USER MOD reduce.3.24.130724 H: found=0, std=0, add=1001, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1003 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 43 ASN : amide:sc= 0.421 X(o=0.28,f=0.55) USER MOD Set 1.2: B 47 GLN : amide:sc= -0.136 X(o=0.28,f=0.55) USER MOD Set 2.1: A 43 ASN : amide:sc= 0.267 K(o=0.53,f=0) USER MOD Set 2.2: A 47 GLN : amide:sc= 0.266 K(o=0.53,f=-0.89) USER MOD Set 3.1: A 8 THR OG1 : rot 114:sc= 0.549 USER MOD Set 3.2: A 11 GLN :FLIP amide:sc= -0.0221 F(o=-0.83!,f=0.53) USER MOD Single : A 7 TYR OH : rot 180:sc= -0.452 USER MOD Single : A 14 LYS NZ :NH3+ 166:sc= -0.0113 (180deg=-0.193) USER MOD Single : A 25 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.118) USER MOD Single : A 26 HIS : no HD1:sc= -0.459 K(o=-0.46,f=-5.3!) USER MOD Single : A 29 SER OG : rot -80:sc= -0.945! USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 MET CE :methyl -132:sc= -1.26 (180deg=-2.49!) USER MOD Single : A 39 ASN : amide:sc= -0.954 X(o=-0.95,f=-0.82) USER MOD Single : A 42 THR OG1 : rot 80:sc= 1.11 USER MOD Single : A 46 ASN :FLIP amide:sc= -0.0144 F(o=-0.86,f=-0.014) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 GLN :FLIP amide:sc= -1.23 F(o=-5.9!,f=-1.2) USER MOD Single : A 55 LYS NZ :NH3+ 178:sc= 0.284 (180deg=0.283) USER MOD Single : A 60 LYS NZ :NH3+ 167:sc= 0.725 (180deg=0.397) USER MOD Single : A 63 GLN :FLIP amide:sc= -0.0124 F(o=-1,f=-0.012) USER MOD Single : A 66 MET CE :methyl -166:sc= -1.45 (180deg=-2.06) USER MOD Single : A 67 SER OG : rot 79:sc= 1.19 USER MOD Single : A 68 SER OG : rot 76:sc= 1.21 USER MOD Single : B 8 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 GLN :FLIP amide:sc= -0.279 F(o=-0.82,f=-0.28) USER MOD Single : B 14 LYS NZ :NH3+ -159:sc= 2.47 (180deg=2.27) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 HIS : no HD1:sc= -1.15 K(o=-1.2,f=-4.6!) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot 69:sc= 0.553 USER MOD Single : B 35 MET CE :methyl 160:sc= -0.0961 (180deg=-0.663) USER MOD Single : B 39 ASN : amide:sc= -0.112 K(o=-0.11,f=-0.9) USER MOD Single : B 42 THR OG1 : rot 79:sc= 1.27 USER MOD Single : B 46 ASN : amide:sc= 0.629 K(o=0.63,f=-1.7) USER MOD Single : B 52 SER OG : rot 180:sc= 0 USER MOD Single : B 53 GLN : amide:sc= -0.341 K(o=-0.34,f=-1.5) USER MOD Single : B 55 LYS NZ :NH3+ -170:sc= -0.0342 (180deg=-0.198) USER MOD Single : B 60 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0302) USER MOD Single : B 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 66 MET CE :methyl -137:sc= -2.01! (180deg=-4.02!) USER MOD Single : B 67 SER OG : rot 59:sc= 1.22 USER MOD Single : B 68 SER OG : rot 74:sc= 0.985 USER MOD ----------------------------------------------------------------- ATOM 97 N TYR A 7 -5.926 5.792 15.790 1.00 0.00 N ATOM 98 CA TYR A 7 -6.005 7.248 15.943 1.00 0.00 C ATOM 99 C TYR A 7 -7.461 7.707 15.964 1.00 0.00 C ATOM 100 O TYR A 7 -8.375 6.889 16.082 1.00 0.00 O ATOM 101 CB TYR A 7 -5.238 7.960 14.818 1.00 0.00 C ATOM 102 CG TYR A 7 -3.765 7.609 14.752 1.00 0.00 C ATOM 103 CD1 TYR A 7 -2.834 8.266 15.550 1.00 0.00 C ATOM 104 CD2 TYR A 7 -3.305 6.623 13.888 1.00 0.00 C ATOM 105 CE1 TYR A 7 -1.490 7.947 15.488 1.00 0.00 C ATOM 106 CE2 TYR A 7 -1.964 6.300 13.821 1.00 0.00 C ATOM 107 CZ TYR A 7 -1.061 6.963 14.621 1.00 0.00 C ATOM 108 OH TYR A 7 0.277 6.643 14.547 1.00 0.00 O ATOM 0 HA TYR A 7 -5.542 7.513 16.894 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -5.702 7.712 13.863 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -5.338 9.037 14.951 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -3.166 9.038 16.229 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -4.009 6.100 13.258 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -0.780 8.465 16.115 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -1.625 5.530 13.144 1.00 0.00 H new ATOM 0 HH TYR A 7 0.407 5.929 13.888 1.00 0.00 H new ATOM 118 N THR A 8 -7.688 9.010 15.876 1.00 0.00 N ATOM 119 CA THR A 8 -9.046 9.517 15.844 1.00 0.00 C ATOM 120 C THR A 8 -9.654 9.254 14.465 1.00 0.00 C ATOM 121 O THR A 8 -9.024 9.525 13.435 1.00 0.00 O ATOM 122 CB THR A 8 -9.112 11.017 16.202 1.00 0.00 C ATOM 123 OG1 THR A 8 -8.589 11.819 15.143 1.00 0.00 O ATOM 124 CG2 THR A 8 -8.323 11.304 17.469 1.00 0.00 C ATOM 0 H THR A 8 -6.960 9.723 15.826 1.00 0.00 H new ATOM 0 HA THR A 8 -9.627 8.990 16.601 1.00 0.00 H new ATOM 0 HB THR A 8 -10.161 11.267 16.360 1.00 0.00 H new ATOM 0 HG1 THR A 8 -9.308 12.364 14.759 1.00 0.00 H new ATOM 0 HG21 THR A 8 -8.383 12.367 17.702 1.00 0.00 H new ATOM 0 HG22 THR A 8 -8.739 10.727 18.295 1.00 0.00 H new ATOM 0 HG23 THR A 8 -7.280 11.024 17.320 1.00 0.00 H new ATOM 132 N ASP A 9 -10.863 8.705 14.454 1.00 0.00 N ATOM 133 CA ASP A 9 -11.487 8.221 13.223 1.00 0.00 C ATOM 134 C ASP A 9 -11.636 9.313 12.176 1.00 0.00 C ATOM 135 O ASP A 9 -11.314 9.100 11.005 1.00 0.00 O ATOM 136 CB ASP A 9 -12.853 7.615 13.523 1.00 0.00 C ATOM 137 CG ASP A 9 -12.754 6.354 14.350 1.00 0.00 C ATOM 138 OD1 ASP A 9 -12.312 5.321 13.812 1.00 0.00 O ATOM 139 OD2 ASP A 9 -13.119 6.387 15.542 1.00 0.00 O ATOM 0 H ASP A 9 -11.436 8.582 15.289 1.00 0.00 H new ATOM 0 HA ASP A 9 -10.823 7.459 12.814 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -13.464 8.346 14.052 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -13.363 7.393 12.586 1.00 0.00 H new ATOM 144 N GLU A 10 -12.133 10.474 12.596 1.00 0.00 N ATOM 145 CA GLU A 10 -12.330 11.600 11.686 1.00 0.00 C ATOM 146 C GLU A 10 -11.016 11.981 11.018 1.00 0.00 C ATOM 147 O GLU A 10 -10.954 12.131 9.805 1.00 0.00 O ATOM 148 CB GLU A 10 -12.907 12.834 12.402 1.00 0.00 C ATOM 149 CG GLU A 10 -13.214 12.647 13.883 1.00 0.00 C ATOM 150 CD GLU A 10 -11.981 12.383 14.721 1.00 0.00 C ATOM 151 OE1 GLU A 10 -10.945 13.052 14.509 1.00 0.00 O ATOM 152 OE2 GLU A 10 -12.043 11.496 15.594 1.00 0.00 O ATOM 0 H GLU A 10 -12.407 10.660 13.561 1.00 0.00 H new ATOM 0 HA GLU A 10 -13.050 11.275 10.935 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.201 13.658 12.296 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -13.824 13.133 11.893 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -13.716 13.539 14.258 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -13.910 11.816 14.001 1.00 0.00 H new ATOM 159 N GLN A 11 -9.969 12.110 11.820 1.00 0.00 N ATOM 160 CA GLN A 11 -8.652 12.496 11.324 1.00 0.00 C ATOM 161 C GLN A 11 -8.202 11.583 10.188 1.00 0.00 C ATOM 162 O GLN A 11 -7.898 12.053 9.093 1.00 0.00 O ATOM 163 CB GLN A 11 -7.642 12.454 12.467 1.00 0.00 C ATOM 164 CG GLN A 11 -6.208 12.742 12.056 1.00 0.00 C ATOM 165 CD GLN A 11 -5.242 12.639 13.219 1.00 0.00 C ATOM 166 OE1 GLN A 11 -5.578 11.809 14.193 1.00 0.00 O flip ATOM 167 NE2 GLN A 11 -4.210 13.306 13.246 1.00 0.00 N flip ATOM 0 H GLN A 11 -10.005 11.952 12.827 1.00 0.00 H new ATOM 0 HA GLN A 11 -8.714 13.511 10.932 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -7.941 13.178 13.225 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -7.682 11.469 12.933 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -5.909 12.042 11.276 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -6.150 13.742 11.626 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -3.989 13.934 12.474 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -3.575 13.231 14.041 1.00 0.00 H new ATOM 176 N VAL A 12 -8.191 10.282 10.449 1.00 0.00 N ATOM 177 CA VAL A 12 -7.743 9.305 9.464 1.00 0.00 C ATOM 178 C VAL A 12 -8.615 9.349 8.209 1.00 0.00 C ATOM 179 O VAL A 12 -8.110 9.370 7.087 1.00 0.00 O ATOM 180 CB VAL A 12 -7.767 7.873 10.042 1.00 0.00 C ATOM 181 CG1 VAL A 12 -7.258 6.867 9.018 1.00 0.00 C ATOM 182 CG2 VAL A 12 -6.941 7.798 11.316 1.00 0.00 C ATOM 0 H VAL A 12 -8.488 9.878 11.337 1.00 0.00 H new ATOM 0 HA VAL A 12 -6.718 9.567 9.201 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.800 7.622 10.283 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -7.284 5.866 9.448 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -7.891 6.898 8.131 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.234 7.116 8.741 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -6.970 6.782 11.709 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -5.909 8.074 11.097 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -7.351 8.485 12.056 1.00 0.00 H new ATOM 192 N GLU A 13 -9.923 9.387 8.413 1.00 0.00 N ATOM 193 CA GLU A 13 -10.873 9.341 7.310 1.00 0.00 C ATOM 194 C GLU A 13 -10.819 10.627 6.486 1.00 0.00 C ATOM 195 O GLU A 13 -10.971 10.604 5.262 1.00 0.00 O ATOM 196 CB GLU A 13 -12.283 9.113 7.854 1.00 0.00 C ATOM 197 CG GLU A 13 -13.180 8.335 6.909 1.00 0.00 C ATOM 198 CD GLU A 13 -12.617 6.967 6.578 1.00 0.00 C ATOM 199 OE1 GLU A 13 -12.599 6.089 7.469 1.00 0.00 O ATOM 200 OE2 GLU A 13 -12.184 6.765 5.427 1.00 0.00 O ATOM 0 H GLU A 13 -10.353 9.450 9.336 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.604 8.513 6.654 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -12.216 8.578 8.801 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -12.742 10.079 8.065 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -14.166 8.221 7.359 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -13.314 8.903 5.988 1.00 0.00 H new ATOM 207 N LYS A 14 -10.588 11.747 7.161 1.00 0.00 N ATOM 208 CA LYS A 14 -10.496 13.039 6.490 1.00 0.00 C ATOM 209 C LYS A 14 -9.216 13.141 5.673 1.00 0.00 C ATOM 210 O LYS A 14 -9.235 13.666 4.563 1.00 0.00 O ATOM 211 CB LYS A 14 -10.577 14.193 7.493 1.00 0.00 C ATOM 212 CG LYS A 14 -11.981 14.764 7.662 1.00 0.00 C ATOM 213 CD LYS A 14 -12.976 13.719 8.140 1.00 0.00 C ATOM 214 CE LYS A 14 -14.386 14.285 8.214 1.00 0.00 C ATOM 215 NZ LYS A 14 -14.914 14.647 6.872 1.00 0.00 N ATOM 0 H LYS A 14 -10.461 11.787 8.172 1.00 0.00 H new ATOM 0 HA LYS A 14 -11.346 13.115 5.812 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -10.217 13.846 8.462 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -9.907 14.990 7.171 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -11.952 15.588 8.375 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -12.320 15.177 6.712 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.961 12.864 7.464 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -12.677 13.353 9.122 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -15.047 13.552 8.677 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -14.389 15.167 8.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -15.941 14.801 6.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -14.452 15.518 6.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -14.719 13.876 6.202 1.00 0.00 H new ATOM 229 N ILE A 15 -8.111 12.632 6.213 1.00 0.00 N ATOM 230 CA ILE A 15 -6.849 12.635 5.482 1.00 0.00 C ATOM 231 C ILE A 15 -6.984 11.796 4.216 1.00 0.00 C ATOM 232 O ILE A 15 -6.516 12.183 3.146 1.00 0.00 O ATOM 233 CB ILE A 15 -5.675 12.108 6.338 1.00 0.00 C ATOM 234 CG1 ILE A 15 -5.468 12.993 7.569 1.00 0.00 C ATOM 235 CG2 ILE A 15 -4.396 12.050 5.510 1.00 0.00 C ATOM 236 CD1 ILE A 15 -4.402 12.480 8.514 1.00 0.00 C ATOM 0 H ILE A 15 -8.064 12.217 7.144 1.00 0.00 H new ATOM 0 HA ILE A 15 -6.624 13.669 5.222 1.00 0.00 H new ATOM 0 HB ILE A 15 -5.920 11.100 6.672 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -5.199 13.998 7.242 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -6.411 13.075 8.109 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.579 11.677 6.128 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.542 11.383 4.660 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -4.151 13.049 5.149 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.311 13.158 9.363 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -4.679 11.488 8.870 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -3.448 12.424 7.990 1.00 0.00 H new ATOM 248 N LEU A 16 -7.657 10.656 4.342 1.00 0.00 N ATOM 249 CA LEU A 16 -7.927 9.795 3.199 1.00 0.00 C ATOM 250 C LEU A 16 -8.737 10.540 2.144 1.00 0.00 C ATOM 251 O LEU A 16 -8.483 10.406 0.948 1.00 0.00 O ATOM 252 CB LEU A 16 -8.676 8.533 3.635 1.00 0.00 C ATOM 253 CG LEU A 16 -7.869 7.556 4.490 1.00 0.00 C ATOM 254 CD1 LEU A 16 -8.743 6.396 4.945 1.00 0.00 C ATOM 255 CD2 LEU A 16 -6.663 7.043 3.717 1.00 0.00 C ATOM 0 H LEU A 16 -8.025 10.308 5.227 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.970 9.502 2.766 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.563 8.832 4.194 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -9.022 8.010 2.744 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.513 8.085 5.374 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.151 5.711 5.552 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.576 6.778 5.536 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.129 5.867 4.073 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.100 6.349 4.340 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -7.000 6.530 2.816 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -6.025 7.882 3.440 1.00 0.00 H new ATOM 267 N ALA A 17 -9.701 11.333 2.596 1.00 0.00 N ATOM 268 CA ALA A 17 -10.528 12.123 1.695 1.00 0.00 C ATOM 269 C ALA A 17 -9.698 13.192 0.991 1.00 0.00 C ATOM 270 O ALA A 17 -9.903 13.474 -0.191 1.00 0.00 O ATOM 271 CB ALA A 17 -11.679 12.761 2.456 1.00 0.00 C ATOM 0 H ALA A 17 -9.929 11.445 3.584 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.937 11.456 0.936 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.288 13.348 1.769 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -12.292 11.982 2.909 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -11.283 13.411 3.236 1.00 0.00 H new ATOM 277 N GLU A 18 -8.761 13.784 1.726 1.00 0.00 N ATOM 278 CA GLU A 18 -7.855 14.778 1.162 1.00 0.00 C ATOM 279 C GLU A 18 -6.962 14.137 0.106 1.00 0.00 C ATOM 280 O GLU A 18 -6.778 14.684 -0.980 1.00 0.00 O ATOM 281 CB GLU A 18 -6.999 15.417 2.261 1.00 0.00 C ATOM 282 CG GLU A 18 -7.812 16.143 3.321 1.00 0.00 C ATOM 283 CD GLU A 18 -6.961 16.657 4.463 1.00 0.00 C ATOM 284 OE1 GLU A 18 -6.478 15.840 5.262 1.00 0.00 O ATOM 285 OE2 GLU A 18 -6.768 17.890 4.569 1.00 0.00 O ATOM 0 H GLU A 18 -8.610 13.591 2.716 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.452 15.560 0.693 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -6.401 14.642 2.741 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.302 16.120 1.805 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -8.337 16.980 2.860 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -8.572 15.468 3.715 1.00 0.00 H new ATOM 292 N VAL A 19 -6.423 12.965 0.427 1.00 0.00 N ATOM 293 CA VAL A 19 -5.599 12.218 -0.517 1.00 0.00 C ATOM 294 C VAL A 19 -6.410 11.841 -1.757 1.00 0.00 C ATOM 295 O VAL A 19 -5.945 12.004 -2.888 1.00 0.00 O ATOM 296 CB VAL A 19 -5.012 10.940 0.126 1.00 0.00 C ATOM 297 CG1 VAL A 19 -4.228 10.125 -0.894 1.00 0.00 C ATOM 298 CG2 VAL A 19 -4.126 11.295 1.311 1.00 0.00 C ATOM 0 H VAL A 19 -6.542 12.512 1.333 1.00 0.00 H new ATOM 0 HA VAL A 19 -4.772 12.866 -0.808 1.00 0.00 H new ATOM 0 HB VAL A 19 -5.844 10.332 0.482 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.826 9.232 -0.415 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -4.888 9.833 -1.711 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.408 10.726 -1.287 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -3.722 10.382 1.750 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.306 11.929 0.975 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.714 11.828 2.058 1.00 0.00 H new ATOM 308 N ALA A 20 -7.628 11.356 -1.540 1.00 0.00 N ATOM 309 CA ALA A 20 -8.522 10.999 -2.638 1.00 0.00 C ATOM 310 C ALA A 20 -8.813 12.208 -3.522 1.00 0.00 C ATOM 311 O ALA A 20 -8.923 12.090 -4.744 1.00 0.00 O ATOM 312 CB ALA A 20 -9.818 10.415 -2.099 1.00 0.00 C ATOM 0 H ALA A 20 -8.020 11.200 -0.611 1.00 0.00 H new ATOM 0 HA ALA A 20 -8.024 10.245 -3.247 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.473 10.154 -2.930 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.599 9.521 -1.515 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.312 11.151 -1.464 1.00 0.00 H new ATOM 318 N LEU A 21 -8.921 13.376 -2.895 1.00 0.00 N ATOM 319 CA LEU A 21 -9.162 14.616 -3.620 1.00 0.00 C ATOM 320 C LEU A 21 -7.974 14.935 -4.523 1.00 0.00 C ATOM 321 O LEU A 21 -8.146 15.442 -5.627 1.00 0.00 O ATOM 322 CB LEU A 21 -9.432 15.765 -2.633 1.00 0.00 C ATOM 323 CG LEU A 21 -9.902 17.090 -3.253 1.00 0.00 C ATOM 324 CD1 LEU A 21 -10.742 17.870 -2.256 1.00 0.00 C ATOM 325 CD2 LEU A 21 -8.718 17.940 -3.696 1.00 0.00 C ATOM 0 H LEU A 21 -8.845 13.488 -1.884 1.00 0.00 H new ATOM 0 HA LEU A 21 -10.044 14.496 -4.249 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -10.185 15.434 -1.918 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -8.519 15.955 -2.069 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.506 16.852 -4.129 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -11.068 18.806 -2.709 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -11.614 17.280 -1.975 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -10.147 18.084 -1.368 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -9.081 18.871 -4.131 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.088 18.163 -2.835 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -8.137 17.395 -4.440 1.00 0.00 H new ATOM 337 N VAL A 22 -6.773 14.602 -4.062 1.00 0.00 N ATOM 338 CA VAL A 22 -5.561 14.846 -4.838 1.00 0.00 C ATOM 339 C VAL A 22 -5.531 13.932 -6.058 1.00 0.00 C ATOM 340 O VAL A 22 -5.144 14.341 -7.156 1.00 0.00 O ATOM 341 CB VAL A 22 -4.289 14.620 -3.988 1.00 0.00 C ATOM 342 CG1 VAL A 22 -3.032 14.815 -4.823 1.00 0.00 C ATOM 343 CG2 VAL A 22 -4.275 15.550 -2.784 1.00 0.00 C ATOM 0 H VAL A 22 -6.612 14.163 -3.156 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.575 15.888 -5.159 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.304 13.590 -3.631 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.153 14.650 -4.201 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -3.030 14.104 -5.649 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.012 15.831 -5.218 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.372 15.375 -2.199 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.292 16.586 -3.124 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.151 15.357 -2.165 1.00 0.00 H new ATOM 353 N LEU A 23 -5.965 12.699 -5.852 1.00 0.00 N ATOM 354 CA LEU A 23 -6.075 11.727 -6.931 1.00 0.00 C ATOM 355 C LEU A 23 -7.046 12.229 -7.992 1.00 0.00 C ATOM 356 O LEU A 23 -6.734 12.235 -9.182 1.00 0.00 O ATOM 357 CB LEU A 23 -6.546 10.379 -6.376 1.00 0.00 C ATOM 358 CG LEU A 23 -5.453 9.453 -5.822 1.00 0.00 C ATOM 359 CD1 LEU A 23 -4.405 10.225 -5.034 1.00 0.00 C ATOM 360 CD2 LEU A 23 -6.081 8.396 -4.937 1.00 0.00 C ATOM 0 H LEU A 23 -6.250 12.344 -4.939 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.095 11.595 -7.389 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.268 10.569 -5.582 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.075 9.849 -7.168 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.954 8.982 -6.669 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.650 9.534 -4.659 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -3.932 10.962 -5.683 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -4.881 10.732 -4.195 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.303 7.740 -4.545 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.601 8.877 -4.109 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.791 7.809 -5.519 1.00 0.00 H new ATOM 372 N GLU A 24 -8.215 12.668 -7.542 1.00 0.00 N ATOM 373 CA GLU A 24 -9.229 13.222 -8.432 1.00 0.00 C ATOM 374 C GLU A 24 -8.704 14.479 -9.129 1.00 0.00 C ATOM 375 O GLU A 24 -8.946 14.692 -10.319 1.00 0.00 O ATOM 376 CB GLU A 24 -10.491 13.552 -7.633 1.00 0.00 C ATOM 377 CG GLU A 24 -11.611 14.145 -8.468 1.00 0.00 C ATOM 378 CD GLU A 24 -12.795 14.563 -7.625 1.00 0.00 C ATOM 379 OE1 GLU A 24 -12.818 15.719 -7.163 1.00 0.00 O ATOM 380 OE2 GLU A 24 -13.709 13.733 -7.419 1.00 0.00 O ATOM 0 H GLU A 24 -8.486 12.651 -6.559 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.469 12.481 -9.195 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.852 12.643 -7.152 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.233 14.253 -6.839 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.235 15.009 -9.016 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.935 13.414 -9.209 1.00 0.00 H new ATOM 387 N LYS A 25 -7.974 15.289 -8.370 1.00 0.00 N ATOM 388 CA LYS A 25 -7.423 16.554 -8.849 1.00 0.00 C ATOM 389 C LYS A 25 -6.593 16.368 -10.121 1.00 0.00 C ATOM 390 O LYS A 25 -6.690 17.163 -11.053 1.00 0.00 O ATOM 391 CB LYS A 25 -6.559 17.170 -7.745 1.00 0.00 C ATOM 392 CG LYS A 25 -6.000 18.544 -8.063 1.00 0.00 C ATOM 393 CD LYS A 25 -5.068 19.012 -6.956 1.00 0.00 C ATOM 394 CE LYS A 25 -4.520 20.403 -7.223 1.00 0.00 C ATOM 395 NZ LYS A 25 -5.588 21.439 -7.216 1.00 0.00 N ATOM 0 H LYS A 25 -7.746 15.086 -7.397 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.251 17.218 -9.096 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.153 17.238 -6.834 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -5.729 16.496 -7.535 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -5.462 18.513 -9.010 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -6.817 19.256 -8.183 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -5.603 19.009 -6.006 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -4.241 18.309 -6.858 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -3.773 20.648 -6.468 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -4.013 20.413 -8.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -5.155 22.384 -7.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -6.192 21.320 -8.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -6.165 21.337 -6.356 1.00 0.00 H new ATOM 409 N HIS A 26 -5.784 15.316 -10.158 1.00 0.00 N ATOM 410 CA HIS A 26 -4.903 15.082 -11.302 1.00 0.00 C ATOM 411 C HIS A 26 -5.417 13.949 -12.181 1.00 0.00 C ATOM 412 O HIS A 26 -4.736 13.535 -13.118 1.00 0.00 O ATOM 413 CB HIS A 26 -3.478 14.764 -10.840 1.00 0.00 C ATOM 414 CG HIS A 26 -2.783 15.903 -10.160 1.00 0.00 C ATOM 415 ND1 HIS A 26 -1.861 16.710 -10.787 1.00 0.00 N ATOM 416 CD2 HIS A 26 -2.871 16.357 -8.891 1.00 0.00 C ATOM 417 CE1 HIS A 26 -1.412 17.608 -9.931 1.00 0.00 C ATOM 418 NE2 HIS A 26 -2.009 17.417 -8.770 1.00 0.00 N ATOM 0 H HIS A 26 -5.718 14.616 -9.419 1.00 0.00 H new ATOM 0 HA HIS A 26 -4.892 16.000 -11.890 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -3.511 13.914 -10.158 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -2.888 14.457 -11.704 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -3.505 15.958 -8.113 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -0.679 18.371 -10.145 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -1.855 17.966 -7.924 1.00 0.00 H new ATOM 427 N ALA A 27 -6.623 13.467 -11.881 1.00 0.00 N ATOM 428 CA ALA A 27 -7.237 12.365 -12.625 1.00 0.00 C ATOM 429 C ALA A 27 -6.373 11.106 -12.558 1.00 0.00 C ATOM 430 O ALA A 27 -6.120 10.450 -13.574 1.00 0.00 O ATOM 431 CB ALA A 27 -7.490 12.771 -14.072 1.00 0.00 C ATOM 0 H ALA A 27 -7.200 13.826 -11.120 1.00 0.00 H new ATOM 0 HA ALA A 27 -8.196 12.136 -12.159 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -7.946 11.939 -14.609 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -8.160 13.630 -14.097 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -6.545 13.034 -14.547 1.00 0.00 H new ATOM 437 N ALA A 28 -5.932 10.773 -11.351 1.00 0.00 N ATOM 438 CA ALA A 28 -5.096 9.602 -11.128 1.00 0.00 C ATOM 439 C ALA A 28 -5.863 8.313 -11.406 1.00 0.00 C ATOM 440 O ALA A 28 -6.901 8.050 -10.794 1.00 0.00 O ATOM 441 CB ALA A 28 -4.563 9.600 -9.703 1.00 0.00 C ATOM 0 H ALA A 28 -6.142 11.303 -10.505 1.00 0.00 H new ATOM 0 HA ALA A 28 -4.257 9.651 -11.822 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -3.939 8.719 -9.549 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -3.969 10.499 -9.535 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -5.398 9.580 -9.002 1.00 0.00 H new ATOM 447 N SER A 29 -5.349 7.524 -12.337 1.00 0.00 N ATOM 448 CA SER A 29 -5.952 6.250 -12.695 1.00 0.00 C ATOM 449 C SER A 29 -5.620 5.198 -11.626 1.00 0.00 C ATOM 450 O SER A 29 -4.601 5.319 -10.942 1.00 0.00 O ATOM 451 CB SER A 29 -5.432 5.822 -14.073 1.00 0.00 C ATOM 452 OG SER A 29 -6.275 4.855 -14.681 1.00 0.00 O ATOM 0 H SER A 29 -4.505 7.748 -12.864 1.00 0.00 H new ATOM 0 HA SER A 29 -7.036 6.348 -12.744 1.00 0.00 H new ATOM 0 HB2 SER A 29 -5.357 6.696 -14.720 1.00 0.00 H new ATOM 0 HB3 SER A 29 -4.427 5.414 -13.971 1.00 0.00 H new ATOM 0 HG SER A 29 -6.079 3.970 -14.309 1.00 0.00 H new ATOM 458 N PRO A 30 -6.486 4.174 -11.449 1.00 0.00 N ATOM 459 CA PRO A 30 -6.314 3.117 -10.437 1.00 0.00 C ATOM 460 C PRO A 30 -4.896 2.536 -10.372 1.00 0.00 C ATOM 461 O PRO A 30 -4.387 2.276 -9.278 1.00 0.00 O ATOM 462 CB PRO A 30 -7.316 2.028 -10.860 1.00 0.00 C ATOM 463 CG PRO A 30 -7.906 2.486 -12.154 1.00 0.00 C ATOM 464 CD PRO A 30 -7.727 3.973 -12.203 1.00 0.00 C ATOM 0 HA PRO A 30 -6.484 3.518 -9.438 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -6.818 1.065 -10.978 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -8.090 1.896 -10.104 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -7.408 2.008 -12.998 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -8.961 2.220 -12.214 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -7.642 4.337 -13.227 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -8.567 4.497 -11.747 1.00 0.00 H new ATOM 472 N GLU A 31 -4.265 2.323 -11.527 1.00 0.00 N ATOM 473 CA GLU A 31 -2.901 1.787 -11.560 1.00 0.00 C ATOM 474 C GLU A 31 -1.961 2.731 -10.825 1.00 0.00 C ATOM 475 O GLU A 31 -1.147 2.311 -10.003 1.00 0.00 O ATOM 476 CB GLU A 31 -2.389 1.597 -12.995 1.00 0.00 C ATOM 477 CG GLU A 31 -3.433 1.120 -13.988 1.00 0.00 C ATOM 478 CD GLU A 31 -4.259 2.264 -14.524 1.00 0.00 C ATOM 479 OE1 GLU A 31 -3.756 3.010 -15.384 1.00 0.00 O ATOM 480 OE2 GLU A 31 -5.402 2.445 -14.064 1.00 0.00 O ATOM 0 H GLU A 31 -4.670 2.511 -12.444 1.00 0.00 H new ATOM 0 HA GLU A 31 -2.925 0.811 -11.075 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.979 2.544 -13.347 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.568 0.880 -12.980 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.941 0.608 -14.815 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -4.087 0.393 -13.507 1.00 0.00 H new ATOM 487 N LEU A 32 -2.104 4.018 -11.116 1.00 0.00 N ATOM 488 CA LEU A 32 -1.298 5.050 -10.483 1.00 0.00 C ATOM 489 C LEU A 32 -1.601 5.110 -8.992 1.00 0.00 C ATOM 490 O LEU A 32 -0.704 5.304 -8.173 1.00 0.00 O ATOM 491 CB LEU A 32 -1.571 6.410 -11.134 1.00 0.00 C ATOM 492 CG LEU A 32 -0.831 7.595 -10.512 1.00 0.00 C ATOM 493 CD1 LEU A 32 0.670 7.405 -10.612 1.00 0.00 C ATOM 494 CD2 LEU A 32 -1.249 8.890 -11.185 1.00 0.00 C ATOM 0 H LEU A 32 -2.779 4.373 -11.794 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.245 4.804 -10.618 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.303 6.349 -12.189 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.642 6.607 -11.088 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.097 7.649 -9.456 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.176 8.260 -10.163 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.958 6.495 -10.085 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.957 7.323 -11.660 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.714 9.725 -10.732 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.012 8.841 -12.248 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.322 9.036 -11.059 1.00 0.00 H new ATOM 506 N THR A 33 -2.869 4.916 -8.651 1.00 0.00 N ATOM 507 CA THR A 33 -3.308 4.918 -7.264 1.00 0.00 C ATOM 508 C THR A 33 -2.535 3.886 -6.435 1.00 0.00 C ATOM 509 O THR A 33 -1.946 4.217 -5.404 1.00 0.00 O ATOM 510 CB THR A 33 -4.815 4.617 -7.175 1.00 0.00 C ATOM 511 OG1 THR A 33 -5.546 5.540 -7.991 1.00 0.00 O ATOM 512 CG2 THR A 33 -5.305 4.702 -5.739 1.00 0.00 C ATOM 0 H THR A 33 -3.617 4.754 -9.325 1.00 0.00 H new ATOM 0 HA THR A 33 -3.111 5.911 -6.859 1.00 0.00 H new ATOM 0 HB THR A 33 -4.981 3.602 -7.535 1.00 0.00 H new ATOM 0 HG1 THR A 33 -6.504 5.342 -7.931 1.00 0.00 H new ATOM 0 HG21 THR A 33 -6.373 4.485 -5.705 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.768 3.977 -5.128 1.00 0.00 H new ATOM 0 HG23 THR A 33 -5.126 5.705 -5.352 1.00 0.00 H new ATOM 520 N LEU A 34 -2.518 2.646 -6.907 1.00 0.00 N ATOM 521 CA LEU A 34 -1.860 1.573 -6.177 1.00 0.00 C ATOM 522 C LEU A 34 -0.339 1.688 -6.322 1.00 0.00 C ATOM 523 O LEU A 34 0.417 1.206 -5.476 1.00 0.00 O ATOM 524 CB LEU A 34 -2.377 0.207 -6.659 1.00 0.00 C ATOM 525 CG LEU A 34 -2.125 -0.954 -5.699 1.00 0.00 C ATOM 526 CD1 LEU A 34 -3.291 -1.929 -5.728 1.00 0.00 C ATOM 527 CD2 LEU A 34 -0.835 -1.675 -6.053 1.00 0.00 C ATOM 0 H LEU A 34 -2.949 2.361 -7.786 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.098 1.661 -5.117 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.449 0.284 -6.839 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -1.909 -0.025 -7.616 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.030 -0.547 -4.692 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.096 -2.750 -5.039 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.204 -1.414 -5.429 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -3.411 -2.323 -6.737 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.675 -2.498 -5.356 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.904 -2.067 -7.068 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.001 -0.978 -5.989 1.00 0.00 H new ATOM 539 N MET A 35 0.103 2.342 -7.392 1.00 0.00 N ATOM 540 CA MET A 35 1.519 2.647 -7.570 1.00 0.00 C ATOM 541 C MET A 35 1.992 3.567 -6.451 1.00 0.00 C ATOM 542 O MET A 35 3.020 3.326 -5.817 1.00 0.00 O ATOM 543 CB MET A 35 1.759 3.334 -8.915 1.00 0.00 C ATOM 544 CG MET A 35 3.229 3.571 -9.230 1.00 0.00 C ATOM 545 SD MET A 35 3.478 4.881 -10.446 1.00 0.00 S ATOM 546 CE MET A 35 2.352 4.374 -11.740 1.00 0.00 C ATOM 0 H MET A 35 -0.498 2.671 -8.148 1.00 0.00 H new ATOM 0 HA MET A 35 2.077 1.711 -7.544 1.00 0.00 H new ATOM 0 HB2 MET A 35 1.321 2.726 -9.706 1.00 0.00 H new ATOM 0 HB3 MET A 35 1.237 4.291 -8.922 1.00 0.00 H new ATOM 0 HG2 MET A 35 3.756 3.828 -8.311 1.00 0.00 H new ATOM 0 HG3 MET A 35 3.670 2.646 -9.602 1.00 0.00 H new ATOM 0 HE1 MET A 35 2.863 4.410 -12.702 1.00 0.00 H new ATOM 0 HE2 MET A 35 2.012 3.356 -11.548 1.00 0.00 H new ATOM 0 HE3 MET A 35 1.494 5.046 -11.759 1.00 0.00 H new ATOM 556 N ILE A 36 1.215 4.616 -6.214 1.00 0.00 N ATOM 557 CA ILE A 36 1.507 5.587 -5.174 1.00 0.00 C ATOM 558 C ILE A 36 1.544 4.926 -3.801 1.00 0.00 C ATOM 559 O ILE A 36 2.420 5.224 -2.989 1.00 0.00 O ATOM 560 CB ILE A 36 0.472 6.733 -5.203 1.00 0.00 C ATOM 561 CG1 ILE A 36 0.663 7.556 -6.481 1.00 0.00 C ATOM 562 CG2 ILE A 36 0.581 7.613 -3.962 1.00 0.00 C ATOM 563 CD1 ILE A 36 -0.410 8.595 -6.712 1.00 0.00 C ATOM 0 H ILE A 36 0.364 4.816 -6.740 1.00 0.00 H new ATOM 0 HA ILE A 36 2.494 6.007 -5.367 1.00 0.00 H new ATOM 0 HB ILE A 36 -0.529 6.303 -5.201 1.00 0.00 H new ATOM 0 HG12 ILE A 36 1.632 8.053 -6.439 1.00 0.00 H new ATOM 0 HG13 ILE A 36 0.689 6.880 -7.335 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -0.161 8.409 -4.014 1.00 0.00 H new ATOM 0 HG22 ILE A 36 0.404 7.010 -3.072 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.579 8.050 -3.912 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -0.202 9.134 -7.636 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -1.381 8.105 -6.789 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.423 9.297 -5.878 1.00 0.00 H new ATOM 575 N ALA A 37 0.613 4.010 -3.555 1.00 0.00 N ATOM 576 CA ALA A 37 0.577 3.272 -2.295 1.00 0.00 C ATOM 577 C ALA A 37 1.895 2.538 -2.054 1.00 0.00 C ATOM 578 O ALA A 37 2.420 2.532 -0.938 1.00 0.00 O ATOM 579 CB ALA A 37 -0.584 2.288 -2.288 1.00 0.00 C ATOM 0 H ALA A 37 -0.127 3.760 -4.211 1.00 0.00 H new ATOM 0 HA ALA A 37 0.433 3.989 -1.487 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -0.596 1.746 -1.342 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -1.522 2.831 -2.408 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -0.467 1.581 -3.109 1.00 0.00 H new ATOM 585 N GLY A 38 2.434 1.942 -3.113 1.00 0.00 N ATOM 586 CA GLY A 38 3.702 1.244 -3.012 1.00 0.00 C ATOM 587 C GLY A 38 4.861 2.195 -2.795 1.00 0.00 C ATOM 588 O GLY A 38 5.795 1.894 -2.048 1.00 0.00 O ATOM 0 H GLY A 38 2.013 1.930 -4.042 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.659 0.532 -2.188 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.872 0.668 -3.922 1.00 0.00 H new ATOM 592 N ASN A 39 4.793 3.350 -3.450 1.00 0.00 N ATOM 593 CA ASN A 39 5.803 4.391 -3.287 1.00 0.00 C ATOM 594 C ASN A 39 5.829 4.876 -1.845 1.00 0.00 C ATOM 595 O ASN A 39 6.898 5.059 -1.264 1.00 0.00 O ATOM 596 CB ASN A 39 5.534 5.573 -4.227 1.00 0.00 C ATOM 597 CG ASN A 39 5.685 5.208 -5.692 1.00 0.00 C ATOM 598 OD1 ASN A 39 6.473 4.337 -6.051 1.00 0.00 O ATOM 599 ND2 ASN A 39 4.933 5.878 -6.554 1.00 0.00 N ATOM 0 H ASN A 39 4.046 3.589 -4.101 1.00 0.00 H new ATOM 0 HA ASN A 39 6.772 3.962 -3.541 1.00 0.00 H new ATOM 0 HB2 ASN A 39 4.525 5.947 -4.053 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.221 6.385 -3.987 1.00 0.00 H new ATOM 0 HD21 ASN A 39 4.998 5.676 -7.552 1.00 0.00 H new ATOM 0 HD22 ASN A 39 4.289 6.595 -6.219 1.00 0.00 H new ATOM 606 N ILE A 40 4.644 5.066 -1.270 1.00 0.00 N ATOM 607 CA ILE A 40 4.527 5.482 0.123 1.00 0.00 C ATOM 608 C ILE A 40 5.212 4.472 1.039 1.00 0.00 C ATOM 609 O ILE A 40 6.110 4.830 1.799 1.00 0.00 O ATOM 610 CB ILE A 40 3.051 5.645 0.557 1.00 0.00 C ATOM 611 CG1 ILE A 40 2.361 6.729 -0.276 1.00 0.00 C ATOM 612 CG2 ILE A 40 2.963 5.980 2.042 1.00 0.00 C ATOM 613 CD1 ILE A 40 0.881 6.868 0.008 1.00 0.00 C ATOM 0 H ILE A 40 3.752 4.938 -1.748 1.00 0.00 H new ATOM 0 HA ILE A 40 5.017 6.452 0.209 1.00 0.00 H new ATOM 0 HB ILE A 40 2.538 4.699 0.385 1.00 0.00 H new ATOM 0 HG12 ILE A 40 2.849 7.685 -0.087 1.00 0.00 H new ATOM 0 HG13 ILE A 40 2.499 6.504 -1.334 1.00 0.00 H new ATOM 0 HG21 ILE A 40 1.917 6.091 2.329 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.415 5.177 2.624 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.493 6.912 2.237 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.462 7.655 -0.620 1.00 0.00 H new ATOM 0 HD12 ILE A 40 0.379 5.925 -0.209 1.00 0.00 H new ATOM 0 HD13 ILE A 40 0.734 7.124 1.057 1.00 0.00 H new ATOM 625 N ALA A 41 4.796 3.209 0.942 1.00 0.00 N ATOM 626 CA ALA A 41 5.328 2.151 1.789 1.00 0.00 C ATOM 627 C ALA A 41 6.849 2.088 1.712 1.00 0.00 C ATOM 628 O ALA A 41 7.529 2.144 2.735 1.00 0.00 O ATOM 629 CB ALA A 41 4.724 0.813 1.394 1.00 0.00 C ATOM 0 H ALA A 41 4.087 2.896 0.279 1.00 0.00 H new ATOM 0 HA ALA A 41 5.056 2.376 2.820 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.128 0.028 2.033 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.641 0.854 1.511 1.00 0.00 H new ATOM 0 HB3 ALA A 41 4.969 0.596 0.354 1.00 0.00 H new ATOM 635 N THR A 42 7.376 2.003 0.495 1.00 0.00 N ATOM 636 CA THR A 42 8.814 1.880 0.288 1.00 0.00 C ATOM 637 C THR A 42 9.566 3.075 0.872 1.00 0.00 C ATOM 638 O THR A 42 10.568 2.909 1.566 1.00 0.00 O ATOM 639 CB THR A 42 9.157 1.746 -1.208 1.00 0.00 C ATOM 640 OG1 THR A 42 8.325 0.747 -1.812 1.00 0.00 O ATOM 641 CG2 THR A 42 10.621 1.364 -1.398 1.00 0.00 C ATOM 0 H THR A 42 6.827 2.017 -0.365 1.00 0.00 H new ATOM 0 HA THR A 42 9.129 0.975 0.807 1.00 0.00 H new ATOM 0 HB THR A 42 8.981 2.710 -1.684 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.443 1.129 -2.006 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.839 1.275 -2.462 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.257 2.133 -0.960 1.00 0.00 H new ATOM 0 HG23 THR A 42 10.815 0.410 -0.907 1.00 0.00 H new ATOM 649 N ASN A 43 9.069 4.278 0.608 1.00 0.00 N ATOM 650 CA ASN A 43 9.723 5.492 1.087 1.00 0.00 C ATOM 651 C ASN A 43 9.714 5.547 2.613 1.00 0.00 C ATOM 652 O ASN A 43 10.677 6.001 3.234 1.00 0.00 O ATOM 653 CB ASN A 43 9.044 6.733 0.504 1.00 0.00 C ATOM 654 CG ASN A 43 9.751 8.022 0.877 1.00 0.00 C ATOM 655 OD1 ASN A 43 10.669 8.462 0.186 1.00 0.00 O ATOM 656 ND2 ASN A 43 9.316 8.649 1.960 1.00 0.00 N ATOM 0 H ASN A 43 8.219 4.440 0.067 1.00 0.00 H new ATOM 0 HA ASN A 43 10.760 5.474 0.752 1.00 0.00 H new ATOM 0 HB2 ASN A 43 9.008 6.645 -0.582 1.00 0.00 H new ATOM 0 HB3 ASN A 43 8.013 6.775 0.855 1.00 0.00 H new ATOM 0 HD21 ASN A 43 9.745 9.529 2.247 1.00 0.00 H new ATOM 0 HD22 ASN A 43 8.552 8.252 2.507 1.00 0.00 H new ATOM 663 N VAL A 44 8.628 5.074 3.217 1.00 0.00 N ATOM 664 CA VAL A 44 8.549 4.981 4.668 1.00 0.00 C ATOM 665 C VAL A 44 9.581 3.984 5.183 1.00 0.00 C ATOM 666 O VAL A 44 10.265 4.245 6.173 1.00 0.00 O ATOM 667 CB VAL A 44 7.138 4.567 5.147 1.00 0.00 C ATOM 668 CG1 VAL A 44 7.111 4.351 6.654 1.00 0.00 C ATOM 669 CG2 VAL A 44 6.115 5.618 4.753 1.00 0.00 C ATOM 0 H VAL A 44 7.795 4.751 2.725 1.00 0.00 H new ATOM 0 HA VAL A 44 8.758 5.972 5.071 1.00 0.00 H new ATOM 0 HB VAL A 44 6.883 3.624 4.662 1.00 0.00 H new ATOM 0 HG11 VAL A 44 6.106 4.061 6.962 1.00 0.00 H new ATOM 0 HG12 VAL A 44 7.814 3.562 6.921 1.00 0.00 H new ATOM 0 HG13 VAL A 44 7.393 5.275 7.159 1.00 0.00 H new ATOM 0 HG21 VAL A 44 5.127 5.311 5.097 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.379 6.572 5.210 1.00 0.00 H new ATOM 0 HG23 VAL A 44 6.104 5.726 3.668 1.00 0.00 H new ATOM 679 N LEU A 45 9.713 2.860 4.483 1.00 0.00 N ATOM 680 CA LEU A 45 10.691 1.840 4.847 1.00 0.00 C ATOM 681 C LEU A 45 12.107 2.397 4.748 1.00 0.00 C ATOM 682 O LEU A 45 12.991 2.027 5.519 1.00 0.00 O ATOM 683 CB LEU A 45 10.565 0.607 3.945 1.00 0.00 C ATOM 684 CG LEU A 45 9.180 -0.043 3.900 1.00 0.00 C ATOM 685 CD1 LEU A 45 9.174 -1.211 2.928 1.00 0.00 C ATOM 686 CD2 LEU A 45 8.757 -0.506 5.284 1.00 0.00 C ATOM 0 H LEU A 45 9.154 2.633 3.660 1.00 0.00 H new ATOM 0 HA LEU A 45 10.490 1.544 5.876 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.846 0.891 2.931 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.286 -0.140 4.278 1.00 0.00 H new ATOM 0 HG LEU A 45 8.464 0.703 3.554 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.182 -1.662 2.908 1.00 0.00 H new ATOM 0 HD12 LEU A 45 9.431 -0.855 1.930 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.904 -1.954 3.248 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.770 -0.965 5.228 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.475 -1.235 5.659 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.722 0.349 5.959 1.00 0.00 H new ATOM 698 N ASN A 46 12.314 3.289 3.796 1.00 0.00 N ATOM 699 CA ASN A 46 13.619 3.899 3.596 1.00 0.00 C ATOM 700 C ASN A 46 13.941 4.891 4.707 1.00 0.00 C ATOM 701 O ASN A 46 14.957 4.762 5.395 1.00 0.00 O ATOM 702 CB ASN A 46 13.688 4.630 2.248 1.00 0.00 C ATOM 703 CG ASN A 46 13.510 3.721 1.042 1.00 0.00 C ATOM 704 OD1 ASN A 46 13.928 2.470 1.162 1.00 0.00 O flip ATOM 705 ND2 ASN A 46 13.009 4.149 0.001 1.00 0.00 N flip ATOM 0 H ASN A 46 11.595 3.608 3.147 1.00 0.00 H new ATOM 0 HA ASN A 46 14.351 3.091 3.609 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.919 5.402 2.225 1.00 0.00 H new ATOM 0 HB3 ASN A 46 14.650 5.136 2.170 1.00 0.00 H new ATOM 0 HD21 ASN A 46 12.698 5.119 -0.054 1.00 0.00 H new ATOM 0 HD22 ASN A 46 12.905 3.533 -0.806 1.00 0.00 H new ATOM 712 N GLN A 47 13.059 5.866 4.893 1.00 0.00 N ATOM 713 CA GLN A 47 13.379 7.041 5.694 1.00 0.00 C ATOM 714 C GLN A 47 12.800 6.989 7.106 1.00 0.00 C ATOM 715 O GLN A 47 13.455 7.400 8.063 1.00 0.00 O ATOM 716 CB GLN A 47 12.845 8.291 4.997 1.00 0.00 C ATOM 717 CG GLN A 47 13.222 8.387 3.528 1.00 0.00 C ATOM 718 CD GLN A 47 12.598 9.590 2.850 1.00 0.00 C ATOM 719 OE1 GLN A 47 11.527 10.055 3.245 1.00 0.00 O ATOM 720 NE2 GLN A 47 13.249 10.088 1.811 1.00 0.00 N ATOM 0 H GLN A 47 12.118 5.866 4.500 1.00 0.00 H new ATOM 0 HA GLN A 47 14.465 7.066 5.787 1.00 0.00 H new ATOM 0 HB2 GLN A 47 11.759 8.308 5.085 1.00 0.00 H new ATOM 0 HB3 GLN A 47 13.220 9.173 5.516 1.00 0.00 H new ATOM 0 HG2 GLN A 47 14.307 8.444 3.437 1.00 0.00 H new ATOM 0 HG3 GLN A 47 12.906 7.479 3.014 1.00 0.00 H new ATOM 0 HE21 GLN A 47 14.133 9.673 1.517 1.00 0.00 H new ATOM 0 HE22 GLN A 47 12.867 10.887 1.305 1.00 0.00 H new ATOM 729 N ARG A 48 11.579 6.494 7.242 1.00 0.00 N ATOM 730 CA ARG A 48 10.826 6.701 8.476 1.00 0.00 C ATOM 731 C ARG A 48 10.699 5.430 9.316 1.00 0.00 C ATOM 732 O ARG A 48 9.837 5.347 10.191 1.00 0.00 O ATOM 733 CB ARG A 48 9.439 7.270 8.154 1.00 0.00 C ATOM 734 CG ARG A 48 9.493 8.569 7.359 1.00 0.00 C ATOM 735 CD ARG A 48 8.118 9.196 7.187 1.00 0.00 C ATOM 736 NE ARG A 48 8.174 10.411 6.370 1.00 0.00 N ATOM 737 CZ ARG A 48 7.732 11.606 6.769 1.00 0.00 C ATOM 738 NH1 ARG A 48 7.204 11.759 7.976 1.00 0.00 N ATOM 739 NH2 ARG A 48 7.817 12.651 5.954 1.00 0.00 N ATOM 0 H ARG A 48 11.092 5.954 6.527 1.00 0.00 H new ATOM 0 HA ARG A 48 11.387 7.417 9.077 1.00 0.00 H new ATOM 0 HB2 ARG A 48 8.872 6.530 7.590 1.00 0.00 H new ATOM 0 HB3 ARG A 48 8.899 7.443 9.085 1.00 0.00 H new ATOM 0 HG2 ARG A 48 10.152 9.275 7.865 1.00 0.00 H new ATOM 0 HG3 ARG A 48 9.927 8.375 6.378 1.00 0.00 H new ATOM 0 HD2 ARG A 48 7.445 8.476 6.722 1.00 0.00 H new ATOM 0 HD3 ARG A 48 7.702 9.435 8.166 1.00 0.00 H new ATOM 0 HE ARG A 48 8.577 10.339 5.436 1.00 0.00 H new ATOM 0 HH11 ARG A 48 7.133 10.961 8.607 1.00 0.00 H new ATOM 0 HH12 ARG A 48 6.869 12.675 8.274 1.00 0.00 H new ATOM 0 HH21 ARG A 48 8.220 12.541 5.023 1.00 0.00 H new ATOM 0 HH22 ARG A 48 7.479 13.564 6.259 1.00 0.00 H new ATOM 753 N VAL A 49 11.565 4.456 9.075 1.00 0.00 N ATOM 754 CA VAL A 49 11.563 3.239 9.877 1.00 0.00 C ATOM 755 C VAL A 49 12.991 2.732 10.072 1.00 0.00 C ATOM 756 O VAL A 49 13.893 3.086 9.307 1.00 0.00 O ATOM 757 CB VAL A 49 10.686 2.131 9.239 1.00 0.00 C ATOM 758 CG1 VAL A 49 11.426 1.418 8.124 1.00 0.00 C ATOM 759 CG2 VAL A 49 10.210 1.137 10.285 1.00 0.00 C ATOM 0 H VAL A 49 12.271 4.482 8.339 1.00 0.00 H new ATOM 0 HA VAL A 49 11.132 3.485 10.847 1.00 0.00 H new ATOM 0 HB VAL A 49 9.810 2.616 8.808 1.00 0.00 H new ATOM 0 HG11 VAL A 49 10.785 0.647 7.697 1.00 0.00 H new ATOM 0 HG12 VAL A 49 11.696 2.136 7.349 1.00 0.00 H new ATOM 0 HG13 VAL A 49 12.330 0.958 8.523 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.597 0.372 9.808 1.00 0.00 H new ATOM 0 HG22 VAL A 49 11.072 0.668 10.760 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.619 1.657 11.039 1.00 0.00 H new ATOM 769 N ALA A 50 13.193 1.917 11.103 1.00 0.00 N ATOM 770 CA ALA A 50 14.504 1.351 11.396 1.00 0.00 C ATOM 771 C ALA A 50 14.877 0.282 10.374 1.00 0.00 C ATOM 772 O ALA A 50 14.016 -0.461 9.900 1.00 0.00 O ATOM 773 CB ALA A 50 14.523 0.769 12.803 1.00 0.00 C ATOM 0 H ALA A 50 12.460 1.633 11.753 1.00 0.00 H new ATOM 0 HA ALA A 50 15.243 2.150 11.335 1.00 0.00 H new ATOM 0 HB1 ALA A 50 15.507 0.349 13.010 1.00 0.00 H new ATOM 0 HB2 ALA A 50 14.305 1.556 13.525 1.00 0.00 H new ATOM 0 HB3 ALA A 50 13.770 -0.015 12.883 1.00 0.00 H new ATOM 779 N ALA A 51 16.162 0.213 10.043 1.00 0.00 N ATOM 780 CA ALA A 51 16.670 -0.757 9.077 1.00 0.00 C ATOM 781 C ALA A 51 16.272 -2.185 9.448 1.00 0.00 C ATOM 782 O ALA A 51 15.832 -2.956 8.595 1.00 0.00 O ATOM 783 CB ALA A 51 18.183 -0.649 8.965 1.00 0.00 C ATOM 0 H ALA A 51 16.879 0.824 10.434 1.00 0.00 H new ATOM 0 HA ALA A 51 16.221 -0.525 8.111 1.00 0.00 H new ATOM 0 HB1 ALA A 51 18.547 -1.378 8.241 1.00 0.00 H new ATOM 0 HB2 ALA A 51 18.453 0.355 8.636 1.00 0.00 H new ATOM 0 HB3 ALA A 51 18.635 -0.846 9.937 1.00 0.00 H new ATOM 789 N SER A 52 16.415 -2.524 10.722 1.00 0.00 N ATOM 790 CA SER A 52 16.085 -3.860 11.202 1.00 0.00 C ATOM 791 C SER A 52 14.571 -4.073 11.261 1.00 0.00 C ATOM 792 O SER A 52 14.093 -5.206 11.266 1.00 0.00 O ATOM 793 CB SER A 52 16.703 -4.074 12.583 1.00 0.00 C ATOM 794 OG SER A 52 18.072 -3.707 12.578 1.00 0.00 O ATOM 0 H SER A 52 16.758 -1.891 11.444 1.00 0.00 H new ATOM 0 HA SER A 52 16.495 -4.588 10.502 1.00 0.00 H new ATOM 0 HB2 SER A 52 16.165 -3.483 13.324 1.00 0.00 H new ATOM 0 HB3 SER A 52 16.602 -5.119 12.875 1.00 0.00 H new ATOM 0 HG SER A 52 18.452 -3.849 13.470 1.00 0.00 H new ATOM 800 N GLN A 53 13.819 -2.979 11.288 1.00 0.00 N ATOM 801 CA GLN A 53 12.367 -3.060 11.368 1.00 0.00 C ATOM 802 C GLN A 53 11.767 -3.213 9.976 1.00 0.00 C ATOM 803 O GLN A 53 10.631 -3.662 9.831 1.00 0.00 O ATOM 804 CB GLN A 53 11.792 -1.809 12.042 1.00 0.00 C ATOM 805 CG GLN A 53 10.313 -1.916 12.403 1.00 0.00 C ATOM 806 CD GLN A 53 10.030 -2.855 13.571 1.00 0.00 C ATOM 807 OE1 GLN A 53 10.850 -3.884 13.748 1.00 0.00 O flip ATOM 808 NE2 GLN A 53 9.074 -2.652 14.315 1.00 0.00 N flip ATOM 0 H GLN A 53 14.190 -2.029 11.256 1.00 0.00 H new ATOM 0 HA GLN A 53 12.109 -3.933 11.967 1.00 0.00 H new ATOM 0 HB2 GLN A 53 12.362 -1.604 12.948 1.00 0.00 H new ATOM 0 HB3 GLN A 53 11.932 -0.956 11.378 1.00 0.00 H new ATOM 0 HG2 GLN A 53 9.936 -0.923 12.648 1.00 0.00 H new ATOM 0 HG3 GLN A 53 9.760 -2.261 11.530 1.00 0.00 H new ATOM 0 HE21 GLN A 53 8.462 -1.852 14.153 1.00 0.00 H new ATOM 0 HE22 GLN A 53 8.892 -3.283 15.095 1.00 0.00 H new ATOM 817 N ARG A 54 12.552 -2.850 8.964 1.00 0.00 N ATOM 818 CA ARG A 54 12.096 -2.852 7.574 1.00 0.00 C ATOM 819 C ARG A 54 11.479 -4.187 7.178 1.00 0.00 C ATOM 820 O ARG A 54 10.403 -4.220 6.591 1.00 0.00 O ATOM 821 CB ARG A 54 13.251 -2.513 6.632 1.00 0.00 C ATOM 822 CG ARG A 54 13.717 -1.071 6.738 1.00 0.00 C ATOM 823 CD ARG A 54 14.910 -0.797 5.839 1.00 0.00 C ATOM 824 NE ARG A 54 15.292 0.613 5.863 1.00 0.00 N ATOM 825 CZ ARG A 54 16.542 1.054 5.719 1.00 0.00 C ATOM 826 NH1 ARG A 54 17.540 0.194 5.545 1.00 0.00 N ATOM 827 NH2 ARG A 54 16.790 2.357 5.742 1.00 0.00 N ATOM 0 H ARG A 54 13.519 -2.547 9.083 1.00 0.00 H new ATOM 0 HA ARG A 54 11.323 -2.089 7.488 1.00 0.00 H new ATOM 0 HB2 ARG A 54 14.090 -3.174 6.847 1.00 0.00 H new ATOM 0 HB3 ARG A 54 12.943 -2.712 5.606 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.898 -0.404 6.469 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.982 -0.850 7.772 1.00 0.00 H new ATOM 0 HD2 ARG A 54 15.754 -1.408 6.158 1.00 0.00 H new ATOM 0 HD3 ARG A 54 14.671 -1.092 4.817 1.00 0.00 H new ATOM 0 HE ARG A 54 14.555 1.305 5.999 1.00 0.00 H new ATOM 0 HH11 ARG A 54 17.351 -0.808 5.521 1.00 0.00 H new ATOM 0 HH12 ARG A 54 18.495 0.536 5.435 1.00 0.00 H new ATOM 0 HH21 ARG A 54 16.025 3.020 5.870 1.00 0.00 H new ATOM 0 HH22 ARG A 54 17.746 2.696 5.632 1.00 0.00 H new ATOM 841 N LYS A 55 12.149 -5.286 7.507 1.00 0.00 N ATOM 842 CA LYS A 55 11.637 -6.610 7.170 1.00 0.00 C ATOM 843 C LYS A 55 10.285 -6.866 7.829 1.00 0.00 C ATOM 844 O LYS A 55 9.306 -7.178 7.152 1.00 0.00 O ATOM 845 CB LYS A 55 12.631 -7.697 7.580 1.00 0.00 C ATOM 846 CG LYS A 55 13.539 -8.160 6.450 1.00 0.00 C ATOM 847 CD LYS A 55 13.257 -9.611 6.065 1.00 0.00 C ATOM 848 CE LYS A 55 11.823 -9.806 5.593 1.00 0.00 C ATOM 849 NZ LYS A 55 11.509 -11.235 5.313 1.00 0.00 N ATOM 0 H LYS A 55 13.041 -5.288 8.003 1.00 0.00 H new ATOM 0 HA LYS A 55 11.504 -6.643 6.089 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.247 -7.323 8.398 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.079 -8.555 7.964 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.397 -7.518 5.581 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.581 -8.059 6.754 1.00 0.00 H new ATOM 0 HD2 LYS A 55 13.944 -9.917 5.276 1.00 0.00 H new ATOM 0 HD3 LYS A 55 13.448 -10.257 6.922 1.00 0.00 H new ATOM 0 HE2 LYS A 55 11.138 -9.428 6.352 1.00 0.00 H new ATOM 0 HE3 LYS A 55 11.656 -9.216 4.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 10.513 -11.322 5.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 12.121 -11.581 4.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.674 -11.801 6.170 1.00 0.00 H new ATOM 863 N LEU A 56 10.240 -6.713 9.145 1.00 0.00 N ATOM 864 CA LEU A 56 9.033 -6.990 9.913 1.00 0.00 C ATOM 865 C LEU A 56 7.881 -6.095 9.456 1.00 0.00 C ATOM 866 O LEU A 56 6.806 -6.581 9.112 1.00 0.00 O ATOM 867 CB LEU A 56 9.305 -6.765 11.406 1.00 0.00 C ATOM 868 CG LEU A 56 8.449 -7.578 12.392 1.00 0.00 C ATOM 869 CD1 LEU A 56 8.825 -7.228 13.819 1.00 0.00 C ATOM 870 CD2 LEU A 56 6.961 -7.346 12.172 1.00 0.00 C ATOM 0 H LEU A 56 11.031 -6.397 9.707 1.00 0.00 H new ATOM 0 HA LEU A 56 8.749 -8.029 9.747 1.00 0.00 H new ATOM 0 HB2 LEU A 56 10.354 -6.991 11.599 1.00 0.00 H new ATOM 0 HB3 LEU A 56 9.162 -5.706 11.623 1.00 0.00 H new ATOM 0 HG LEU A 56 8.650 -8.634 12.212 1.00 0.00 H new ATOM 0 HD11 LEU A 56 8.213 -7.809 14.509 1.00 0.00 H new ATOM 0 HD12 LEU A 56 9.877 -7.458 13.985 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.655 -6.165 13.990 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.391 -7.938 12.888 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.733 -6.289 12.312 1.00 0.00 H new ATOM 0 HD23 LEU A 56 6.692 -7.644 11.159 1.00 0.00 H new ATOM 882 N ILE A 57 8.123 -4.790 9.429 1.00 0.00 N ATOM 883 CA ILE A 57 7.061 -3.821 9.193 1.00 0.00 C ATOM 884 C ILE A 57 6.554 -3.887 7.743 1.00 0.00 C ATOM 885 O ILE A 57 5.406 -3.535 7.462 1.00 0.00 O ATOM 886 CB ILE A 57 7.531 -2.391 9.557 1.00 0.00 C ATOM 887 CG1 ILE A 57 6.337 -1.485 9.865 1.00 0.00 C ATOM 888 CG2 ILE A 57 8.377 -1.786 8.446 1.00 0.00 C ATOM 889 CD1 ILE A 57 6.740 -0.147 10.452 1.00 0.00 C ATOM 0 H ILE A 57 9.046 -4.379 9.568 1.00 0.00 H new ATOM 0 HA ILE A 57 6.224 -4.077 9.843 1.00 0.00 H new ATOM 0 HB ILE A 57 8.149 -2.469 10.451 1.00 0.00 H new ATOM 0 HG12 ILE A 57 5.771 -1.317 8.949 1.00 0.00 H new ATOM 0 HG13 ILE A 57 5.672 -1.995 10.562 1.00 0.00 H new ATOM 0 HG21 ILE A 57 8.691 -0.782 8.733 1.00 0.00 H new ATOM 0 HG22 ILE A 57 9.257 -2.407 8.279 1.00 0.00 H new ATOM 0 HG23 ILE A 57 7.790 -1.734 7.529 1.00 0.00 H new ATOM 0 HD11 ILE A 57 5.848 0.448 10.648 1.00 0.00 H new ATOM 0 HD12 ILE A 57 7.281 -0.307 11.385 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.381 0.382 9.747 1.00 0.00 H new ATOM 901 N ALA A 58 7.400 -4.365 6.833 1.00 0.00 N ATOM 902 CA ALA A 58 7.003 -4.531 5.438 1.00 0.00 C ATOM 903 C ALA A 58 6.087 -5.739 5.280 1.00 0.00 C ATOM 904 O ALA A 58 5.076 -5.679 4.577 1.00 0.00 O ATOM 905 CB ALA A 58 8.224 -4.668 4.543 1.00 0.00 C ATOM 0 H ALA A 58 8.360 -4.643 7.036 1.00 0.00 H new ATOM 0 HA ALA A 58 6.454 -3.640 5.133 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.905 -4.791 3.508 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.840 -3.773 4.629 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.804 -5.539 4.849 1.00 0.00 H new ATOM 911 N GLU A 59 6.436 -6.832 5.947 1.00 0.00 N ATOM 912 CA GLU A 59 5.607 -8.030 5.917 1.00 0.00 C ATOM 913 C GLU A 59 4.333 -7.789 6.715 1.00 0.00 C ATOM 914 O GLU A 59 3.268 -8.302 6.379 1.00 0.00 O ATOM 915 CB GLU A 59 6.381 -9.225 6.470 1.00 0.00 C ATOM 916 CG GLU A 59 7.703 -9.449 5.757 1.00 0.00 C ATOM 917 CD GLU A 59 8.451 -10.657 6.266 1.00 0.00 C ATOM 918 OE1 GLU A 59 8.929 -10.630 7.415 1.00 0.00 O ATOM 919 OE2 GLU A 59 8.591 -11.635 5.505 1.00 0.00 O ATOM 0 H GLU A 59 7.282 -6.914 6.512 1.00 0.00 H new ATOM 0 HA GLU A 59 5.335 -8.255 4.886 1.00 0.00 H new ATOM 0 HB2 GLU A 59 6.568 -9.071 7.533 1.00 0.00 H new ATOM 0 HB3 GLU A 59 5.768 -10.122 6.381 1.00 0.00 H new ATOM 0 HG2 GLU A 59 7.518 -9.566 4.689 1.00 0.00 H new ATOM 0 HG3 GLU A 59 8.328 -8.564 5.877 1.00 0.00 H new ATOM 926 N LYS A 60 4.465 -6.983 7.762 1.00 0.00 N ATOM 927 CA LYS A 60 3.334 -6.507 8.546 1.00 0.00 C ATOM 928 C LYS A 60 2.297 -5.857 7.633 1.00 0.00 C ATOM 929 O LYS A 60 1.096 -6.075 7.781 1.00 0.00 O ATOM 930 CB LYS A 60 3.845 -5.511 9.595 1.00 0.00 C ATOM 931 CG LYS A 60 2.769 -4.717 10.316 1.00 0.00 C ATOM 932 CD LYS A 60 3.378 -3.835 11.397 1.00 0.00 C ATOM 933 CE LYS A 60 2.342 -2.932 12.040 1.00 0.00 C ATOM 934 NZ LYS A 60 1.941 -1.806 11.157 1.00 0.00 N ATOM 0 H LYS A 60 5.367 -6.640 8.092 1.00 0.00 H new ATOM 0 HA LYS A 60 2.852 -7.344 9.052 1.00 0.00 H new ATOM 0 HB2 LYS A 60 4.428 -6.057 10.336 1.00 0.00 H new ATOM 0 HB3 LYS A 60 4.524 -4.812 9.107 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.226 -4.100 9.600 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.045 -5.399 10.762 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.837 -4.462 12.161 1.00 0.00 H new ATOM 0 HD3 LYS A 60 4.172 -3.226 10.964 1.00 0.00 H new ATOM 0 HE2 LYS A 60 1.461 -3.520 12.296 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.741 -2.534 12.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.087 -1.352 11.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.712 -1.110 11.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 1.743 -2.167 10.202 1.00 0.00 H new ATOM 948 N PHE A 61 2.781 -5.074 6.677 1.00 0.00 N ATOM 949 CA PHE A 61 1.924 -4.451 5.680 1.00 0.00 C ATOM 950 C PHE A 61 1.252 -5.509 4.805 1.00 0.00 C ATOM 951 O PHE A 61 0.029 -5.531 4.673 1.00 0.00 O ATOM 952 CB PHE A 61 2.744 -3.491 4.812 1.00 0.00 C ATOM 953 CG PHE A 61 1.971 -2.870 3.680 1.00 0.00 C ATOM 954 CD1 PHE A 61 1.200 -1.738 3.887 1.00 0.00 C ATOM 955 CD2 PHE A 61 2.014 -3.422 2.410 1.00 0.00 C ATOM 956 CE1 PHE A 61 0.495 -1.166 2.849 1.00 0.00 C ATOM 957 CE2 PHE A 61 1.309 -2.854 1.368 1.00 0.00 C ATOM 958 CZ PHE A 61 0.547 -1.726 1.588 1.00 0.00 C ATOM 0 H PHE A 61 3.772 -4.855 6.572 1.00 0.00 H new ATOM 0 HA PHE A 61 1.145 -3.889 6.196 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.142 -2.697 5.444 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.598 -4.030 4.401 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.150 -1.298 4.872 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.606 -4.308 2.233 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.098 -0.280 3.022 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.354 -3.292 0.382 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.008 -1.281 0.775 1.00 0.00 H new ATOM 968 N ALA A 62 2.061 -6.393 4.229 1.00 0.00 N ATOM 969 CA ALA A 62 1.562 -7.384 3.283 1.00 0.00 C ATOM 970 C ALA A 62 0.567 -8.340 3.928 1.00 0.00 C ATOM 971 O ALA A 62 -0.458 -8.656 3.338 1.00 0.00 O ATOM 972 CB ALA A 62 2.710 -8.171 2.673 1.00 0.00 C ATOM 0 H ALA A 62 3.065 -6.443 4.401 1.00 0.00 H new ATOM 0 HA ALA A 62 1.041 -6.838 2.497 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.315 -8.905 1.970 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.380 -7.490 2.148 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.260 -8.684 3.462 1.00 0.00 H new ATOM 978 N GLN A 63 0.865 -8.800 5.136 1.00 0.00 N ATOM 979 CA GLN A 63 -0.010 -9.746 5.823 1.00 0.00 C ATOM 980 C GLN A 63 -1.341 -9.094 6.175 1.00 0.00 C ATOM 981 O GLN A 63 -2.395 -9.727 6.085 1.00 0.00 O ATOM 982 CB GLN A 63 0.661 -10.304 7.078 1.00 0.00 C ATOM 983 CG GLN A 63 1.915 -11.116 6.777 1.00 0.00 C ATOM 984 CD GLN A 63 2.538 -11.729 8.017 1.00 0.00 C ATOM 985 OE1 GLN A 63 1.712 -12.067 8.995 1.00 0.00 O flip ATOM 986 NE2 GLN A 63 3.752 -11.911 8.090 1.00 0.00 N flip ATOM 0 H GLN A 63 1.700 -8.537 5.659 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.202 -10.576 5.144 1.00 0.00 H new ATOM 0 HB2 GLN A 63 0.921 -9.479 7.741 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -0.051 -10.932 7.614 1.00 0.00 H new ATOM 0 HG2 GLN A 63 1.667 -11.909 6.072 1.00 0.00 H new ATOM 0 HG3 GLN A 63 2.648 -10.474 6.289 1.00 0.00 H new ATOM 0 HE21 GLN A 63 4.356 -11.637 7.315 1.00 0.00 H new ATOM 0 HE22 GLN A 63 4.155 -12.336 8.925 1.00 0.00 H new ATOM 995 N ALA A 64 -1.293 -7.824 6.561 1.00 0.00 N ATOM 996 CA ALA A 64 -2.507 -7.074 6.847 1.00 0.00 C ATOM 997 C ALA A 64 -3.317 -6.881 5.570 1.00 0.00 C ATOM 998 O ALA A 64 -4.533 -7.073 5.555 1.00 0.00 O ATOM 999 CB ALA A 64 -2.169 -5.729 7.471 1.00 0.00 C ATOM 0 H ALA A 64 -0.429 -7.295 6.682 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.107 -7.640 7.560 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.089 -5.182 7.678 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.623 -5.886 8.401 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.552 -5.153 6.782 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.623 -6.522 4.497 1.00 0.00 N ATOM 1006 CA LEU A 65 -3.248 -6.317 3.196 1.00 0.00 C ATOM 1007 C LEU A 65 -3.845 -7.622 2.669 1.00 0.00 C ATOM 1008 O LEU A 65 -4.945 -7.643 2.125 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.211 -5.779 2.208 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.754 -5.391 0.835 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.776 -4.282 0.975 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.626 -4.958 -0.084 1.00 0.00 C ATOM 0 H LEU A 65 -1.615 -6.365 4.504 1.00 0.00 H new ATOM 0 HA LEU A 65 -4.055 -5.593 3.307 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.732 -4.906 2.650 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.436 -6.534 2.073 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.238 -6.262 0.394 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.157 -4.012 -0.010 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.600 -4.623 1.602 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.307 -3.411 1.434 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.034 -4.686 -1.057 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.114 -4.098 0.348 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.919 -5.779 -0.204 1.00 0.00 H new ATOM 1024 N MET A 66 -3.108 -8.705 2.860 1.00 0.00 N ATOM 1025 CA MET A 66 -3.515 -10.025 2.393 1.00 0.00 C ATOM 1026 C MET A 66 -4.764 -10.497 3.133 1.00 0.00 C ATOM 1027 O MET A 66 -5.567 -11.259 2.598 1.00 0.00 O ATOM 1028 CB MET A 66 -2.371 -11.021 2.624 1.00 0.00 C ATOM 1029 CG MET A 66 -2.213 -12.076 1.538 1.00 0.00 C ATOM 1030 SD MET A 66 -1.136 -11.549 0.181 1.00 0.00 S ATOM 1031 CE MET A 66 -2.045 -10.166 -0.505 1.00 0.00 C ATOM 0 H MET A 66 -2.210 -8.696 3.343 1.00 0.00 H new ATOM 0 HA MET A 66 -3.745 -9.966 1.329 1.00 0.00 H new ATOM 0 HB2 MET A 66 -1.437 -10.466 2.710 1.00 0.00 H new ATOM 0 HB3 MET A 66 -2.533 -11.523 3.578 1.00 0.00 H new ATOM 0 HG2 MET A 66 -1.809 -12.986 1.981 1.00 0.00 H new ATOM 0 HG3 MET A 66 -3.196 -12.325 1.137 1.00 0.00 H new ATOM 0 HE1 MET A 66 -1.633 -9.908 -1.481 1.00 0.00 H new ATOM 0 HE2 MET A 66 -3.095 -10.439 -0.614 1.00 0.00 H new ATOM 0 HE3 MET A 66 -1.961 -9.308 0.162 1.00 0.00 H new ATOM 1041 N SER A 67 -4.918 -10.033 4.366 1.00 0.00 N ATOM 1042 CA SER A 67 -6.066 -10.396 5.182 1.00 0.00 C ATOM 1043 C SER A 67 -7.252 -9.471 4.896 1.00 0.00 C ATOM 1044 O SER A 67 -8.410 -9.853 5.075 1.00 0.00 O ATOM 1045 CB SER A 67 -5.686 -10.341 6.664 1.00 0.00 C ATOM 1046 OG SER A 67 -4.581 -11.192 6.936 1.00 0.00 O ATOM 0 H SER A 67 -4.259 -9.402 4.823 1.00 0.00 H new ATOM 0 HA SER A 67 -6.366 -11.413 4.930 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.438 -9.317 6.942 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.539 -10.640 7.274 1.00 0.00 H new ATOM 0 HG SER A 67 -3.751 -10.749 6.661 1.00 0.00 H new ATOM 1052 N SER A 68 -6.955 -8.264 4.430 1.00 0.00 N ATOM 1053 CA SER A 68 -7.990 -7.284 4.116 1.00 0.00 C ATOM 1054 C SER A 68 -8.452 -7.441 2.669 1.00 0.00 C ATOM 1055 O SER A 68 -9.250 -6.650 2.160 1.00 0.00 O ATOM 1056 CB SER A 68 -7.458 -5.872 4.359 1.00 0.00 C ATOM 1057 OG SER A 68 -6.951 -5.743 5.678 1.00 0.00 O ATOM 0 H SER A 68 -6.003 -7.939 4.260 1.00 0.00 H new ATOM 0 HA SER A 68 -8.847 -7.454 4.767 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.671 -5.646 3.639 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.255 -5.146 4.199 1.00 0.00 H new ATOM 0 HG SER A 68 -6.074 -6.177 5.735 1.00 0.00 H new ATOM 1063 N LEU A 69 -7.939 -8.474 2.017 1.00 0.00 N ATOM 1064 CA LEU A 69 -8.295 -8.777 0.645 1.00 0.00 C ATOM 1065 C LEU A 69 -9.627 -9.522 0.620 1.00 0.00 C ATOM 1066 O LEU A 69 -9.718 -10.671 1.056 1.00 0.00 O ATOM 1067 CB LEU A 69 -7.173 -9.612 -0.001 1.00 0.00 C ATOM 1068 CG LEU A 69 -7.162 -9.671 -1.535 1.00 0.00 C ATOM 1069 CD1 LEU A 69 -5.821 -10.189 -2.023 1.00 0.00 C ATOM 1070 CD2 LEU A 69 -8.278 -10.559 -2.063 1.00 0.00 C ATOM 0 H LEU A 69 -7.266 -9.122 2.426 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.409 -7.857 0.072 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.215 -9.213 0.332 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.243 -10.631 0.379 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.324 -8.661 -1.912 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -5.821 -10.228 -3.112 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -5.028 -9.523 -1.684 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -5.650 -11.189 -1.624 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -8.242 -10.579 -3.152 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.152 -11.570 -1.677 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.241 -10.165 -1.739 1.00 0.00 H new ATOM 1440 N THR B 8 3.930 9.316 -17.119 1.00 0.00 N ATOM 1441 CA THR B 8 4.713 10.525 -16.970 1.00 0.00 C ATOM 1442 C THR B 8 5.056 10.752 -15.500 1.00 0.00 C ATOM 1443 O THR B 8 4.170 10.911 -14.654 1.00 0.00 O ATOM 1444 CB THR B 8 3.982 11.758 -17.551 1.00 0.00 C ATOM 1445 OG1 THR B 8 4.666 12.962 -17.182 1.00 0.00 O ATOM 1446 CG2 THR B 8 2.534 11.826 -17.084 1.00 0.00 C ATOM 0 HA THR B 8 5.635 10.395 -17.536 1.00 0.00 H new ATOM 0 HB THR B 8 3.983 11.657 -18.636 1.00 0.00 H new ATOM 0 HG1 THR B 8 4.194 13.735 -17.557 1.00 0.00 H new ATOM 0 HG21 THR B 8 2.054 12.706 -17.513 1.00 0.00 H new ATOM 0 HG22 THR B 8 2.005 10.930 -17.408 1.00 0.00 H new ATOM 0 HG23 THR B 8 2.505 11.891 -15.996 1.00 0.00 H new ATOM 1454 N ASP B 9 6.349 10.746 -15.199 1.00 0.00 N ATOM 1455 CA ASP B 9 6.818 10.903 -13.827 1.00 0.00 C ATOM 1456 C ASP B 9 6.477 12.272 -13.273 1.00 0.00 C ATOM 1457 O ASP B 9 6.440 12.452 -12.066 1.00 0.00 O ATOM 1458 CB ASP B 9 8.323 10.662 -13.724 1.00 0.00 C ATOM 1459 CG ASP B 9 8.662 9.187 -13.717 1.00 0.00 C ATOM 1460 OD1 ASP B 9 8.789 8.598 -14.810 1.00 0.00 O ATOM 1461 OD2 ASP B 9 8.775 8.605 -12.618 1.00 0.00 O ATOM 0 H ASP B 9 7.093 10.634 -15.888 1.00 0.00 H new ATOM 0 HA ASP B 9 6.302 10.152 -13.229 1.00 0.00 H new ATOM 0 HB2 ASP B 9 8.826 11.146 -14.562 1.00 0.00 H new ATOM 0 HB3 ASP B 9 8.703 11.126 -12.814 1.00 0.00 H new ATOM 1466 N GLU B 10 6.220 13.234 -14.149 1.00 0.00 N ATOM 1467 CA GLU B 10 5.799 14.557 -13.707 1.00 0.00 C ATOM 1468 C GLU B 10 4.471 14.469 -12.965 1.00 0.00 C ATOM 1469 O GLU B 10 4.287 15.090 -11.920 1.00 0.00 O ATOM 1470 CB GLU B 10 5.684 15.514 -14.892 1.00 0.00 C ATOM 1471 CG GLU B 10 7.026 16.019 -15.395 1.00 0.00 C ATOM 1472 CD GLU B 10 7.803 16.739 -14.312 1.00 0.00 C ATOM 1473 OE1 GLU B 10 7.233 17.652 -13.674 1.00 0.00 O ATOM 1474 OE2 GLU B 10 8.980 16.400 -14.089 1.00 0.00 O ATOM 0 H GLU B 10 6.295 13.125 -15.160 1.00 0.00 H new ATOM 0 HA GLU B 10 6.555 14.947 -13.026 1.00 0.00 H new ATOM 0 HB2 GLU B 10 5.166 15.010 -15.707 1.00 0.00 H new ATOM 0 HB3 GLU B 10 5.069 16.366 -14.602 1.00 0.00 H new ATOM 0 HG2 GLU B 10 7.614 15.179 -15.766 1.00 0.00 H new ATOM 0 HG3 GLU B 10 6.867 16.693 -16.237 1.00 0.00 H new ATOM 1481 N GLN B 11 3.557 13.674 -13.500 1.00 0.00 N ATOM 1482 CA GLN B 11 2.262 13.469 -12.867 1.00 0.00 C ATOM 1483 C GLN B 11 2.436 12.709 -11.554 1.00 0.00 C ATOM 1484 O GLN B 11 1.915 13.111 -10.514 1.00 0.00 O ATOM 1485 CB GLN B 11 1.334 12.695 -13.810 1.00 0.00 C ATOM 1486 CG GLN B 11 -0.061 12.456 -13.254 1.00 0.00 C ATOM 1487 CD GLN B 11 -0.927 11.622 -14.182 1.00 0.00 C ATOM 1488 OE1 GLN B 11 -0.706 11.751 -15.482 1.00 0.00 O flip ATOM 1489 NE2 GLN B 11 -1.793 10.871 -13.733 1.00 0.00 N flip ATOM 0 H GLN B 11 3.688 13.160 -14.371 1.00 0.00 H new ATOM 0 HA GLN B 11 1.814 14.439 -12.653 1.00 0.00 H new ATOM 0 HB2 GLN B 11 1.250 13.242 -14.749 1.00 0.00 H new ATOM 0 HB3 GLN B 11 1.790 11.733 -14.042 1.00 0.00 H new ATOM 0 HG2 GLN B 11 0.018 11.955 -12.289 1.00 0.00 H new ATOM 0 HG3 GLN B 11 -0.546 13.416 -13.076 1.00 0.00 H new ATOM 0 HE21 GLN B 11 -1.933 10.799 -12.725 1.00 0.00 H new ATOM 0 HE22 GLN B 11 -2.370 10.321 -14.369 1.00 0.00 H new ATOM 1498 N VAL B 12 3.201 11.626 -11.611 1.00 0.00 N ATOM 1499 CA VAL B 12 3.411 10.767 -10.450 1.00 0.00 C ATOM 1500 C VAL B 12 4.133 11.514 -9.326 1.00 0.00 C ATOM 1501 O VAL B 12 3.663 11.550 -8.188 1.00 0.00 O ATOM 1502 CB VAL B 12 4.234 9.515 -10.827 1.00 0.00 C ATOM 1503 CG1 VAL B 12 4.376 8.583 -9.633 1.00 0.00 C ATOM 1504 CG2 VAL B 12 3.603 8.787 -12.008 1.00 0.00 C ATOM 0 H VAL B 12 3.689 11.320 -12.453 1.00 0.00 H new ATOM 0 HA VAL B 12 2.425 10.462 -10.100 1.00 0.00 H new ATOM 0 HB VAL B 12 5.231 9.842 -11.124 1.00 0.00 H new ATOM 0 HG11 VAL B 12 4.959 7.708 -9.921 1.00 0.00 H new ATOM 0 HG12 VAL B 12 4.883 9.106 -8.822 1.00 0.00 H new ATOM 0 HG13 VAL B 12 3.388 8.266 -9.299 1.00 0.00 H new ATOM 0 HG21 VAL B 12 4.200 7.909 -12.255 1.00 0.00 H new ATOM 0 HG22 VAL B 12 2.592 8.476 -11.746 1.00 0.00 H new ATOM 0 HG23 VAL B 12 3.566 9.454 -12.869 1.00 0.00 H new ATOM 1514 N GLU B 13 5.267 12.116 -9.665 1.00 0.00 N ATOM 1515 CA GLU B 13 6.124 12.786 -8.691 1.00 0.00 C ATOM 1516 C GLU B 13 5.388 13.929 -7.996 1.00 0.00 C ATOM 1517 O GLU B 13 5.512 14.102 -6.779 1.00 0.00 O ATOM 1518 CB GLU B 13 7.399 13.290 -9.386 1.00 0.00 C ATOM 1519 CG GLU B 13 8.386 14.013 -8.481 1.00 0.00 C ATOM 1520 CD GLU B 13 8.270 15.520 -8.585 1.00 0.00 C ATOM 1521 OE1 GLU B 13 8.717 16.085 -9.607 1.00 0.00 O ATOM 1522 OE2 GLU B 13 7.745 16.147 -7.648 1.00 0.00 O ATOM 0 H GLU B 13 5.619 12.154 -10.622 1.00 0.00 H new ATOM 0 HA GLU B 13 6.402 12.068 -7.919 1.00 0.00 H new ATOM 0 HB2 GLU B 13 7.905 12.440 -9.843 1.00 0.00 H new ATOM 0 HB3 GLU B 13 7.112 13.962 -10.194 1.00 0.00 H new ATOM 0 HG2 GLU B 13 8.217 13.709 -7.448 1.00 0.00 H new ATOM 0 HG3 GLU B 13 9.401 13.711 -8.740 1.00 0.00 H new ATOM 1529 N LYS B 14 4.603 14.688 -8.758 1.00 0.00 N ATOM 1530 CA LYS B 14 3.878 15.824 -8.196 1.00 0.00 C ATOM 1531 C LYS B 14 2.800 15.362 -7.223 1.00 0.00 C ATOM 1532 O LYS B 14 2.693 15.897 -6.119 1.00 0.00 O ATOM 1533 CB LYS B 14 3.271 16.696 -9.299 1.00 0.00 C ATOM 1534 CG LYS B 14 4.165 17.856 -9.721 1.00 0.00 C ATOM 1535 CD LYS B 14 5.501 17.379 -10.267 1.00 0.00 C ATOM 1536 CE LYS B 14 6.463 18.534 -10.477 1.00 0.00 C ATOM 1537 NZ LYS B 14 7.752 18.082 -11.061 1.00 0.00 N ATOM 0 H LYS B 14 4.454 14.539 -9.756 1.00 0.00 H new ATOM 0 HA LYS B 14 4.597 16.430 -7.644 1.00 0.00 H new ATOM 0 HB2 LYS B 14 3.063 16.074 -10.169 1.00 0.00 H new ATOM 0 HB3 LYS B 14 2.316 17.091 -8.954 1.00 0.00 H new ATOM 0 HG2 LYS B 14 3.655 18.449 -10.480 1.00 0.00 H new ATOM 0 HG3 LYS B 14 4.336 18.511 -8.867 1.00 0.00 H new ATOM 0 HD2 LYS B 14 5.941 16.659 -9.577 1.00 0.00 H new ATOM 0 HD3 LYS B 14 5.344 16.859 -11.212 1.00 0.00 H new ATOM 0 HE2 LYS B 14 6.005 19.273 -11.135 1.00 0.00 H new ATOM 0 HE3 LYS B 14 6.650 19.029 -9.524 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 8.489 18.790 -10.866 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 8.025 17.172 -10.637 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 7.646 17.967 -12.089 1.00 0.00 H new ATOM 1551 N ILE B 15 2.022 14.360 -7.619 1.00 0.00 N ATOM 1552 CA ILE B 15 0.977 13.823 -6.749 1.00 0.00 C ATOM 1553 C ILE B 15 1.584 13.267 -5.463 1.00 0.00 C ATOM 1554 O ILE B 15 1.051 13.473 -4.372 1.00 0.00 O ATOM 1555 CB ILE B 15 0.153 12.718 -7.448 1.00 0.00 C ATOM 1556 CG1 ILE B 15 -0.529 13.272 -8.699 1.00 0.00 C ATOM 1557 CG2 ILE B 15 -0.885 12.143 -6.492 1.00 0.00 C ATOM 1558 CD1 ILE B 15 -1.300 12.228 -9.481 1.00 0.00 C ATOM 0 H ILE B 15 2.093 13.905 -8.529 1.00 0.00 H new ATOM 0 HA ILE B 15 0.306 14.648 -6.511 1.00 0.00 H new ATOM 0 HB ILE B 15 0.831 11.919 -7.746 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -1.210 14.072 -8.408 1.00 0.00 H new ATOM 0 HG13 ILE B 15 0.226 13.716 -9.348 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -1.457 11.366 -7.000 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -0.383 11.715 -5.624 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -1.559 12.936 -6.167 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -1.757 12.692 -10.355 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -0.620 11.439 -9.803 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -2.078 11.801 -8.848 1.00 0.00 H new ATOM 1570 N LEU B 16 2.714 12.572 -5.597 1.00 0.00 N ATOM 1571 CA LEU B 16 3.423 12.035 -4.441 1.00 0.00 C ATOM 1572 C LEU B 16 3.774 13.149 -3.462 1.00 0.00 C ATOM 1573 O LEU B 16 3.588 13.008 -2.253 1.00 0.00 O ATOM 1574 CB LEU B 16 4.701 11.314 -4.874 1.00 0.00 C ATOM 1575 CG LEU B 16 4.497 10.014 -5.652 1.00 0.00 C ATOM 1576 CD1 LEU B 16 5.832 9.465 -6.124 1.00 0.00 C ATOM 1577 CD2 LEU B 16 3.777 8.990 -4.792 1.00 0.00 C ATOM 0 H LEU B 16 3.155 12.369 -6.494 1.00 0.00 H new ATOM 0 HA LEU B 16 2.764 11.321 -3.948 1.00 0.00 H new ATOM 0 HB2 LEU B 16 5.290 11.995 -5.488 1.00 0.00 H new ATOM 0 HB3 LEU B 16 5.292 11.095 -3.985 1.00 0.00 H new ATOM 0 HG LEU B 16 3.881 10.226 -6.526 1.00 0.00 H new ATOM 0 HD11 LEU B 16 5.670 8.539 -6.676 1.00 0.00 H new ATOM 0 HD12 LEU B 16 6.317 10.195 -6.773 1.00 0.00 H new ATOM 0 HD13 LEU B 16 6.469 9.266 -5.262 1.00 0.00 H new ATOM 0 HD21 LEU B 16 3.639 8.070 -5.360 1.00 0.00 H new ATOM 0 HD22 LEU B 16 4.370 8.781 -3.902 1.00 0.00 H new ATOM 0 HD23 LEU B 16 2.804 9.383 -4.496 1.00 0.00 H new ATOM 1589 N ALA B 17 4.266 14.262 -4.000 1.00 0.00 N ATOM 1590 CA ALA B 17 4.648 15.407 -3.184 1.00 0.00 C ATOM 1591 C ALA B 17 3.439 15.992 -2.463 1.00 0.00 C ATOM 1592 O ALA B 17 3.505 16.307 -1.274 1.00 0.00 O ATOM 1593 CB ALA B 17 5.322 16.468 -4.043 1.00 0.00 C ATOM 0 H ALA B 17 4.409 14.394 -5.001 1.00 0.00 H new ATOM 0 HA ALA B 17 5.357 15.066 -2.430 1.00 0.00 H new ATOM 0 HB1 ALA B 17 5.602 17.317 -3.420 1.00 0.00 H new ATOM 0 HB2 ALA B 17 6.215 16.048 -4.506 1.00 0.00 H new ATOM 0 HB3 ALA B 17 4.633 16.799 -4.819 1.00 0.00 H new ATOM 1599 N GLU B 18 2.334 16.123 -3.187 1.00 0.00 N ATOM 1600 CA GLU B 18 1.102 16.654 -2.623 1.00 0.00 C ATOM 1601 C GLU B 18 0.605 15.771 -1.482 1.00 0.00 C ATOM 1602 O GLU B 18 0.361 16.254 -0.377 1.00 0.00 O ATOM 1603 CB GLU B 18 0.030 16.764 -3.708 1.00 0.00 C ATOM 1604 CG GLU B 18 0.423 17.672 -4.861 1.00 0.00 C ATOM 1605 CD GLU B 18 -0.561 17.605 -6.009 1.00 0.00 C ATOM 1606 OE1 GLU B 18 -0.745 16.511 -6.572 1.00 0.00 O ATOM 1607 OE2 GLU B 18 -1.158 18.646 -6.358 1.00 0.00 O ATOM 0 H GLU B 18 2.268 15.867 -4.172 1.00 0.00 H new ATOM 0 HA GLU B 18 1.307 17.648 -2.225 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -0.185 15.769 -4.097 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -0.891 17.137 -3.260 1.00 0.00 H new ATOM 0 HG2 GLU B 18 0.491 18.700 -4.504 1.00 0.00 H new ATOM 0 HG3 GLU B 18 1.414 17.393 -5.219 1.00 0.00 H new ATOM 1614 N VAL B 19 0.485 14.473 -1.752 1.00 0.00 N ATOM 1615 CA VAL B 19 0.012 13.518 -0.753 1.00 0.00 C ATOM 1616 C VAL B 19 0.917 13.517 0.478 1.00 0.00 C ATOM 1617 O VAL B 19 0.439 13.631 1.608 1.00 0.00 O ATOM 1618 CB VAL B 19 -0.071 12.087 -1.331 1.00 0.00 C ATOM 1619 CG1 VAL B 19 -0.493 11.088 -0.263 1.00 0.00 C ATOM 1620 CG2 VAL B 19 -1.034 12.040 -2.504 1.00 0.00 C ATOM 0 H VAL B 19 0.709 14.058 -2.656 1.00 0.00 H new ATOM 0 HA VAL B 19 -0.989 13.835 -0.460 1.00 0.00 H new ATOM 0 HB VAL B 19 0.923 11.810 -1.682 1.00 0.00 H new ATOM 0 HG11 VAL B 19 -0.543 10.090 -0.698 1.00 0.00 H new ATOM 0 HG12 VAL B 19 0.234 11.094 0.549 1.00 0.00 H new ATOM 0 HG13 VAL B 19 -1.473 11.364 0.126 1.00 0.00 H new ATOM 0 HG21 VAL B 19 -1.079 11.024 -2.897 1.00 0.00 H new ATOM 0 HG22 VAL B 19 -2.027 12.345 -2.172 1.00 0.00 H new ATOM 0 HG23 VAL B 19 -0.689 12.717 -3.286 1.00 0.00 H new ATOM 1630 N ALA B 20 2.223 13.414 0.251 1.00 0.00 N ATOM 1631 CA ALA B 20 3.195 13.379 1.341 1.00 0.00 C ATOM 1632 C ALA B 20 3.124 14.645 2.185 1.00 0.00 C ATOM 1633 O ALA B 20 3.265 14.596 3.410 1.00 0.00 O ATOM 1634 CB ALA B 20 4.601 13.185 0.795 1.00 0.00 C ATOM 0 H ALA B 20 2.634 13.353 -0.680 1.00 0.00 H new ATOM 0 HA ALA B 20 2.948 12.533 1.982 1.00 0.00 H new ATOM 0 HB1 ALA B 20 5.312 13.161 1.621 1.00 0.00 H new ATOM 0 HB2 ALA B 20 4.651 12.245 0.246 1.00 0.00 H new ATOM 0 HB3 ALA B 20 4.849 14.010 0.127 1.00 0.00 H new ATOM 1640 N LEU B 21 2.898 15.777 1.527 1.00 0.00 N ATOM 1641 CA LEU B 21 2.799 17.049 2.219 1.00 0.00 C ATOM 1642 C LEU B 21 1.548 17.082 3.089 1.00 0.00 C ATOM 1643 O LEU B 21 1.593 17.551 4.221 1.00 0.00 O ATOM 1644 CB LEU B 21 2.803 18.214 1.217 1.00 0.00 C ATOM 1645 CG LEU B 21 2.859 19.619 1.830 1.00 0.00 C ATOM 1646 CD1 LEU B 21 3.603 20.562 0.901 1.00 0.00 C ATOM 1647 CD2 LEU B 21 1.459 20.155 2.097 1.00 0.00 C ATOM 0 H LEU B 21 2.780 15.836 0.515 1.00 0.00 H new ATOM 0 HA LEU B 21 3.669 17.161 2.866 1.00 0.00 H new ATOM 0 HB2 LEU B 21 3.658 18.094 0.552 1.00 0.00 H new ATOM 0 HB3 LEU B 21 1.907 18.142 0.601 1.00 0.00 H new ATOM 0 HG LEU B 21 3.389 19.554 2.780 1.00 0.00 H new ATOM 0 HD11 LEU B 21 3.638 21.557 1.344 1.00 0.00 H new ATOM 0 HD12 LEU B 21 4.619 20.197 0.749 1.00 0.00 H new ATOM 0 HD13 LEU B 21 3.087 20.610 -0.058 1.00 0.00 H new ATOM 0 HD21 LEU B 21 1.528 21.152 2.531 1.00 0.00 H new ATOM 0 HD22 LEU B 21 0.904 20.205 1.160 1.00 0.00 H new ATOM 0 HD23 LEU B 21 0.942 19.492 2.791 1.00 0.00 H new ATOM 1659 N VAL B 22 0.438 16.566 2.566 1.00 0.00 N ATOM 1660 CA VAL B 22 -0.810 16.516 3.322 1.00 0.00 C ATOM 1661 C VAL B 22 -0.634 15.671 4.583 1.00 0.00 C ATOM 1662 O VAL B 22 -1.080 16.052 5.669 1.00 0.00 O ATOM 1663 CB VAL B 22 -1.974 15.948 2.474 1.00 0.00 C ATOM 1664 CG1 VAL B 22 -3.237 15.800 3.310 1.00 0.00 C ATOM 1665 CG2 VAL B 22 -2.241 16.838 1.270 1.00 0.00 C ATOM 0 H VAL B 22 0.378 16.178 1.625 1.00 0.00 H new ATOM 0 HA VAL B 22 -1.062 17.539 3.600 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.681 14.959 2.121 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -4.039 15.399 2.690 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -3.046 15.120 4.140 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -3.532 16.774 3.699 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -3.062 16.423 0.686 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -2.507 17.839 1.609 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.346 16.891 0.651 1.00 0.00 H new ATOM 1675 N LEU B 23 0.046 14.541 4.435 1.00 0.00 N ATOM 1676 CA LEU B 23 0.309 13.651 5.559 1.00 0.00 C ATOM 1677 C LEU B 23 1.144 14.357 6.618 1.00 0.00 C ATOM 1678 O LEU B 23 0.824 14.319 7.806 1.00 0.00 O ATOM 1679 CB LEU B 23 1.033 12.388 5.081 1.00 0.00 C ATOM 1680 CG LEU B 23 0.338 11.624 3.952 1.00 0.00 C ATOM 1681 CD1 LEU B 23 1.159 10.409 3.542 1.00 0.00 C ATOM 1682 CD2 LEU B 23 -1.062 11.207 4.373 1.00 0.00 C ATOM 0 H LEU B 23 0.426 14.218 3.545 1.00 0.00 H new ATOM 0 HA LEU B 23 -0.647 13.367 5.999 1.00 0.00 H new ATOM 0 HB2 LEU B 23 2.033 12.666 4.747 1.00 0.00 H new ATOM 0 HB3 LEU B 23 1.156 11.716 5.930 1.00 0.00 H new ATOM 0 HG LEU B 23 0.254 12.286 3.090 1.00 0.00 H new ATOM 0 HD11 LEU B 23 0.648 9.879 2.738 1.00 0.00 H new ATOM 0 HD12 LEU B 23 2.141 10.733 3.196 1.00 0.00 H new ATOM 0 HD13 LEU B 23 1.277 9.744 4.398 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -1.541 10.665 3.558 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -1.001 10.563 5.250 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -1.649 12.094 4.613 1.00 0.00 H new ATOM 1694 N GLU B 24 2.199 15.027 6.174 1.00 0.00 N ATOM 1695 CA GLU B 24 3.101 15.717 7.080 1.00 0.00 C ATOM 1696 C GLU B 24 2.424 16.955 7.671 1.00 0.00 C ATOM 1697 O GLU B 24 2.702 17.345 8.806 1.00 0.00 O ATOM 1698 CB GLU B 24 4.388 16.092 6.344 1.00 0.00 C ATOM 1699 CG GLU B 24 5.553 16.397 7.269 1.00 0.00 C ATOM 1700 CD GLU B 24 6.882 16.410 6.540 1.00 0.00 C ATOM 1701 OE1 GLU B 24 7.385 15.316 6.200 1.00 0.00 O ATOM 1702 OE2 GLU B 24 7.427 17.505 6.304 1.00 0.00 O ATOM 0 H GLU B 24 2.450 15.106 5.188 1.00 0.00 H new ATOM 0 HA GLU B 24 3.356 15.052 7.905 1.00 0.00 H new ATOM 0 HB2 GLU B 24 4.668 15.274 5.679 1.00 0.00 H new ATOM 0 HB3 GLU B 24 4.197 16.962 5.716 1.00 0.00 H new ATOM 0 HG2 GLU B 24 5.393 17.365 7.744 1.00 0.00 H new ATOM 0 HG3 GLU B 24 5.586 15.653 8.065 1.00 0.00 H new ATOM 1709 N LYS B 25 1.520 17.551 6.897 1.00 0.00 N ATOM 1710 CA LYS B 25 0.738 18.699 7.347 1.00 0.00 C ATOM 1711 C LYS B 25 -0.138 18.319 8.536 1.00 0.00 C ATOM 1712 O LYS B 25 -0.354 19.121 9.443 1.00 0.00 O ATOM 1713 CB LYS B 25 -0.137 19.227 6.201 1.00 0.00 C ATOM 1714 CG LYS B 25 -1.079 20.352 6.602 1.00 0.00 C ATOM 1715 CD LYS B 25 -2.013 20.725 5.463 1.00 0.00 C ATOM 1716 CE LYS B 25 -3.076 21.713 5.915 1.00 0.00 C ATOM 1717 NZ LYS B 25 -4.028 22.045 4.823 1.00 0.00 N ATOM 0 H LYS B 25 1.310 17.253 5.944 1.00 0.00 H new ATOM 0 HA LYS B 25 1.428 19.483 7.659 1.00 0.00 H new ATOM 0 HB2 LYS B 25 0.510 19.579 5.398 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -0.725 18.402 5.798 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -1.664 20.047 7.469 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -0.499 21.225 6.900 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -1.437 21.158 4.645 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -2.492 19.826 5.075 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -3.624 21.295 6.759 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -2.596 22.626 6.268 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -4.736 22.721 5.173 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -3.509 22.468 4.027 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -4.506 21.178 4.503 1.00 0.00 H new ATOM 1731 N HIS B 26 -0.633 17.084 8.530 1.00 0.00 N ATOM 1732 CA HIS B 26 -1.486 16.603 9.611 1.00 0.00 C ATOM 1733 C HIS B 26 -0.684 15.821 10.639 1.00 0.00 C ATOM 1734 O HIS B 26 -1.256 15.203 11.537 1.00 0.00 O ATOM 1735 CB HIS B 26 -2.623 15.732 9.075 1.00 0.00 C ATOM 1736 CG HIS B 26 -3.644 16.488 8.284 1.00 0.00 C ATOM 1737 ND1 HIS B 26 -4.636 17.241 8.862 1.00 0.00 N ATOM 1738 CD2 HIS B 26 -3.828 16.595 6.948 1.00 0.00 C ATOM 1739 CE1 HIS B 26 -5.386 17.776 7.918 1.00 0.00 C ATOM 1740 NE2 HIS B 26 -4.919 17.402 6.743 1.00 0.00 N ATOM 0 H HIS B 26 -0.459 16.402 7.792 1.00 0.00 H new ATOM 0 HA HIS B 26 -1.915 17.481 10.094 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -2.201 14.946 8.449 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -3.118 15.241 9.913 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -3.226 16.130 6.182 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -6.241 18.415 8.081 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -5.303 17.667 5.836 1.00 0.00 H new ATOM 1749 N ALA B 27 0.637 15.844 10.487 1.00 0.00 N ATOM 1750 CA ALA B 27 1.546 15.197 11.433 1.00 0.00 C ATOM 1751 C ALA B 27 1.288 13.697 11.508 1.00 0.00 C ATOM 1752 O ALA B 27 1.203 13.121 12.597 1.00 0.00 O ATOM 1753 CB ALA B 27 1.427 15.835 12.812 1.00 0.00 C ATOM 0 H ALA B 27 1.107 16.308 9.710 1.00 0.00 H new ATOM 0 HA ALA B 27 2.565 15.342 11.073 1.00 0.00 H new ATOM 0 HB1 ALA B 27 2.111 15.340 13.502 1.00 0.00 H new ATOM 0 HB2 ALA B 27 1.680 16.893 12.746 1.00 0.00 H new ATOM 0 HB3 ALA B 27 0.405 15.728 13.175 1.00 0.00 H new ATOM 1759 N ALA B 28 1.155 13.073 10.345 1.00 0.00 N ATOM 1760 CA ALA B 28 0.940 11.637 10.267 1.00 0.00 C ATOM 1761 C ALA B 28 2.190 10.868 10.685 1.00 0.00 C ATOM 1762 O ALA B 28 3.260 11.019 10.089 1.00 0.00 O ATOM 1763 CB ALA B 28 0.518 11.238 8.859 1.00 0.00 C ATOM 0 H ALA B 28 1.193 13.542 9.440 1.00 0.00 H new ATOM 0 HA ALA B 28 0.139 11.380 10.960 1.00 0.00 H new ATOM 0 HB1 ALA B 28 0.361 10.160 8.818 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -0.408 11.750 8.598 1.00 0.00 H new ATOM 0 HB3 ALA B 28 1.299 11.518 8.152 1.00 0.00 H new ATOM 1769 N SER B 29 2.046 10.058 11.725 1.00 0.00 N ATOM 1770 CA SER B 29 3.124 9.194 12.187 1.00 0.00 C ATOM 1771 C SER B 29 3.390 8.091 11.154 1.00 0.00 C ATOM 1772 O SER B 29 2.537 7.820 10.306 1.00 0.00 O ATOM 1773 CB SER B 29 2.748 8.592 13.547 1.00 0.00 C ATOM 1774 OG SER B 29 2.427 9.610 14.483 1.00 0.00 O ATOM 0 H SER B 29 1.186 9.981 12.268 1.00 0.00 H new ATOM 0 HA SER B 29 4.037 9.777 12.304 1.00 0.00 H new ATOM 0 HB2 SER B 29 1.898 7.920 13.429 1.00 0.00 H new ATOM 0 HB3 SER B 29 3.577 7.993 13.925 1.00 0.00 H new ATOM 0 HG SER B 29 2.189 9.202 15.342 1.00 0.00 H new ATOM 1780 N PRO B 30 4.578 7.451 11.200 1.00 0.00 N ATOM 1781 CA PRO B 30 4.962 6.391 10.254 1.00 0.00 C ATOM 1782 C PRO B 30 3.890 5.311 10.090 1.00 0.00 C ATOM 1783 O PRO B 30 3.515 4.972 8.968 1.00 0.00 O ATOM 1784 CB PRO B 30 6.240 5.789 10.864 1.00 0.00 C ATOM 1785 CG PRO B 30 6.371 6.399 12.223 1.00 0.00 C ATOM 1786 CD PRO B 30 5.654 7.716 12.162 1.00 0.00 C ATOM 0 HA PRO B 30 5.103 6.796 9.252 1.00 0.00 H new ATOM 0 HB2 PRO B 30 6.168 4.703 10.928 1.00 0.00 H new ATOM 0 HB3 PRO B 30 7.111 6.015 10.249 1.00 0.00 H new ATOM 0 HG2 PRO B 30 5.933 5.752 12.984 1.00 0.00 H new ATOM 0 HG3 PRO B 30 7.419 6.538 12.488 1.00 0.00 H new ATOM 0 HD2 PRO B 30 5.263 8.010 13.136 1.00 0.00 H new ATOM 0 HD3 PRO B 30 6.310 8.519 11.826 1.00 0.00 H new ATOM 1794 N GLU B 31 3.397 4.782 11.209 1.00 0.00 N ATOM 1795 CA GLU B 31 2.346 3.768 11.183 1.00 0.00 C ATOM 1796 C GLU B 31 1.090 4.291 10.492 1.00 0.00 C ATOM 1797 O GLU B 31 0.525 3.613 9.640 1.00 0.00 O ATOM 1798 CB GLU B 31 2.019 3.297 12.602 1.00 0.00 C ATOM 1799 CG GLU B 31 2.994 2.259 13.138 1.00 0.00 C ATOM 1800 CD GLU B 31 2.742 0.874 12.564 1.00 0.00 C ATOM 1801 OE1 GLU B 31 3.222 0.573 11.451 1.00 0.00 O ATOM 1802 OE2 GLU B 31 2.049 0.074 13.224 1.00 0.00 O ATOM 0 H GLU B 31 3.709 5.040 12.145 1.00 0.00 H new ATOM 0 HA GLU B 31 2.716 2.918 10.609 1.00 0.00 H new ATOM 0 HB2 GLU B 31 2.014 4.158 13.270 1.00 0.00 H new ATOM 0 HB3 GLU B 31 1.013 2.879 12.614 1.00 0.00 H new ATOM 0 HG2 GLU B 31 4.013 2.567 12.903 1.00 0.00 H new ATOM 0 HG3 GLU B 31 2.916 2.218 14.224 1.00 0.00 H new ATOM 1809 N LEU B 32 0.671 5.502 10.848 1.00 0.00 N ATOM 1810 CA LEU B 32 -0.489 6.127 10.218 1.00 0.00 C ATOM 1811 C LEU B 32 -0.255 6.290 8.719 1.00 0.00 C ATOM 1812 O LEU B 32 -1.128 5.983 7.908 1.00 0.00 O ATOM 1813 CB LEU B 32 -0.774 7.491 10.859 1.00 0.00 C ATOM 1814 CG LEU B 32 -1.954 8.271 10.261 1.00 0.00 C ATOM 1815 CD1 LEU B 32 -3.240 7.464 10.346 1.00 0.00 C ATOM 1816 CD2 LEU B 32 -2.124 9.603 10.975 1.00 0.00 C ATOM 0 H LEU B 32 1.117 6.070 11.569 1.00 0.00 H new ATOM 0 HA LEU B 32 -1.354 5.482 10.369 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -0.962 7.341 11.922 1.00 0.00 H new ATOM 0 HB3 LEU B 32 0.123 8.105 10.778 1.00 0.00 H new ATOM 0 HG LEU B 32 -1.737 8.458 9.209 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -4.060 8.039 9.916 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -3.122 6.532 9.794 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -3.462 7.242 11.390 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -2.964 10.144 10.540 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -2.315 9.427 12.034 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -1.215 10.194 10.864 1.00 0.00 H new ATOM 1828 N THR B 33 0.931 6.764 8.367 1.00 0.00 N ATOM 1829 CA THR B 33 1.312 6.944 6.975 1.00 0.00 C ATOM 1830 C THR B 33 1.206 5.632 6.201 1.00 0.00 C ATOM 1831 O THR B 33 0.546 5.555 5.161 1.00 0.00 O ATOM 1832 CB THR B 33 2.756 7.470 6.870 1.00 0.00 C ATOM 1833 OG1 THR B 33 2.870 8.738 7.529 1.00 0.00 O ATOM 1834 CG2 THR B 33 3.189 7.596 5.417 1.00 0.00 C ATOM 0 H THR B 33 1.653 7.033 9.035 1.00 0.00 H new ATOM 0 HA THR B 33 0.625 7.671 6.542 1.00 0.00 H new ATOM 0 HB THR B 33 3.414 6.752 7.360 1.00 0.00 H new ATOM 0 HG1 THR B 33 2.778 8.613 8.497 1.00 0.00 H new ATOM 0 HG21 THR B 33 4.212 7.969 5.373 1.00 0.00 H new ATOM 0 HG22 THR B 33 3.138 6.619 4.936 1.00 0.00 H new ATOM 0 HG23 THR B 33 2.527 8.290 4.899 1.00 0.00 H new ATOM 1842 N LEU B 34 1.847 4.598 6.726 1.00 0.00 N ATOM 1843 CA LEU B 34 1.893 3.311 6.055 1.00 0.00 C ATOM 1844 C LEU B 34 0.519 2.637 6.085 1.00 0.00 C ATOM 1845 O LEU B 34 0.153 1.913 5.159 1.00 0.00 O ATOM 1846 CB LEU B 34 2.971 2.428 6.698 1.00 0.00 C ATOM 1847 CG LEU B 34 3.335 1.170 5.914 1.00 0.00 C ATOM 1848 CD1 LEU B 34 4.834 0.920 5.975 1.00 0.00 C ATOM 1849 CD2 LEU B 34 2.581 -0.032 6.460 1.00 0.00 C ATOM 0 H LEU B 34 2.343 4.627 7.617 1.00 0.00 H new ATOM 0 HA LEU B 34 2.157 3.461 5.008 1.00 0.00 H new ATOM 0 HB2 LEU B 34 3.873 3.025 6.835 1.00 0.00 H new ATOM 0 HB3 LEU B 34 2.631 2.132 7.691 1.00 0.00 H new ATOM 0 HG LEU B 34 3.049 1.319 4.873 1.00 0.00 H new ATOM 0 HD11 LEU B 34 5.076 0.019 5.411 1.00 0.00 H new ATOM 0 HD12 LEU B 34 5.363 1.771 5.545 1.00 0.00 H new ATOM 0 HD13 LEU B 34 5.139 0.791 7.013 1.00 0.00 H new ATOM 0 HD21 LEU B 34 2.852 -0.921 5.890 1.00 0.00 H new ATOM 0 HD22 LEU B 34 2.842 -0.180 7.508 1.00 0.00 H new ATOM 0 HD23 LEU B 34 1.508 0.141 6.374 1.00 0.00 H new ATOM 1861 N MET B 35 -0.248 2.897 7.138 1.00 0.00 N ATOM 1862 CA MET B 35 -1.614 2.391 7.228 1.00 0.00 C ATOM 1863 C MET B 35 -2.490 3.037 6.158 1.00 0.00 C ATOM 1864 O MET B 35 -3.363 2.387 5.584 1.00 0.00 O ATOM 1865 CB MET B 35 -2.202 2.635 8.622 1.00 0.00 C ATOM 1866 CG MET B 35 -3.667 2.241 8.743 1.00 0.00 C ATOM 1867 SD MET B 35 -4.258 2.205 10.448 1.00 0.00 S ATOM 1868 CE MET B 35 -3.930 3.887 10.970 1.00 0.00 C ATOM 0 H MET B 35 0.051 3.453 7.939 1.00 0.00 H new ATOM 0 HA MET B 35 -1.589 1.315 7.058 1.00 0.00 H new ATOM 0 HB2 MET B 35 -1.622 2.074 9.355 1.00 0.00 H new ATOM 0 HB3 MET B 35 -2.097 3.691 8.872 1.00 0.00 H new ATOM 0 HG2 MET B 35 -4.273 2.943 8.170 1.00 0.00 H new ATOM 0 HG3 MET B 35 -3.810 1.257 8.295 1.00 0.00 H new ATOM 0 HE1 MET B 35 -4.541 4.123 11.841 1.00 0.00 H new ATOM 0 HE2 MET B 35 -2.876 3.989 11.228 1.00 0.00 H new ATOM 0 HE3 MET B 35 -4.173 4.574 10.159 1.00 0.00 H new ATOM 1878 N ILE B 36 -2.245 4.314 5.885 1.00 0.00 N ATOM 1879 CA ILE B 36 -2.950 5.018 4.822 1.00 0.00 C ATOM 1880 C ILE B 36 -2.645 4.386 3.467 1.00 0.00 C ATOM 1881 O ILE B 36 -3.549 4.166 2.659 1.00 0.00 O ATOM 1882 CB ILE B 36 -2.602 6.526 4.816 1.00 0.00 C ATOM 1883 CG1 ILE B 36 -3.306 7.217 5.991 1.00 0.00 C ATOM 1884 CG2 ILE B 36 -2.982 7.177 3.488 1.00 0.00 C ATOM 1885 CD1 ILE B 36 -3.039 8.700 6.076 1.00 0.00 C ATOM 0 H ILE B 36 -1.563 4.883 6.386 1.00 0.00 H new ATOM 0 HA ILE B 36 -4.019 4.927 5.013 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.524 6.639 4.931 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -4.380 7.055 5.904 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -2.987 6.746 6.921 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.725 8.236 3.515 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -2.439 6.693 2.677 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -4.054 7.068 3.323 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -3.571 9.117 6.931 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -1.969 8.871 6.195 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -3.384 9.185 5.163 1.00 0.00 H new ATOM 1897 N ALA B 37 -1.376 4.063 3.238 1.00 0.00 N ATOM 1898 CA ALA B 37 -0.973 3.365 2.022 1.00 0.00 C ATOM 1899 C ALA B 37 -1.673 2.011 1.937 1.00 0.00 C ATOM 1900 O ALA B 37 -2.085 1.574 0.858 1.00 0.00 O ATOM 1901 CB ALA B 37 0.537 3.182 1.989 1.00 0.00 C ATOM 0 H ALA B 37 -0.610 4.273 3.878 1.00 0.00 H new ATOM 0 HA ALA B 37 -1.266 3.967 1.162 1.00 0.00 H new ATOM 0 HB1 ALA B 37 0.820 2.660 1.075 1.00 0.00 H new ATOM 0 HB2 ALA B 37 1.022 4.158 2.015 1.00 0.00 H new ATOM 0 HB3 ALA B 37 0.852 2.597 2.854 1.00 0.00 H new ATOM 1907 N GLY B 38 -1.815 1.358 3.089 1.00 0.00 N ATOM 1908 CA GLY B 38 -2.533 0.101 3.154 1.00 0.00 C ATOM 1909 C GLY B 38 -3.995 0.263 2.799 1.00 0.00 C ATOM 1910 O GLY B 38 -4.544 -0.536 2.041 1.00 0.00 O ATOM 0 H GLY B 38 -1.442 1.682 3.982 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -2.072 -0.615 2.474 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -2.448 -0.313 4.159 1.00 0.00 H new ATOM 1914 N ASN B 39 -4.620 1.305 3.345 1.00 0.00 N ATOM 1915 CA ASN B 39 -6.018 1.615 3.043 1.00 0.00 C ATOM 1916 C ASN B 39 -6.212 1.793 1.547 1.00 0.00 C ATOM 1917 O ASN B 39 -7.152 1.249 0.964 1.00 0.00 O ATOM 1918 CB ASN B 39 -6.471 2.887 3.770 1.00 0.00 C ATOM 1919 CG ASN B 39 -6.590 2.708 5.272 1.00 0.00 C ATOM 1920 OD1 ASN B 39 -6.876 1.618 5.766 1.00 0.00 O ATOM 1921 ND2 ASN B 39 -6.379 3.787 6.011 1.00 0.00 N ATOM 0 H ASN B 39 -4.180 1.951 4.000 1.00 0.00 H new ATOM 0 HA ASN B 39 -6.624 0.778 3.390 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -5.762 3.689 3.561 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -7.435 3.202 3.371 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -6.452 3.732 7.027 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -6.144 4.673 5.564 1.00 0.00 H new ATOM 1928 N ILE B 40 -5.301 2.545 0.930 1.00 0.00 N ATOM 1929 CA ILE B 40 -5.337 2.777 -0.508 1.00 0.00 C ATOM 1930 C ILE B 40 -5.359 1.452 -1.263 1.00 0.00 C ATOM 1931 O ILE B 40 -6.288 1.178 -2.022 1.00 0.00 O ATOM 1932 CB ILE B 40 -4.122 3.612 -0.981 1.00 0.00 C ATOM 1933 CG1 ILE B 40 -4.132 4.996 -0.325 1.00 0.00 C ATOM 1934 CG2 ILE B 40 -4.123 3.746 -2.499 1.00 0.00 C ATOM 1935 CD1 ILE B 40 -2.910 5.832 -0.642 1.00 0.00 C ATOM 0 H ILE B 40 -4.527 3.005 1.409 1.00 0.00 H new ATOM 0 HA ILE B 40 -6.248 3.337 -0.722 1.00 0.00 H new ATOM 0 HB ILE B 40 -3.212 3.093 -0.680 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -5.023 5.535 -0.648 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -4.207 4.875 0.756 1.00 0.00 H new ATOM 0 HG21 ILE B 40 -3.262 4.336 -2.813 1.00 0.00 H new ATOM 0 HG22 ILE B 40 -4.069 2.756 -2.952 1.00 0.00 H new ATOM 0 HG23 ILE B 40 -5.039 4.242 -2.820 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -2.990 6.797 -0.142 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -2.016 5.316 -0.293 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -2.844 5.986 -1.719 1.00 0.00 H new ATOM 1947 N ALA B 41 -4.345 0.624 -1.028 1.00 0.00 N ATOM 1948 CA ALA B 41 -4.235 -0.662 -1.703 1.00 0.00 C ATOM 1949 C ALA B 41 -5.465 -1.529 -1.448 1.00 0.00 C ATOM 1950 O ALA B 41 -5.997 -2.142 -2.368 1.00 0.00 O ATOM 1951 CB ALA B 41 -2.975 -1.382 -1.257 1.00 0.00 C ATOM 0 H ALA B 41 -3.588 0.823 -0.374 1.00 0.00 H new ATOM 0 HA ALA B 41 -4.175 -0.477 -2.776 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -2.904 -2.342 -1.768 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -2.103 -0.775 -1.502 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -3.012 -1.547 -0.180 1.00 0.00 H new ATOM 1957 N THR B 42 -5.920 -1.554 -0.201 1.00 0.00 N ATOM 1958 CA THR B 42 -7.074 -2.358 0.188 1.00 0.00 C ATOM 1959 C THR B 42 -8.319 -1.971 -0.614 1.00 0.00 C ATOM 1960 O THR B 42 -8.940 -2.817 -1.259 1.00 0.00 O ATOM 1961 CB THR B 42 -7.367 -2.210 1.696 1.00 0.00 C ATOM 1962 OG1 THR B 42 -6.209 -2.576 2.456 1.00 0.00 O ATOM 1963 CG2 THR B 42 -8.544 -3.081 2.113 1.00 0.00 C ATOM 0 H THR B 42 -5.504 -1.023 0.564 1.00 0.00 H new ATOM 0 HA THR B 42 -6.829 -3.398 -0.028 1.00 0.00 H new ATOM 0 HB THR B 42 -7.621 -1.168 1.891 1.00 0.00 H new ATOM 0 HG1 THR B 42 -5.564 -1.838 2.445 1.00 0.00 H new ATOM 0 HG21 THR B 42 -8.728 -2.957 3.180 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.432 -2.784 1.555 1.00 0.00 H new ATOM 0 HG23 THR B 42 -8.316 -4.126 1.903 1.00 0.00 H new ATOM 1971 N ASN B 43 -8.667 -0.687 -0.596 1.00 0.00 N ATOM 1972 CA ASN B 43 -9.859 -0.215 -1.295 1.00 0.00 C ATOM 1973 C ASN B 43 -9.729 -0.411 -2.802 1.00 0.00 C ATOM 1974 O ASN B 43 -10.713 -0.696 -3.484 1.00 0.00 O ATOM 1975 CB ASN B 43 -10.144 1.256 -0.974 1.00 0.00 C ATOM 1976 CG ASN B 43 -10.773 1.444 0.395 1.00 0.00 C ATOM 1977 OD1 ASN B 43 -10.081 1.606 1.397 1.00 0.00 O ATOM 1978 ND2 ASN B 43 -12.096 1.425 0.447 1.00 0.00 N ATOM 0 H ASN B 43 -8.145 0.041 -0.109 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.700 -0.812 -0.943 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -9.213 1.822 -1.023 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -10.808 1.668 -1.734 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -12.573 1.547 1.340 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -12.638 1.288 -0.406 1.00 0.00 H new ATOM 1985 N VAL B 44 -8.514 -0.274 -3.323 1.00 0.00 N ATOM 1986 CA VAL B 44 -8.278 -0.489 -4.744 1.00 0.00 C ATOM 1987 C VAL B 44 -8.442 -1.964 -5.100 1.00 0.00 C ATOM 1988 O VAL B 44 -9.125 -2.299 -6.066 1.00 0.00 O ATOM 1989 CB VAL B 44 -6.883 0.007 -5.192 1.00 0.00 C ATOM 1990 CG1 VAL B 44 -6.614 -0.363 -6.644 1.00 0.00 C ATOM 1991 CG2 VAL B 44 -6.771 1.513 -5.007 1.00 0.00 C ATOM 0 H VAL B 44 -7.685 -0.017 -2.787 1.00 0.00 H new ATOM 0 HA VAL B 44 -9.024 0.099 -5.278 1.00 0.00 H new ATOM 0 HB VAL B 44 -6.135 -0.483 -4.569 1.00 0.00 H new ATOM 0 HG11 VAL B 44 -5.627 -0.003 -6.934 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -6.653 -1.446 -6.757 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -7.370 0.095 -7.282 1.00 0.00 H new ATOM 0 HG21 VAL B 44 -5.784 1.846 -5.327 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -7.534 2.011 -5.606 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -6.915 1.762 -3.956 1.00 0.00 H new ATOM 2001 N LEU B 45 -7.845 -2.839 -4.299 1.00 0.00 N ATOM 2002 CA LEU B 45 -7.907 -4.275 -4.551 1.00 0.00 C ATOM 2003 C LEU B 45 -9.331 -4.804 -4.431 1.00 0.00 C ATOM 2004 O LEU B 45 -9.741 -5.681 -5.186 1.00 0.00 O ATOM 2005 CB LEU B 45 -6.996 -5.038 -3.585 1.00 0.00 C ATOM 2006 CG LEU B 45 -5.498 -4.763 -3.737 1.00 0.00 C ATOM 2007 CD1 LEU B 45 -4.715 -5.494 -2.659 1.00 0.00 C ATOM 2008 CD2 LEU B 45 -5.016 -5.185 -5.117 1.00 0.00 C ATOM 0 H LEU B 45 -7.312 -2.580 -3.469 1.00 0.00 H new ATOM 0 HA LEU B 45 -7.563 -4.436 -5.573 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -7.291 -4.793 -2.565 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -7.167 -6.106 -3.719 1.00 0.00 H new ATOM 0 HG LEU B 45 -5.331 -3.692 -3.625 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -3.651 -5.289 -2.780 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -5.041 -5.152 -1.677 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -4.890 -6.566 -2.746 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -3.949 -4.982 -5.207 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -5.196 -6.251 -5.255 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -5.558 -4.624 -5.879 1.00 0.00 H new ATOM 2020 N ASN B 46 -10.087 -4.275 -3.488 1.00 0.00 N ATOM 2021 CA ASN B 46 -11.427 -4.787 -3.230 1.00 0.00 C ATOM 2022 C ASN B 46 -12.471 -4.185 -4.161 1.00 0.00 C ATOM 2023 O ASN B 46 -13.512 -4.796 -4.401 1.00 0.00 O ATOM 2024 CB ASN B 46 -11.829 -4.543 -1.773 1.00 0.00 C ATOM 2025 CG ASN B 46 -11.001 -5.360 -0.802 1.00 0.00 C ATOM 2026 OD1 ASN B 46 -10.508 -6.435 -1.140 1.00 0.00 O ATOM 2027 ND2 ASN B 46 -10.846 -4.861 0.412 1.00 0.00 N ATOM 0 H ASN B 46 -9.803 -3.498 -2.891 1.00 0.00 H new ATOM 0 HA ASN B 46 -11.393 -5.859 -3.423 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -11.717 -3.484 -1.540 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -12.883 -4.788 -1.644 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -10.301 -5.371 1.107 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -11.271 -3.966 0.654 1.00 0.00 H new ATOM 2034 N GLN B 47 -12.198 -3.009 -4.705 1.00 0.00 N ATOM 2035 CA GLN B 47 -13.225 -2.288 -5.448 1.00 0.00 C ATOM 2036 C GLN B 47 -12.800 -1.941 -6.877 1.00 0.00 C ATOM 2037 O GLN B 47 -13.531 -2.216 -7.828 1.00 0.00 O ATOM 2038 CB GLN B 47 -13.605 -1.017 -4.689 1.00 0.00 C ATOM 2039 CG GLN B 47 -14.056 -1.283 -3.257 1.00 0.00 C ATOM 2040 CD GLN B 47 -14.187 -0.020 -2.427 1.00 0.00 C ATOM 2041 OE1 GLN B 47 -13.967 -0.039 -1.214 1.00 0.00 O ATOM 2042 NE2 GLN B 47 -14.561 1.079 -3.062 1.00 0.00 N ATOM 0 H GLN B 47 -11.294 -2.540 -4.650 1.00 0.00 H new ATOM 0 HA GLN B 47 -14.086 -2.950 -5.533 1.00 0.00 H new ATOM 0 HB2 GLN B 47 -12.750 -0.342 -4.674 1.00 0.00 H new ATOM 0 HB3 GLN B 47 -14.405 -0.507 -5.226 1.00 0.00 H new ATOM 0 HG2 GLN B 47 -15.016 -1.799 -3.275 1.00 0.00 H new ATOM 0 HG3 GLN B 47 -13.343 -1.953 -2.777 1.00 0.00 H new ATOM 0 HE21 GLN B 47 -14.733 1.054 -4.067 1.00 0.00 H new ATOM 0 HE22 GLN B 47 -14.677 1.952 -2.546 1.00 0.00 H new ATOM 2051 N ARG B 48 -11.622 -1.351 -7.033 1.00 0.00 N ATOM 2052 CA ARG B 48 -11.220 -0.797 -8.327 1.00 0.00 C ATOM 2053 C ARG B 48 -10.604 -1.845 -9.260 1.00 0.00 C ATOM 2054 O ARG B 48 -10.916 -1.877 -10.451 1.00 0.00 O ATOM 2055 CB ARG B 48 -10.242 0.369 -8.134 1.00 0.00 C ATOM 2056 CG ARG B 48 -10.896 1.631 -7.594 1.00 0.00 C ATOM 2057 CD ARG B 48 -9.948 2.821 -7.661 1.00 0.00 C ATOM 2058 NE ARG B 48 -10.639 4.089 -7.419 1.00 0.00 N ATOM 2059 CZ ARG B 48 -10.305 5.248 -7.998 1.00 0.00 C ATOM 2060 NH1 ARG B 48 -9.260 5.320 -8.813 1.00 0.00 N ATOM 2061 NH2 ARG B 48 -11.019 6.337 -7.759 1.00 0.00 N ATOM 0 H ARG B 48 -10.932 -1.242 -6.290 1.00 0.00 H new ATOM 0 HA ARG B 48 -12.131 -0.437 -8.805 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -9.451 0.059 -7.451 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -9.768 0.596 -9.089 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -11.797 1.849 -8.167 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -11.206 1.469 -6.562 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -9.155 2.694 -6.924 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -9.471 2.850 -8.641 1.00 0.00 H new ATOM 0 HE ARG B 48 -11.424 4.089 -6.768 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -8.703 4.487 -9.003 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -9.014 6.208 -9.249 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -11.824 6.292 -7.134 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -10.765 7.221 -8.200 1.00 0.00 H new ATOM 2075 N VAL B 49 -9.745 -2.702 -8.723 1.00 0.00 N ATOM 2076 CA VAL B 49 -8.977 -3.626 -9.555 1.00 0.00 C ATOM 2077 C VAL B 49 -9.831 -4.810 -10.014 1.00 0.00 C ATOM 2078 O VAL B 49 -10.831 -5.155 -9.378 1.00 0.00 O ATOM 2079 CB VAL B 49 -7.719 -4.137 -8.811 1.00 0.00 C ATOM 2080 CG1 VAL B 49 -8.072 -5.216 -7.800 1.00 0.00 C ATOM 2081 CG2 VAL B 49 -6.671 -4.637 -9.791 1.00 0.00 C ATOM 0 H VAL B 49 -9.562 -2.778 -7.723 1.00 0.00 H new ATOM 0 HA VAL B 49 -8.658 -3.071 -10.437 1.00 0.00 H new ATOM 0 HB VAL B 49 -7.297 -3.294 -8.264 1.00 0.00 H new ATOM 0 HG11 VAL B 49 -7.166 -5.552 -7.296 1.00 0.00 H new ATOM 0 HG12 VAL B 49 -8.768 -4.812 -7.065 1.00 0.00 H new ATOM 0 HG13 VAL B 49 -8.535 -6.058 -8.314 1.00 0.00 H new ATOM 0 HG21 VAL B 49 -5.798 -4.990 -9.242 1.00 0.00 H new ATOM 0 HG22 VAL B 49 -7.085 -5.456 -10.380 1.00 0.00 H new ATOM 0 HG23 VAL B 49 -6.377 -3.824 -10.456 1.00 0.00 H new ATOM 2091 N ALA B 50 -9.437 -5.409 -11.133 1.00 0.00 N ATOM 2092 CA ALA B 50 -10.137 -6.558 -11.693 1.00 0.00 C ATOM 2093 C ALA B 50 -10.181 -7.725 -10.715 1.00 0.00 C ATOM 2094 O ALA B 50 -9.160 -8.108 -10.154 1.00 0.00 O ATOM 2095 CB ALA B 50 -9.474 -6.988 -12.990 1.00 0.00 C ATOM 0 H ALA B 50 -8.626 -5.112 -11.675 1.00 0.00 H new ATOM 0 HA ALA B 50 -11.165 -6.256 -11.893 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -10.003 -7.847 -13.402 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -9.506 -6.166 -13.705 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -8.437 -7.260 -12.796 1.00 0.00 H new ATOM 2101 N ALA B 51 -11.378 -8.272 -10.512 1.00 0.00 N ATOM 2102 CA ALA B 51 -11.581 -9.446 -9.665 1.00 0.00 C ATOM 2103 C ALA B 51 -10.615 -10.581 -10.007 1.00 0.00 C ATOM 2104 O ALA B 51 -9.985 -11.154 -9.119 1.00 0.00 O ATOM 2105 CB ALA B 51 -13.018 -9.936 -9.790 1.00 0.00 C ATOM 0 H ALA B 51 -12.236 -7.913 -10.931 1.00 0.00 H new ATOM 0 HA ALA B 51 -11.380 -9.143 -8.637 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -13.161 -10.811 -9.156 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -13.700 -9.146 -9.477 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -13.223 -10.202 -10.827 1.00 0.00 H new ATOM 2111 N SER B 52 -10.494 -10.892 -11.292 1.00 0.00 N ATOM 2112 CA SER B 52 -9.637 -11.989 -11.739 1.00 0.00 C ATOM 2113 C SER B 52 -8.152 -11.637 -11.612 1.00 0.00 C ATOM 2114 O SER B 52 -7.287 -12.505 -11.713 1.00 0.00 O ATOM 2115 CB SER B 52 -9.966 -12.349 -13.188 1.00 0.00 C ATOM 2116 OG SER B 52 -11.345 -12.641 -13.334 1.00 0.00 O ATOM 0 H SER B 52 -10.977 -10.402 -12.044 1.00 0.00 H new ATOM 0 HA SER B 52 -9.831 -12.847 -11.095 1.00 0.00 H new ATOM 0 HB2 SER B 52 -9.694 -11.522 -13.844 1.00 0.00 H new ATOM 0 HB3 SER B 52 -9.373 -13.210 -13.497 1.00 0.00 H new ATOM 0 HG SER B 52 -11.534 -12.867 -14.269 1.00 0.00 H new ATOM 2122 N GLN B 53 -7.866 -10.365 -11.374 1.00 0.00 N ATOM 2123 CA GLN B 53 -6.493 -9.894 -11.268 1.00 0.00 C ATOM 2124 C GLN B 53 -6.166 -9.587 -9.808 1.00 0.00 C ATOM 2125 O GLN B 53 -5.027 -9.289 -9.457 1.00 0.00 O ATOM 2126 CB GLN B 53 -6.320 -8.630 -12.120 1.00 0.00 C ATOM 2127 CG GLN B 53 -4.883 -8.350 -12.530 1.00 0.00 C ATOM 2128 CD GLN B 53 -4.277 -9.485 -13.331 1.00 0.00 C ATOM 2129 OE1 GLN B 53 -3.652 -10.390 -12.778 1.00 0.00 O ATOM 2130 NE2 GLN B 53 -4.479 -9.461 -14.638 1.00 0.00 N ATOM 0 H GLN B 53 -8.570 -9.638 -11.250 1.00 0.00 H new ATOM 0 HA GLN B 53 -5.814 -10.666 -11.629 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -6.931 -8.723 -13.018 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -6.701 -7.774 -11.563 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -4.849 -7.434 -13.120 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -4.281 -8.177 -11.638 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -5.002 -8.693 -15.059 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -4.112 -10.210 -15.225 1.00 0.00 H new ATOM 2139 N ARG B 54 -7.182 -9.709 -8.966 1.00 0.00 N ATOM 2140 CA ARG B 54 -7.123 -9.246 -7.585 1.00 0.00 C ATOM 2141 C ARG B 54 -6.051 -9.982 -6.782 1.00 0.00 C ATOM 2142 O ARG B 54 -5.181 -9.361 -6.175 1.00 0.00 O ATOM 2143 CB ARG B 54 -8.488 -9.446 -6.931 1.00 0.00 C ATOM 2144 CG ARG B 54 -8.734 -8.561 -5.726 1.00 0.00 C ATOM 2145 CD ARG B 54 -10.050 -8.901 -5.048 1.00 0.00 C ATOM 2146 NE ARG B 54 -11.152 -9.084 -5.998 1.00 0.00 N ATOM 2147 CZ ARG B 54 -12.137 -8.203 -6.179 1.00 0.00 C ATOM 2148 NH1 ARG B 54 -12.054 -6.989 -5.663 1.00 0.00 N ATOM 2149 NH2 ARG B 54 -13.187 -8.521 -6.920 1.00 0.00 N ATOM 0 H ARG B 54 -8.074 -10.133 -9.221 1.00 0.00 H new ATOM 0 HA ARG B 54 -6.858 -8.189 -7.592 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -9.265 -9.256 -7.672 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -8.584 -10.489 -6.628 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -7.916 -8.677 -5.015 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.742 -7.516 -6.036 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -9.926 -9.812 -4.463 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.308 -8.106 -4.349 1.00 0.00 H new ATOM 0 HE ARG B 54 -11.166 -9.938 -6.555 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -11.232 -6.720 -5.122 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -12.812 -6.321 -5.806 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -13.244 -9.442 -7.354 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -13.939 -7.845 -7.056 1.00 0.00 H new ATOM 2163 N LYS B 55 -6.115 -11.311 -6.801 1.00 0.00 N ATOM 2164 CA LYS B 55 -5.210 -12.142 -6.010 1.00 0.00 C ATOM 2165 C LYS B 55 -3.785 -12.013 -6.527 1.00 0.00 C ATOM 2166 O LYS B 55 -2.826 -11.925 -5.754 1.00 0.00 O ATOM 2167 CB LYS B 55 -5.645 -13.612 -6.077 1.00 0.00 C ATOM 2168 CG LYS B 55 -7.077 -13.868 -5.617 1.00 0.00 C ATOM 2169 CD LYS B 55 -7.242 -13.654 -4.121 1.00 0.00 C ATOM 2170 CE LYS B 55 -6.358 -14.591 -3.315 1.00 0.00 C ATOM 2171 NZ LYS B 55 -6.615 -16.023 -3.622 1.00 0.00 N ATOM 0 H LYS B 55 -6.787 -11.838 -7.358 1.00 0.00 H new ATOM 0 HA LYS B 55 -5.248 -11.801 -4.975 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -5.538 -13.963 -7.103 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -4.968 -14.207 -5.464 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -7.754 -13.205 -6.155 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -7.362 -14.889 -5.871 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -6.998 -12.621 -3.873 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -8.285 -13.811 -3.844 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -5.312 -14.362 -3.517 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -6.523 -14.416 -2.252 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -6.115 -16.621 -2.933 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -7.636 -16.212 -3.568 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -6.274 -16.239 -4.580 1.00 0.00 H new ATOM 2185 N LEU B 56 -3.662 -11.993 -7.842 1.00 0.00 N ATOM 2186 CA LEU B 56 -2.366 -11.951 -8.487 1.00 0.00 C ATOM 2187 C LEU B 56 -1.681 -10.610 -8.284 1.00 0.00 C ATOM 2188 O LEU B 56 -0.533 -10.561 -7.852 1.00 0.00 O ATOM 2189 CB LEU B 56 -2.505 -12.258 -9.977 1.00 0.00 C ATOM 2190 CG LEU B 56 -2.957 -13.683 -10.286 1.00 0.00 C ATOM 2191 CD1 LEU B 56 -3.113 -13.878 -11.785 1.00 0.00 C ATOM 2192 CD2 LEU B 56 -1.963 -14.684 -9.714 1.00 0.00 C ATOM 0 H LEU B 56 -4.452 -12.005 -8.487 1.00 0.00 H new ATOM 0 HA LEU B 56 -1.740 -12.714 -8.024 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -3.219 -11.560 -10.415 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -1.546 -12.080 -10.464 1.00 0.00 H new ATOM 0 HG LEU B 56 -3.927 -13.852 -9.818 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -3.436 -14.899 -11.987 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -3.858 -13.180 -12.167 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -2.158 -13.695 -12.277 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -2.296 -15.697 -9.940 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -0.982 -14.517 -10.158 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -1.899 -14.556 -8.633 1.00 0.00 H new ATOM 2204 N ILE B 57 -2.386 -9.522 -8.571 1.00 0.00 N ATOM 2205 CA ILE B 57 -1.780 -8.199 -8.513 1.00 0.00 C ATOM 2206 C ILE B 57 -1.420 -7.823 -7.075 1.00 0.00 C ATOM 2207 O ILE B 57 -0.454 -7.099 -6.841 1.00 0.00 O ATOM 2208 CB ILE B 57 -2.689 -7.115 -9.146 1.00 0.00 C ATOM 2209 CG1 ILE B 57 -1.847 -5.927 -9.604 1.00 0.00 C ATOM 2210 CG2 ILE B 57 -3.762 -6.652 -8.169 1.00 0.00 C ATOM 2211 CD1 ILE B 57 -2.610 -4.955 -10.475 1.00 0.00 C ATOM 0 H ILE B 57 -3.369 -9.529 -8.844 1.00 0.00 H new ATOM 0 HA ILE B 57 -0.863 -8.243 -9.101 1.00 0.00 H new ATOM 0 HB ILE B 57 -3.188 -7.556 -10.009 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -1.468 -5.400 -8.728 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -0.981 -6.295 -10.154 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -4.383 -5.892 -8.644 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -4.383 -7.500 -7.882 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -3.289 -6.232 -7.281 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -1.954 -4.135 -10.766 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -2.966 -5.469 -11.368 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -3.461 -4.560 -9.920 1.00 0.00 H new ATOM 2223 N ALA B 58 -2.185 -8.336 -6.114 1.00 0.00 N ATOM 2224 CA ALA B 58 -1.891 -8.109 -4.706 1.00 0.00 C ATOM 2225 C ALA B 58 -0.593 -8.805 -4.322 1.00 0.00 C ATOM 2226 O ALA B 58 0.241 -8.250 -3.603 1.00 0.00 O ATOM 2227 CB ALA B 58 -3.036 -8.602 -3.836 1.00 0.00 C ATOM 0 H ALA B 58 -3.010 -8.910 -6.287 1.00 0.00 H new ATOM 0 HA ALA B 58 -1.774 -7.038 -4.543 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.799 -8.424 -2.787 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -3.948 -8.066 -4.097 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -3.183 -9.670 -3.999 1.00 0.00 H new ATOM 2233 N GLU B 59 -0.424 -10.020 -4.827 1.00 0.00 N ATOM 2234 CA GLU B 59 0.781 -10.797 -4.575 1.00 0.00 C ATOM 2235 C GLU B 59 1.975 -10.169 -5.294 1.00 0.00 C ATOM 2236 O GLU B 59 3.055 -10.033 -4.718 1.00 0.00 O ATOM 2237 CB GLU B 59 0.568 -12.245 -5.022 1.00 0.00 C ATOM 2238 CG GLU B 59 1.743 -13.163 -4.736 1.00 0.00 C ATOM 2239 CD GLU B 59 1.423 -14.612 -5.030 1.00 0.00 C ATOM 2240 OE1 GLU B 59 0.977 -14.911 -6.157 1.00 0.00 O ATOM 2241 OE2 GLU B 59 1.592 -15.458 -4.131 1.00 0.00 O ATOM 0 H GLU B 59 -1.111 -10.490 -5.417 1.00 0.00 H new ATOM 0 HA GLU B 59 0.993 -10.795 -3.506 1.00 0.00 H new ATOM 0 HB2 GLU B 59 -0.317 -12.641 -4.524 1.00 0.00 H new ATOM 0 HB3 GLU B 59 0.364 -12.257 -6.093 1.00 0.00 H new ATOM 0 HG2 GLU B 59 2.598 -12.853 -5.336 1.00 0.00 H new ATOM 0 HG3 GLU B 59 2.034 -13.062 -3.690 1.00 0.00 H new ATOM 2248 N LYS B 60 1.767 -9.773 -6.547 1.00 0.00 N ATOM 2249 CA LYS B 60 2.802 -9.085 -7.322 1.00 0.00 C ATOM 2250 C LYS B 60 3.250 -7.808 -6.616 1.00 0.00 C ATOM 2251 O LYS B 60 4.442 -7.499 -6.566 1.00 0.00 O ATOM 2252 CB LYS B 60 2.289 -8.734 -8.722 1.00 0.00 C ATOM 2253 CG LYS B 60 1.880 -9.939 -9.553 1.00 0.00 C ATOM 2254 CD LYS B 60 1.343 -9.529 -10.914 1.00 0.00 C ATOM 2255 CE LYS B 60 0.754 -10.717 -11.659 1.00 0.00 C ATOM 2256 NZ LYS B 60 1.773 -11.765 -11.945 1.00 0.00 N ATOM 0 H LYS B 60 0.891 -9.916 -7.050 1.00 0.00 H new ATOM 0 HA LYS B 60 3.652 -9.762 -7.410 1.00 0.00 H new ATOM 0 HB2 LYS B 60 1.434 -8.065 -8.627 1.00 0.00 H new ATOM 0 HB3 LYS B 60 3.066 -8.185 -9.255 1.00 0.00 H new ATOM 0 HG2 LYS B 60 2.738 -10.598 -9.684 1.00 0.00 H new ATOM 0 HG3 LYS B 60 1.119 -10.508 -9.018 1.00 0.00 H new ATOM 0 HD2 LYS B 60 0.580 -8.761 -10.789 1.00 0.00 H new ATOM 0 HD3 LYS B 60 2.145 -9.088 -11.506 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -0.053 -11.150 -11.068 1.00 0.00 H new ATOM 0 HE3 LYS B 60 0.315 -10.374 -12.596 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 1.342 -12.523 -12.512 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 2.564 -11.345 -12.473 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 2.125 -12.160 -11.050 1.00 0.00 H new ATOM 2270 N PHE B 61 2.285 -7.070 -6.077 1.00 0.00 N ATOM 2271 CA PHE B 61 2.567 -5.832 -5.363 1.00 0.00 C ATOM 2272 C PHE B 61 3.404 -6.098 -4.116 1.00 0.00 C ATOM 2273 O PHE B 61 4.405 -5.419 -3.876 1.00 0.00 O ATOM 2274 CB PHE B 61 1.256 -5.136 -4.986 1.00 0.00 C ATOM 2275 CG PHE B 61 1.433 -3.937 -4.102 1.00 0.00 C ATOM 2276 CD1 PHE B 61 2.105 -2.817 -4.558 1.00 0.00 C ATOM 2277 CD2 PHE B 61 0.915 -3.930 -2.819 1.00 0.00 C ATOM 2278 CE1 PHE B 61 2.260 -1.711 -3.747 1.00 0.00 C ATOM 2279 CE2 PHE B 61 1.068 -2.828 -2.003 1.00 0.00 C ATOM 2280 CZ PHE B 61 1.740 -1.715 -2.467 1.00 0.00 C ATOM 0 H PHE B 61 1.295 -7.311 -6.122 1.00 0.00 H new ATOM 0 HA PHE B 61 3.141 -5.179 -6.020 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.744 -4.829 -5.898 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.608 -5.853 -4.482 1.00 0.00 H new ATOM 0 HD1 PHE B 61 2.512 -2.808 -5.558 1.00 0.00 H new ATOM 0 HD2 PHE B 61 0.385 -4.797 -2.452 1.00 0.00 H new ATOM 0 HE1 PHE B 61 2.788 -0.843 -4.113 1.00 0.00 H new ATOM 0 HE2 PHE B 61 0.662 -2.836 -1.002 1.00 0.00 H new ATOM 0 HZ PHE B 61 1.859 -0.850 -1.831 1.00 0.00 H new ATOM 2290 N ALA B 62 2.999 -7.088 -3.331 1.00 0.00 N ATOM 2291 CA ALA B 62 3.735 -7.451 -2.129 1.00 0.00 C ATOM 2292 C ALA B 62 5.144 -7.910 -2.486 1.00 0.00 C ATOM 2293 O ALA B 62 6.112 -7.554 -1.813 1.00 0.00 O ATOM 2294 CB ALA B 62 2.995 -8.534 -1.360 1.00 0.00 C ATOM 0 H ALA B 62 2.167 -7.652 -3.505 1.00 0.00 H new ATOM 0 HA ALA B 62 3.813 -6.571 -1.491 1.00 0.00 H new ATOM 0 HB1 ALA B 62 3.559 -8.794 -0.464 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.009 -8.168 -1.075 1.00 0.00 H new ATOM 0 HB3 ALA B 62 2.886 -9.417 -1.989 1.00 0.00 H new ATOM 2300 N GLN B 63 5.254 -8.682 -3.561 1.00 0.00 N ATOM 2301 CA GLN B 63 6.549 -9.130 -4.051 1.00 0.00 C ATOM 2302 C GLN B 63 7.425 -7.937 -4.402 1.00 0.00 C ATOM 2303 O GLN B 63 8.582 -7.876 -4.002 1.00 0.00 O ATOM 2304 CB GLN B 63 6.381 -10.013 -5.285 1.00 0.00 C ATOM 2305 CG GLN B 63 7.679 -10.627 -5.782 1.00 0.00 C ATOM 2306 CD GLN B 63 7.462 -11.569 -6.947 1.00 0.00 C ATOM 2307 OE1 GLN B 63 7.272 -12.771 -6.759 1.00 0.00 O ATOM 2308 NE2 GLN B 63 7.470 -11.032 -8.155 1.00 0.00 N ATOM 0 H GLN B 63 4.459 -9.010 -4.110 1.00 0.00 H new ATOM 0 HA GLN B 63 7.026 -9.708 -3.260 1.00 0.00 H new ATOM 0 HB2 GLN B 63 5.677 -10.812 -5.055 1.00 0.00 H new ATOM 0 HB3 GLN B 63 5.940 -9.421 -6.087 1.00 0.00 H new ATOM 0 HG2 GLN B 63 8.362 -9.833 -6.083 1.00 0.00 H new ATOM 0 HG3 GLN B 63 8.158 -11.167 -4.966 1.00 0.00 H new ATOM 0 HE21 GLN B 63 7.631 -10.031 -8.267 1.00 0.00 H new ATOM 0 HE22 GLN B 63 7.315 -11.619 -8.975 1.00 0.00 H new ATOM 2317 N ALA B 64 6.859 -6.991 -5.144 1.00 0.00 N ATOM 2318 CA ALA B 64 7.584 -5.794 -5.556 1.00 0.00 C ATOM 2319 C ALA B 64 8.062 -5.009 -4.344 1.00 0.00 C ATOM 2320 O ALA B 64 9.191 -4.514 -4.319 1.00 0.00 O ATOM 2321 CB ALA B 64 6.708 -4.919 -6.443 1.00 0.00 C ATOM 0 H ALA B 64 5.895 -7.031 -5.474 1.00 0.00 H new ATOM 0 HA ALA B 64 8.458 -6.105 -6.129 1.00 0.00 H new ATOM 0 HB1 ALA B 64 7.265 -4.031 -6.741 1.00 0.00 H new ATOM 0 HB2 ALA B 64 6.416 -5.479 -7.331 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.816 -4.620 -5.892 1.00 0.00 H new ATOM 2327 N LEU B 65 7.208 -4.921 -3.333 1.00 0.00 N ATOM 2328 CA LEU B 65 7.547 -4.214 -2.107 1.00 0.00 C ATOM 2329 C LEU B 65 8.706 -4.912 -1.397 1.00 0.00 C ATOM 2330 O LEU B 65 9.676 -4.272 -0.993 1.00 0.00 O ATOM 2331 CB LEU B 65 6.325 -4.126 -1.184 1.00 0.00 C ATOM 2332 CG LEU B 65 6.457 -3.129 -0.028 1.00 0.00 C ATOM 2333 CD1 LEU B 65 6.745 -1.740 -0.562 1.00 0.00 C ATOM 2334 CD2 LEU B 65 5.190 -3.110 0.813 1.00 0.00 C ATOM 0 H LEU B 65 6.274 -5.331 -3.339 1.00 0.00 H new ATOM 0 HA LEU B 65 7.857 -3.201 -2.363 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.456 -3.853 -1.782 1.00 0.00 H new ATOM 0 HB3 LEU B 65 6.129 -5.115 -0.770 1.00 0.00 H new ATOM 0 HG LEU B 65 7.288 -3.446 0.603 1.00 0.00 H new ATOM 0 HD11 LEU B 65 6.836 -1.042 0.270 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.676 -1.754 -1.128 1.00 0.00 H new ATOM 0 HD13 LEU B 65 5.930 -1.424 -1.213 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.305 -2.396 1.628 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.344 -2.817 0.191 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.011 -4.104 1.224 1.00 0.00 H new ATOM 2346 N MET B 66 8.610 -6.234 -1.269 1.00 0.00 N ATOM 2347 CA MET B 66 9.672 -7.030 -0.653 1.00 0.00 C ATOM 2348 C MET B 66 10.944 -6.992 -1.498 1.00 0.00 C ATOM 2349 O MET B 66 12.053 -7.084 -0.977 1.00 0.00 O ATOM 2350 CB MET B 66 9.228 -8.487 -0.464 1.00 0.00 C ATOM 2351 CG MET B 66 8.695 -8.830 0.926 1.00 0.00 C ATOM 2352 SD MET B 66 7.001 -8.279 1.230 1.00 0.00 S ATOM 2353 CE MET B 66 7.248 -6.549 1.621 1.00 0.00 C ATOM 0 H MET B 66 7.807 -6.778 -1.584 1.00 0.00 H new ATOM 0 HA MET B 66 9.881 -6.593 0.324 1.00 0.00 H new ATOM 0 HB2 MET B 66 8.454 -8.712 -1.198 1.00 0.00 H new ATOM 0 HB3 MET B 66 10.074 -9.139 -0.682 1.00 0.00 H new ATOM 0 HG2 MET B 66 8.744 -9.910 1.065 1.00 0.00 H new ATOM 0 HG3 MET B 66 9.350 -8.383 1.674 1.00 0.00 H new ATOM 0 HE1 MET B 66 6.626 -6.276 2.474 1.00 0.00 H new ATOM 0 HE2 MET B 66 8.296 -6.377 1.866 1.00 0.00 H new ATOM 0 HE3 MET B 66 6.972 -5.939 0.761 1.00 0.00 H new ATOM 2363 N SER B 67 10.771 -6.855 -2.804 1.00 0.00 N ATOM 2364 CA SER B 67 11.892 -6.808 -3.732 1.00 0.00 C ATOM 2365 C SER B 67 12.585 -5.447 -3.681 1.00 0.00 C ATOM 2366 O SER B 67 13.729 -5.302 -4.113 1.00 0.00 O ATOM 2367 CB SER B 67 11.403 -7.128 -5.149 1.00 0.00 C ATOM 2368 OG SER B 67 10.880 -8.445 -5.213 1.00 0.00 O ATOM 0 H SER B 67 9.857 -6.774 -3.249 1.00 0.00 H new ATOM 0 HA SER B 67 12.626 -7.558 -3.439 1.00 0.00 H new ATOM 0 HB2 SER B 67 10.636 -6.412 -5.445 1.00 0.00 H new ATOM 0 HB3 SER B 67 12.226 -7.024 -5.856 1.00 0.00 H new ATOM 0 HG SER B 67 10.138 -8.533 -4.579 1.00 0.00 H new ATOM 2374 N SER B 68 11.887 -4.458 -3.137 1.00 0.00 N ATOM 2375 CA SER B 68 12.451 -3.129 -2.952 1.00 0.00 C ATOM 2376 C SER B 68 12.921 -2.950 -1.507 1.00 0.00 C ATOM 2377 O SER B 68 13.343 -1.866 -1.097 1.00 0.00 O ATOM 2378 CB SER B 68 11.410 -2.068 -3.316 1.00 0.00 C ATOM 2379 OG SER B 68 10.900 -2.286 -4.627 1.00 0.00 O ATOM 0 H SER B 68 10.924 -4.553 -2.815 1.00 0.00 H new ATOM 0 HA SER B 68 13.313 -3.013 -3.609 1.00 0.00 H new ATOM 0 HB2 SER B 68 10.593 -2.092 -2.595 1.00 0.00 H new ATOM 0 HB3 SER B 68 11.859 -1.077 -3.256 1.00 0.00 H new ATOM 0 HG SER B 68 10.290 -3.053 -4.617 1.00 0.00 H new ATOM 2385 N LEU B 69 12.852 -4.032 -0.741 1.00 0.00 N ATOM 2386 CA LEU B 69 13.252 -4.011 0.653 1.00 0.00 C ATOM 2387 C LEU B 69 14.744 -4.303 0.774 1.00 0.00 C ATOM 2388 O LEU B 69 15.176 -5.449 0.620 1.00 0.00 O ATOM 2389 CB LEU B 69 12.438 -5.034 1.447 1.00 0.00 C ATOM 2390 CG LEU B 69 12.622 -4.981 2.962 1.00 0.00 C ATOM 2391 CD1 LEU B 69 12.163 -3.636 3.504 1.00 0.00 C ATOM 2392 CD2 LEU B 69 11.857 -6.116 3.625 1.00 0.00 C ATOM 0 H LEU B 69 12.520 -4.939 -1.068 1.00 0.00 H new ATOM 0 HA LEU B 69 13.059 -3.020 1.064 1.00 0.00 H new ATOM 0 HB2 LEU B 69 11.382 -4.888 1.221 1.00 0.00 H new ATOM 0 HB3 LEU B 69 12.703 -6.033 1.100 1.00 0.00 H new ATOM 0 HG LEU B 69 13.681 -5.099 3.191 1.00 0.00 H new ATOM 0 HD11 LEU B 69 12.300 -3.613 4.585 1.00 0.00 H new ATOM 0 HD12 LEU B 69 12.751 -2.840 3.047 1.00 0.00 H new ATOM 0 HD13 LEU B 69 11.109 -3.490 3.269 1.00 0.00 H new ATOM 0 HD21 LEU B 69 11.997 -6.067 4.705 1.00 0.00 H new ATOM 0 HD22 LEU B 69 10.796 -6.025 3.392 1.00 0.00 H new ATOM 0 HD23 LEU B 69 12.229 -7.071 3.254 1.00 0.00 H new