU A 46 -7.569 5.456 -5.947 1.00 0.00 C ATOM 719 O LEU A 46 -6.987 6.525 -6.148 1.00 0.00 O ATOM 720 CB LEU A 46 -6.495 3.252 -6.484 1.00 0.00 C ATOM 721 CG LEU A 46 -5.202 3.525 -7.260 1.00 0.00 C ATOM 722 CD1 LEU A 46 -4.821 2.319 -8.106 1.00 0.00 C ATOM 723 CD2 LEU A 46 -5.352 4.765 -8.133 1.00 0.00 C ATOM 0 H LEU A 46 -8.195 2.857 -4.635 1.00 0.00 H new ATOM 0 HA LEU A 46 -5.879 4.613 -4.934 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -6.434 2.255 -6.047 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -7.327 3.241 -7.188 1.00 0.00 H new ATOM 0 HG LEU A 46 -4.403 3.706 -6.541 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -3.901 2.532 -8.650 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -4.669 1.455 -7.460 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -5.620 2.105 -8.816 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -4.424 4.942 -8.676 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.165 4.614 -8.844 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -5.575 5.627 -7.505 1.00 0.00 H new ATOM 735 N LYS A 47 -8.862 5.269 -6.218 1.00 0.00 N ATOM 736 CA LYS A 47 -9.690 6.334 -6.782 1.00 0.00 C ATOM 737 C LYS A 47 -10.916 6.609 -5.912 1.00 0.00 C ATOM 738 O LYS A 47 -11.420 5.717 -5.224 1.00 0.00 O ATOM 739 CB LYS A 47 -10.141 5.961 -8.197 1.00 0.00 C ATOM 740 CG LYS A 47 -9.169 6.392 -9.284 1.00 0.00 C ATOM 741 CD LYS A 47 -9.687 6.029 -10.668 1.00 0.00 C ATOM 742 CE LYS A 47 -10.343 7.221 -11.350 1.00 0.00 C ATOM 743 NZ LYS A 47 -10.580 6.974 -12.801 1.00 0.00 N ATOM 0 H LYS A 47 -9.357 4.392 -6.056 1.00 0.00 H new ATOM 0 HA LYS A 47 -9.084 7.239 -6.817 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -10.278 4.881 -8.252 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -11.113 6.415 -8.390 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -9.009 7.469 -9.225 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -8.202 5.916 -9.119 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -8.863 5.666 -11.282 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -10.407 5.214 -10.586 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -11.291 7.442 -10.860 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -9.710 8.100 -11.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -11.028 7.810 -13.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -9.673 6.788 -13.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -11.205 6.151 -12.915 1.00 0.00 H new ATOM 757 N ILE A 48 -11.396 7.853 -5.963 1.00 0.00 N ATOM 758 CA ILE A 48 -12.568 8.269 -5.198 1.00 0.00 C ATOM 759 C ILE A 48 -13.456 9.186 -6.036 1.00 0.00 C ATOM 760 O ILE A 48 -13.010 10.235 -6.506 1.00 0.00 O ATOM 761 CB ILE A 48 -12.170 9.004 -3.899 1.00 0.00 C ATOM 762 CG1 ILE A 48 -11.121 8.198 -3.127 1.00 0.00 C ATOM 763 CG2 ILE A 48 -13.396 9.257 -3.029 1.00 0.00 C ATOM 764 CD1 ILE A 48 -10.575 8.920 -1.915 1.00 0.00 C ATOM 0 H ILE A 48 -10.986 8.594 -6.532 1.00 0.00 H new ATOM 0 HA ILE A 48 -13.115 7.364 -4.933 1.00 0.00 H new ATOM 0 HB ILE A 48 -11.736 9.967 -4.168 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -11.562 7.254 -2.809 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -10.296 7.955 -3.797 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -13.095 9.776 -2.119 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -14.111 9.871 -3.577 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -13.860 8.306 -2.768 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -9.838 8.290 -1.418 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -10.104 9.852 -2.228 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -11.389 9.139 -1.225 1.00 0.00 H new ATOM 776 N ASN A 49 -14.714 8.776 -6.224 1.00 0.00 N ATOM 777 CA ASN A 49 -15.678 9.546 -7.011 1.00 0.00 C ATOM 778 C ASN A 49 -15.194 9.742 -8.451 1.00 0.00 C ATOM 779 O ASN A 49 -15.432 10.788 -9.060 1.00 0.00 O ATOM 780 CB ASN A 49 -15.947 10.907 -6.351 1.00 0.00 C ATOM 781 CG ASN A 49 -17.409 11.317 -6.440 1.00 0.00 C ATOM 782 OD1 ASN A 49 -18.172 10.777 -7.243 1.00 0.00 O ATOM 783 ND2 ASN A 49 -17.810 12.279 -5.615 1.00 0.00 N ATOM 0 H ASN A 49 -15.089 7.909 -5.838 1.00 0.00 H new ATOM 0 HA ASN A 49 -16.608 8.979 -7.043 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -15.648 10.865 -5.304 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -15.330 11.668 -6.829 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -18.780 12.595 -5.633 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -17.148 12.702 -4.964 1.00 0.00 H new ATOM 790 N GLY A 50 -14.513 8.728 -8.993 1.00 0.00 N ATOM 791 CA GLY A 50 -14.008 8.812 -10.353 1.00 0.00 C ATOM 792 C GLY A 50 -12.797 9.722 -10.477 1.00 0.00 C ATOM 793 O GLY A 50 -12.573 10.322 -11.528 1.00 0.00 O ATOM 0 H GLY A 50 -14.304 7.853 -8.513 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -13.743 7.813 -10.700 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -14.799 9.177 -11.008 1.00 0.00 H new ATOM 797 N THR A 51 -12.015 9.830 -9.399 1.00 0.00 N ATOM 798 CA THR A 51 -10.827 10.679 -9.391 1.00 0.00 C ATOM 799 C THR A 51 -9.687 10.002 -8.634 1.00 0.00 C ATOM 800 O THR A 51 -9.921 9.289 -7.659 1.00 0.00 O ATOM 801 CB THR A 51 -11.143 12.041 -8.753 1.00 0.00 C ATOM 802 OG1 THR A 51 -12.510 12.382 -8.923 1.00 0.00 O ATOM 803 CG2 THR A 51 -10.319 13.177 -9.323 1.00 0.00 C ATOM 0 H THR A 51 -12.186 9.339 -8.522 1.00 0.00 H new ATOM 0 HA THR A 51 -10.516 10.837 -10.424 1.00 0.00 H new ATOM 0 HB THR A 51 -10.896 11.921 -7.698 1.00 0.00 H new ATOM 0 HG1 THR A 51 -12.684 13.252 -8.507 1.00 0.00 H new ATOM 0 HG21 THR A 51 -10.593 14.109 -8.828 1.00 0.00 H new ATOM 0 HG22 THR A 51 -9.260 12.976 -9.159 1.00 0.00 H new ATOM 0 HG23 THR A 51 -10.510 13.264 -10.393 1.00 0.00 H new ATOM 811 N VAL A 52 -8.456 10.234 -9.086 1.00 0.00 N ATOM 812 CA VAL A 52 -7.279 9.649 -8.444 1.00 0.00 C ATOM 813 C VAL A 52 -6.933 10.406 -7.163 1.00 0.00 C ATOM 814 O VAL A 52 -6.990 11.636 -7.131 1.00 0.00 O ATOM 815 CB VAL A 52 -6.048 9.654 -9.381 1.00 0.00 C ATOM 816 CG1 VAL A 52 -4.899 8.868 -8.762 1.00 0.00 C ATOM 817 CG2 VAL A 52 -6.407 9.088 -10.750 1.00 0.00 C ATOM 0 H VAL A 52 -8.247 10.822 -9.893 1.00 0.00 H new ATOM 0 HA VAL A 52 -7.529 8.615 -8.207 1.00 0.00 H new ATOM 0 HB VAL A 52 -5.727 10.687 -9.513 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -4.043 8.883 -9.436 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.620 9.320 -7.810 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -5.211 7.837 -8.596 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -5.526 9.102 -11.392 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -6.759 8.062 -10.639 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -7.193 9.695 -11.200 1.00 0.00 H new ATOM 827 N THR A 53 -6.580 9.666 -6.112 1.00 0.00 N ATOM 828 CA THR A 53 -6.229 10.275 -4.828 1.00 0.00 C ATOM 829 C THR A 53 -4.774 9.995 -4.449 1.00 0.00 C ATOM 830 O THR A 53 -4.395 10.123 -3.285 1.00 0.00 O ATOM 831 CB THR A 53 -7.171 9.772 -3.725 1.00 0.00 C ATOM 832 OG1 THR A 53 -8.374 9.256 -4.277 1.00 0.00 O ATOM 833 CG2 THR A 53 -7.551 10.842 -2.725 1.00 0.00 C ATOM 0 H THR A 53 -6.529 8.647 -6.124 1.00 0.00 H new ATOM 0 HA THR A 53 -6.343 11.354 -4.932 1.00 0.00 H new ATOM 0 HB THR A 53 -6.610 8.994 -3.208 1.00 0.00 H new ATOM 0 HG1 THR A 53 -9.083 9.928 -4.202 1.00 0.00 H new ATOM 0 HG21 THR A 53 -8.218 10.418 -1.974 1.00 0.00 H new ATOM 0 HG22 THR A 53 -6.652 11.222 -2.239 1.00 0.00 H new ATOM 0 HG23 THR A 53 -8.057 11.658 -3.240 1.00 0.00 H new ATOM 841 N GLU A 54 -3.958 9.640 -5.438 1.00 0.00 N ATOM 842 CA GLU A 54 -2.551 9.368 -5.202 1.00 0.00 C ATOM 843 C GLU A 54 -1.761 10.668 -5.165 1.00 0.00 C ATOM 844 O GLU A 54 -2.139 11.650 -5.803 1.00 0.00 O ATOM 845 CB GLU A 54 -1.987 8.443 -6.279 1.00 0.00 C ATOM 846 CG GLU A 54 -1.251 7.237 -5.719 1.00 0.00 C ATOM 847 CD GLU A 54 -1.563 5.962 -6.472 1.00 0.00 C ATOM 848 OE1 GLU A 54 -2.705 5.470 -6.363 1.00 0.00 O ATOM 849 OE2 GLU A 54 -0.662 5.452 -7.171 1.00 0.00 O ATOM 0 H GLU A 54 -4.251 9.535 -6.409 1.00 0.00 H new ATOM 0 HA GLU A 54 -2.459 8.869 -4.237 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -2.803 8.098 -6.914 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -1.307 9.011 -6.914 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -0.177 7.422 -5.755 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -1.517 7.109 -4.670 1.00 0.00 H new ATOM 856 N ASN A 55 -0.674 10.659 -4.397 1.00 0.00 N ATOM 857 CA ASN A 55 0.198 11.828 -4.232 1.00 0.00 C ATOM 858 C ASN A 55 -0.583 13.088 -3.835 1.00 0.00 C ATOM 859 O ASN A 55 -0.083 14.206 -3.976 1.00 0.00 O ATOM 860 CB ASN A 55 1.031 12.072 -5.503 1.00 0.00 C ATOM 861 CG ASN A 55 0.266 12.773 -6.618 1.00 0.00 C ATOM 862 OD1 ASN A 55 0.050 13.984 -6.579 1.00 0.00 O ATOM 863 ND2 ASN A 55 -0.136 12.014 -7.630 1.00 0.00 N ATOM 0 H ASN A 55 -0.369 9.841 -3.869 1.00 0.00 H new ATOM 0 HA ASN A 55 0.878 11.606 -3.409 1.00 0.00 H new ATOM 0 HB2 ASN A 55 1.905 12.670 -5.244 1.00 0.00 H new ATOM 0 HB3 ASN A 55 1.398 11.115 -5.874 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -0.643 12.431 -8.411 1.00 0.00 H new ATOM 0 HD22 ASN A 55 0.062 11.013 -7.627 1.00 0.00 H new ATOM 870 N MET A 56 -1.804 12.907 -3.323 1.00 0.00 N ATOM 871 CA MET A 56 -2.629 14.030 -2.901 1.00 0.00 C ATOM 872 C MET A 56 -2.494 14.267 -1.398 1.00 0.00 C ATOM 873 O MET A 56 -1.901 13.457 -0.683 1.00 0.00 O ATOM 874 CB MET A 56 -4.094 13.775 -3.265 1.00 0.00 C ATOM 875 CG MET A 56 -4.760 14.947 -3.969 1.00 0.00 C ATOM 876 SD MET A 56 -4.291 15.073 -5.706 1.00 0.00 S ATOM 877 CE MET A 56 -4.950 13.539 -6.353 1.00 0.00 C ATOM 0 H MET A 56 -2.238 11.993 -3.193 1.00 0.00 H new ATOM 0 HA MET A 56 -2.284 14.923 -3.422 1.00 0.00 H new ATOM 0 HB2 MET A 56 -4.152 12.896 -3.907 1.00 0.00 H new ATOM 0 HB3 MET A 56 -4.650 13.544 -2.357 1.00 0.00 H new ATOM 0 HG2 MET A 56 -5.842 14.842 -3.896 1.00 0.00 H new ATOM 0 HG3 MET A 56 -4.494 15.872 -3.457 1.00 0.00 H new ATOM 0 HE1 MET A 56 -5.113 13.637 -7.426 1.00 0.00 H new ATOM 0 HE2 MET A 56 -4.242 12.731 -6.166 1.00 0.00 H new ATOM 0 HE3 MET A 56 -5.896 13.314 -5.861 1.00 0.00 H new ATOM 887 N SER A 57 -3.053 15.378 -0.925 1.00 0.00 N ATOM 888 CA SER A 57 -3.003 15.720 0.492 1.00 0.00 C ATOM 889 C SER A 57 -4.059 14.945 1.272 1.00 0.00 C ATOM 890 O SER A 57 -5.165 14.718 0.778 1.00 0.00 O ATOM 891 CB SER A 57 -3.203 17.226 0.681 1.00 0.00 C ATOM 892 OG SER A 57 -1.969 17.919 0.579 1.00 0.00 O ATOM 0 H SER A 57 -3.546 16.057 -1.504 1.00 0.00 H new ATOM 0 HA SER A 57 -2.021 15.444 0.877 1.00 0.00 H new ATOM 0 HB2 SER A 57 -3.898 17.601 -0.070 1.00 0.00 H new ATOM 0 HB3 SER A 57 -3.652 17.417 1.655 1.00 0.00 H new ATOM 0 HG SER A 57 -2.122 18.879 0.701 1.00 0.00 H new ATOM 898 N LEU A 58 -3.712 14.545 2.498 1.00 0.00 N ATOM 899 CA LEU A 58 -4.635 13.800 3.355 1.00 0.00 C ATOM 900 C LEU A 58 -5.937 14.574 3.547 1.00 0.00 C ATOM 901 O LEU A 58 -7.013 13.980 3.637 1.00 0.00 O ATOM 902 CB LEU A 58 -3.999 13.519 4.718 1.00 0.00 C ATOM 903 CG LEU A 58 -4.642 12.375 5.508 1.00 0.00 C ATOM 904 CD1 LEU A 58 -3.745 11.151 5.501 1.00 0.00 C ATOM 905 CD2 LEU A 58 -4.938 12.803 6.936 1.00 0.00 C ATOM 0 H LEU A 58 -2.800 14.725 2.918 1.00 0.00 H new ATOM 0 HA LEU A 58 -4.856 12.852 2.864 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -2.944 13.290 4.570 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -4.047 14.427 5.319 1.00 0.00 H new ATOM 0 HG LEU A 58 -5.584 12.119 5.024 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -4.219 10.349 6.067 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -3.584 10.824 4.474 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -2.787 11.400 5.957 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -5.394 11.974 7.477 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -4.010 13.091 7.429 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.623 13.651 6.927 1.00 0.00 H new ATOM 917 N THR A 59 -5.829 15.903 3.601 1.00 0.00 N ATOM 918 CA THR A 59 -6.994 16.767 3.775 1.00 0.00 C ATOM 919 C THR A 59 -7.851 16.772 2.512 1.00 0.00 C ATOM 920 O THR A 59 -9.080 16.777 2.591 1.00 0.00 O ATOM 921 CB THR A 59 -6.568 18.200 4.118 1.00 0.00 C ATOM 922 OG1 THR A 59 -5.243 18.232 4.622 1.00 0.00 O ATOM 923 CG2 THR A 59 -7.465 18.861 5.145 1.00 0.00 C ATOM 0 H THR A 59 -4.943 16.404 3.526 1.00 0.00 H new ATOM 0 HA THR A 59 -7.582 16.371 4.603 1.00 0.00 H new ATOM 0 HB THR A 59 -6.643 18.751 3.180 1.00 0.00 H new ATOM 0 HG1 THR A 59 -4.995 19.157 4.831 1.00 0.00 H new ATOM 0 HG21 THR A 59 -7.109 19.872 5.343 1.00 0.00 H new ATOM 0 HG22 THR A 59 -8.485 18.904 4.763 1.00 0.00 H new ATOM 0 HG23 THR A 59 -7.448 18.283 6.069 1.00 0.00 H new ATOM 931 N ASP A 60 -7.192 16.763 1.350 1.00 0.00 N ATOM 932 CA ASP A 60 -7.890 16.756 0.066 1.00 0.00 C ATOM 933 C ASP A 60 -8.837 15.562 -0.029 1.00 0.00 C ATOM 934 O ASP A 60 -9.987 15.704 -0.446 1.00 0.00 O ATOM 935 CB ASP A 60 -6.885 16.713 -1.090 1.00 0.00 C ATOM 936 CG ASP A 60 -7.395 17.416 -2.332 1.00 0.00 C ATOM 937 OD1 ASP A 60 -8.438 16.989 -2.873 1.00 0.00 O ATOM 938 OD2 ASP A 60 -6.750 18.391 -2.768 1.00 0.00 O ATOM 0 H ASP A 60 -6.175 16.760 1.274 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.475 17.673 -0.005 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -5.951 17.177 -0.772 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -6.659 15.674 -1.332 1.00 0.00 H new ATOM 943 N ALA A 61 -8.345 14.386 0.371 1.00 0.00 N ATOM 944 CA ALA A 61 -9.152 13.167 0.341 1.00 0.00 C ATOM 945 C ALA A 61 -10.421 13.333 1.173 1.00 0.00 C ATOM 946 O ALA A 61 -11.493 12.866 0.785 1.00 0.00 O ATOM 947 CB ALA A 61 -8.345 11.976 0.839 1.00 0.00 C ATOM 0 H ALA A 61 -7.395 14.254 0.718 1.00 0.00 H new ATOM 0 HA ALA A 61 -9.442 12.982 -0.693 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -8.964 11.079 0.809 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -7.472 11.836 0.202 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -8.021 12.159 1.864 1.00 0.00 H new ATOM 953 N LYS A 62 -10.293 14.019 2.312 1.00 0.00 N ATOM 954 CA LYS A 62 -11.431 14.268 3.196 1.00 0.00 C ATOM 955 C LYS A 62 -12.462 15.157 2.504 1.00 0.00 C ATOM 956 O LYS A 62 -13.667 14.974 2.680 1.00 0.00 O ATOM 957 CB LYS A 62 -10.968 14.925 4.506 1.00 0.00 C ATOM 958 CG LYS A 62 -9.840 14.179 5.207 1.00 0.00 C ATOM 959 CD LYS A 62 -10.346 12.929 5.911 1.00 0.00 C ATOM 960 CE LYS A 62 -9.897 11.663 5.195 1.00 0.00 C ATOM 961 NZ LYS A 62 -8.476 11.323 5.494 1.00 0.00 N ATOM 0 H LYS A 62 -9.411 14.411 2.642 1.00 0.00 H new ATOM 0 HA LYS A 62 -11.893 13.309 3.431 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -10.640 15.943 4.294 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -11.818 14.998 5.184 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -9.078 13.903 4.478 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -9.363 14.838 5.933 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -9.981 12.916 6.938 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -11.435 12.954 5.960 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -10.538 10.833 5.491 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -10.020 11.792 4.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -7.979 11.098 4.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -8.014 12.134 5.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -8.442 10.500 6.128 1.00 0.00 H new ATOM 975 N THR A 63 -11.976 16.113 1.706 1.00 0.00 N ATOM 976 CA THR A 63 -12.851 17.026 0.974 1.00 0.00 C ATOM 977 C THR A 63 -13.698 16.268 -0.047 1.00 0.00 C ATOM 978 O THR A 63 -14.888 16.543 -0.196 1.00 0.00 O ATOM 979 CB THR A 63 -12.033 18.104 0.260 1.00 0.00 C ATOM 980 OG1 THR A 63 -10.743 18.244 0.837 1.00 0.00 O ATOM 981 CG2 THR A 63 -12.692 19.467 0.276 1.00 0.00 C ATOM 0 H THR A 63 -10.980 16.272 1.552 1.00 0.00 H new ATOM 0 HA THR A 63 -13.512 17.502 1.698 1.00 0.00 H new ATOM 0 HB THR A 63 -11.961 17.760 -0.772 1.00 0.00 H new ATOM 0 HG1 THR A 63 -10.244 18.939 0.358 1.00 0.00 H new ATOM 0 HG21 THR A 63 -12.059 20.183 -0.247 1.00 0.00 H new ATOM 0 HG22 THR A 63 -13.661 19.409 -0.220 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.832 19.791 1.307 1.00 0.00 H new ATOM 989 N LEU A 64 -13.079 15.307 -0.741 1.00 0.00 N ATOM 990 CA LEU A 64 -13.788 14.502 -1.738 1.00 0.00 C ATOM 991 C LEU A 64 -15.027 13.863 -1.118 1.00 0.00 C ATOM 992 O LEU A 64 -16.066 13.743 -1.770 1.00 0.00 O ATOM 993 CB LEU A 64 -12.871 13.415 -2.307 1.00 0.00 C ATOM 994 CG LEU A 64 -12.220 13.752 -3.649 1.00 0.00 C ATOM 995 CD1 LEU A 64 -10.924 12.972 -3.825 1.00 0.00 C ATOM 996 CD2 LEU A 64 -13.183 13.467 -4.796 1.00 0.00 C ATOM 0 H LEU A 64 -12.093 15.069 -0.631 1.00 0.00 H new ATOM 0 HA LEU A 64 -14.096 15.160 -2.551 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -12.085 13.208 -1.581 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -13.448 12.498 -2.421 1.00 0.00 H new ATOM 0 HG LEU A 64 -11.981 14.815 -3.660 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.475 13.225 -4.786 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -10.233 13.229 -3.022 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -11.135 11.903 -3.793 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -12.703 13.713 -5.743 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -13.454 12.411 -4.790 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.081 14.073 -4.676 1.00 0.00 H new ATOM 1008 N ILE A 65 -14.912 13.469 0.151 1.00 0.00 N ATOM 1009 CA ILE A 65 -16.022 12.858 0.873 1.00 0.00 C ATOM 1010 C ILE A 65 -17.154 13.869 1.089 1.00 0.00 C ATOM 1011 O ILE A 65 -18.331 13.504 1.067 1.00 0.00 O ATOM 1012 CB ILE A 65 -15.573 12.297 2.242 1.00 0.00 C ATOM 1013 CG1 ILE A 65 -14.343 11.396 2.081 1.00 0.00 C ATOM 1014 CG2 ILE A 65 -16.711 11.531 2.900 1.00 0.00 C ATOM 1015 CD1 ILE A 65 -13.707 10.993 3.395 1.00 0.00 C ATOM 0 H ILE A 65 -14.057 13.564 0.699 1.00 0.00 H new ATOM 0 HA ILE A 65 -16.383 12.032 0.260 1.00 0.00 H new ATOM 0 HB ILE A 65 -15.301 13.135 2.884 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -14.631 10.497 1.536 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -13.602 11.914 1.472 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -16.379 11.142 3.863 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -17.559 12.198 3.051 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -17.011 10.703 2.258 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -12.843 10.357 3.201 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -13.387 11.885 3.933 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -14.432 10.446 3.998 1.00 0.00 H new ATOM 1027 N GLU A 66 -16.792 15.141 1.289 1.00 0.00 N ATOM 1028 CA GLU A 66 -17.784 16.194 1.500 1.00 0.00 C ATOM 1029 C GLU A 66 -18.439 16.602 0.181 1.00 0.00 C ATOM 1030 O GLU A 66 -19.660 16.736 0.102 1.00 0.00 O ATOM 1031 CB GLU A 66 -17.139 17.418 2.156 1.00 0.00 C ATOM 1032 CG GLU A 66 -17.112 17.359 3.677 1.00 0.00 C ATOM 1033 CD GLU A 66 -16.215 18.421 4.288 1.00 0.00 C ATOM 1034 OE1 GLU A 66 -15.023 18.480 3.914 1.00 0.00 O ATOM 1035 OE2 GLU A 66 -16.705 19.194 5.137 1.00 0.00 O ATOM 0 H GLU A 66 -15.824 15.462 1.309 1.00 0.00 H new ATOM 0 HA GLU A 66 -18.553 15.798 2.163 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -16.118 17.520 1.788 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -17.680 18.312 1.846 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -18.125 17.481 4.059 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -16.769 16.374 3.992 1.00 0.00 H new ATOM 1042 N ARG A 67 -17.619 16.793 -0.854 1.00 0.00 N ATOM 1043 CA ARG A 67 -18.118 17.184 -2.175 1.00 0.00 C ATOM 1044 C ARG A 67 -18.967 16.080 -2.813 1.00 0.00 C ATOM 1045 O ARG A 67 -19.676 16.330 -3.792 1.00 0.00 O ATOM 1046 CB ARG A 67 -16.953 17.536 -3.102 1.00 0.00 C ATOM 1047 CG ARG A 67 -17.372 18.330 -4.329 1.00 0.00 C ATOM 1048 CD ARG A 67 -16.187 18.637 -5.230 1.00 0.00 C ATOM 1049 NE ARG A 67 -16.312 17.997 -6.539 1.00 0.00 N ATOM 1050 CZ ARG A 67 -17.074 18.466 -7.533 1.00 0.00 C ATOM 1051 NH1 ARG A 67 -17.801 19.571 -7.367 1.00 0.00 N ATOM 1052 NH2 ARG A 67 -17.111 17.823 -8.697 1.00 0.00 N ATOM 0 H ARG A 67 -16.606 16.683 -0.804 1.00 0.00 H new ATOM 0 HA ARG A 67 -18.752 18.060 -2.035 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -16.215 18.110 -2.542 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -16.465 16.616 -3.424 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -18.119 17.768 -4.889 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -17.843 19.262 -4.016 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -16.101 19.716 -5.361 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -15.269 18.300 -4.748 1.00 0.00 H new ATOM 0 HE ARG A 67 -15.785 17.139 -6.704 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -17.779 20.067 -6.476 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -18.379 19.921 -8.131 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -16.559 16.975 -8.829 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -17.691 18.178 -9.457 1.00 0.00 H new ATOM 1066 N SER A 68 -18.885 14.865 -2.267 1.00 0.00 N ATOM 1067 CA SER A 68 -19.639 13.733 -2.791 1.00 0.00 C ATOM 1068 C SER A 68 -21.121 14.071 -2.924 1.00 0.00 C ATOM 1069 O SER A 68 -21.810 14.298 -1.926 1.00 0.00 O ATOM 1070 CB SER A 68 -19.462 12.516 -1.885 1.00 0.00 C ATOM 1071 OG SER A 68 -18.126 12.050 -1.923 1.00 0.00 O ATOM 0 H SER A 68 -18.301 14.643 -1.460 1.00 0.00 H new ATOM 0 HA SER A 68 -19.251 13.502 -3.783 1.00 0.00 H new ATOM 0 HB2 SER A 68 -19.732 12.777 -0.862 1.00 0.00 H new ATOM 0 HB3 SER A 68 -20.138 11.721 -2.200 1.00 0.00 H new ATOM 0 HG SER A 68 -17.513 12.806 -1.809 1.00 0.00 H new ATOM 1077 N LYS A 69 -21.599 14.105 -4.167 1.00 0.00 N ATOM 1078 CA LYS A 69 -22.999 14.415 -4.452 1.00 0.00 C ATOM 1079 C LYS A 69 -23.899 13.248 -4.046 1.00 0.00 C ATOM 1080 O LYS A 69 -24.331 12.458 -4.890 1.00 0.00 O ATOM 1081 CB LYS A 69 -23.188 14.737 -5.939 1.00 0.00 C ATOM 1082 CG LYS A 69 -22.143 15.687 -6.502 1.00 0.00 C ATOM 1083 CD LYS A 69 -21.491 15.115 -7.752 1.00 0.00 C ATOM 1084 CE LYS A 69 -20.211 14.361 -7.423 1.00 0.00 C ATOM 1085 NZ LYS A 69 -19.528 13.851 -8.646 1.00 0.00 N ATOM 0 H LYS A 69 -21.034 13.921 -4.996 1.00 0.00 H new ATOM 0 HA LYS A 69 -23.280 15.292 -3.869 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -23.164 13.807 -6.508 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -24.176 15.173 -6.083 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -22.608 16.644 -6.738 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -21.380 15.880 -5.748 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -22.190 14.445 -8.253 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -21.269 15.923 -8.449 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -19.534 15.019 -6.878 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -20.443 13.525 -6.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -18.661 13.344 -8.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -20.163 13.203 -9.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -19.282 14.650 -9.265 1.00 0.00 H new ATOM 1099 N GLY A 70 -24.167 13.142 -2.744 1.00 0.00 N ATOM 1100 CA GLY A 70 -25.000 12.068 -2.234 1.00 0.00 C ATOM 1101 C GLY A 70 -24.256 10.750 -2.166 1.00 0.00 C ATOM 1102 O GLY A 70 -23.583 10.465 -1.181 1.00 0.00 O ATOM 0 H GLY A 70 -23.819 13.785 -2.033 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -25.361 12.331 -1.240 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -25.877 11.956 -2.872 1.00 0.00 H new ATOM 1106 N LYS A 71 -24.376 9.948 -3.220 1.00 0.00 N ATOM 1107 CA LYS A 71 -23.708 8.649 -3.278 1.00 0.00 C ATOM 1108 C LYS A 71 -22.197 8.804 -3.472 1.00 0.00 C ATOM 1109 O LYS A 71 -21.741 9.682 -4.209 1.00 0.00 O ATOM 1110 CB LYS A 71 -24.294 7.794 -4.406 1.00 0.00 C ATOM 1111 CG LYS A 71 -24.321 8.495 -5.757 1.00 0.00 C ATOM 1112 CD LYS A 71 -23.577 7.696 -6.814 1.00 0.00 C ATOM 1113 CE LYS A 71 -23.458 8.469 -8.120 1.00 0.00 C ATOM 1114 NZ LYS A 71 -22.137 8.256 -8.778 1.00 0.00 N ATOM 0 H LYS A 71 -24.930 10.174 -4.046 1.00 0.00 H new ATOM 0 HA LYS A 71 -23.879 8.149 -2.325 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -23.711 6.877 -4.494 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -25.309 7.502 -4.138 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -25.354 8.642 -6.071 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -23.872 9.484 -5.664 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -22.582 7.445 -6.447 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -24.098 6.755 -6.993 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -24.254 8.160 -8.797 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -23.599 9.532 -7.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -22.098 8.800 -9.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -21.377 8.574 -8.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -22.012 7.245 -8.987 1.00 0.00 H new ATOM 1128 N LEU A 72 -21.429 7.939 -2.806 1.00 0.00 N ATOM 1129 CA LEU A 72 -19.969 7.966 -2.897 1.00 0.00 C ATOM 1130 C LEU A 72 -19.446 6.724 -3.616 1.00 0.00 C ATOM 1131 O LEU A 72 -20.008 5.636 -3.482 1.00 0.00 O ATOM 1132 CB LEU A 72 -19.346 8.041 -1.498 1.00 0.00 C ATOM 1133 CG LEU A 72 -18.369 9.200 -1.271 1.00 0.00 C ATOM 1134 CD1 LEU A 72 -17.728 9.098 0.105 1.00 0.00 C ATOM 1135 CD2 LEU A 72 -17.299 9.232 -2.353 1.00 0.00 C ATOM 0 H LEU A 72 -21.796 7.209 -2.196 1.00 0.00 H new ATOM 0 HA LEU A 72 -19.687 8.851 -3.467 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -20.149 8.118 -0.765 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -18.824 7.105 -1.302 1.00 0.00 H new ATOM 0 HG LEU A 72 -18.934 10.131 -1.324 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -17.038 9.929 0.247 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -18.503 9.134 0.871 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -17.184 8.157 0.184 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -16.619 10.064 -2.168 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.740 8.296 -2.340 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -17.771 9.359 -3.327 1.00 0.00 H new ATOM 1147 N LYS A 73 -18.358 6.891 -4.366 1.00 0.00 N ATOM 1148 CA LYS A 73 -17.749 5.783 -5.093 1.00 0.00 C ATOM 1149 C LYS A 73 -16.261 5.680 -4.763 1.00 0.00 C ATOM 1150 O LYS A 73 -15.513 6.643 -4.935 1.00 0.00 O ATOM 1151 CB LYS A 73 -17.946 5.957 -6.602 1.00 0.00 C ATOM 1152 CG LYS A 73 -19.045 5.074 -7.175 1.00 0.00 C ATOM 1153 CD LYS A 73 -18.671 4.529 -8.546 1.00 0.00 C ATOM 1154 CE LYS A 73 -19.127 3.086 -8.720 1.00 0.00 C ATOM 1155 NZ LYS A 73 -19.566 2.803 -10.117 1.00 0.00 N ATOM 0 H LYS A 73 -17.881 7.785 -4.485 1.00 0.00 H new ATOM 0 HA LYS A 73 -18.239 4.860 -4.783 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -18.182 7.000 -6.812 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -17.008 5.734 -7.111 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -19.238 4.245 -6.494 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -19.970 5.646 -7.251 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -19.122 5.150 -9.320 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -17.591 4.588 -8.679 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -18.312 2.414 -8.453 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -19.948 2.880 -8.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -19.868 1.811 -10.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -20.361 3.426 -10.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -18.776 2.974 -10.771 1.00 0.00 H new ATOM 1169 N MET A 74 -15.837 4.510 -4.285 1.00 0.00 N ATOM 1170 CA MET A 74 -14.437 4.284 -3.927 1.00 0.00 C ATOM 1171 C MET A 74 -13.917 2.991 -4.554 1.00 0.00 C ATOM 1172 O MET A 74 -14.558 1.945 -4.456 1.00 0.00 O ATOM 1173 CB MET A 74 -14.274 4.226 -2.405 1.00 0.00 C ATOM 1174 CG MET A 74 -14.834 5.441 -1.679 1.00 0.00 C ATOM 1175 SD MET A 74 -14.111 5.659 -0.040 1.00 0.00 S ATOM 1176 CE MET A 74 -14.709 4.191 0.793 1.00 0.00 C ATOM 0 H MET A 74 -16.444 3.704 -4.137 1.00 0.00 H new ATOM 0 HA MET A 74 -13.853 5.119 -4.314 1.00 0.00 H new ATOM 0 HB2 MET A 74 -14.769 3.330 -2.030 1.00 0.00 H new ATOM 0 HB3 MET A 74 -13.215 4.128 -2.166 1.00 0.00 H new ATOM 0 HG2 MET A 74 -14.649 6.334 -2.276 1.00 0.00 H new ATOM 0 HG3 MET A 74 -15.915 5.338 -1.585 1.00 0.00 H new ATOM 0 HE1 MET A 74 -14.390 4.208 1.835 1.00 0.00 H new ATOM 0 HE2 MET A 74 -15.798 4.165 0.748 1.00 0.00 H new ATOM 0 HE3 MET A 74 -14.304 3.305 0.304 1.00 0.00 H new ATOM 1186 N VAL A 75 -12.751 3.072 -5.193 1.00 0.00 N ATOM 1187 CA VAL A 75 -12.143 1.909 -5.833 1.00 0.00 C ATOM 1188 C VAL A 75 -10.921 1.431 -5.051 1.00 0.00 C ATOM 1189 O VAL A 75 -9.906 2.129 -4.979 1.00 0.00 O ATOM 1190 CB VAL A 75 -11.725 2.215 -7.290 1.00 0.00 C ATOM 1191 CG1 VAL A 75 -11.296 0.942 -8.006 1.00 0.00 C ATOM 1192 CG2 VAL A 75 -12.858 2.899 -8.043 1.00 0.00 C ATOM 0 H VAL A 75 -12.209 3.932 -5.281 1.00 0.00 H new ATOM 0 HA VAL A 75 -12.898 1.123 -5.842 1.00 0.00 H new ATOM 0 HB VAL A 75 -10.873 2.895 -7.264 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -11.006 1.180 -9.029 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -10.449 0.498 -7.483 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -12.125 0.235 -8.019 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -12.543 3.105 -9.066 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -13.731 2.247 -8.057 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -13.112 3.835 -7.546 1.00 0.00 H new ATOM 1202 N VAL A 76 -11.031 0.239 -4.464 1.00 0.00 N ATOM 1203 CA VAL A 76 -9.939 -0.340 -3.679 1.00 0.00 C ATOM 1204 C VAL A 76 -9.321 -1.555 -4.375 1.00 0.00 C ATOM 1205 O VAL A 76 -9.796 -1.988 -5.428 1.00 0.00 O ATOM 1206 CB VAL A 76 -10.414 -0.753 -2.266 1.00 0.00 C ATOM 1207 CG1 VAL A 76 -10.773 0.474 -1.443 1.00 0.00 C ATOM 1208 CG2 VAL A 76 -11.592 -1.712 -2.346 1.00 0.00 C ATOM 0 H VAL A 76 -11.865 -0.345 -4.517 1.00 0.00 H new ATOM 0 HA VAL A 76 -9.180 0.438 -3.589 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.593 -1.271 -1.770 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -11.105 0.163 -0.452 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -9.898 1.117 -1.348 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -11.574 1.023 -1.938 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -11.906 -1.987 -1.339 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -12.420 -1.229 -2.866 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -11.295 -2.608 -2.891 1.00 0.00 H new ATOM 1218 N GLN A 77 -8.256 -2.098 -3.779 1.00 0.00 N ATOM 1219 CA GLN A 77 -7.567 -3.262 -4.336 1.00 0.00 C ATOM 1220 C GLN A 77 -7.999 -4.546 -3.627 1.00 0.00 C ATOM 1221 O GLN A 77 -8.095 -4.581 -2.399 1.00 0.00 O ATOM 1222 CB GLN A 77 -6.049 -3.086 -4.221 1.00 0.00 C ATOM 1223 CG GLN A 77 -5.449 -2.216 -5.316 1.00 0.00 C ATOM 1224 CD GLN A 77 -4.849 -0.929 -4.781 1.00 0.00 C ATOM 1225 OE1 GLN A 77 -5.415 -0.283 -3.899 1.00 0.00 O ATOM 1226 NE2 GLN A 77 -3.695 -0.547 -5.314 1.00 0.00 N ATOM 0 H GLN A 77 -7.853 -1.749 -2.910 1.00 0.00 H new ATOM 0 HA GLN A 77 -7.838 -3.343 -5.389 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -5.816 -2.646 -3.251 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -5.575 -4.067 -4.248 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -4.678 -2.780 -5.841 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -6.221 -1.975 -6.047 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -3.259 -1.111 -6.043 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -3.245 0.311 -4.994 1.00 0.00 H new ATOM 1321 N THR B 1 -14.472 -4.919 -7.419 1.00 0.00 N ATOM 1322 CA THR B 1 -13.649 -4.237 -6.375 1.00 0.00 C ATOM 1323 C THR B 1 -13.981 -2.742 -6.288 1.00 0.00 C ATOM 1324 O THR B 1 -13.084 -1.902 -6.178 1.00 0.00 O ATOM 1325 CB THR B 1 -12.159 -4.435 -6.707 1.00 0.00 C ATOM 1326 OG1 THR B 1 -11.963 -5.560 -7.555 1.00 0.00 O ATOM 1327 CG2 THR B 1 -11.295 -4.628 -5.479 1.00 0.00 C ATOM 0 H1 THR B 1 -13.902 -5.653 -7.886 1.00 0.00 H new ATOM 0 H2 THR B 1 -15.303 -5.357 -6.974 1.00 0.00 H new ATOM 0 H3 THR B 1 -14.784 -4.222 -8.125 1.00 0.00 H new ATOM 0 HA THR B 1 -13.876 -4.678 -5.404 1.00 0.00 H new ATOM 0 HB THR B 1 -11.857 -3.516 -7.208 1.00 0.00 H new ATOM 0 HG1 THR B 1 -11.008 -5.660 -7.750 1.00 0.00 H new ATOM 0 HG21 THR B 1 -10.257 -4.762 -5.782 1.00 0.00 H new ATOM 0 HG22 THR B 1 -11.375 -3.751 -4.836 1.00 0.00 H new ATOM 0 HG23 THR B 1 -11.630 -5.510 -4.933 1.00 0.00 H new ATOM 1337 N LYS B 2 -15.277 -2.413 -6.334 1.00 0.00 N ATOM 1338 CA LYS B 2 -15.719 -1.023 -6.258 1.00 0.00 C ATOM 1339 C LYS B 2 -16.744 -0.839 -5.143 1.00 0.00 C ATOM 1340 O LYS B 2 -17.655 -1.653 -4.984 1.00 0.00 O ATOM 1341 CB LYS B 2 -16.320 -0.578 -7.594 1.00 0.00 C ATOM 1342 CG LYS B 2 -15.319 0.105 -8.514 1.00 0.00 C ATOM 1343 CD LYS B 2 -15.514 -0.312 -9.963 1.00 0.00 C ATOM 1344 CE LYS B 2 -15.105 -1.761 -10.188 1.00 0.00 C ATOM 1345 NZ LYS B 2 -14.334 -1.941 -11.450 1.00 0.00 N ATOM 0 H LYS B 2 -16.034 -3.091 -6.423 1.00 0.00 H new ATOM 0 HA LYS B 2 -14.849 -0.405 -6.037 1.00 0.00 H new ATOM 0 HB2 LYS B 2 -16.735 -1.447 -8.104 1.00 0.00 H new ATOM 0 HB3 LYS B 2 -17.148 0.104 -7.401 1.00 0.00 H new ATOM 0 HG2 LYS B 2 -15.425 1.186 -8.429 1.00 0.00 H new ATOM 0 HG3 LYS B 2 -14.306 -0.142 -8.197 1.00 0.00 H new ATOM 0 HD2 LYS B 2 -16.559 -0.181 -10.243 1.00 0.00 H new ATOM 0 HD3 LYS B 2 -14.926 0.338 -10.612 1.00 0.00 H new ATOM 0 HE2 LYS B 2 -14.503 -2.101 -9.345 1.00 0.00 H new ATOM 0 HE3 LYS B 2 -15.996 -2.388 -10.217 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 -14.078 -2.943 -11.560 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 -14.916 -1.642 -12.258 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 -13.469 -1.364 -11.414 1.00 0.00 H new ATOM 1359 N VAL B 3 -16.585 0.237 -4.374 1.00 0.00 N ATOM 1360 CA VAL B 3 -17.488 0.539 -3.269 1.00 0.00 C ATOM 1361 C VAL B 3 -18.412 1.702 -3.618 1.00 0.00 C ATOM 1362 O VAL B 3 -17.954 2.754 -4.067 1.00 0.00 O ATOM 1363 CB VAL B 3 -16.707 0.891 -1.984 1.00 0.00 C ATOM 1364 CG1 VAL B 3 -17.658 1.109 -0.815 1.00 0.00 C ATOM 1365 CG2 VAL B 3 -15.690 -0.196 -1.659 1.00 0.00 C ATOM 0 H VAL B 3 -15.834 0.916 -4.499 1.00 0.00 H new ATOM 0 HA VAL B 3 -18.082 -0.357 -3.092 1.00 0.00 H new ATOM 0 HB VAL B 3 -16.167 1.822 -2.158 1.00 0.00 H new ATOM 0 HG11 VAL B 3 -17.085 1.356 0.079 1.00 0.00 H new ATOM 0 HG12 VAL B 3 -18.338 1.928 -1.047 1.00 0.00 H new ATOM 0 HG13 VAL B 3 -18.232 0.199 -0.638 1.00 0.00 H new ATOM 0 HG21 VAL B 3 -15.150 0.071 -0.750 1.00 0.00 H new ATOM 0 HG22 VAL B 3 -16.206 -1.144 -1.509 1.00 0.00 H new ATOM 0 HG23 VAL B 3 -14.985 -0.293 -2.485 1.00 0.00 H new ATOM 1375 N THR B 4 -19.712 1.509 -3.404 1.00 0.00 N ATOM 1376 CA THR B 4 -20.696 2.547 -3.691 1.00 0.00 C ATOM 1377 C THR B 4 -21.578 2.804 -2.468 1.00 0.00 C ATOM 1378 O THR B 4 -22.450 1.999 -2.143 1.00 0.00 O ATOM 1379 CB THR B 4 -21.563 2.155 -4.895 1.00 0.00 C ATOM 1380 OG1 THR B 4 -20.857 1.303 -5.787 1.00 0.00 O ATOM 1381 CG2 THR B 4 -22.049 3.346 -5.693 1.00 0.00 C ATOM 0 H THR B 4 -20.107 0.644 -3.033 1.00 0.00 H new ATOM 0 HA THR B 4 -20.160 3.464 -3.934 1.00 0.00 H new ATOM 0 HB THR B 4 -22.423 1.641 -4.465 1.00 0.00 H new ATOM 0 HG1 THR B 4 -21.435 1.069 -6.543 1.00 0.00 H new ATOM 0 HG21 THR B 4 -22.656 3.000 -6.530 1.00 0.00 H new ATOM 0 HG22 THR B 4 -22.649 3.993 -5.053 1.00 0.00 H new ATOM 0 HG23 THR B 4 -21.193 3.904 -6.072 1.00 0.00 H new ATOM 1389 N LEU B 5 -21.340 3.932 -1.801 1.00 0.00 N ATOM 1390 CA LEU B 5 -22.105 4.312 -0.613 1.00 0.00 C ATOM 1391 C LEU B 5 -23.206 5.306 -0.971 1.00 0.00 C ATOM 1392 O LEU B 5 -23.151 5.952 -2.018 1.00 0.00 O ATOM 1393 CB LEU B 5 -21.184 4.924 0.446 1.00 0.00 C ATOM 1394 CG LEU B 5 -20.150 3.970 1.051 1.00 0.00 C ATOM 1395 CD1 LEU B 5 -19.287 4.704 2.067 1.00 0.00 C ATOM 1396 CD2 LEU B 5 -20.832 2.766 1.694 1.00 0.00 C ATOM 0 H LEU B 5 -20.619 4.603 -2.065 1.00 0.00 H new ATOM 0 HA LEU B 5 -22.564 3.410 -0.209 1.00 0.00 H new ATOM 0 HB2 LEU B 5 -20.657 5.768 0.000 1.00 0.00 H new ATOM 0 HB3 LEU B 5 -21.800 5.323 1.252 1.00 0.00 H new ATOM 0 HG LEU B 5 -19.509 3.605 0.249 1.00 0.00 H new ATOM 0 HD11 LEU B 5 -18.556 4.014 2.489 1.00 0.00 H new ATOM 0 HD12 LEU B 5 -18.768 5.527 1.576 1.00 0.00 H new ATOM 0 HD13 LEU B 5 -19.918 5.097 2.864 1.00 0.00 H new ATOM 0 HD21 LEU B 5 -20.077 2.103 2.117 1.00 0.00 H new ATOM 0 HD22 LEU B 5 -21.500 3.106 2.485 1.00 0.00 H new ATOM 0 HD23 LEU B 5 -21.407 2.228 0.940 1.00 0.00 H new ATOM 1408 N VAL B 6 -24.203 5.428 -0.096 1.00 0.00 N ATOM 1409 CA VAL B 6 -25.312 6.350 -0.325 1.00 0.00 C ATOM 1410 C VAL B 6 -25.469 7.321 0.844 1.00 0.00 C ATOM 1411 O VAL B 6 -26.016 6.966 1.889 1.00 0.00 O ATOM 1412 CB VAL B 6 -26.641 5.599 -0.544 1.00 0.00 C ATOM 1413 CG1 VAL B 6 -27.739 6.567 -0.966 1.00 0.00 C ATOM 1414 CG2 VAL B 6 -26.469 4.491 -1.576 1.00 0.00 C ATOM 0 H VAL B 6 -24.265 4.901 0.775 1.00 0.00 H new ATOM 0 HA VAL B 6 -25.074 6.910 -1.229 1.00 0.00 H new ATOM 0 HB VAL B 6 -26.936 5.140 0.400 1.00 0.00 H new ATOM 0 HG11 VAL B 6 -28.669 6.019 -1.116 1.00 0.00 H new ATOM 0 HG12 VAL B 6 -27.881 7.317 -0.188 1.00 0.00 H new ATOM 0 HG13 VAL B 6 -27.453 7.058 -1.896 1.00 0.00 H new ATOM 0 HG21 VAL B 6 -27.418 3.973 -1.716 1.00 0.00 H new ATOM 0 HG22 VAL B 6 -26.148 4.923 -2.524 1.00 0.00 H new ATOM 0 HG23 VAL B 6 -25.717 3.783 -1.227 1.00 0.00 H new ATOM 1424 N LYS B 7 -24.986 8.549 0.659 1.00 0.00 N ATOM 1425 CA LYS B 7 -25.072 9.576 1.697 1.00 0.00 C ATOM 1426 C LYS B 7 -26.392 10.337 1.608 1.00 0.00 C ATOM 1427 O LYS B 7 -26.793 10.779 0.530 1.00 0.00 O ATOM 1428 CB LYS B 7 -23.904 10.553 1.578 1.00 0.00 C ATOM 1429 CG LYS B 7 -23.509 11.205 2.891 1.00 0.00 C ATOM 1430 CD LYS B 7 -23.847 12.687 2.897 1.00 0.00 C ATOM 1431 CE LYS B 7 -22.703 13.525 2.342 1.00 0.00 C ATOM 1432 NZ LYS B 7 -22.593 14.848 3.022 1.00 0.00 N ATOM 0 H LYS B 7 -24.531 8.857 -0.200 1.00 0.00 H new ATOM 0 HA LYS B 7 -25.025 9.077 2.665 1.00 0.00 H new ATOM 0 HB2 LYS B 7 -23.041 10.024 1.172 1.00 0.00 H new ATOM 0 HB3 LYS B 7 -24.166 11.332 0.862 1.00 0.00 H new ATOM 0 HG2 LYS B 7 -24.023 10.709 3.714 1.00 0.00 H new ATOM 0 HG3 LYS B 7 -22.440 11.073 3.057 1.00 0.00 H new ATOM 0 HD2 LYS B 7 -24.745 12.858 2.304 1.00 0.00 H new ATOM 0 HD3 LYS B 7 -24.072 13.005 3.915 1.00 0.00 H new ATOM 0 HE2 LYS B 7 -21.766 12.980 2.457 1.00 0.00 H new ATOM 0 HE3 LYS B 7 -22.853 13.679 1.273 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -22.041 15.499 2.428 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 -23.544 15.240 3.174 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 -22.117 14.729 3.939 1.00 0.00 H new ATOM 1532 N GLU B 13 -23.731 10.142 8.504 1.00 0.00 N ATOM 1533 CA GLU B 13 -22.658 10.301 7.527 1.00 0.00 C ATOM 1534 C GLU B 13 -22.028 8.948 7.180 1.00 0.00 C ATOM 1535 O GLU B 13 -22.453 7.904 7.682 1.00 0.00 O ATOM 1536 CB GLU B 13 -21.584 11.256 8.067 1.00 0.00 C ATOM 1537 CG GLU B 13 -21.487 12.562 7.295 1.00 0.00 C ATOM 1538 CD GLU B 13 -20.792 12.401 5.956 1.00 0.00 C ATOM 1539 OE1 GLU B 13 -19.671 11.849 5.926 1.00 0.00 O ATOM 1540 OE2 GLU B 13 -21.370 12.822 4.935 1.00 0.00 O ATOM 0 HA GLU B 13 -23.087 10.724 6.619 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -21.799 11.477 9.113 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -20.617 10.754 8.039 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -22.489 12.959 7.134 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -20.946 13.294 7.895 1.00 0.00 H new ATOM 1547 N TYR B 14 -21.011 8.974 6.319 1.00 0.00 N ATOM 1548 CA TYR B 14 -20.319 7.755 5.906 1.00 0.00 C ATOM 1549 C TYR B 14 -19.714 7.030 7.106 1.00 0.00 C ATOM 1550 O TYR B 14 -19.700 5.797 7.152 1.00 0.00 O ATOM 1551 CB TYR B 14 -19.223 8.084 4.893 1.00 0.00 C ATOM 1552 CG TYR B 14 -19.752 8.640 3.590 1.00 0.00 C ATOM 1553 CD1 TYR B 14 -20.534 7.861 2.744 1.00 0.00 C ATOM 1554 CD2 TYR B 14 -19.459 9.939 3.201 1.00 0.00 C ATOM 1555 CE1 TYR B 14 -21.011 8.363 1.552 1.00 0.00 C ATOM 1556 CE2 TYR B 14 -19.929 10.449 2.006 1.00 0.00 C ATOM 1557 CZ TYR B 14 -20.703 9.659 1.186 1.00 0.00 C ATOM 1558 OH TYR B 14 -21.162 10.160 -0.011 1.00 0.00 O ATOM 0 H TYR B 14 -20.648 9.827 5.894 1.00 0.00 H new ATOM 0 HA TYR B 14 -21.052 7.096 5.441 1.00 0.00 H new ATOM 0 HB2 TYR B 14 -18.536 8.806 5.335 1.00 0.00 H new ATOM 0 HB3 TYR B 14 -18.647 7.182 4.687 1.00 0.00 H new ATOM 0 HD1 TYR B 14 -20.772 6.846 3.026 1.00 0.00 H new ATOM 0 HD2 TYR B 14 -18.854 10.562 3.843 1.00 0.00 H new ATOM 0 HE1 TYR B 14 -21.622 7.747 0.908 1.00 0.00 H new ATOM 0 HE2 TYR B 14 -19.691 11.462 1.717 1.00 0.00 H new ATOM 0 HH TYR B 14 -21.846 9.561 -0.376 1.00 0.00 H new ATOM 1568 N GLY B 15 -19.214 7.806 8.074 1.00 0.00 N ATOM 1569 CA GLY B 15 -18.616 7.232 9.265 1.00 0.00 C ATOM 1570 C GLY B 15 -17.464 6.296 8.954 1.00 0.00 C ATOM 1571 O GLY B 15 -17.422 5.173 9.457 1.00 0.00 O ATOM 0 H GLY B 15 -19.215 8.826 8.049 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -18.261 8.035 9.910 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -19.379 6.689 9.823 1.00 0.00 H new ATOM 1575 N LEU B 16 -16.529 6.751 8.124 1.00 0.00 N ATOM 1576 CA LEU B 16 -15.374 5.937 7.755 1.00 0.00 C ATOM 1577 C LEU B 16 -14.070 6.699 7.975 1.00 0.00 C ATOM 1578 O LEU B 16 -13.936 7.854 7.564 1.00 0.00 O ATOM 1579 CB LEU B 16 -15.475 5.471 6.296 1.00 0.00 C ATOM 1580 CG LEU B 16 -15.842 6.557 5.276 1.00 0.00 C ATOM 1581 CD1 LEU B 16 -14.597 7.283 4.791 1.00 0.00 C ATOM 1582 CD2 LEU B 16 -16.595 5.950 4.101 1.00 0.00 C ATOM 0 H LEU B 16 -16.548 7.676 7.695 1.00 0.00 H new ATOM 0 HA LEU B 16 -15.371 5.059 8.401 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -14.519 5.034 6.006 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -16.219 4.677 6.238 1.00 0.00 H new ATOM 0 HG LEU B 16 -16.491 7.282 5.767 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -14.880 8.049 4.069 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -14.096 7.751 5.638 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -13.921 6.570 4.318 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -16.848 6.734 3.387 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -15.968 5.203 3.614 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -17.509 5.477 4.460 1.00 0.00 H new ATOM 1594 N ARG B 17 -13.111 6.041 8.620 1.00 0.00 N ATOM 1595 CA ARG B 17 -11.809 6.640 8.891 1.00 0.00 C ATOM 1596 C ARG B 17 -10.854 6.378 7.733 1.00 0.00 C ATOM 1597 O ARG B 17 -10.682 5.234 7.309 1.00 0.00 O ATOM 1598 CB ARG B 17 -11.221 6.082 10.190 1.00 0.00 C ATOM 1599 CG ARG B 17 -10.910 7.154 11.224 1.00 0.00 C ATOM 1600 CD ARG B 17 -9.529 6.965 11.832 1.00 0.00 C ATOM 1601 NE ARG B 17 -9.580 6.839 13.290 1.00 0.00 N ATOM 1602 CZ ARG B 17 -9.894 5.711 13.934 1.00 0.00 C ATOM 1603 NH1 ARG B 17 -10.202 4.610 13.254 1.00 0.00 N ATOM 1604 NH2 ARG B 17 -9.906 5.685 15.263 1.00 0.00 N ATOM 0 H ARG B 17 -13.213 5.087 8.966 1.00 0.00 H new ATOM 0 HA ARG B 17 -11.943 7.716 9.002 1.00 0.00 H new ATOM 0 HB2 ARG B 17 -11.922 5.367 10.619 1.00 0.00 H new ATOM 0 HB3 ARG B 17 -10.307 5.534 9.960 1.00 0.00 H new ATOM 0 HG2 ARG B 17 -10.971 8.138 10.758 1.00 0.00 H new ATOM 0 HG3 ARG B 17 -11.662 7.128 12.013 1.00 0.00 H new ATOM 0 HD2 ARG B 17 -9.066 6.074 11.408 1.00 0.00 H new ATOM 0 HD3 ARG B 17 -8.897 7.811 11.564 1.00 0.00 H new ATOM 0 HE ARG B 17 -9.362 7.664 13.849 1.00 0.00 H new ATOM 0 HH11 ARG B 17 -10.200 4.623 12.234 1.00 0.00 H new ATOM 0 HH12 ARG B 17 -10.441 3.753 13.753 1.00 0.00 H new ATOM 0 HH21 ARG B 17 -9.675 6.526 15.792 1.00 0.00 H new ATOM 0 HH22 ARG B 17 -10.146 4.824 15.754 1.00 0.00 H new ATOM 1618 N LEU B 18 -10.238 7.441 7.219 1.00 0.00 N ATOM 1619 CA LEU B 18 -9.304 7.316 6.105 1.00 0.00 C ATOM 1620 C LEU B 18 -7.947 7.922 6.444 1.00 0.00 C ATOM 1621 O LEU B 18 -7.850 8.863 7.236 1.00 0.00 O ATOM 1622 CB LEU B 18 -9.878 7.976 4.849 1.00 0.00 C ATOM 1623 CG LEU B 18 -10.158 7.013 3.694 1.00 0.00 C ATOM 1624 CD1 LEU B 18 -11.445 6.243 3.943 1.00 0.00 C ATOM 1625 CD2 LEU B 18 -10.230 7.760 2.373 1.00 0.00 C ATOM 0 H LEU B 18 -10.369 8.395 7.556 1.00 0.00 H new ATOM 0 HA LEU B 18 -9.159 6.253 5.913 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -10.805 8.485 5.113 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -9.181 8.741 4.506 1.00 0.00 H new ATOM 0 HG LEU B 18 -9.335 6.301 3.637 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -11.629 5.563 3.111 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -11.354 5.671 4.866 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -12.276 6.942 4.030 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -10.430 7.055 1.567 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -11.030 8.499 2.416 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -9.281 8.264 2.188 1.00 0.00 H new ATOM 1637 N ALA B 19 -6.901 7.369 5.832 1.00 0.00 N ATOM 1638 CA ALA B 19 -5.534 7.837 6.052 1.00 0.00 C ATOM 1639 C ALA B 19 -4.703 7.717 4.775 1.00 0.00 C ATOM 1640 O ALA B 19 -5.196 7.251 3.745 1.00 0.00 O ATOM 1641 CB ALA B 19 -4.889 7.055 7.187 1.00 0.00 C ATOM 0 H ALA B 19 -6.976 6.592 5.176 1.00 0.00 H new ATOM 0 HA ALA B 19 -5.571 8.890 6.329 1.00 0.00 H new ATOM 0 HB1 ALA B 19 -3.871 7.412 7.342 1.00 0.00 H new ATOM 0 HB2 ALA B 19 -5.466 7.197 8.101 1.00 0.00 H new ATOM 0 HB3 ALA B 19 -4.867 5.995 6.932 1.00 0.00 H new ATOM 1647 N SER B 20 -3.441 8.145 4.842 1.00 0.00 N ATOM 1648 CA SER B 20 -2.555 8.082 3.682 1.00 0.00 C ATOM 1649 C SER B 20 -1.223 7.418 4.024 1.00 0.00 C ATOM 1650 O SER B 20 -0.775 7.446 5.173 1.00 0.00 O ATOM 1651 CB SER B 20 -2.309 9.485 3.117 1.00 0.00 C ATOM 1652 OG SER B 20 -1.429 10.229 3.943 1.00 0.00 O ATOM 0 H SER B 20 -3.013 8.536 5.681 1.00 0.00 H new ATOM 0 HA SER B 20 -3.051 7.472 2.927 1.00 0.00 H new ATOM 0 HB2 SER B 20 -1.890 9.406 2.114 1.00 0.00 H new ATOM 0 HB3 SER B 20 -3.258 10.013 3.025 1.00 0.00 H new ATOM 0 HG SER B 20 -1.290 11.118 3.556 1.00 0.00 H new ATOM 1658 N HIS B 21 -0.596 6.828 3.007 1.00 0.00 N ATOM 1659 CA HIS B 21 0.690 6.156 3.169 1.00 0.00 C ATOM 1660 C HIS B 21 1.727 6.749 2.215 1.00 0.00 C ATOM 1661 O HIS B 21 1.437 7.699 1.483 1.00 0.00 O ATOM 1662 CB HIS B 21 0.533 4.654 2.902 1.00 0.00 C ATOM 1663 CG HIS B 21 0.630 3.805 4.131 1.00 0.00 C ATOM 1664 ND1 HIS B 21 1.573 2.813 4.291 1.00 0.00 N ATOM 1665 CD2 HIS B 21 -0.113 3.799 5.261 1.00 0.00 C ATOM 1666 CE1 HIS B 21 1.403 2.232 5.464 1.00 0.00 C ATOM 1667 NE2 HIS B 21 0.387 2.812 6.074 1.00 0.00 N ATOM 0 H HIS B 21 -0.963 6.803 2.055 1.00 0.00 H new ATOM 0 HA HIS B 21 1.033 6.304 4.193 1.00 0.00 H new ATOM 0 HB2 HIS B 21 -0.432 4.479 2.427 1.00 0.00 H new ATOM 0 HB3 HIS B 21 1.299 4.339 2.194 1.00 0.00 H new ATOM 0 HD2 HIS B 21 -0.946 4.450 5.483 1.00 0.00 H new ATOM 0 HE1 HIS B 21 1.995 1.419 5.858 1.00 0.00 H new ATOM 0 HE2 HIS B 21 0.031 2.567 6.998 1.00 0.00 H new ATOM 1676 N ILE B 22 2.934 6.183 2.221 1.00 0.00 N ATOM 1677 CA ILE B 22 4.008 6.657 1.352 1.00 0.00 C ATOM 1678 C ILE B 22 4.621 5.507 0.559 1.00 0.00 C ATOM 1679 O ILE B 22 4.797 4.408 1.083 1.00 0.00 O ATOM 1680 CB ILE B 22 5.115 7.364 2.162 1.00 0.00 C ATOM 1681 CG1 ILE B 22 4.518 8.476 3.030 1.00 0.00 C ATOM 1682 CG2 ILE B 22 6.182 7.927 1.235 1.00 0.00 C ATOM 1683 CD1 ILE B 22 3.915 9.617 2.238 1.00 0.00 C ATOM 0 H ILE B 22 3.191 5.397 2.818 1.00 0.00 H new ATOM 0 HA ILE B 22 3.565 7.373 0.660 1.00 0.00 H new ATOM 0 HB ILE B 22 5.583 6.629 2.816 1.00 0.00 H new ATOM 0 HG12 ILE B 22 3.750 8.048 3.674 1.00 0.00 H new ATOM 0 HG13 ILE B 22 5.296 8.871 3.683 1.00 0.00 H new ATOM 0 HG21 ILE B 22 6.953 8.421 1.826 1.00 0.00 H new ATOM 0 HG22 ILE B 22 6.629 7.116 0.660 1.00 0.00 H new ATOM 0 HG23 ILE B 22 5.729 8.647 0.554 1.00 0.00 H new ATOM 0 HD11 ILE B 22 3.514 10.363 2.923 1.00 0.00 H new ATOM 0 HD12 ILE B 22 4.684 10.073 1.614 1.00 0.00 H new ATOM 0 HD13 ILE B 22 3.113 9.237 1.605 1.00 0.00 H new ATOM 1695 N PHE B 23 4.941 5.770 -0.708 1.00 0.00 N ATOM 1696 CA PHE B 23 5.536 4.758 -1.582 1.00 0.00 C ATOM 1697 C PHE B 23 6.460 5.402 -2.620 1.00 0.00 C ATOM 1698 O PHE B 23 6.611 6.625 -2.657 1.00 0.00 O ATOM 1699 CB PHE B 23 4.435 3.953 -2.285 1.00 0.00 C ATOM 1700 CG PHE B 23 3.722 4.725 -3.360 1.00 0.00 C ATOM 1701 CD1 PHE B 23 2.966 5.839 -3.037 1.00 0.00 C ATOM 1702 CD2 PHE B 23 3.817 4.347 -4.690 1.00 0.00 C ATOM 1703 CE1 PHE B 23 2.319 6.560 -4.017 1.00 0.00 C ATOM 1704 CE2 PHE B 23 3.171 5.068 -5.676 1.00 0.00 C ATOM 1705 CZ PHE B 23 2.420 6.177 -5.337 1.00 0.00 C ATOM 0 H PHE B 23 4.798 6.677 -1.153 1.00 0.00 H new ATOM 0 HA PHE B 23 6.132 4.086 -0.965 1.00 0.00 H new ATOM 0 HB2 PHE B 23 4.874 3.057 -2.723 1.00 0.00 H new ATOM 0 HB3 PHE B 23 3.708 3.622 -1.543 1.00 0.00 H new ATOM 0 HD1 PHE B 23 2.882 6.146 -2.005 1.00 0.00 H new ATOM 0 HD2 PHE B 23 4.402 3.480 -4.959 1.00 0.00 H new ATOM 0 HE1 PHE B 23 1.732 7.426 -3.750 1.00 0.00 H new ATOM 0 HE2 PHE B 23 3.253 4.765 -6.709 1.00 0.00 H new ATOM 0 HZ PHE B 23 1.913 6.743 -6.105 1.00 0.00 H new ATOM 1715 N VAL B 24 7.074 4.572 -3.465 1.00 0.00 N ATOM 1716 CA VAL B 24 7.977 5.062 -4.504 1.00 0.00 C ATOM 1717 C VAL B 24 7.349 4.921 -5.890 1.00 0.00 C ATOM 1718 O VAL B 24 7.067 3.808 -6.344 1.00 0.00 O ATOM 1719 CB VAL B 24 9.327 4.310 -4.480 1.00 0.00 C ATOM 1720 CG1 VAL B 24 10.334 4.973 -5.412 1.00 0.00 C ATOM 1721 CG2 VAL B 24 9.875 4.240 -3.062 1.00 0.00 C ATOM 0 H VAL B 24 6.962 3.558 -3.449 1.00 0.00 H new ATOM 0 HA VAL B 24 8.156 6.117 -4.296 1.00 0.00 H new ATOM 0 HB VAL B 24 9.156 3.293 -4.834 1.00 0.00 H new ATOM 0 HG11 VAL B 24 11.276 4.426 -5.378 1.00 0.00 H new ATOM 0 HG12 VAL B 24 9.947 4.966 -6.431 1.00 0.00 H new ATOM 0 HG13 VAL B 24 10.500 6.002 -5.095 1.00 0.00 H new ATOM 0 HG21 VAL B 24 10.826 3.707 -3.065 1.00 0.00 H new ATOM 0 HG22 VAL B 24 10.026 5.250 -2.680 1.00 0.00 H new ATOM 0 HG23 VAL B 24 9.166 3.713 -2.423 1.00 0.00 H new ATOM 1731 N LYS B 25 7.142 6.057 -6.556 1.00 0.00 N ATOM 1732 CA LYS B 25 6.558 6.078 -7.897 1.00 0.00 C ATOM 1733 C LYS B 25 7.426 5.301 -8.887 1.00 0.00 C ATOM 1734 O LYS B 25 6.927 4.440 -9.614 1.00 0.00 O ATOM 1735 CB LYS B 25 6.383 7.523 -8.380 1.00 0.00 C ATOM 1736 CG LYS B 25 5.323 7.685 -9.459 1.00 0.00 C ATOM 1737 CD LYS B 25 3.990 8.123 -8.872 1.00 0.00 C ATOM 1738 CE LYS B 25 2.912 8.228 -9.941 1.00 0.00 C ATOM 1739 NZ LYS B 25 1.566 7.862 -9.415 1.00 0.00 N ATOM 0 H LYS B 25 7.372 6.979 -6.186 1.00 0.00 H new ATOM 0 HA LYS B 25 5.581 5.597 -7.845 1.00 0.00 H new ATOM 0 HB2 LYS B 25 6.121 8.152 -7.529 1.00 0.00 H new ATOM 0 HB3 LYS B 25 7.337 7.886 -8.763 1.00 0.00 H new ATOM 0 HG2 LYS B 25 5.658 8.420 -10.192 1.00 0.00 H new ATOM 0 HG3 LYS B 25 5.195 6.741 -9.989 1.00 0.00 H new ATOM 0 HD2 LYS B 25 3.677 7.411 -8.108 1.00 0.00 H new ATOM 0 HD3 LYS B 25 4.109 9.088 -8.379 1.00 0.00 H new ATOM 0 HE2 LYS B 25 2.885 9.246 -10.330 1.00 0.00 H new ATOM 0 HE3 LYS B 25 3.165 7.575 -10.776 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 0.861 7.947 -10.175 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 1.584 6.882 -9.067 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 1.313 8.501 -8.635 1.00 0.00 H new ATOM 1753 N GLU B 26 8.725 5.612 -8.908 1.00 0.00 N ATOM 1754 CA GLU B 26 9.668 4.942 -9.807 1.00 0.00 C ATOM 1755 C GLU B 26 11.096 5.430 -9.563 1.00 0.00 C ATOM 1756 O GLU B 26 11.306 6.511 -9.007 1.00 0.00 O ATOM 1757 CB GLU B 26 9.278 5.180 -11.274 1.00 0.00 C ATOM 1758 CG GLU B 26 10.113 4.386 -12.271 1.00 0.00 C ATOM 1759 CD GLU B 26 9.555 4.433 -13.683 1.00 0.00 C ATOM 1760 OE1 GLU B 26 9.091 5.514 -14.106 1.00 0.00 O ATOM 1761 OE2 GLU B 26 9.591 3.391 -14.369 1.00 0.00 O ATOM 0 H GLU B 26 9.148 6.324 -8.312 1.00 0.00 H new ATOM 0 HA GLU B 26 9.626 3.873 -9.599 1.00 0.00 H new ATOM 0 HB2 GLU B 26 8.228 4.921 -11.407 1.00 0.00 H new ATOM 0 HB3 GLU B 26 9.375 6.242 -11.498 1.00 0.00 H new ATOM 0 HG2 GLU B 26 11.131 4.776 -12.275 1.00 0.00 H new ATOM 0 HG3 GLU B 26 10.170 3.348 -11.943 1.00 0.00 H new ATOM 1768 N ILE B 27 12.074 4.631 -9.988 1.00 0.00 N ATOM 1769 CA ILE B 27 13.480 4.983 -9.822 1.00 0.00 C ATOM 1770 C ILE B 27 14.159 5.177 -11.178 1.00 0.00 C ATOM 1771 O ILE B 27 13.932 4.404 -12.111 1.00 0.00 O ATOM 1772 CB ILE B 27 14.250 3.910 -9.021 1.00 0.00 C ATOM 1773 CG1 ILE B 27 13.482 3.535 -7.749 1.00 0.00 C ATOM 1774 CG2 ILE B 27 15.644 4.411 -8.672 1.00 0.00 C ATOM 1775 CD1 ILE B 27 12.615 2.306 -7.903 1.00 0.00 C ATOM 0 H ILE B 27 11.916 3.735 -10.450 1.00 0.00 H new ATOM 0 HA ILE B 27 13.504 5.919 -9.264 1.00 0.00 H new ATOM 0 HB ILE B 27 14.346 3.018 -9.640 1.00 0.00 H new ATOM 0 HG12 ILE B 27 14.194 3.367 -6.941 1.00 0.00 H new ATOM 0 HG13 ILE B 27 12.855 4.376 -7.452 1.00 0.00 H new ATOM 0 HG21 ILE B 27 16.175 3.645 -8.108 1.00 0.00 H new ATOM 0 HG22 ILE B 27 16.191 4.632 -9.588 1.00 0.00 H new ATOM 0 HG23 ILE B 27 15.565 5.316 -8.070 1.00 0.00 H new ATOM 0 HD11 ILE B 27 12.103 2.102 -6.963 1.00 0.00 H new ATOM 0 HD12 ILE B 27 11.878 2.476 -8.688 1.00 0.00 H new ATOM 0 HD13 ILE B 27 13.238 1.452 -8.169 1.00 0.00 H new ATOM 1787 N SER B 28 14.992 6.212 -11.275 1.00 0.00 N ATOM 1788 CA SER B 28 15.709 6.513 -12.512 1.00 0.00 C ATOM 1789 C SER B 28 16.867 5.542 -12.726 1.00 0.00 C ATOM 1790 O SER B 28 17.499 5.096 -11.766 1.00 0.00 O ATOM 1791 CB SER B 28 16.235 7.952 -12.484 1.00 0.00 C ATOM 1792 OG SER B 28 15.184 8.876 -12.258 1.00 0.00 O ATOM 0 H SER B 28 15.187 6.857 -10.510 1.00 0.00 H new ATOM 0 HA SER B 28 15.010 6.402 -13.341 1.00 0.00 H new ATOM 0 HB2 SER B 28 16.986 8.053 -11.701 1.00 0.00 H new ATOM 0 HB3 SER B 28 16.727 8.181 -13.429 1.00 0.00 H new ATOM 0 HG SER B 28 15.546 9.786 -12.243 1.00 0.00 H new ATOM 1798 N GLN B 29 17.138 5.220 -13.990 1.00 0.00 N ATOM 1799 CA GLN B 29 18.221 4.299 -14.333 1.00 0.00 C ATOM 1800 C GLN B 29 19.585 4.924 -14.046 1.00 0.00 C ATOM 1801 O GLN B 29 19.756 6.140 -14.158 1.00 0.00 O ATOM 1802 CB GLN B 29 18.133 3.893 -15.808 1.00 0.00 C ATOM 1803 CG GLN B 29 17.355 2.608 -16.045 1.00 0.00 C ATOM 1804 CD GLN B 29 18.149 1.369 -15.673 1.00 0.00 C ATOM 1805 OE1 GLN B 29 19.189 1.083 -16.267 1.00 0.00 O ATOM 1806 NE2 GLN B 29 17.662 0.622 -14.687 1.00 0.00 N ATOM 0 H GLN B 29 16.623 5.583 -14.793 1.00 0.00 H new ATOM 0 HA GLN B 29 18.112 3.410 -13.712 1.00 0.00 H new ATOM 0 HB2 GLN B 29 17.663 4.700 -16.370 1.00 0.00 H new ATOM 0 HB3 GLN B 29 19.142 3.774 -16.203 1.00 0.00 H new ATOM 0 HG2 GLN B 29 16.433 2.633 -15.463 1.00 0.00 H new ATOM 0 HG3 GLN B 29 17.068 2.550 -17.095 1.00 0.00 H new ATOM 0 HE21 GLN B 29 16.797 0.894 -14.220 1.00 0.00 H new ATOM 0 HE22 GLN B 29 18.154 -0.223 -14.397 1.00 0.00 H new ATOM 1815 N ASP B 30 20.550 4.081 -13.674 1.00 0.00 N ATOM 1816 CA ASP B 30 21.906 4.538 -13.362 1.00 0.00 C ATOM 1817 C ASP B 30 21.896 5.536 -12.199 1.00 0.00 C ATOM 1818 O ASP B 30 22.608 6.542 -12.221 1.00 0.00 O ATOM 1819 CB ASP B 30 22.556 5.168 -14.601 1.00 0.00 C ATOM 1820 CG ASP B 30 24.023 4.803 -14.741 1.00 0.00 C ATOM 1821 OD1 ASP B 30 24.348 3.599 -14.656 1.00 0.00 O ATOM 1822 OD2 ASP B 30 24.846 5.720 -14.938 1.00 0.00 O ATOM 0 H ASP B 30 20.417 3.074 -13.581 1.00 0.00 H new ATOM 0 HA ASP B 30 22.494 3.671 -13.060 1.00 0.00 H new ATOM 0 HB2 ASP B 30 22.018 4.845 -15.492 1.00 0.00 H new ATOM 0 HB3 ASP B 30 22.459 6.252 -14.546 1.00 0.00 H new ATOM 1827 N SER B 31 21.083 5.246 -11.182 1.00 0.00 N ATOM 1828 CA SER B 31 20.977 6.111 -10.011 1.00 0.00 C ATOM 1829 C SER B 31 21.507 5.408 -8.763 1.00 0.00 C ATOM 1830 O SER B 31 21.884 4.234 -8.811 1.00 0.00 O ATOM 1831 CB SER B 31 19.518 6.537 -9.802 1.00 0.00 C ATOM 1832 OG SER B 31 18.765 5.513 -9.172 1.00 0.00 O ATOM 0 H SER B 31 20.489 4.418 -11.148 1.00 0.00 H new ATOM 0 HA SER B 31 21.585 6.999 -10.184 1.00 0.00 H new ATOM 0 HB2 SER B 31 19.485 7.441 -9.194 1.00 0.00 H new ATOM 0 HB3 SER B 31 19.068 6.783 -10.764 1.00 0.00 H new ATOM 0 HG SER B 31 18.266 5.010 -9.849 1.00 0.00 H new ATOM 1838 N LEU B 32 21.524 6.132 -7.642 1.00 0.00 N ATOM 1839 CA LEU B 32 21.998 5.577 -6.375 1.00 0.00 C ATOM 1840 C LEU B 32 21.183 4.344 -5.983 1.00 0.00 C ATOM 1841 O LEU B 32 21.729 3.375 -5.453 1.00 0.00 O ATOM 1842 CB LEU B 32 21.918 6.629 -5.265 1.00 0.00 C ATOM 1843 CG LEU B 32 22.980 7.729 -5.333 1.00 0.00 C ATOM 1844 CD1 LEU B 32 22.466 9.009 -4.692 1.00 0.00 C ATOM 1845 CD2 LEU B 32 24.264 7.268 -4.659 1.00 0.00 C ATOM 0 H LEU B 32 21.215 7.103 -7.587 1.00 0.00 H new ATOM 0 HA LEU B 32 23.038 5.279 -6.506 1.00 0.00 H new ATOM 0 HB2 LEU B 32 20.933 7.094 -5.298 1.00 0.00 H new ATOM 0 HB3 LEU B 32 22.001 6.125 -4.302 1.00 0.00 H new ATOM 0 HG LEU B 32 23.197 7.937 -6.381 1.00 0.00 H new ATOM 0 HD11 LEU B 32 23.235 9.779 -4.750 1.00 0.00 H new ATOM 0 HD12 LEU B 32 21.574 9.347 -5.219 1.00 0.00 H new ATOM 0 HD13 LEU B 32 22.220 8.819 -3.647 1.00 0.00 H new ATOM 0 HD21 LEU B 32 25.010 8.061 -4.716 1.00 0.00 H new ATOM 0 HD22 LEU B 32 24.062 7.033 -3.614 1.00 0.00 H new ATOM 0 HD23 LEU B 32 24.641 6.379 -5.164 1.00 0.00 H new ATOM 1857 N ALA B 33 19.876 4.385 -6.255 1.00 0.00 N ATOM 1858 CA ALA B 33 18.986 3.269 -5.939 1.00 0.00 C ATOM 1859 C ALA B 33 19.273 2.062 -6.831 1.00 0.00 C ATOM 1860 O ALA B 33 19.287 0.925 -6.358 1.00 0.00 O ATOM 1861 CB ALA B 33 17.532 3.692 -6.083 1.00 0.00 C ATOM 0 H ALA B 33 19.412 5.180 -6.694 1.00 0.00 H new ATOM 0 HA ALA B 33 19.170 2.978 -4.905 1.00 0.00 H new ATOM 0 HB1 ALA B 33 16.883 2.850 -5.844 1.00 0.00 H new ATOM 0 HB2 ALA B 33 17.323 4.516 -5.400 1.00 0.00 H new ATOM 0 HB3 ALA B 33 17.347 4.014 -7.108 1.00 0.00 H new ATOM 1867 N ALA B 34 19.503 2.318 -8.122 1.00 0.00 N ATOM 1868 CA ALA B 34 19.795 1.251 -9.081 1.00 0.00 C ATOM 1869 C ALA B 34 21.028 0.451 -8.656 1.00 0.00 C ATOM 1870 O ALA B 34 21.063 -0.771 -8.801 1.00 0.00 O ATOM 1871 CB ALA B 34 19.992 1.829 -10.474 1.00 0.00 C ATOM 0 H ALA B 34 19.492 3.254 -8.526 1.00 0.00 H new ATOM 0 HA ALA B 34 18.942 0.572 -9.101 1.00 0.00 H new ATOM 0 HB1 ALA B 34 20.208 1.023 -11.175 1.00 0.00 H new ATOM 0 HB2 ALA B 34 19.084 2.347 -10.785 1.00 0.00 H new ATOM 0 HB3 ALA B 34 20.825 2.532 -10.462 1.00 0.00 H new ATOM 1877 N ARG B 35 22.033 1.150 -8.125 1.00 0.00 N ATOM 1878 CA ARG B 35 23.263 0.508 -7.667 1.00 0.00 C ATOM 1879 C ARG B 35 23.059 -0.144 -6.298 1.00 0.00 C ATOM 1880 O ARG B 35 23.632 -1.197 -6.013 1.00 0.00 O ATOM 1881 CB ARG B 35 24.405 1.527 -7.594 1.00 0.00 C ATOM 1882 CG ARG B 35 25.388 1.429 -8.749 1.00 0.00 C ATOM 1883 CD ARG B 35 26.204 0.145 -8.683 1.00 0.00 C ATOM 1884 NE ARG B 35 27.587 0.341 -9.121 1.00 0.00 N ATOM 1885 CZ ARG B 35 28.592 -0.489 -8.824 1.00 0.00 C ATOM 1886 NH1 ARG B 35 28.375 -1.580 -8.091 1.00 0.00 N ATOM 1887 NH2 ARG B 35 29.819 -0.229 -9.263 1.00 0.00 N ATOM 0 H ARG B 35 22.017 2.162 -8.002 1.00 0.00 H new ATOM 0 HA ARG B 35 23.526 -0.268 -8.386 1.00 0.00 H new ATOM 0 HB2 ARG B 35 23.983 2.532 -7.573 1.00 0.00 H new ATOM 0 HB3 ARG B 35 24.944 1.388 -6.657 1.00 0.00 H new ATOM 0 HG2 ARG B 35 24.845 1.468 -9.694 1.00 0.00 H new ATOM 0 HG3 ARG B 35 26.058 2.288 -8.731 1.00 0.00 H new ATOM 0 HD2 ARG B 35 26.199 -0.233 -7.661 1.00 0.00 H new ATOM 0 HD3 ARG B 35 25.732 -0.615 -9.306 1.00 0.00 H new ATOM 0 HE ARG B 35 27.797 1.162 -9.688 1.00 0.00 H new ATOM 0 HH11 ARG B 35 27.436 -1.788 -7.751 1.00 0.00 H new ATOM 0 HH12 ARG B 35 29.148 -2.208 -7.869 1.00 0.00 H new ATOM 0 HH21 ARG B 35 29.993 0.603 -9.826 1.00 0.00 H new ATOM 0 HH22 ARG B 35 30.586 -0.862 -9.037 1.00 0.00 H new ATOM 1901 N ASP B 36 22.240 0.491 -5.454 1.00 0.00 N ATOM 1902 CA ASP B 36 21.958 -0.025 -4.115 1.00 0.00 C ATOM 1903 C ASP B 36 21.147 -1.319 -4.178 1.00 0.00 C ATOM 1904 O ASP B 36 21.428 -2.270 -3.448 1.00 0.00 O ATOM 1905 CB ASP B 36 21.198 1.021 -3.292 1.00 0.00 C ATOM 1906 CG ASP B 36 21.428 0.874 -1.798 1.00 0.00 C ATOM 1907 OD1 ASP B 36 22.603 0.845 -1.373 1.00 0.00 O ATOM 1908 OD2 ASP B 36 20.430 0.798 -1.052 1.00 0.00 O ATOM 0 H ASP B 36 21.761 1.364 -5.677 1.00 0.00 H new ATOM 0 HA ASP B 36 22.912 -0.241 -3.634 1.00 0.00 H new ATOM 0 HB2 ASP B 36 21.506 2.018 -3.606 1.00 0.00 H new ATOM 0 HB3 ASP B 36 20.132 0.937 -3.501 1.00 0.00 H new ATOM 1913 N GLY B 37 20.135 -1.342 -5.047 1.00 0.00 N ATOM 1914 CA GLY B 37 19.292 -2.520 -5.183 1.00 0.00 C ATOM 1915 C GLY B 37 18.347 -2.698 -4.005 1.00 0.00 C ATOM 1916 O GLY B 37 18.112 -3.821 -3.558 1.00 0.00 O ATOM 0 H GLY B 37 19.885 -0.565 -5.659 1.00 0.00 H new ATOM 0 HA2 GLY B 37 18.711 -2.443 -6.102 1.00 0.00 H new ATOM 0 HA3 GLY B 37 19.922 -3.405 -5.277 1.00 0.00 H new ATOM 1920 N ASN B 38 17.811 -1.584 -3.498 1.00 0.00 N ATOM 1921 CA ASN B 38 16.893 -1.618 -2.358 1.00 0.00 C ATOM 1922 C ASN B 38 15.553 -0.967 -2.703 1.00 0.00 C ATOM 1923 O ASN B 38 14.494 -1.514 -2.393 1.00 0.00 O ATOM 1924 CB ASN B 38 17.522 -0.920 -1.149 1.00 0.00 C ATOM 1925 CG ASN B 38 18.513 -1.809 -0.421 1.00 0.00 C ATOM 1926 OD1 ASN B 38 18.220 -2.333 0.654 1.00 0.00 O ATOM 1927 ND2 ASN B 38 19.694 -1.985 -1.004 1.00 0.00 N ATOM 0 H ASN B 38 17.997 -0.649 -3.859 1.00 0.00 H new ATOM 0 HA ASN B 38 16.706 -2.663 -2.110 1.00 0.00 H new ATOM 0 HB2 ASN B 38 18.026 -0.012 -1.479 1.00 0.00 H new ATOM 0 HB3 ASN B 38 16.736 -0.615 -0.459 1.00 0.00 H new ATOM 0 HD21 ASN B 38 20.399 -2.573 -0.560 1.00 0.00 H new ATOM 0 HD22 ASN B 38 19.895 -1.532 -1.895 1.00 0.00 H new ATOM 1934 N ILE B 39 15.606 0.203 -3.340 1.00 0.00 N ATOM 1935 CA ILE B 39 14.397 0.931 -3.725 1.00 0.00 C ATOM 1936 C ILE B 39 13.804 0.369 -5.017 1.00 0.00 C ATOM 1937 O ILE B 39 14.513 0.192 -6.009 1.00 0.00 O ATOM 1938 CB ILE B 39 14.680 2.437 -3.920 1.00 0.00 C ATOM 1939 CG1 ILE B 39 15.475 2.995 -2.735 1.00 0.00 C ATOM 1940 CG2 ILE B 39 13.377 3.207 -4.095 1.00 0.00 C ATOM 1941 CD1 ILE B 39 16.134 4.326 -3.023 1.00 0.00 C ATOM 0 H ILE B 39 16.476 0.668 -3.601 1.00 0.00 H new ATOM 0 HA ILE B 39 13.683 0.805 -2.911 1.00 0.00 H new ATOM 0 HB ILE B 39 15.278 2.558 -4.823 1.00 0.00 H new ATOM 0 HG12 ILE B 39 14.808 3.106 -1.880 1.00 0.00 H new ATOM 0 HG13 ILE B 39 16.241 2.274 -2.450 1.00 0.00 H new ATOM 0 HG21 ILE B 39 13.596 4.266 -4.231 1.00 0.00 H new ATOM 0 HG22 ILE B 39 12.847 2.831 -4.970 1.00 0.00 H new ATOM 0 HG23 ILE B 39 12.755 3.076 -3.209 1.00 0.00 H new ATOM 0 HD11 ILE B 39 16.679 4.661 -2.140 1.00 0.00 H new ATOM 0 HD12 ILE B 39 16.827 4.216 -3.857 1.00 0.00 H new ATOM 0 HD13 ILE B 39 15.372 5.062 -3.279 1.00 0.00 H new ATOM 1953 N GLN B 40 12.497 0.098 -4.998 1.00 0.00 N ATOM 1954 CA GLN B 40 11.802 -0.438 -6.167 1.00 0.00 C ATOM 1955 C GLN B 40 10.454 0.253 -6.371 1.00 0.00 C ATOM 1956 O GLN B 40 9.925 0.886 -5.456 1.00 0.00 O ATOM 1957 CB GLN B 40 11.590 -1.947 -6.020 1.00 0.00 C ATOM 1958 CG GLN B 40 11.621 -2.697 -7.343 1.00 0.00 C ATOM 1959 CD GLN B 40 12.091 -4.131 -7.190 1.00 0.00 C ATOM 1960 OE1 GLN B 40 13.250 -4.384 -6.856 1.00 0.00 O ATOM 1961 NE2 GLN B 40 11.195 -5.081 -7.434 1.00 0.00 N ATOM 0 H GLN B 40 11.899 0.242 -4.184 1.00 0.00 H new ATOM 0 HA GLN B 40 12.426 -0.247 -7.040 1.00 0.00 H new ATOM 0 HB2 GLN B 40 12.361 -2.352 -5.364 1.00 0.00 H new ATOM 0 HB3 GLN B 40 10.631 -2.125 -5.533 1.00 0.00 H new ATOM 0 HG2 GLN B 40 10.624 -2.690 -7.784 1.00 0.00 H new ATOM 0 HG3 GLN B 40 12.280 -2.175 -8.037 1.00 0.00 H new ATOM 0 HE21 GLN B 40 10.246 -4.828 -7.708 1.00 0.00 H new ATOM 0 HE22 GLN B 40 11.456 -6.063 -7.347 1.00 0.00 H new ATOM 1970 N GLU B 41 9.903 0.124 -7.579 1.00 0.00 N ATOM 1971 CA GLU B 41 8.614 0.733 -7.907 1.00 0.00 C ATOM 1972 C GLU B 41 7.482 0.038 -7.153 1.00 0.00 C ATOM 1973 O GLU B 41 7.368 -1.189 -7.185 1.00 0.00 O ATOM 1974 CB GLU B 41 8.346 0.659 -9.413 1.00 0.00 C ATOM 1975 CG GLU B 41 9.485 1.184 -10.274 1.00 0.00 C ATOM 1976 CD GLU B 41 9.695 0.354 -11.526 1.00 0.00 C ATOM 1977 OE1 GLU B 41 10.459 -0.632 -11.463 1.00 0.00 O ATOM 1978 OE2 GLU B 41 9.093 0.689 -12.567 1.00 0.00 O ATOM 0 H GLU B 41 10.329 -0.396 -8.346 1.00 0.00 H new ATOM 0 HA GLU B 41 8.654 1.780 -7.605 1.00 0.00 H new ATOM 0 HB2 GLU B 41 8.147 -0.378 -9.685 1.00 0.00 H new ATOM 0 HB3 GLU B 41 7.443 1.226 -9.639 1.00 0.00 H new ATOM 0 HG2 GLU B 41 9.277 2.216 -10.556 1.00 0.00 H new ATOM 0 HG3 GLU B 41 10.405 1.193 -9.689 1.00 0.00 H new ATOM 1985 N GLY B 42 6.652 0.829 -6.472 1.00 0.00 N ATOM 1986 CA GLY B 42 5.544 0.269 -5.712 1.00 0.00 C ATOM 1987 C GLY B 42 5.877 0.075 -4.239 1.00 0.00 C ATOM 1988 O GLY B 42 4.972 -0.022 -3.408 1.00 0.00 O ATOM 0 H GLY B 42 6.727 1.845 -6.433 1.00 0.00 H new ATOM 0 HA2 GLY B 42 4.679 0.927 -5.801 1.00 0.00 H new ATOM 0 HA3 GLY B 42 5.260 -0.690 -6.145 1.00 0.00 H new ATOM 1992 N ASP B 43 7.175 0.020 -3.913 1.00 0.00 N ATOM 1993 CA ASP B 43 7.623 -0.161 -2.534 1.00 0.00 C ATOM 1994 C ASP B 43 7.014 0.901 -1.620 1.00 0.00 C ATOM 1995 O ASP B 43 7.248 2.098 -1.799 1.00 0.00 O ATOM 1996 CB ASP B 43 9.155 -0.101 -2.457 1.00 0.00 C ATOM 1997 CG ASP B 43 9.813 -1.466 -2.594 1.00 0.00 C ATOM 1998 OD1 ASP B 43 9.212 -2.364 -3.222 1.00 0.00 O ATOM 1999 OD2 ASP B 43 10.935 -1.633 -2.072 1.00 0.00 O ATOM 0 H ASP B 43 7.933 0.099 -4.591 1.00 0.00 H new ATOM 0 HA ASP B 43 7.288 -1.142 -2.196 1.00 0.00 H new ATOM 0 HB2 ASP B 43 9.527 0.556 -3.243 1.00 0.00 H new ATOM 0 HB3 ASP B 43 9.448 0.343 -1.506 1.00 0.00 H new ATOM 2004 N VAL B 44 6.224 0.449 -0.646 1.00 0.00 N ATOM 2005 CA VAL B 44 5.572 1.353 0.294 1.00 0.00 C ATOM 2006 C VAL B 44 6.479 1.653 1.486 1.00 0.00 C ATOM 2007 O VAL B 44 6.763 0.772 2.301 1.00 0.00 O ATOM 2008 CB VAL B 44 4.232 0.776 0.801 1.00 0.00 C ATOM 2009 CG1 VAL B 44 3.473 1.816 1.609 1.00 0.00 C ATOM 2010 CG2 VAL B 44 3.378 0.281 -0.361 1.00 0.00 C ATOM 0 H VAL B 44 6.022 -0.538 -0.490 1.00 0.00 H new ATOM 0 HA VAL B 44 5.371 2.279 -0.245 1.00 0.00 H new ATOM 0 HB VAL B 44 4.454 -0.073 1.448 1.00 0.00 H new ATOM 0 HG11 VAL B 44 2.532 1.390 1.957 1.00 0.00 H new ATOM 0 HG12 VAL B 44 4.073 2.120 2.467 1.00 0.00 H new ATOM 0 HG13 VAL B 44 3.269 2.685 0.983 1.00 0.00 H new ATOM 0 HG21 VAL B 44 2.440 -0.121 0.022 1.00 0.00 H new ATOM 0 HG22 VAL B 44 3.169 1.110 -1.038 1.00 0.00 H new ATOM 0 HG23 VAL B 44 3.914 -0.500 -0.900 1.00 0.00 H new ATOM 2020 N VAL B 45 6.930 2.904 1.578 1.00 0.00 N ATOM 2021 CA VAL B 45 7.806 3.335 2.662 1.00 0.00 C ATOM 2022 C VAL B 45 6.997 3.769 3.887 1.00 0.00 C ATOM 2023 O VAL B 45 6.264 4.758 3.841 1.00 0.00 O ATOM 2024 CB VAL B 45 8.719 4.502 2.218 1.00 0.00 C ATOM 2025 CG1 VAL B 45 9.767 4.795 3.279 1.00 0.00 C ATOM 2026 CG2 VAL B 45 9.380 4.197 0.879 1.00 0.00 C ATOM 0 H VAL B 45 6.700 3.639 0.909 1.00 0.00 H new ATOM 0 HA VAL B 45 8.427 2.479 2.927 1.00 0.00 H new ATOM 0 HB VAL B 45 8.098 5.389 2.094 1.00 0.00 H new ATOM 0 HG11 VAL B 45 10.399 5.619 2.948 1.00 0.00 H new ATOM 0 HG12 VAL B 45 9.274 5.068 4.212 1.00 0.00 H new ATOM 0 HG13 VAL B 45 10.381 3.908 3.439 1.00 0.00 H new ATOM 0 HG21 VAL B 45 10.017 5.033 0.589 1.00 0.00 H new ATOM 0 HG22 VAL B 45 9.985 3.294 0.969 1.00 0.00 H new ATOM 0 HG23 VAL B 45 8.612 4.045 0.120 1.00 0.00 H new ATOM 2036 N LEU B 46 7.146 3.024 4.981 1.00 0.00 N ATOM 2037 CA LEU B 46 6.438 3.324 6.225 1.00 0.00 C ATOM 2038 C LEU B 46 7.203 4.354 7.062 1.00 0.00 C ATOM 2039 O LEU B 46 6.599 5.243 7.667 1.00 0.00 O ATOM 2040 CB LEU B 46 6.228 2.041 7.037 1.00 0.00 C ATOM 2041 CG LEU B 46 4.934 1.992 7.855 1.00 0.00 C ATOM 2042 CD1 LEU B 46 4.346 0.589 7.849 1.00 0.00 C ATOM 2043 CD2 LEU B 46 5.184 2.462 9.282 1.00 0.00 C ATOM 0 H LEU B 46 7.753 2.206 5.031 1.00 0.00 H new ATOM 0 HA LEU B 46 5.468 3.748 5.966 1.00 0.00 H new ATOM 0 HB2 LEU B 46 6.240 1.192 6.354 1.00 0.00 H new ATOM 0 HB3 LEU B 46 7.073 1.917 7.715 1.00 0.00 H new ATOM 0 HG LEU B 46 4.213 2.666 7.393 1.00 0.00 H new ATOM 0 HD11 LEU B 46 3.428 0.577 8.436 1.00 0.00 H new ATOM 0 HD12 LEU B 46 4.126 0.291 6.824 1.00 0.00 H new ATOM 0 HD13 LEU B 46 5.063 -0.108 8.283 1.00 0.00 H new ATOM 0 HD21 LEU B 46 4.253 2.420 9.847 1.00 0.00 H new ATOM 0 HD22 LEU B 46 5.924 1.816 9.754 1.00 0.00 H new ATOM 0 HD23 LEU B 46 5.554 3.487 9.268 1.00 0.00 H new ATOM 2055 N LYS B 47 8.534 4.227 7.094 1.00 0.00 N ATOM 2056 CA LYS B 47 9.376 5.146 7.858 1.00 0.00 C ATOM 2057 C LYS B 47 10.540 5.660 7.013 1.00 0.00 C ATOM 2058 O LYS B 47 10.984 4.991 6.079 1.00 0.00 O ATOM 2059 CB LYS B 47 9.923 4.454 9.111 1.00 0.00 C ATOM 2060 CG LYS B 47 9.103 4.716 10.364 1.00 0.00 C ATOM 2061 CD LYS B 47 9.767 4.131 11.601 1.00 0.00 C ATOM 2062 CE LYS B 47 9.113 2.823 12.023 1.00 0.00 C ATOM 2063 NZ LYS B 47 9.162 2.625 13.500 1.00 0.00 N ATOM 0 H LYS B 47 9.048 3.497 6.600 1.00 0.00 H new ATOM 0 HA LYS B 47 8.757 5.994 8.152 1.00 0.00 H new ATOM 0 HB2 LYS B 47 9.964 3.379 8.933 1.00 0.00 H new ATOM 0 HB3 LYS B 47 10.947 4.788 9.281 1.00 0.00 H new ATOM 0 HG2 LYS B 47 8.971 5.790 10.495 1.00 0.00 H new ATOM 0 HG3 LYS B 47 8.109 4.285 10.246 1.00 0.00 H new ATOM 0 HD2 LYS B 47 10.825 3.961 11.401 1.00 0.00 H new ATOM 0 HD3 LYS B 47 9.708 4.848 12.420 1.00 0.00 H new ATOM 0 HE2 LYS B 47 8.075 2.813 11.690 1.00 0.00 H new ATOM 0 HE3 LYS B 47 9.615 1.991 11.529 1.00 0.00 H new ATOM 0 HZ1 LYS B 47 8.706 1.723 13.745 1.00 0.00 H new ATOM 0 HZ2 LYS B 47 10.153 2.609 13.815 1.00 0.00 H new ATOM 0 HZ3 LYS B 47 8.661 3.405 13.972 1.00 0.00 H new ATOM 2077 N ILE B 48 11.035 6.848 7.357 1.00 0.00 N ATOM 2078 CA ILE B 48 12.155 7.453 6.643 1.00 0.00 C ATOM 2079 C ILE B 48 13.081 8.179 7.616 1.00 0.00 C ATOM 2080 O ILE B 48 12.646 9.061 8.359 1.00 0.00 O ATOM 2081 CB ILE B 48 11.679 8.443 5.557 1.00 0.00 C ATOM 2082 CG1 ILE B 48 10.587 7.804 4.693 1.00 0.00 C ATOM 2083 CG2 ILE B 48 12.852 8.889 4.690 1.00 0.00 C ATOM 2084 CD1 ILE B 48 10.020 8.734 3.642 1.00 0.00 C ATOM 0 H ILE B 48 10.676 7.411 8.128 1.00 0.00 H new ATOM 0 HA ILE B 48 12.696 6.643 6.154 1.00 0.00 H new ATOM 0 HB ILE B 48 11.261 9.321 6.049 1.00 0.00 H new ATOM 0 HG12 ILE B 48 10.995 6.921 4.202 1.00 0.00 H new ATOM 0 HG13 ILE B 48 9.778 7.464 5.339 1.00 0.00 H new ATOM 0 HG21 ILE B 48 12.499 9.586 3.930 1.00 0.00 H new ATOM 0 HG22 ILE B 48 13.599 9.380 5.313 1.00 0.00 H new ATOM 0 HG23 ILE B 48 13.298 8.020 4.206 1.00 0.00 H new ATOM 0 HD11 ILE B 48 9.253 8.212 3.070 1.00 0.00 H new ATOM 0 HD12 ILE B 48 9.581 9.606 4.127 1.00 0.00 H new ATOM 0 HD13 ILE B 48 10.817 9.055 2.972 1.00 0.00 H new ATOM 2096 N ASN B 49 14.358 7.791 7.606 1.00 0.00 N ATOM 2097 CA ASN B 49 15.365 8.386 8.486 1.00 0.00 C ATOM 2098 C ASN B 49 14.986 8.218 9.962 1.00 0.00 C ATOM 2099 O ASN B 49 15.284 9.082 10.791 1.00 0.00 O ATOM 2100 CB ASN B 49 15.560 9.871 8.152 1.00 0.00 C ATOM 2101 CG ASN B 49 17.027 10.259 8.104 1.00 0.00 C ATOM 2102 OD1 ASN B 49 17.791 9.950 9.019 1.00 0.00 O ATOM 2103 ND2 ASN B 49 17.434 10.935 7.034 1.00 0.00 N ATOM 0 H ASN B 49 14.721 7.061 6.993 1.00 0.00 H new ATOM 0 HA ASN B 49 16.305 7.861 8.319 1.00 0.00 H new ATOM 0 HB2 ASN B 49 15.096 10.089 7.190 1.00 0.00 H new ATOM 0 HB3 ASN B 49 15.049 10.480 8.898 1.00 0.00 H new ATOM 0 HD21 ASN B 49 18.411 11.217 6.950 1.00 0.00 H new ATOM 0 HD22 ASN B 49 16.770 11.172 6.297 1.00 0.00 H new ATOM 2110 N GLY B 50 14.325 7.102 10.283 1.00 0.00 N ATOM 2111 CA GLY B 50 13.916 6.851 11.654 1.00 0.00 C ATOM 2112 C GLY B 50 12.719 7.695 12.069 1.00 0.00 C ATOM 2113 O GLY B 50 12.586 8.052 13.241 1.00 0.00 O ATOM 0 H GLY B 50 14.068 6.372 9.618 1.00 0.00 H new ATOM 0 HA2 GLY B 50 13.669 5.795 11.769 1.00 0.00 H new ATOM 0 HA3 GLY B 50 14.752 7.058 12.323 1.00 0.00 H new ATOM 2117 N THR B 51 11.853 8.017 11.107 1.00 0.00 N ATOM 2118 CA THR B 51 10.669 8.829 11.375 1.00 0.00 C ATOM 2119 C THR B 51 9.483 8.338 10.550 1.00 0.00 C ATOM 2120 O THR B 51 9.630 8.023 9.367 1.00 0.00 O ATOM 2121 CB THR B 51 10.955 10.304 11.064 1.00 0.00 C ATOM 2122 OG1 THR B 51 12.218 10.694 11.579 1.00 0.00 O ATOM 2123 CG2 THR B 51 9.922 11.253 11.632 1.00 0.00 C ATOM 0 H THR B 51 11.951 7.726 10.134 1.00 0.00 H new ATOM 0 HA THR B 51 10.418 8.734 12.432 1.00 0.00 H new ATOM 0 HB THR B 51 10.930 10.373 9.976 1.00 0.00 H new ATOM 0 HG1 THR B 51 12.380 11.637 11.368 1.00 0.00 H new ATOM 0 HG21 THR B 51 10.188 12.278 11.373 1.00 0.00 H new ATOM 0 HG22 THR B 51 8.943 11.016 11.216 1.00 0.00 H new ATOM 0 HG23 THR B 51 9.890 11.149 12.717 1.00 0.00 H new ATOM 2131 N VAL B 52 8.310 8.274 11.180 1.00 0.00 N ATOM 2132 CA VAL B 52 7.095 7.821 10.502 1.00 0.00 C ATOM 2133 C VAL B 52 6.649 8.838 9.454 1.00 0.00 C ATOM 2134 O VAL B 52 6.780 10.045 9.661 1.00 0.00 O ATOM 2135 CB VAL B 52 5.938 7.578 11.499 1.00 0.00 C ATOM 2136 CG1 VAL B 52 4.737 6.965 10.791 1.00 0.00 C ATOM 2137 CG2 VAL B 52 6.392 6.689 12.650 1.00 0.00 C ATOM 0 H VAL B 52 8.175 8.530 12.158 1.00 0.00 H new ATOM 0 HA VAL B 52 7.337 6.876 10.015 1.00 0.00 H new ATOM 0 HB VAL B 52 5.639 8.542 11.911 1.00 0.00 H new ATOM 0 HG11 VAL B 52 3.935 6.802 11.510 1.00 0.00 H new ATOM 0 HG12 VAL B 52 4.392 7.641 10.009 1.00 0.00 H new ATOM 0 HG13 VAL B 52 5.024 6.012 10.346 1.00 0.00 H new ATOM 0 HG21 VAL B 52 5.561 6.532 13.338 1.00 0.00 H new ATOM 0 HG22 VAL B 52 6.725 5.728 12.258 1.00 0.00 H new ATOM 0 HG23 VAL B 52 7.215 7.170 13.178 1.00 0.00 H new ATOM 2147 N THR B 53 6.132 8.344 8.328 1.00 0.00 N ATOM 2148 CA THR B 53 5.677 9.218 7.246 1.00 0.00 C ATOM 2149 C THR B 53 4.216 8.941 6.875 1.00 0.00 C ATOM 2150 O THR B 53 3.843 8.997 5.704 1.00 0.00 O ATOM 2151 CB THR B 53 6.576 9.050 6.013 1.00 0.00 C ATOM 2152 OG1 THR B 53 7.869 8.588 6.378 1.00 0.00 O ATOM 2153 CG2 THR B 53 6.755 10.333 5.230 1.00 0.00 C ATOM 0 H THR B 53 6.018 7.348 8.142 1.00 0.00 H new ATOM 0 HA THR B 53 5.743 10.247 7.601 1.00 0.00 H new ATOM 0 HB THR B 53 6.064 8.320 5.386 1.00 0.00 H new ATOM 0 HG1 THR B 53 8.542 9.241 6.094 1.00 0.00 H new ATOM 0 HG21 THR B 53 7.400 10.148 4.371 1.00 0.00 H new ATOM 0 HG22 THR B 53 5.784 10.687 4.885 1.00 0.00 H new ATOM 0 HG23 THR B 53 7.210 11.089 5.870 1.00 0.00 H new ATOM 2161 N GLU B 54 3.388 8.657 7.880 1.00 0.00 N ATOM 2162 CA GLU B 54 1.973 8.388 7.655 1.00 0.00 C ATOM 2163 C GLU B 54 1.129 9.580 8.092 1.00 0.00 C ATOM 2164 O GLU B 54 1.431 10.226 9.097 1.00 0.00 O ATOM 2165 CB GLU B 54 1.538 7.139 8.417 1.00 0.00 C ATOM 2166 CG GLU B 54 1.067 6.010 7.520 1.00 0.00 C ATOM 2167 CD GLU B 54 1.763 4.701 7.832 1.00 0.00 C ATOM 2168 OE1 GLU B 54 2.882 4.489 7.319 1.00 0.00 O ATOM 2169 OE2 GLU B 54 1.190 3.889 8.588 1.00 0.00 O ATOM 0 H GLU B 54 3.675 8.608 8.857 1.00 0.00 H new ATOM 0 HA GLU B 54 1.823 8.220 6.588 1.00 0.00 H new ATOM 0 HB2 GLU B 54 2.372 6.785 9.023 1.00 0.00 H new ATOM 0 HB3 GLU B 54 0.734 7.405 9.104 1.00 0.00 H new ATOM 0 HG2 GLU B 54 -0.010 5.883 7.634 1.00 0.00 H new ATOM 0 HG3 GLU B 54 1.248 6.276 6.479 1.00 0.00 H new ATOM 2176 N ASN B 55 0.075 9.866 7.326 1.00 0.00 N ATOM 2177 CA ASN B 55 -0.824 10.986 7.622 1.00 0.00 C ATOM 2178 C ASN B 55 -0.149 12.348 7.398 1.00 0.00 C ATOM 2179 O ASN B 55 -0.736 13.387 7.710 1.00 0.00 O ATOM 2180 CB ASN B 55 -1.336 10.892 9.065 1.00 0.00 C ATOM 2181 CG ASN B 55 -2.846 11.003 9.157 1.00 0.00 C ATOM 2182 OD1 ASN B 55 -3.384 12.073 9.441 1.00 0.00 O ATOM 2183 ND2 ASN B 55 -3.538 9.893 8.922 1.00 0.00 N ATOM 0 H ASN B 55 -0.179 9.336 6.492 1.00 0.00 H new ATOM 0 HA ASN B 55 -1.663 10.914 6.930 1.00 0.00 H new ATOM 0 HB2 ASN B 55 -1.018 9.944 9.498 1.00 0.00 H new ATOM 0 HB3 ASN B 55 -0.880 11.683 9.660 1.00 0.00 H new ATOM 0 HD21 ASN B 55 -4.557 9.906 8.974 1.00 0.00 H new ATOM 0 HD22 ASN B 55 -3.051 9.028 8.690 1.00 0.00 H new ATOM 2190 N MET B 56 1.077 12.348 6.862 1.00 0.00 N ATOM 2191 CA MET B 56 1.802 13.591 6.610 1.00 0.00 C ATOM 2192 C MET B 56 1.607 14.059 5.170 1.00 0.00 C ATOM 2193 O MET B 56 1.222 13.279 4.296 1.00 0.00 O ATOM 2194 CB MET B 56 3.293 13.401 6.898 1.00 0.00 C ATOM 2195 CG MET B 56 3.857 14.412 7.887 1.00 0.00 C ATOM 2196 SD MET B 56 3.972 13.755 9.563 1.00 0.00 S ATOM 2197 CE MET B 56 4.970 12.294 9.286 1.00 0.00 C ATOM 0 H MET B 56 1.583 11.503 6.597 1.00 0.00 H new ATOM 0 HA MET B 56 1.402 14.355 7.276 1.00 0.00 H new ATOM 0 HB2 MET B 56 3.454 12.396 7.287 1.00 0.00 H new ATOM 0 HB3 MET B 56 3.847 13.473 5.962 1.00 0.00 H new ATOM 0 HG2 MET B 56 4.847 14.726 7.555 1.00 0.00 H new ATOM 0 HG3 MET B 56 3.226 15.301 7.892 1.00 0.00 H new ATOM 0 HE1 MET B 56 5.651 12.154 10.126 1.00 0.00 H new ATOM 0 HE2 MET B 56 4.322 11.422 9.195 1.00 0.00 H new ATOM 0 HE3 MET B 56 5.546 12.415 8.368 1.00 0.00 H new ATOM 2207 N SER B 57 1.885 15.340 4.930 1.00 0.00 N ATOM 2208 CA SER B 57 1.752 15.922 3.597 1.00 0.00 C ATOM 2209 C SER B 57 2.862 15.420 2.675 1.00 0.00 C ATOM 2210 O SER B 57 3.988 15.190 3.118 1.00 0.00 O ATOM 2211 CB SER B 57 1.789 17.453 3.677 1.00 0.00 C ATOM 2212 OG SER B 57 2.707 17.897 4.665 1.00 0.00 O ATOM 0 H SER B 57 2.204 15.995 5.644 1.00 0.00 H new ATOM 0 HA SER B 57 0.792 15.612 3.185 1.00 0.00 H new ATOM 0 HB2 SER B 57 2.069 17.863 2.707 1.00 0.00 H new ATOM 0 HB3 SER B 57 0.793 17.831 3.907 1.00 0.00 H new ATOM 0 HG SER B 57 2.710 18.877 4.692 1.00 0.00 H new ATOM 2218 N LEU B 58 2.537 15.256 1.391 1.00 0.00 N ATOM 2219 CA LEU B 58 3.510 14.786 0.402 1.00 0.00 C ATOM 2220 C LEU B 58 4.750 15.683 0.377 1.00 0.00 C ATOM 2221 O LEU B 58 5.854 15.217 0.084 1.00 0.00 O ATOM 2222 CB LEU B 58 2.876 14.736 -0.992 1.00 0.00 C ATOM 2223 CG LEU B 58 3.684 13.975 -2.047 1.00 0.00 C ATOM 2224 CD1 LEU B 58 3.669 12.481 -1.760 1.00 0.00 C ATOM 2225 CD2 LEU B 58 3.143 14.262 -3.440 1.00 0.00 C ATOM 0 H LEU B 58 1.608 15.441 1.012 1.00 0.00 H new ATOM 0 HA LEU B 58 3.818 13.781 0.690 1.00 0.00 H new ATOM 0 HB2 LEU B 58 1.891 14.276 -0.910 1.00 0.00 H new ATOM 0 HB3 LEU B 58 2.723 15.757 -1.341 1.00 0.00 H new ATOM 0 HG LEU B 58 4.718 14.318 -2.003 1.00 0.00 H new ATOM 0 HD11 LEU B 58 4.249 11.958 -2.521 1.00 0.00 H new ATOM 0 HD12 LEU B 58 4.106 12.295 -0.779 1.00 0.00 H new ATOM 0 HD13 LEU B 58 2.641 12.118 -1.774 1.00 0.00 H new ATOM 0 HD21 LEU B 58 3.728 13.713 -4.178 1.00 0.00 H new ATOM 0 HD22 LEU B 58 2.101 13.948 -3.497 1.00 0.00 H new ATOM 0 HD23 LEU B 58 3.212 15.331 -3.644 1.00 0.00 H new ATOM 2237 N THR B 59 4.560 16.967 0.693 1.00 0.00 N ATOM 2238 CA THR B 59 5.663 17.928 0.716 1.00 0.00 C ATOM 2239 C THR B 59 6.685 17.553 1.788 1.00 0.00 C ATOM 2240 O THR B 59 7.891 17.684 1.573 1.00 0.00 O ATOM 2241 CB THR B 59 5.139 19.347 0.975 1.00 0.00 C ATOM 2242 OG1 THR B 59 3.757 19.450 0.663 1.00 0.00 O ATOM 2243 CG2 THR B 59 5.871 20.411 0.183 1.00 0.00 C ATOM 0 H THR B 59 3.652 17.364 0.936 1.00 0.00 H new ATOM 0 HA THR B 59 6.149 17.902 -0.259 1.00 0.00 H new ATOM 0 HB THR B 59 5.312 19.522 2.037 1.00 0.00 H new ATOM 0 HG1 THR B 59 3.449 20.364 0.839 1.00 0.00 H new ATOM 0 HG21 THR B 59 5.450 21.390 0.413 1.00 0.00 H new ATOM 0 HG22 THR B 59 6.928 20.399 0.448 1.00 0.00 H new ATOM 0 HG23 THR B 59 5.762 20.211 -0.883 1.00 0.00 H new ATOM 2251 N ASP B 60 6.196 17.082 2.939 1.00 0.00 N ATOM 2252 CA ASP B 60 7.068 16.681 4.042 1.00 0.00 C ATOM 2253 C ASP B 60 8.008 15.557 3.611 1.00 0.00 C ATOM 2254 O ASP B 60 9.186 15.552 3.972 1.00 0.00 O ATOM 2255 CB ASP B 60 6.238 16.234 5.249 1.00 0.00 C ATOM 2256 CG ASP B 60 7.012 16.331 6.550 1.00 0.00 C ATOM 2257 OD1 ASP B 60 7.377 17.460 6.942 1.00 0.00 O ATOM 2258 OD2 ASP B 60 7.250 15.279 7.177 1.00 0.00 O ATOM 0 H ASP B 60 5.200 16.970 3.129 1.00 0.00 H new ATOM 0 HA ASP B 60 7.668 17.545 4.327 1.00 0.00 H new ATOM 0 HB2 ASP B 60 5.340 16.848 5.317 1.00 0.00 H new ATOM 0 HB3 ASP B 60 5.910 15.205 5.100 1.00 0.00 H new ATOM 2263 N ALA B 61 7.483 14.612 2.824 1.00 0.00 N ATOM 2264 CA ALA B 61 8.284 13.492 2.332 1.00 0.00 C ATOM 2265 C ALA B 61 9.468 13.999 1.514 1.00 0.00 C ATOM 2266 O ALA B 61 10.577 13.470 1.615 1.00 0.00 O ATOM 2267 CB ALA B 61 7.432 12.544 1.500 1.00 0.00 C ATOM 0 H ALA B 61 6.511 14.602 2.516 1.00 0.00 H new ATOM 0 HA ALA B 61 8.666 12.944 3.193 1.00 0.00 H new ATOM 0 HB1 ALA B 61 8.048 11.718 1.144 1.00 0.00 H new ATOM 0 HB2 ALA B 61 6.619 12.153 2.112 1.00 0.00 H new ATOM 0 HB3 ALA B 61 7.017 13.081 0.647 1.00 0.00 H new ATOM 2273 N LYS B 62 9.227 15.042 0.715 1.00 0.00 N ATOM 2274 CA LYS B 62 10.273 15.644 -0.109 1.00 0.00 C ATOM 2275 C LYS B 62 11.378 16.223 0.776 1.00 0.00 C ATOM 2276 O LYS B 62 12.560 16.151 0.432 1.00 0.00 O ATOM 2277 CB LYS B 62 9.687 16.741 -1.005 1.00 0.00 C ATOM 2278 CG LYS B 62 8.524 16.270 -1.871 1.00 0.00 C ATOM 2279 CD LYS B 62 8.579 16.871 -3.267 1.00 0.00 C ATOM 2280 CE LYS B 62 8.290 18.365 -3.248 1.00 0.00 C ATOM 2281 NZ LYS B 62 7.699 18.835 -4.532 1.00 0.00 N ATOM 0 H LYS B 62 8.314 15.486 0.623 1.00 0.00 H new ATOM 0 HA LYS B 62 10.700 14.868 -0.744 1.00 0.00 H new ATOM 0 HB2 LYS B 62 9.351 17.568 -0.379 1.00 0.00 H new ATOM 0 HB3 LYS B 62 10.475 17.130 -1.650 1.00 0.00 H new ATOM 0 HG2 LYS B 62 8.541 15.182 -1.943 1.00 0.00 H new ATOM 0 HG3 LYS B 62 7.582 16.543 -1.395 1.00 0.00 H new ATOM 0 HD2 LYS B 62 9.564 16.696 -3.700 1.00 0.00 H new ATOM 0 HD3 LYS B 62 7.855 16.368 -3.908 1.00 0.00 H new ATOM 0 HE2 LYS B 62 7.607 18.592 -2.430 1.00 0.00 H new ATOM 0 HE3 LYS B 62 9.213 18.910 -3.053 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 7.518 19.858 -4.477 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 8.362 18.642 -5.310 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 6.805 18.334 -4.707 1.00 0.00 H new ATOM 2295 N THR B 63 10.984 16.785 1.922 1.00 0.00 N ATOM 2296 CA THR B 63 11.936 17.366 2.866 1.00 0.00 C ATOM 2297 C THR B 63 12.822 16.287 3.483 1.00 0.00 C ATOM 2298 O THR B 63 14.013 16.510 3.700 1.00 0.00 O ATOM 2299 CB THR B 63 11.208 18.122 3.977 1.00 0.00 C ATOM 2300 OG1 THR B 63 9.882 18.445 3.594 1.00 0.00 O ATOM 2301 CG2 THR B 63 11.894 19.411 4.371 1.00 0.00 C ATOM 0 H THR B 63 10.010 16.849 2.217 1.00 0.00 H new ATOM 0 HA THR B 63 12.563 18.064 2.311 1.00 0.00 H new ATOM 0 HB THR B 63 11.214 17.444 4.830 1.00 0.00 H new ATOM 0 HG1 THR B 63 9.439 18.926 4.324 1.00 0.00 H new ATOM 0 HG21 THR B 63 11.326 19.898 5.164 1.00 0.00 H new ATOM 0 HG22 THR B 63 12.901 19.193 4.727 1.00 0.00 H new ATOM 0 HG23 THR B 63 11.950 20.072 3.506 1.00 0.00 H new ATOM 2309 N LEU B 64 12.239 15.117 3.763 1.00 0.00 N ATOM 2310 CA LEU B 64 12.990 14.006 4.348 1.00 0.00 C ATOM 2311 C LEU B 64 14.208 13.664 3.490 1.00 0.00 C ATOM 2312 O LEU B 64 15.264 13.299 4.010 1.00 0.00 O ATOM 2313 CB LEU B 64 12.099 12.770 4.498 1.00 0.00 C ATOM 2314 CG LEU B 64 11.478 12.580 5.884 1.00 0.00 C ATOM 2315 CD1 LEU B 64 10.190 11.774 5.788 1.00 0.00 C ATOM 2316 CD2 LEU B 64 12.469 11.904 6.824 1.00 0.00 C ATOM 0 H LEU B 64 11.253 14.917 3.594 1.00 0.00 H new ATOM 0 HA LEU B 64 13.331 14.317 5.335 1.00 0.00 H new ATOM 0 HB2 LEU B 64 11.297 12.829 3.763 1.00 0.00 H new ATOM 0 HB3 LEU B 64 12.688 11.885 4.257 1.00 0.00 H new ATOM 0 HG LEU B 64 11.235 13.562 6.291 1.00 0.00 H new ATOM 0 HD11 LEU B 64 9.764 11.650 6.783 1.00 0.00 H new ATOM 0 HD12 LEU B 64 9.478 12.300 5.151 1.00 0.00 H new ATOM 0 HD13 LEU B 64 10.405 10.795 5.360 1.00 0.00 H new ATOM 0 HD21 LEU B 64 12.011 11.777 7.805 1.00 0.00 H new ATOM 0 HD22 LEU B 64 12.744 10.929 6.423 1.00 0.00 H new ATOM 0 HD23 LEU B 64 13.362 12.523 6.918 1.00 0.00 H new ATOM 2328 N ILE B 65 14.053 13.800 2.172 1.00 0.00 N ATOM 2329 CA ILE B 65 15.136 13.522 1.234 1.00 0.00 C ATOM 2330 C ILE B 65 16.165 14.656 1.237 1.00 0.00 C ATOM 2331 O ILE B 65 17.356 14.419 1.028 1.00 0.00 O ATOM 2332 CB ILE B 65 14.605 13.325 -0.204 1.00 0.00 C ATOM 2333 CG1 ILE B 65 13.437 12.332 -0.216 1.00 0.00 C ATOM 2334 CG2 ILE B 65 15.721 12.843 -1.121 1.00 0.00 C ATOM 2335 CD1 ILE B 65 12.613 12.374 -1.485 1.00 0.00 C ATOM 0 H ILE B 65 13.184 14.102 1.731 1.00 0.00 H new ATOM 0 HA ILE B 65 15.612 12.598 1.563 1.00 0.00 H new ATOM 0 HB ILE B 65 14.244 14.285 -0.572 1.00 0.00 H new ATOM 0 HG12 ILE B 65 13.828 11.324 -0.081 1.00 0.00 H new ATOM 0 HG13 ILE B 65 12.788 12.539 0.635 1.00 0.00 H new ATOM 0 HG21 ILE B 65 15.331 12.709 -2.130 1.00 0.00 H new ATOM 0 HG22 ILE B 65 16.523 13.581 -1.137 1.00 0.00 H new ATOM 0 HG23 ILE B 65 16.109 11.893 -0.753 1.00 0.00 H new ATOM 0 HD11 ILE B 65 11.806 11.644 -1.419 1.00 0.00 H new ATOM 0 HD12 ILE B 65 12.191 13.371 -1.612 1.00 0.00 H new ATOM 0 HD13 ILE B 65 13.248 12.137 -2.339 1.00 0.00 H new ATOM 2347 N GLU B 66 15.698 15.885 1.472 1.00 0.00 N ATOM 2348 CA GLU B 66 16.579 17.049 1.499 1.00 0.00 C ATOM 2349 C GLU B 66 17.382 17.105 2.798 1.00 0.00 C ATOM 2350 O GLU B 66 18.600 17.286 2.773 1.00 0.00 O ATOM 2351 CB GLU B 66 15.769 18.336 1.330 1.00 0.00 C ATOM 2352 CG GLU B 66 16.632 19.566 1.082 1.00 0.00 C ATOM 2353 CD GLU B 66 16.200 20.768 1.904 1.00 0.00 C ATOM 2354 OE1 GLU B 66 15.890 20.596 3.104 1.00 0.00 O ATOM 2355 OE2 GLU B 66 16.173 21.884 1.346 1.00 0.00 O ATOM 0 H GLU B 66 14.715 16.097 1.646 1.00 0.00 H new ATOM 0 HA GLU B 66 17.279 16.956 0.668 1.00 0.00 H new ATOM 0 HB2 GLU B 66 15.076 18.214 0.497 1.00 0.00 H new ATOM 0 HB3 GLU B 66 15.167 18.498 2.224 1.00 0.00 H new ATOM 0 HG2 GLU B 66 17.670 19.328 1.314 1.00 0.00 H new ATOM 0 HG3 GLU B 66 16.593 19.823 0.024 1.00 0.00 H new ATOM 2362 N ARG B 67 16.695 16.940 3.931 1.00 0.00 N ATOM 2363 CA ARG B 67 17.349 16.965 5.243 1.00 0.00 C ATOM 2364 C ARG B 67 18.455 15.908 5.339 1.00 0.00 C ATOM 2365 O ARG B 67 19.385 16.050 6.135 1.00 0.00 O ATOM 2366 CB ARG B 67 16.324 16.745 6.362 1.00 0.00 C ATOM 2367 CG ARG B 67 15.673 15.368 6.344 1.00 0.00 C ATOM 2368 CD ARG B 67 14.946 15.078 7.647 1.00 0.00 C ATOM 2369 NE ARG B 67 15.866 14.965 8.781 1.00 0.00 N ATOM 2370 CZ ARG B 67 15.481 14.975 10.059 1.00 0.00 C ATOM 2371 NH1 ARG B 67 14.192 15.082 10.373 1.00 0.00 N ATOM 2372 NH2 ARG B 67 16.385 14.877 11.026 1.00 0.00 N ATOM 0 H ARG B 67 15.687 16.788 3.967 1.00 0.00 H new ATOM 0 HA ARG B 67 17.804 17.949 5.362 1.00 0.00 H new ATOM 0 HB2 ARG B 67 16.815 16.891 7.324 1.00 0.00 H new ATOM 0 HB3 ARG B 67 15.546 17.504 6.283 1.00 0.00 H new ATOM 0 HG2 ARG B 67 14.970 15.308 5.513 1.00 0.00 H new ATOM 0 HG3 ARG B 67 16.434 14.607 6.174 1.00 0.00 H new ATOM 0 HD2 ARG B 67 14.226 15.872 7.844 1.00 0.00 H new ATOM 0 HD3 ARG B 67 14.380 14.152 7.547 1.00 0.00 H new ATOM 0 HE ARG B 67 16.862 14.873 8.582 1.00 0.00 H new ATOM 0 HH11 ARG B 67 13.492 15.157 9.635 1.00 0.00 H new ATOM 0 HH12 ARG B 67 13.904 15.089 11.352 1.00 0.00 H new ATOM 0 HH21 ARG B 67 17.374 14.794 10.793 1.00 0.00 H new ATOM 0 HH22 ARG B 67 16.090 14.885 12.002 1.00 0.00 H new ATOM 2386 N SER B 68 18.343 14.850 4.527 1.00 0.00 N ATOM 2387 CA SER B 68 19.324 13.768 4.514 1.00 0.00 C ATOM 2388 C SER B 68 20.745 14.310 4.376 1.00 0.00 C ATOM 2389 O SER B 68 21.122 14.820 3.320 1.00 0.00 O ATOM 2390 CB SER B 68 19.032 12.803 3.361 1.00 0.00 C ATOM 2391 OG SER B 68 19.802 11.620 3.482 1.00 0.00 O ATOM 0 H SER B 68 17.575 14.724 3.867 1.00 0.00 H new ATOM 0 HA SER B 68 19.246 13.238 5.463 1.00 0.00 H new ATOM 0 HB2 SER B 68 17.971 12.552 3.352 1.00 0.00 H new ATOM 0 HB3 SER B 68 19.252 13.289 2.411 1.00 0.00 H new ATOM 0 HG SER B 68 20.087 11.323 2.593 1.00 0.00 H new ATOM 2397 N LYS B 69 21.534 14.185 5.444 1.00 0.00 N ATOM 2398 CA LYS B 69 22.918 14.655 5.427 1.00 0.00 C ATOM 2399 C LYS B 69 23.827 13.622 4.755 1.00 0.00 C ATOM 2400 O LYS B 69 24.754 13.090 5.373 1.00 0.00 O ATOM 2401 CB LYS B 69 23.407 14.967 6.851 1.00 0.00 C ATOM 2402 CG LYS B 69 23.431 13.762 7.779 1.00 0.00 C ATOM 2403 CD LYS B 69 23.276 14.175 9.234 1.00 0.00 C ATOM 2404 CE LYS B 69 21.820 14.135 9.671 1.00 0.00 C ATOM 2405 NZ LYS B 69 21.236 15.500 9.787 1.00 0.00 N ATOM 0 H LYS B 69 21.240 13.765 6.326 1.00 0.00 H new ATOM 0 HA LYS B 69 22.959 15.577 4.847 1.00 0.00 H new ATOM 0 HB2 LYS B 69 24.411 15.388 6.794 1.00 0.00 H new ATOM 0 HB3 LYS B 69 22.764 15.733 7.285 1.00 0.00 H new ATOM 0 HG2 LYS B 69 22.629 13.076 7.507 1.00 0.00 H new ATOM 0 HG3 LYS B 69 24.369 13.222 7.651 1.00 0.00 H new ATOM 0 HD2 LYS B 69 23.866 13.511 9.867 1.00 0.00 H new ATOM 0 HD3 LYS B 69 23.671 15.181 9.372 1.00 0.00 H new ATOM 0 HE2 LYS B 69 21.242 13.553 8.954 1.00 0.00 H new ATOM 0 HE3 LYS B 69 21.743 13.625 10.631 1.00 0.00 H new ATOM 0 HZ1 LYS B 69 20.243 15.428 10.087 1.00 0.00 H new ATOM 0 HZ2 LYS B 69 21.771 16.048 10.490 1.00 0.00 H new ATOM 0 HZ3 LYS B 69 21.285 15.978 8.865 1.00 0.00 H new ATOM 2419 N GLY B 70 23.550 13.339 3.480 1.00 0.00 N ATOM 2420 CA GLY B 70 24.343 12.374 2.742 1.00 0.00 C ATOM 2421 C GLY B 70 23.631 11.045 2.564 1.00 0.00 C ATOM 2422 O GLY B 70 23.077 10.770 1.501 1.00 0.00 O ATOM 0 H GLY B 70 22.790 13.763 2.949 1.00 0.00 H new ATOM 0 HA2 GLY B 70 24.588 12.784 1.762 1.00 0.00 H new ATOM 0 HA3 GLY B 70 25.286 12.210 3.264 1.00 0.00 H new ATOM 2426 N LYS B 71 23.648 10.216 3.608 1.00 0.00 N ATOM 2427 CA LYS B 71 23.003 8.904 3.555 1.00 0.00 C ATOM 2428 C LYS B 71 21.513 8.999 3.889 1.00 0.00 C ATOM 2429 O LYS B 71 21.127 9.635 4.869 1.00 0.00 O ATOM 2430 CB LYS B 71 23.684 7.928 4.522 1.00 0.00 C ATOM 2431 CG LYS B 71 25.201 7.894 4.400 1.00 0.00 C ATOM 2432 CD LYS B 71 25.864 7.661 5.751 1.00 0.00 C ATOM 2433 CE LYS B 71 27.057 8.583 5.961 1.00 0.00 C ATOM 2434 NZ LYS B 71 26.642 9.996 6.195 1.00 0.00 N ATOM 0 H LYS B 71 24.100 10.429 4.498 1.00 0.00 H new ATOM 0 HA LYS B 71 23.105 8.533 2.535 1.00 0.00 H new ATOM 0 HB2 LYS B 71 23.418 8.199 5.544 1.00 0.00 H new ATOM 0 HB3 LYS B 71 23.293 6.926 4.346 1.00 0.00 H new ATOM 0 HG2 LYS B 71 25.494 7.104 3.709 1.00 0.00 H new ATOM 0 HG3 LYS B 71 25.554 8.835 3.977 1.00 0.00 H new ATOM 0 HD2 LYS B 71 25.136 7.822 6.546 1.00 0.00 H new ATOM 0 HD3 LYS B 71 26.190 6.623 5.822 1.00 0.00 H new ATOM 0 HE2 LYS B 71 27.640 8.232 6.812 1.00 0.00 H new ATOM 0 HE3 LYS B 71 27.708 8.537 5.088 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 27.477 10.568 6.433 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 26.197 10.374 5.334 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 25.962 10.032 6.981 1.00 0.00 H new ATOM 2448 N LEU B 72 20.686 8.350 3.066 1.00 0.00 N ATOM 2449 CA LEU B 72 19.237 8.342 3.265 1.00 0.00 C ATOM 2450 C LEU B 72 18.766 6.970 3.745 1.00 0.00 C ATOM 2451 O LEU B 72 19.270 5.941 3.292 1.00 0.00 O ATOM 2452 CB LEU B 72 18.516 8.707 1.960 1.00 0.00 C ATOM 2453 CG LEU B 72 17.490 9.843 2.063 1.00 0.00 C ATOM 2454 CD1 LEU B 72 16.756 10.021 0.741 1.00 0.00 C ATOM 2455 CD2 LEU B 72 16.498 9.576 3.184 1.00 0.00 C ATOM 0 H LEU B 72 20.998 7.821 2.252 1.00 0.00 H new ATOM 0 HA LEU B 72 18.996 9.084 4.026 1.00 0.00 H new ATOM 0 HB2 LEU B 72 19.265 8.984 1.218 1.00 0.00 H new ATOM 0 HB3 LEU B 72 18.010 7.818 1.585 1.00 0.00 H new ATOM 0 HG LEU B 72 18.027 10.764 2.291 1.00 0.00 H new ATOM 0 HD11 LEU B 72 16.032 10.831 0.833 1.00 0.00 H new ATOM 0 HD12 LEU B 72 17.473 10.262 -0.044 1.00 0.00 H new ATOM 0 HD13 LEU B 72 16.236 9.097 0.486 1.00 0.00 H new ATOM 0 HD21 LEU B 72 15.781 10.395 3.238 1.00 0.00 H new ATOM 0 HD22 LEU B 72 15.970 8.643 2.988 1.00 0.00 H new ATOM 0 HD23 LEU B 72 17.032 9.498 4.131 1.00 0.00 H new ATOM 2467 N LYS B 73 17.794 6.959 4.654 1.00 0.00 N ATOM 2468 CA LYS B 73 17.249 5.710 5.181 1.00 0.00 C ATOM 2469 C LYS B 73 15.742 5.642 4.949 1.00 0.00 C ATOM 2470 O LYS B 73 15.000 6.524 5.382 1.00 0.00 O ATOM 2471 CB LYS B 73 17.557 5.572 6.678 1.00 0.00 C ATOM 2472 CG LYS B 73 18.430 4.371 7.012 1.00 0.00 C ATOM 2473 CD LYS B 73 17.768 3.454 8.031 1.00 0.00 C ATOM 2474 CE LYS B 73 18.359 3.639 9.423 1.00 0.00 C ATOM 2475 NZ LYS B 73 17.526 4.535 10.277 1.00 0.00 N ATOM 0 H LYS B 73 17.367 7.801 5.041 1.00 0.00 H new ATOM 0 HA LYS B 73 17.723 4.884 4.650 1.00 0.00 H new ATOM 0 HB2 LYS B 73 18.053 6.479 7.023 1.00 0.00 H new ATOM 0 HB3 LYS B 73 16.619 5.493 7.228 1.00 0.00 H new ATOM 0 HG2 LYS B 73 18.640 3.810 6.101 1.00 0.00 H new ATOM 0 HG3 LYS B 73 19.388 4.716 7.402 1.00 0.00 H new ATOM 0 HD2 LYS B 73 16.697 3.656 8.061 1.00 0.00 H new ATOM 0 HD3 LYS B 73 17.889 2.416 7.719 1.00 0.00 H new ATOM 0 HE2 LYS B 73 18.456 2.667 9.906 1.00 0.00 H new ATOM 0 HE3 LYS B 73 19.363 4.054 9.337 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 17.968 4.631 11.214 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 17.454 5.472 9.831 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 16.575 4.128 10.383 1.00 0.00 H new ATOM 2489 N MET B 74 15.296 4.591 4.266 1.00 0.00 N ATOM 2490 CA MET B 74 13.876 4.407 3.977 1.00 0.00 C ATOM 2491 C MET B 74 13.420 3.008 4.383 1.00 0.00 C ATOM 2492 O MET B 74 13.994 2.008 3.951 1.00 0.00 O ATOM 2493 CB MET B 74 13.594 4.641 2.491 1.00 0.00 C ATOM 2494 CG MET B 74 13.651 6.106 2.081 1.00 0.00 C ATOM 2495 SD MET B 74 14.595 6.371 0.567 1.00 0.00 S ATOM 2496 CE MET B 74 13.584 5.491 -0.623 1.00 0.00 C ATOM 0 H MET B 74 15.898 3.853 3.902 1.00 0.00 H new ATOM 0 HA MET B 74 13.315 5.138 4.559 1.00 0.00 H new ATOM 0 HB2 MET B 74 14.317 4.079 1.900 1.00 0.00 H new ATOM 0 HB3 MET B 74 12.608 4.244 2.250 1.00 0.00 H new ATOM 0 HG2 MET B 74 12.636 6.479 1.941 1.00 0.00 H new ATOM 0 HG3 MET B 74 14.096 6.688 2.888 1.00 0.00 H new ATOM 0 HE1 MET B 74 13.990 5.638 -1.624 1.00 0.00 H new ATOM 0 HE2 MET B 74 13.583 4.428 -0.384 1.00 0.00 H new ATOM 0 HE3 MET B 74 12.563 5.872 -0.586 1.00 0.00 H new ATOM 2506 N VAL B 75 12.381 2.948 5.209 1.00 0.00 N ATOM 2507 CA VAL B 75 11.839 1.675 5.675 1.00 0.00 C ATOM 2508 C VAL B 75 10.623 1.279 4.847 1.00 0.00 C ATOM 2509 O VAL B 75 9.644 2.021 4.776 1.00 0.00 O ATOM 2510 CB VAL B 75 11.438 1.740 7.164 1.00 0.00 C ATOM 2511 CG1 VAL B 75 11.117 0.350 7.699 1.00 0.00 C ATOM 2512 CG2 VAL B 75 12.536 2.399 7.990 1.00 0.00 C ATOM 0 H VAL B 75 11.895 3.769 5.571 1.00 0.00 H new ATOM 0 HA VAL B 75 12.624 0.928 5.558 1.00 0.00 H new ATOM 0 HB VAL B 75 10.539 2.350 7.248 1.00 0.00 H new ATOM 0 HG11 VAL B 75 10.837 0.420 8.750 1.00 0.00 H new ATOM 0 HG12 VAL B 75 10.290 -0.076 7.131 1.00 0.00 H new ATOM 0 HG13 VAL B 75 11.994 -0.290 7.599 1.00 0.00 H new ATOM 0 HG21 VAL B 75 12.233 2.434 9.036 1.00 0.00 H new ATOM 0 HG22 VAL B 75 13.456 1.822 7.898 1.00 0.00 H new ATOM 0 HG23 VAL B 75 12.706 3.413 7.627 1.00 0.00 H new ATOM 2522 N VAL B 76 10.693 0.104 4.228 1.00 0.00 N ATOM 2523 CA VAL B 76 9.598 -0.400 3.401 1.00 0.00 C ATOM 2524 C VAL B 76 8.767 -1.424 4.176 1.00 0.00 C ATOM 2525 O VAL B 76 9.237 -2.003 5.158 1.00 0.00 O ATOM 2526 CB VAL B 76 10.130 -1.043 2.098 1.00 0.00 C ATOM 2527 CG1 VAL B 76 8.994 -1.326 1.123 1.00 0.00 C ATOM 2528 CG2 VAL B 76 11.177 -0.153 1.444 1.00 0.00 C ATOM 0 H VAL B 76 11.498 -0.519 4.283 1.00 0.00 H new ATOM 0 HA VAL B 76 8.968 0.449 3.137 1.00 0.00 H new ATOM 0 HB VAL B 76 10.597 -1.991 2.363 1.00 0.00 H new ATOM 0 HG11 VAL B 76 9.397 -1.778 0.216 1.00 0.00 H new ATOM 0 HG12 VAL B 76 8.281 -2.010 1.583 1.00 0.00 H new ATOM 0 HG13 VAL B 76 8.490 -0.393 0.871 1.00 0.00 H new ATOM 0 HG21 VAL B 76 11.537 -0.625 0.530 1.00 0.00 H new ATOM 0 HG22 VAL B 76 10.734 0.813 1.203 1.00 0.00 H new ATOM 0 HG23 VAL B 76 12.012 -0.008 2.130 1.00 0.00 H new ATOM 2538 N GLN B 77 7.530 -1.641 3.730 1.00 0.00 N ATOM 2539 CA GLN B 77 6.635 -2.589 4.386 1.00 0.00 C ATOM 2540 C GLN B 77 6.740 -3.969 3.741 1.00 0.00 C ATOM 2541 O GLN B 77 6.433 -4.141 2.559 1.00 0.00 O ATOM 2542 CB GLN B 77 5.194 -2.079 4.323 1.00 0.00 C ATOM 2543 CG GLN B 77 4.181 -2.999 4.993 1.00 0.00 C ATOM 2544 CD GLN B 77 2.845 -2.320 5.234 1.00 0.00 C ATOM 2545 OE1 GLN B 77 2.306 -2.362 6.340 1.00 0.00 O ATOM 2546 NE2 GLN B 77 2.300 -1.688 4.197 1.00 0.00 N ATOM 0 H GLN B 77 7.127 -1.173 2.918 1.00 0.00 H new ATOM 0 HA GLN B 77 6.932 -2.680 5.431 1.00 0.00 H new ATOM 0 HB2 GLN B 77 5.146 -1.098 4.795 1.00 0.00 H new ATOM 0 HB3 GLN B 77 4.912 -1.945 3.279 1.00 0.00 H new ATOM 0 HG2 GLN B 77 4.029 -3.881 4.370 1.00 0.00 H new ATOM 0 HG3 GLN B 77 4.585 -3.346 5.944 1.00 0.00 H new ATOM 0 HE21 GLN B 77 2.780 -1.677 3.297 1.00 0.00 H new ATOM 0 HE22 GLN B 77 1.403 -1.215 4.302 1.00 0.00 H new