USER MOD reduce.3.24.130724 H: found=0, std=0, add=708, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 709 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 73 MET CE :methyl 177:sc= -0.59 (180deg=-0.481) USER MOD Set 1.2: B 286 GLN : amide:sc= -0.132 X(o=-0.72,f=-0.57) USER MOD Set 2.1: A 48 TYR OH : rot 180:sc= 0.314 USER MOD Set 2.2: A 68 ASN : amide:sc= 0.257 K(o=0.57,f=-2!) USER MOD Set 3.1: A 4 THR OG1 : rot 180:sc= 1.01 USER MOD Set 3.2: A 14 LYS NZ :NH3+ -139:sc= 1.97 (180deg=-0.0974) USER MOD Set 4.1: A 10 GLN : amide:sc= 0.00729 X(o=0.015,f=-0.098) USER MOD Set 4.2: B 289 TYR OH : rot 180:sc= 0.00811 USER MOD Single : A 1 MET CE :methyl 173:sc= -0.725 (180deg=-0.862) USER MOD Single : A 1 MET N :NH3+ -162:sc= 1.95 (180deg=1.6) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.315 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 GLN : amide:sc= -0.0184 X(o=-0.018,f=-0.018) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 158:sc= 1.29 (180deg=1.22) USER MOD Single : A 29 LYS NZ :NH3+ -174:sc= 1.2 (180deg=1.17) USER MOD Single : A 32 SER OG : rot 74:sc= 0.923 USER MOD Single : A 34 LYS NZ :NH3+ -163:sc= 0.00123 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 174:sc= 0.843 (180deg=0.741) USER MOD Single : A 44 GLN : amide:sc= 0.892 K(o=0.89,f=-2.2!) USER MOD Single : A 45 LYS NZ :NH3+ -138:sc= 0.342 (180deg=-0.21) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0.0938 K(o=0.094,f=-4.1!) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 TYR OH : rot 151:sc= 0.532 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 1.22 (180deg=1.22) USER MOD Single : B 291 MET CE :methyl 170:sc= 0 (180deg=-0.102) USER MOD Single : B 292 GLN : amide:sc= -0.0359 X(o=-0.036,f=-0.036) USER MOD Single : B 293 MET CE :methyl -130:sc=-0.00992 (180deg=-0.458) USER MOD Single : B 294 SER OG : rot -24:sc= 0.834 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.518 1.650 6.229 1.00 0.00 N ATOM 2 CA MET A 1 -16.780 1.534 4.773 1.00 0.00 C ATOM 3 C MET A 1 -15.468 1.486 4.009 1.00 0.00 C ATOM 4 O MET A 1 -14.605 2.339 4.200 1.00 0.00 O ATOM 5 CB MET A 1 -17.720 2.620 4.209 1.00 0.00 C ATOM 6 CG MET A 1 -17.215 4.064 4.225 1.00 0.00 C ATOM 7 SD MET A 1 -18.410 5.231 3.516 1.00 0.00 S ATOM 8 CE MET A 1 -17.605 5.669 1.958 1.00 0.00 C ATOM 0 H1 MET A 1 -17.372 1.380 6.758 1.00 0.00 H new ATOM 0 H2 MET A 1 -15.734 1.020 6.492 1.00 0.00 H new ATOM 0 H3 MET A 1 -16.265 2.632 6.459 1.00 0.00 H new ATOM 0 HA MET A 1 -17.318 0.597 4.632 1.00 0.00 H new ATOM 0 HB2 MET A 1 -17.958 2.358 3.178 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.653 2.583 4.771 1.00 0.00 H new ATOM 0 HG2 MET A 1 -16.993 4.356 5.252 1.00 0.00 H new ATOM 0 HG3 MET A 1 -16.280 4.124 3.668 1.00 0.00 H new ATOM 0 HE1 MET A 1 -18.279 6.281 1.360 1.00 0.00 H new ATOM 0 HE2 MET A 1 -16.693 6.229 2.165 1.00 0.00 H new ATOM 0 HE3 MET A 1 -17.356 4.761 1.409 1.00 0.00 H new ATOM 20 N GLN A 2 -15.293 0.472 3.167 1.00 0.00 N ATOM 21 CA GLN A 2 -14.027 0.162 2.498 1.00 0.00 C ATOM 22 C GLN A 2 -13.972 0.790 1.098 1.00 0.00 C ATOM 23 O GLN A 2 -14.105 0.112 0.073 1.00 0.00 O ATOM 24 CB GLN A 2 -13.739 -1.347 2.512 1.00 0.00 C ATOM 25 CG GLN A 2 -13.957 -2.023 3.874 1.00 0.00 C ATOM 26 CD GLN A 2 -13.539 -3.491 3.849 1.00 0.00 C ATOM 27 OE1 GLN A 2 -14.346 -4.397 3.678 1.00 0.00 O ATOM 28 NE2 GLN A 2 -12.267 -3.794 4.012 1.00 0.00 N ATOM 0 H GLN A 2 -16.043 -0.174 2.923 1.00 0.00 H new ATOM 0 HA GLN A 2 -13.215 0.620 3.063 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -14.376 -1.833 1.773 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -12.707 -1.510 2.200 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -13.386 -1.495 4.638 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -15.008 -1.949 4.153 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -11.581 -3.053 4.156 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -11.969 -4.769 3.995 1.00 0.00 H new ATOM 37 N VAL A 3 -13.780 2.111 1.071 1.00 0.00 N ATOM 38 CA VAL A 3 -13.595 2.924 -0.142 1.00 0.00 C ATOM 39 C VAL A 3 -12.386 2.413 -0.925 1.00 0.00 C ATOM 40 O VAL A 3 -11.331 2.168 -0.338 1.00 0.00 O ATOM 41 CB VAL A 3 -13.369 4.408 0.221 1.00 0.00 C ATOM 42 CG1 VAL A 3 -13.235 5.301 -1.020 1.00 0.00 C ATOM 43 CG2 VAL A 3 -14.551 4.964 1.011 1.00 0.00 C ATOM 0 H VAL A 3 -13.747 2.669 1.924 1.00 0.00 H new ATOM 0 HA VAL A 3 -14.496 2.842 -0.749 1.00 0.00 H new ATOM 0 HB VAL A 3 -12.447 4.424 0.803 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -13.078 6.334 -0.710 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -12.386 4.968 -1.618 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -14.146 5.236 -1.615 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -14.366 6.010 1.254 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -15.458 4.885 0.412 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -14.674 4.394 1.932 1.00 0.00 H new ATOM 53 N THR A 4 -12.512 2.257 -2.243 1.00 0.00 N ATOM 54 CA THR A 4 -11.353 1.994 -3.108 1.00 0.00 C ATOM 55 C THR A 4 -10.617 3.302 -3.389 1.00 0.00 C ATOM 56 O THR A 4 -11.222 4.298 -3.776 1.00 0.00 O ATOM 57 CB THR A 4 -11.770 1.359 -4.434 1.00 0.00 C ATOM 58 OG1 THR A 4 -12.359 0.100 -4.192 1.00 0.00 O ATOM 59 CG2 THR A 4 -10.565 1.124 -5.340 1.00 0.00 C ATOM 0 H THR A 4 -13.402 2.307 -2.738 1.00 0.00 H new ATOM 0 HA THR A 4 -10.700 1.295 -2.586 1.00 0.00 H new ATOM 0 HB THR A 4 -12.469 2.042 -4.916 1.00 0.00 H new ATOM 0 HG1 THR A 4 -12.627 -0.305 -5.043 1.00 0.00 H new ATOM 0 HG21 THR A 4 -10.895 0.671 -6.275 1.00 0.00 H new ATOM 0 HG22 THR A 4 -10.077 2.076 -5.550 1.00 0.00 H new ATOM 0 HG23 THR A 4 -9.861 0.457 -4.843 1.00 0.00 H new ATOM 67 N LEU A 5 -9.303 3.303 -3.217 1.00 0.00 N ATOM 68 CA LEU A 5 -8.396 4.410 -3.490 1.00 0.00 C ATOM 69 C LEU A 5 -7.622 4.152 -4.783 1.00 0.00 C ATOM 70 O LEU A 5 -7.291 3.009 -5.107 1.00 0.00 O ATOM 71 CB LEU A 5 -7.436 4.528 -2.294 1.00 0.00 C ATOM 72 CG LEU A 5 -8.002 5.263 -1.063 1.00 0.00 C ATOM 73 CD1 LEU A 5 -7.569 6.720 -1.122 1.00 0.00 C ATOM 74 CD2 LEU A 5 -9.510 5.169 -0.818 1.00 0.00 C ATOM 0 H LEU A 5 -8.812 2.483 -2.862 1.00 0.00 H new ATOM 0 HA LEU A 5 -8.950 5.340 -3.620 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -7.135 3.525 -1.991 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -6.535 5.046 -2.623 1.00 0.00 H new ATOM 0 HG LEU A 5 -7.581 4.733 -0.208 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -7.963 7.252 -0.256 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -6.480 6.777 -1.118 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -7.953 7.177 -2.034 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -9.769 5.731 0.079 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -10.044 5.584 -1.673 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -9.793 4.125 -0.686 1.00 0.00 H new ATOM 86 N LYS A 6 -7.295 5.238 -5.485 1.00 0.00 N ATOM 87 CA LYS A 6 -6.449 5.255 -6.685 1.00 0.00 C ATOM 88 C LYS A 6 -5.478 6.435 -6.659 1.00 0.00 C ATOM 89 O LYS A 6 -5.891 7.584 -6.491 1.00 0.00 O ATOM 90 CB LYS A 6 -7.315 5.224 -7.954 1.00 0.00 C ATOM 91 CG LYS A 6 -6.423 5.036 -9.190 1.00 0.00 C ATOM 92 CD LYS A 6 -7.189 4.433 -10.371 1.00 0.00 C ATOM 93 CE LYS A 6 -6.163 4.034 -11.435 1.00 0.00 C ATOM 94 NZ LYS A 6 -6.790 3.277 -12.551 1.00 0.00 N ATOM 0 H LYS A 6 -7.624 6.168 -5.225 1.00 0.00 H new ATOM 0 HA LYS A 6 -5.835 4.354 -6.695 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -8.040 4.412 -7.891 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -7.882 6.151 -8.041 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -6.005 5.999 -9.484 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -5.584 4.389 -8.935 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -7.765 3.565 -10.050 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -7.899 5.155 -10.775 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -5.681 4.929 -11.829 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -5.382 3.426 -10.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -6.063 3.025 -13.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -7.228 2.410 -12.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -7.518 3.866 -13.004 1.00 0.00 H new ATOM 108 N THR A 7 -4.187 6.147 -6.788 1.00 0.00 N ATOM 109 CA THR A 7 -3.110 7.152 -6.810 1.00 0.00 C ATOM 110 C THR A 7 -2.946 7.784 -8.200 1.00 0.00 C ATOM 111 O THR A 7 -3.453 7.261 -9.197 1.00 0.00 O ATOM 112 CB THR A 7 -1.774 6.539 -6.353 1.00 0.00 C ATOM 113 OG1 THR A 7 -1.191 5.767 -7.382 1.00 0.00 O ATOM 114 CG2 THR A 7 -1.914 5.625 -5.133 1.00 0.00 C ATOM 0 H THR A 7 -3.845 5.191 -6.883 1.00 0.00 H new ATOM 0 HA THR A 7 -3.397 7.939 -6.112 1.00 0.00 H new ATOM 0 HB THR A 7 -1.148 7.392 -6.091 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.343 5.390 -7.068 1.00 0.00 H new ATOM 0 HG21 THR A 7 -0.936 5.226 -4.863 1.00 0.00 H new ATOM 0 HG22 THR A 7 -2.317 6.195 -4.296 1.00 0.00 H new ATOM 0 HG23 THR A 7 -2.589 4.802 -5.370 1.00 0.00 H new ATOM 122 N LEU A 8 -2.174 8.873 -8.309 1.00 0.00 N ATOM 123 CA LEU A 8 -1.784 9.437 -9.614 1.00 0.00 C ATOM 124 C LEU A 8 -0.818 8.539 -10.408 1.00 0.00 C ATOM 125 O LEU A 8 -0.759 8.626 -11.634 1.00 0.00 O ATOM 126 CB LEU A 8 -1.175 10.833 -9.446 1.00 0.00 C ATOM 127 CG LEU A 8 -2.067 11.877 -8.758 1.00 0.00 C ATOM 128 CD1 LEU A 8 -1.377 13.239 -8.792 1.00 0.00 C ATOM 129 CD2 LEU A 8 -3.412 12.043 -9.448 1.00 0.00 C ATOM 0 H LEU A 8 -1.805 9.385 -7.508 1.00 0.00 H new ATOM 0 HA LEU A 8 -2.704 9.503 -10.194 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -0.252 10.739 -8.874 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.902 11.210 -10.432 1.00 0.00 H new ATOM 0 HG LEU A 8 -2.230 11.523 -7.740 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -2.010 13.980 -8.304 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -0.422 13.176 -8.269 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -1.205 13.534 -9.827 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.002 12.793 -8.920 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.255 12.364 -10.478 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.944 11.092 -9.441 1.00 0.00 H new ATOM 141 N GLN A 9 -0.101 7.639 -9.728 1.00 0.00 N ATOM 142 CA GLN A 9 0.693 6.564 -10.341 1.00 0.00 C ATOM 143 C GLN A 9 -0.199 5.391 -10.818 1.00 0.00 C ATOM 144 O GLN A 9 0.310 4.371 -11.285 1.00 0.00 O ATOM 145 CB GLN A 9 1.776 6.092 -9.352 1.00 0.00 C ATOM 146 CG GLN A 9 2.813 7.188 -9.054 1.00 0.00 C ATOM 147 CD GLN A 9 3.919 6.681 -8.129 1.00 0.00 C ATOM 148 OE1 GLN A 9 3.876 6.836 -6.915 1.00 0.00 O ATOM 149 NE2 GLN A 9 4.954 6.057 -8.656 1.00 0.00 N ATOM 0 H GLN A 9 -0.054 7.636 -8.709 1.00 0.00 H new ATOM 0 HA GLN A 9 1.183 6.958 -11.231 1.00 0.00 H new ATOM 0 HB2 GLN A 9 1.303 5.780 -8.421 1.00 0.00 H new ATOM 0 HB3 GLN A 9 2.282 5.218 -9.761 1.00 0.00 H new ATOM 0 HG2 GLN A 9 3.252 7.538 -9.988 1.00 0.00 H new ATOM 0 HG3 GLN A 9 2.317 8.043 -8.594 1.00 0.00 H new ATOM 0 HE21 GLN A 9 5.007 5.919 -9.665 1.00 0.00 H new ATOM 0 HE22 GLN A 9 5.702 5.712 -8.054 1.00 0.00 H new ATOM 158 N GLN A 10 -1.529 5.538 -10.718 1.00 0.00 N ATOM 159 CA GLN A 10 -2.579 4.584 -11.091 1.00 0.00 C ATOM 160 C GLN A 10 -2.557 3.279 -10.269 1.00 0.00 C ATOM 161 O GLN A 10 -3.065 2.246 -10.714 1.00 0.00 O ATOM 162 CB GLN A 10 -2.622 4.378 -12.620 1.00 0.00 C ATOM 163 CG GLN A 10 -2.910 5.683 -13.386 1.00 0.00 C ATOM 164 CD GLN A 10 -2.979 5.464 -14.898 1.00 0.00 C ATOM 165 OE1 GLN A 10 -3.574 4.517 -15.400 1.00 0.00 O ATOM 166 NE2 GLN A 10 -2.386 6.331 -15.691 1.00 0.00 N ATOM 0 H GLN A 10 -1.928 6.399 -10.343 1.00 0.00 H new ATOM 0 HA GLN A 10 -3.534 5.031 -10.814 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -1.669 3.968 -12.954 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -3.389 3.642 -12.862 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -3.853 6.105 -13.039 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -2.132 6.413 -13.162 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -1.886 7.126 -15.294 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -2.427 6.208 -16.703 1.00 0.00 H new ATOM 175 N GLN A 11 -2.031 3.331 -9.041 1.00 0.00 N ATOM 176 CA GLN A 11 -2.000 2.203 -8.103 1.00 0.00 C ATOM 177 C GLN A 11 -3.275 2.194 -7.255 1.00 0.00 C ATOM 178 O GLN A 11 -3.798 3.257 -6.920 1.00 0.00 O ATOM 179 CB GLN A 11 -0.748 2.291 -7.215 1.00 0.00 C ATOM 180 CG GLN A 11 0.564 2.264 -8.018 1.00 0.00 C ATOM 181 CD GLN A 11 0.814 0.916 -8.695 1.00 0.00 C ATOM 182 OE1 GLN A 11 0.559 0.717 -9.876 1.00 0.00 O ATOM 183 NE2 GLN A 11 1.317 -0.069 -7.978 1.00 0.00 N ATOM 0 H GLN A 11 -1.605 4.177 -8.663 1.00 0.00 H new ATOM 0 HA GLN A 11 -1.955 1.269 -8.663 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -0.789 3.209 -6.629 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -0.752 1.461 -6.508 1.00 0.00 H new ATOM 0 HG2 GLN A 11 0.538 3.047 -8.776 1.00 0.00 H new ATOM 0 HG3 GLN A 11 1.397 2.492 -7.353 1.00 0.00 H new ATOM 0 HE21 GLN A 11 1.536 0.078 -6.993 1.00 0.00 H new ATOM 0 HE22 GLN A 11 1.487 -0.978 -8.409 1.00 0.00 H new ATOM 192 N THR A 12 -3.796 1.010 -6.922 1.00 0.00 N ATOM 193 CA THR A 12 -5.111 0.852 -6.274 1.00 0.00 C ATOM 194 C THR A 12 -5.087 -0.094 -5.071 1.00 0.00 C ATOM 195 O THR A 12 -4.458 -1.155 -5.083 1.00 0.00 O ATOM 196 CB THR A 12 -6.201 0.415 -7.270 1.00 0.00 C ATOM 197 OG1 THR A 12 -5.801 -0.730 -7.998 1.00 0.00 O ATOM 198 CG2 THR A 12 -6.537 1.513 -8.283 1.00 0.00 C ATOM 0 H THR A 12 -3.318 0.125 -7.093 1.00 0.00 H new ATOM 0 HA THR A 12 -5.360 1.845 -5.899 1.00 0.00 H new ATOM 0 HB THR A 12 -7.081 0.196 -6.666 1.00 0.00 H new ATOM 0 HG1 THR A 12 -6.512 -0.986 -8.621 1.00 0.00 H new ATOM 0 HG21 THR A 12 -7.310 1.156 -8.963 1.00 0.00 H new ATOM 0 HG22 THR A 12 -6.897 2.397 -7.756 1.00 0.00 H new ATOM 0 HG23 THR A 12 -5.643 1.769 -8.852 1.00 0.00 H new ATOM 206 N PHE A 13 -5.764 0.330 -4.003 1.00 0.00 N ATOM 207 CA PHE A 13 -5.971 -0.367 -2.725 1.00 0.00 C ATOM 208 C PHE A 13 -7.309 0.066 -2.104 1.00 0.00 C ATOM 209 O PHE A 13 -7.988 0.933 -2.653 1.00 0.00 O ATOM 210 CB PHE A 13 -4.792 -0.065 -1.777 1.00 0.00 C ATOM 211 CG PHE A 13 -4.467 1.410 -1.568 1.00 0.00 C ATOM 212 CD1 PHE A 13 -3.639 2.090 -2.484 1.00 0.00 C ATOM 213 CD2 PHE A 13 -4.975 2.105 -0.453 1.00 0.00 C ATOM 214 CE1 PHE A 13 -3.342 3.452 -2.299 1.00 0.00 C ATOM 215 CE2 PHE A 13 -4.677 3.469 -0.268 1.00 0.00 C ATOM 216 CZ PHE A 13 -3.865 4.145 -1.194 1.00 0.00 C ATOM 0 H PHE A 13 -6.220 1.243 -4.006 1.00 0.00 H new ATOM 0 HA PHE A 13 -6.010 -1.443 -2.894 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -5.008 -0.511 -0.806 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -3.903 -0.562 -2.165 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -3.230 1.562 -3.333 1.00 0.00 H new ATOM 0 HD2 PHE A 13 -5.596 1.589 0.264 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -2.710 3.967 -3.008 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -5.073 3.996 0.587 1.00 0.00 H new ATOM 0 HZ PHE A 13 -3.644 5.193 -1.057 1.00 0.00 H new ATOM 226 N LYS A 14 -7.700 -0.492 -0.954 1.00 0.00 N ATOM 227 CA LYS A 14 -8.841 -0.002 -0.154 1.00 0.00 C ATOM 228 C LYS A 14 -8.420 0.686 1.148 1.00 0.00 C ATOM 229 O LYS A 14 -7.377 0.378 1.725 1.00 0.00 O ATOM 230 CB LYS A 14 -9.808 -1.153 0.148 1.00 0.00 C ATOM 231 CG LYS A 14 -10.643 -1.467 -1.092 1.00 0.00 C ATOM 232 CD LYS A 14 -11.672 -2.556 -0.787 1.00 0.00 C ATOM 233 CE LYS A 14 -12.588 -2.750 -1.992 1.00 0.00 C ATOM 234 NZ LYS A 14 -13.476 -1.576 -2.202 1.00 0.00 N ATOM 0 H LYS A 14 -7.235 -1.302 -0.544 1.00 0.00 H new ATOM 0 HA LYS A 14 -9.339 0.756 -0.759 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -9.250 -2.038 0.455 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -10.461 -0.883 0.978 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -11.151 -0.565 -1.433 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.991 -1.792 -1.903 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -11.166 -3.491 -0.548 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -12.260 -2.279 0.088 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -11.985 -2.915 -2.885 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -13.195 -3.644 -1.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -14.430 -1.903 -2.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -13.525 -1.017 -1.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -13.095 -0.986 -2.969 1.00 0.00 H new ATOM 248 N ILE A 15 -9.294 1.566 1.635 1.00 0.00 N ATOM 249 CA ILE A 15 -9.249 2.233 2.941 1.00 0.00 C ATOM 250 C ILE A 15 -10.597 2.043 3.631 1.00 0.00 C ATOM 251 O ILE A 15 -11.619 2.560 3.181 1.00 0.00 O ATOM 252 CB ILE A 15 -8.872 3.724 2.788 1.00 0.00 C ATOM 253 CG1 ILE A 15 -7.378 3.892 2.453 1.00 0.00 C ATOM 254 CG2 ILE A 15 -9.229 4.576 4.016 1.00 0.00 C ATOM 255 CD1 ILE A 15 -6.376 3.571 3.574 1.00 0.00 C ATOM 0 H ILE A 15 -10.109 1.853 1.093 1.00 0.00 H new ATOM 0 HA ILE A 15 -8.473 1.786 3.563 1.00 0.00 H new ATOM 0 HB ILE A 15 -9.475 4.092 1.957 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -7.148 3.255 1.599 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -7.215 4.922 2.136 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -8.936 5.611 3.838 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -10.304 4.528 4.192 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -8.701 4.194 4.890 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -5.361 3.729 3.211 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -6.562 4.224 4.426 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -6.494 2.532 3.881 1.00 0.00 H new ATOM 267 N ASP A 16 -10.599 1.268 4.715 1.00 0.00 N ATOM 268 CA ASP A 16 -11.754 1.157 5.615 1.00 0.00 C ATOM 269 C ASP A 16 -11.852 2.403 6.516 1.00 0.00 C ATOM 270 O ASP A 16 -11.054 2.568 7.443 1.00 0.00 O ATOM 271 CB ASP A 16 -11.697 -0.112 6.473 1.00 0.00 C ATOM 272 CG ASP A 16 -12.983 -0.276 7.314 1.00 0.00 C ATOM 273 OD1 ASP A 16 -14.084 0.111 6.844 1.00 0.00 O ATOM 274 OD2 ASP A 16 -12.891 -0.798 8.450 1.00 0.00 O ATOM 0 H ASP A 16 -9.801 0.698 4.997 1.00 0.00 H new ATOM 0 HA ASP A 16 -12.646 1.091 4.991 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -11.566 -0.983 5.831 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -10.831 -0.069 7.133 1.00 0.00 H new ATOM 279 N ILE A 17 -12.802 3.290 6.239 1.00 0.00 N ATOM 280 CA ILE A 17 -12.999 4.590 6.902 1.00 0.00 C ATOM 281 C ILE A 17 -14.419 4.722 7.481 1.00 0.00 C ATOM 282 O ILE A 17 -15.355 4.089 6.996 1.00 0.00 O ATOM 283 CB ILE A 17 -12.631 5.719 5.907 1.00 0.00 C ATOM 284 CG1 ILE A 17 -12.818 7.139 6.475 1.00 0.00 C ATOM 285 CG2 ILE A 17 -13.382 5.585 4.561 1.00 0.00 C ATOM 286 CD1 ILE A 17 -11.999 7.435 7.739 1.00 0.00 C ATOM 0 H ILE A 17 -13.495 3.120 5.510 1.00 0.00 H new ATOM 0 HA ILE A 17 -12.336 4.672 7.763 1.00 0.00 H new ATOM 0 HB ILE A 17 -11.564 5.585 5.729 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -12.548 7.862 5.706 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -13.874 7.290 6.699 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -13.090 6.400 3.899 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -13.130 4.632 4.097 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -14.457 5.629 4.738 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -12.193 8.456 8.068 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -12.284 6.739 8.528 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -10.937 7.320 7.520 1.00 0.00 H new ATOM 298 N ASP A 18 -14.603 5.532 8.527 1.00 0.00 N ATOM 299 CA ASP A 18 -15.928 5.806 9.112 1.00 0.00 C ATOM 300 C ASP A 18 -16.663 6.957 8.368 1.00 0.00 C ATOM 301 O ASP A 18 -16.099 8.049 8.258 1.00 0.00 O ATOM 302 CB ASP A 18 -15.749 6.122 10.602 1.00 0.00 C ATOM 303 CG ASP A 18 -17.097 6.193 11.340 1.00 0.00 C ATOM 304 OD1 ASP A 18 -17.936 7.053 10.986 1.00 0.00 O ATOM 305 OD2 ASP A 18 -17.323 5.372 12.261 1.00 0.00 O ATOM 0 H ASP A 18 -13.840 6.019 8.996 1.00 0.00 H new ATOM 0 HA ASP A 18 -16.558 4.924 9.000 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -15.123 5.358 11.062 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -15.225 7.072 10.711 1.00 0.00 H new ATOM 310 N PRO A 19 -17.900 6.765 7.856 1.00 0.00 N ATOM 311 CA PRO A 19 -18.612 7.776 7.059 1.00 0.00 C ATOM 312 C PRO A 19 -19.117 9.001 7.841 1.00 0.00 C ATOM 313 O PRO A 19 -19.377 10.041 7.229 1.00 0.00 O ATOM 314 CB PRO A 19 -19.818 7.043 6.460 1.00 0.00 C ATOM 315 CG PRO A 19 -20.085 5.909 7.446 1.00 0.00 C ATOM 316 CD PRO A 19 -18.687 5.543 7.938 1.00 0.00 C ATOM 0 HA PRO A 19 -17.913 8.185 6.329 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -20.681 7.703 6.367 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -19.599 6.662 5.463 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -20.729 6.230 8.265 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -20.577 5.064 6.965 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -18.719 5.168 8.961 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -18.251 4.756 7.323 1.00 0.00 H new ATOM 324 N GLU A 20 -19.299 8.903 9.163 1.00 0.00 N ATOM 325 CA GLU A 20 -19.708 10.028 10.012 1.00 0.00 C ATOM 326 C GLU A 20 -18.522 10.948 10.355 1.00 0.00 C ATOM 327 O GLU A 20 -18.719 12.118 10.691 1.00 0.00 O ATOM 328 CB GLU A 20 -20.371 9.509 11.297 1.00 0.00 C ATOM 329 CG GLU A 20 -21.686 8.766 11.022 1.00 0.00 C ATOM 330 CD GLU A 20 -22.419 8.430 12.336 1.00 0.00 C ATOM 331 OE1 GLU A 20 -23.177 9.290 12.849 1.00 0.00 O ATOM 332 OE2 GLU A 20 -22.259 7.301 12.862 1.00 0.00 O ATOM 0 H GLU A 20 -19.165 8.033 9.678 1.00 0.00 H new ATOM 0 HA GLU A 20 -20.430 10.621 9.450 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -19.681 8.841 11.813 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -20.564 10.347 11.966 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -22.328 9.379 10.390 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -21.480 7.848 10.472 1.00 0.00 H new ATOM 339 N GLU A 21 -17.290 10.441 10.250 1.00 0.00 N ATOM 340 CA GLU A 21 -16.069 11.247 10.319 1.00 0.00 C ATOM 341 C GLU A 21 -15.862 12.041 9.011 1.00 0.00 C ATOM 342 O GLU A 21 -16.565 11.856 8.008 1.00 0.00 O ATOM 343 CB GLU A 21 -14.841 10.363 10.598 1.00 0.00 C ATOM 344 CG GLU A 21 -14.880 9.598 11.928 1.00 0.00 C ATOM 345 CD GLU A 21 -14.951 10.519 13.166 1.00 0.00 C ATOM 346 OE1 GLU A 21 -14.274 11.576 13.197 1.00 0.00 O ATOM 347 OE2 GLU A 21 -15.675 10.182 14.135 1.00 0.00 O ATOM 0 H GLU A 21 -17.111 9.446 10.113 1.00 0.00 H new ATOM 0 HA GLU A 21 -16.183 11.952 11.142 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -14.738 9.644 9.786 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -13.950 10.990 10.583 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -15.743 8.932 11.930 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -13.993 8.970 12.003 1.00 0.00 H new ATOM 354 N THR A 22 -14.895 12.960 9.016 1.00 0.00 N ATOM 355 CA THR A 22 -14.662 13.881 7.897 1.00 0.00 C ATOM 356 C THR A 22 -13.631 13.370 6.888 1.00 0.00 C ATOM 357 O THR A 22 -12.981 12.337 7.075 1.00 0.00 O ATOM 358 CB THR A 22 -14.303 15.287 8.385 1.00 0.00 C ATOM 359 OG1 THR A 22 -13.026 15.275 8.986 1.00 0.00 O ATOM 360 CG2 THR A 22 -15.307 15.846 9.389 1.00 0.00 C ATOM 0 H THR A 22 -14.250 13.089 9.795 1.00 0.00 H new ATOM 0 HA THR A 22 -15.611 13.935 7.363 1.00 0.00 H new ATOM 0 HB THR A 22 -14.317 15.931 7.506 1.00 0.00 H new ATOM 0 HG1 THR A 22 -12.801 16.178 9.295 1.00 0.00 H new ATOM 0 HG21 THR A 22 -14.997 16.845 9.696 1.00 0.00 H new ATOM 0 HG22 THR A 22 -16.293 15.899 8.927 1.00 0.00 H new ATOM 0 HG23 THR A 22 -15.350 15.195 10.262 1.00 0.00 H new ATOM 368 N VAL A 23 -13.445 14.123 5.803 1.00 0.00 N ATOM 369 CA VAL A 23 -12.396 13.870 4.800 1.00 0.00 C ATOM 370 C VAL A 23 -10.993 13.902 5.429 1.00 0.00 C ATOM 371 O VAL A 23 -10.118 13.142 5.012 1.00 0.00 O ATOM 372 CB VAL A 23 -12.518 14.903 3.669 1.00 0.00 C ATOM 373 CG1 VAL A 23 -11.395 14.822 2.627 1.00 0.00 C ATOM 374 CG2 VAL A 23 -13.857 14.745 2.937 1.00 0.00 C ATOM 0 H VAL A 23 -14.022 14.936 5.589 1.00 0.00 H new ATOM 0 HA VAL A 23 -12.536 12.869 4.391 1.00 0.00 H new ATOM 0 HB VAL A 23 -12.446 15.873 4.161 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -11.552 15.583 1.863 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -10.434 14.990 3.114 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -11.399 13.836 2.163 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -13.925 15.485 2.140 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -13.922 13.744 2.510 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -14.676 14.893 3.641 1.00 0.00 H new ATOM 384 N LYS A 24 -10.772 14.699 6.485 1.00 0.00 N ATOM 385 CA LYS A 24 -9.532 14.662 7.277 1.00 0.00 C ATOM 386 C LYS A 24 -9.278 13.290 7.923 1.00 0.00 C ATOM 387 O LYS A 24 -8.125 12.882 8.030 1.00 0.00 O ATOM 388 CB LYS A 24 -9.565 15.795 8.315 1.00 0.00 C ATOM 389 CG LYS A 24 -8.194 16.023 8.971 1.00 0.00 C ATOM 390 CD LYS A 24 -8.177 17.282 9.854 1.00 0.00 C ATOM 391 CE LYS A 24 -9.103 17.217 11.080 1.00 0.00 C ATOM 392 NZ LYS A 24 -8.655 16.211 12.081 1.00 0.00 N ATOM 0 H LYS A 24 -11.448 15.388 6.815 1.00 0.00 H new ATOM 0 HA LYS A 24 -8.689 14.819 6.604 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -9.893 16.716 7.834 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.299 15.558 9.085 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -7.932 15.154 9.575 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -7.433 16.114 8.196 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -7.157 17.457 10.195 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -8.461 18.140 9.245 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -9.146 18.199 11.551 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -10.115 16.975 10.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -9.312 16.207 12.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -8.639 15.268 11.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.700 16.454 12.414 1.00 0.00 H new ATOM 406 N ALA A 25 -10.320 12.545 8.300 1.00 0.00 N ATOM 407 CA ALA A 25 -10.189 11.165 8.777 1.00 0.00 C ATOM 408 C ALA A 25 -9.899 10.163 7.639 1.00 0.00 C ATOM 409 O ALA A 25 -9.112 9.236 7.823 1.00 0.00 O ATOM 410 CB ALA A 25 -11.438 10.779 9.571 1.00 0.00 C ATOM 0 H ALA A 25 -11.282 12.883 8.283 1.00 0.00 H new ATOM 0 HA ALA A 25 -9.321 11.117 9.434 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.341 9.753 9.926 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -11.549 11.449 10.424 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.316 10.860 8.930 1.00 0.00 H new ATOM 416 N LEU A 26 -10.468 10.349 6.440 1.00 0.00 N ATOM 417 CA LEU A 26 -10.075 9.583 5.250 1.00 0.00 C ATOM 418 C LEU A 26 -8.558 9.728 5.022 1.00 0.00 C ATOM 419 O LEU A 26 -7.819 8.741 5.022 1.00 0.00 O ATOM 420 CB LEU A 26 -10.957 10.019 4.059 1.00 0.00 C ATOM 421 CG LEU A 26 -10.589 9.435 2.686 1.00 0.00 C ATOM 422 CD1 LEU A 26 -10.333 7.938 2.770 1.00 0.00 C ATOM 423 CD2 LEU A 26 -11.733 9.677 1.700 1.00 0.00 C ATOM 0 H LEU A 26 -11.208 11.030 6.268 1.00 0.00 H new ATOM 0 HA LEU A 26 -10.249 8.515 5.379 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -11.989 9.747 4.281 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -10.922 11.106 3.988 1.00 0.00 H new ATOM 0 HG LEU A 26 -9.679 9.931 2.348 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -10.075 7.557 1.782 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -9.510 7.748 3.458 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -11.230 7.435 3.130 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -11.469 9.262 0.727 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -12.638 9.194 2.067 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -11.908 10.748 1.602 1.00 0.00 H new ATOM 435 N LYS A 27 -8.087 10.975 4.946 1.00 0.00 N ATOM 436 CA LYS A 27 -6.660 11.337 4.948 1.00 0.00 C ATOM 437 C LYS A 27 -5.865 10.690 6.090 1.00 0.00 C ATOM 438 O LYS A 27 -4.783 10.168 5.824 1.00 0.00 O ATOM 439 CB LYS A 27 -6.468 12.860 4.958 1.00 0.00 C ATOM 440 CG LYS A 27 -6.897 13.562 3.663 1.00 0.00 C ATOM 441 CD LYS A 27 -6.565 15.054 3.773 1.00 0.00 C ATOM 442 CE LYS A 27 -6.724 15.771 2.431 1.00 0.00 C ATOM 443 NZ LYS A 27 -6.272 17.179 2.547 1.00 0.00 N ATOM 0 H LYS A 27 -8.702 11.786 4.879 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.256 10.935 4.019 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -7.035 13.280 5.789 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -5.417 13.080 5.145 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -6.382 13.123 2.808 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -7.965 13.425 3.496 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -7.217 15.518 4.513 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -5.542 15.174 4.130 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -6.144 15.257 1.665 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -7.767 15.741 2.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -6.028 17.544 1.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -7.035 17.756 2.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -5.435 17.225 3.163 1.00 0.00 H new ATOM 457 N GLU A 28 -6.361 10.700 7.333 1.00 0.00 N ATOM 458 CA GLU A 28 -5.672 10.080 8.482 1.00 0.00 C ATOM 459 C GLU A 28 -5.439 8.577 8.293 1.00 0.00 C ATOM 460 O GLU A 28 -4.340 8.084 8.555 1.00 0.00 O ATOM 461 CB GLU A 28 -6.334 10.412 9.844 1.00 0.00 C ATOM 462 CG GLU A 28 -7.244 9.369 10.537 1.00 0.00 C ATOM 463 CD GLU A 28 -7.580 9.829 11.969 1.00 0.00 C ATOM 464 OE1 GLU A 28 -8.506 10.657 12.147 1.00 0.00 O ATOM 465 OE2 GLU A 28 -6.920 9.364 12.932 1.00 0.00 O ATOM 0 H GLU A 28 -7.250 11.137 7.575 1.00 0.00 H new ATOM 0 HA GLU A 28 -4.685 10.541 8.513 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -5.534 10.659 10.542 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -6.926 11.317 9.705 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.162 9.238 9.964 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -6.745 8.401 10.565 1.00 0.00 H new ATOM 472 N LYS A 29 -6.445 7.840 7.806 1.00 0.00 N ATOM 473 CA LYS A 29 -6.340 6.405 7.546 1.00 0.00 C ATOM 474 C LYS A 29 -5.423 6.092 6.358 1.00 0.00 C ATOM 475 O LYS A 29 -4.655 5.135 6.431 1.00 0.00 O ATOM 476 CB LYS A 29 -7.761 5.845 7.400 1.00 0.00 C ATOM 477 CG LYS A 29 -7.840 4.318 7.501 1.00 0.00 C ATOM 478 CD LYS A 29 -7.350 3.753 8.847 1.00 0.00 C ATOM 479 CE LYS A 29 -7.646 2.254 9.005 1.00 0.00 C ATOM 480 NZ LYS A 29 -9.069 1.989 9.343 1.00 0.00 N ATOM 0 H LYS A 29 -7.361 8.229 7.581 1.00 0.00 H new ATOM 0 HA LYS A 29 -5.856 5.905 8.385 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -8.395 6.284 8.171 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -8.167 6.157 6.438 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -8.872 4.007 7.342 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -7.248 3.880 6.698 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.276 3.918 8.936 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -7.826 4.301 9.661 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.393 1.737 8.079 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -7.007 1.841 9.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -9.196 0.976 9.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -9.334 2.540 10.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -9.673 2.266 8.543 1.00 0.00 H new ATOM 494 N ILE A 30 -5.425 6.928 5.315 1.00 0.00 N ATOM 495 CA ILE A 30 -4.448 6.869 4.211 1.00 0.00 C ATOM 496 C ILE A 30 -3.022 7.076 4.741 1.00 0.00 C ATOM 497 O ILE A 30 -2.145 6.261 4.465 1.00 0.00 O ATOM 498 CB ILE A 30 -4.791 7.893 3.106 1.00 0.00 C ATOM 499 CG1 ILE A 30 -6.132 7.545 2.425 1.00 0.00 C ATOM 500 CG2 ILE A 30 -3.683 7.955 2.038 1.00 0.00 C ATOM 501 CD1 ILE A 30 -6.773 8.754 1.741 1.00 0.00 C ATOM 0 H ILE A 30 -6.111 7.675 5.208 1.00 0.00 H new ATOM 0 HA ILE A 30 -4.501 5.877 3.763 1.00 0.00 H new ATOM 0 HB ILE A 30 -4.875 8.867 3.588 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -5.968 6.759 1.688 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.821 7.145 3.169 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.954 8.684 1.275 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -2.744 8.251 2.505 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -3.566 6.974 1.577 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -7.713 8.454 1.278 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -6.964 9.531 2.481 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -6.099 9.139 0.976 1.00 0.00 H new ATOM 513 N GLU A 31 -2.779 8.130 5.525 1.00 0.00 N ATOM 514 CA GLU A 31 -1.471 8.402 6.138 1.00 0.00 C ATOM 515 C GLU A 31 -1.019 7.237 7.040 1.00 0.00 C ATOM 516 O GLU A 31 0.143 6.837 7.003 1.00 0.00 O ATOM 517 CB GLU A 31 -1.538 9.712 6.940 1.00 0.00 C ATOM 518 CG GLU A 31 -0.155 10.188 7.406 1.00 0.00 C ATOM 519 CD GLU A 31 -0.278 11.337 8.417 1.00 0.00 C ATOM 520 OE1 GLU A 31 -0.570 11.080 9.607 1.00 0.00 O ATOM 521 OE2 GLU A 31 -0.013 12.507 8.049 1.00 0.00 O ATOM 0 H GLU A 31 -3.489 8.826 5.755 1.00 0.00 H new ATOM 0 HA GLU A 31 -0.733 8.505 5.343 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.997 10.487 6.326 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -2.181 9.570 7.808 1.00 0.00 H new ATOM 0 HG2 GLU A 31 0.385 9.357 7.859 1.00 0.00 H new ATOM 0 HG3 GLU A 31 0.429 10.517 6.546 1.00 0.00 H new ATOM 528 N SER A 32 -1.939 6.655 7.817 1.00 0.00 N ATOM 529 CA SER A 32 -1.691 5.482 8.671 1.00 0.00 C ATOM 530 C SER A 32 -1.299 4.232 7.868 1.00 0.00 C ATOM 531 O SER A 32 -0.363 3.523 8.242 1.00 0.00 O ATOM 532 CB SER A 32 -2.924 5.159 9.528 1.00 0.00 C ATOM 533 OG SER A 32 -3.246 6.235 10.395 1.00 0.00 O ATOM 0 H SER A 32 -2.900 6.992 7.873 1.00 0.00 H new ATOM 0 HA SER A 32 -0.850 5.749 9.311 1.00 0.00 H new ATOM 0 HB2 SER A 32 -3.774 4.945 8.880 1.00 0.00 H new ATOM 0 HB3 SER A 32 -2.736 4.260 10.115 1.00 0.00 H new ATOM 0 HG SER A 32 -3.643 6.966 9.876 1.00 0.00 H new ATOM 539 N GLU A 33 -1.998 3.949 6.764 1.00 0.00 N ATOM 540 CA GLU A 33 -1.748 2.798 5.885 1.00 0.00 C ATOM 541 C GLU A 33 -0.449 2.952 5.070 1.00 0.00 C ATOM 542 O GLU A 33 0.411 2.067 5.082 1.00 0.00 O ATOM 543 CB GLU A 33 -2.959 2.621 4.949 1.00 0.00 C ATOM 544 CG GLU A 33 -2.951 1.316 4.139 1.00 0.00 C ATOM 545 CD GLU A 33 -3.107 0.073 5.040 1.00 0.00 C ATOM 546 OE1 GLU A 33 -4.236 -0.209 5.508 1.00 0.00 O ATOM 547 OE2 GLU A 33 -2.100 -0.635 5.284 1.00 0.00 O ATOM 0 H GLU A 33 -2.775 4.529 6.447 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.617 1.912 6.506 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -3.871 2.659 5.544 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.994 3.463 4.258 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.760 1.338 3.409 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.019 1.243 3.579 1.00 0.00 H new ATOM 554 N LYS A 34 -0.312 4.067 4.340 1.00 0.00 N ATOM 555 CA LYS A 34 0.745 4.310 3.340 1.00 0.00 C ATOM 556 C LYS A 34 2.012 4.966 3.913 1.00 0.00 C ATOM 557 O LYS A 34 3.065 4.938 3.274 1.00 0.00 O ATOM 558 CB LYS A 34 0.174 5.170 2.192 1.00 0.00 C ATOM 559 CG LYS A 34 -1.152 4.666 1.581 1.00 0.00 C ATOM 560 CD LYS A 34 -1.111 3.228 1.044 1.00 0.00 C ATOM 561 CE LYS A 34 -0.252 3.120 -0.222 1.00 0.00 C ATOM 562 NZ LYS A 34 -0.312 1.753 -0.802 1.00 0.00 N ATOM 0 H LYS A 34 -0.955 4.854 4.430 1.00 0.00 H new ATOM 0 HA LYS A 34 1.058 3.332 2.974 1.00 0.00 H new ATOM 0 HB2 LYS A 34 0.021 6.184 2.562 1.00 0.00 H new ATOM 0 HB3 LYS A 34 0.920 5.229 1.399 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -1.933 4.733 2.338 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -1.438 5.334 0.768 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -0.713 2.564 1.811 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -2.125 2.892 0.826 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -0.595 3.845 -0.960 1.00 0.00 H new ATOM 0 HE3 LYS A 34 0.782 3.371 0.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 0.478 1.623 -1.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -0.243 1.049 -0.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -1.213 1.629 -1.307 1.00 0.00 H new ATOM 576 N GLY A 35 1.914 5.536 5.113 1.00 0.00 N ATOM 577 CA GLY A 35 2.945 6.313 5.809 1.00 0.00 C ATOM 578 C GLY A 35 2.966 7.794 5.401 1.00 0.00 C ATOM 579 O GLY A 35 2.619 8.150 4.268 1.00 0.00 O ATOM 0 H GLY A 35 1.058 5.464 5.663 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.781 6.241 6.884 1.00 0.00 H new ATOM 0 HA3 GLY A 35 3.921 5.873 5.606 1.00 0.00 H new ATOM 583 N LYS A 36 3.459 8.664 6.297 1.00 0.00 N ATOM 584 CA LYS A 36 3.683 10.100 6.021 1.00 0.00 C ATOM 585 C LYS A 36 4.683 10.345 4.884 1.00 0.00 C ATOM 586 O LYS A 36 4.612 11.372 4.215 1.00 0.00 O ATOM 587 CB LYS A 36 4.195 10.837 7.271 1.00 0.00 C ATOM 588 CG LYS A 36 3.120 11.068 8.334 1.00 0.00 C ATOM 589 CD LYS A 36 3.691 11.823 9.545 1.00 0.00 C ATOM 590 CE LYS A 36 2.617 12.185 10.581 1.00 0.00 C ATOM 591 NZ LYS A 36 1.718 13.277 10.120 1.00 0.00 N ATOM 0 H LYS A 36 3.717 8.391 7.245 1.00 0.00 H new ATOM 0 HA LYS A 36 2.710 10.488 5.720 1.00 0.00 H new ATOM 0 HB2 LYS A 36 5.011 10.263 7.711 1.00 0.00 H new ATOM 0 HB3 LYS A 36 4.608 11.800 6.970 1.00 0.00 H new ATOM 0 HG2 LYS A 36 2.295 11.636 7.904 1.00 0.00 H new ATOM 0 HG3 LYS A 36 2.713 10.110 8.658 1.00 0.00 H new ATOM 0 HD2 LYS A 36 4.457 11.211 10.021 1.00 0.00 H new ATOM 0 HD3 LYS A 36 4.180 12.735 9.202 1.00 0.00 H new ATOM 0 HE2 LYS A 36 2.021 11.300 10.805 1.00 0.00 H new ATOM 0 HE3 LYS A 36 3.101 12.487 11.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 0.953 13.412 10.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 2.262 14.159 10.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 1.310 13.025 9.197 1.00 0.00 H new ATOM 605 N ASP A 37 5.604 9.409 4.652 1.00 0.00 N ATOM 606 CA ASP A 37 6.590 9.456 3.563 1.00 0.00 C ATOM 607 C ASP A 37 5.930 9.484 2.174 1.00 0.00 C ATOM 608 O ASP A 37 6.418 10.161 1.265 1.00 0.00 O ATOM 609 CB ASP A 37 7.514 8.234 3.649 1.00 0.00 C ATOM 610 CG ASP A 37 8.362 8.234 4.930 1.00 0.00 C ATOM 611 OD1 ASP A 37 9.439 8.877 4.946 1.00 0.00 O ATOM 612 OD2 ASP A 37 7.953 7.589 5.926 1.00 0.00 O ATOM 0 H ASP A 37 5.690 8.573 5.230 1.00 0.00 H new ATOM 0 HA ASP A 37 7.157 10.379 3.684 1.00 0.00 H new ATOM 0 HB2 ASP A 37 6.914 7.324 3.613 1.00 0.00 H new ATOM 0 HB3 ASP A 37 8.172 8.217 2.780 1.00 0.00 H new ATOM 617 N ALA A 38 4.818 8.758 2.013 1.00 0.00 N ATOM 618 CA ALA A 38 4.036 8.700 0.782 1.00 0.00 C ATOM 619 C ALA A 38 2.920 9.762 0.754 1.00 0.00 C ATOM 620 O ALA A 38 2.812 10.524 -0.210 1.00 0.00 O ATOM 621 CB ALA A 38 3.464 7.284 0.638 1.00 0.00 C ATOM 0 H ALA A 38 4.430 8.180 2.759 1.00 0.00 H new ATOM 0 HA ALA A 38 4.685 8.925 -0.064 1.00 0.00 H new ATOM 0 HB1 ALA A 38 2.876 7.221 -0.277 1.00 0.00 H new ATOM 0 HB2 ALA A 38 4.281 6.564 0.595 1.00 0.00 H new ATOM 0 HB3 ALA A 38 2.828 7.060 1.494 1.00 0.00 H new ATOM 627 N PHE A 39 2.090 9.810 1.804 1.00 0.00 N ATOM 628 CA PHE A 39 0.852 10.597 1.861 1.00 0.00 C ATOM 629 C PHE A 39 0.624 11.244 3.248 1.00 0.00 C ATOM 630 O PHE A 39 -0.206 10.761 4.022 1.00 0.00 O ATOM 631 CB PHE A 39 -0.316 9.682 1.441 1.00 0.00 C ATOM 632 CG PHE A 39 -0.340 9.320 -0.036 1.00 0.00 C ATOM 633 CD1 PHE A 39 -0.630 10.303 -1.004 1.00 0.00 C ATOM 634 CD2 PHE A 39 -0.067 8.003 -0.451 1.00 0.00 C ATOM 635 CE1 PHE A 39 -0.642 9.970 -2.371 1.00 0.00 C ATOM 636 CE2 PHE A 39 -0.085 7.667 -1.817 1.00 0.00 C ATOM 637 CZ PHE A 39 -0.372 8.652 -2.778 1.00 0.00 C ATOM 0 H PHE A 39 2.267 9.287 2.662 1.00 0.00 H new ATOM 0 HA PHE A 39 0.925 11.437 1.170 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.268 8.763 2.026 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -1.255 10.174 1.696 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -0.844 11.316 -0.695 1.00 0.00 H new ATOM 0 HD2 PHE A 39 0.158 7.245 0.285 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -0.859 10.728 -3.109 1.00 0.00 H new ATOM 0 HE2 PHE A 39 0.121 6.653 -2.127 1.00 0.00 H new ATOM 0 HZ PHE A 39 -0.385 8.396 -3.827 1.00 0.00 H new ATOM 647 N PRO A 40 1.300 12.361 3.581 1.00 0.00 N ATOM 648 CA PRO A 40 1.055 13.104 4.821 1.00 0.00 C ATOM 649 C PRO A 40 -0.279 13.871 4.727 1.00 0.00 C ATOM 650 O PRO A 40 -0.568 14.454 3.682 1.00 0.00 O ATOM 651 CB PRO A 40 2.252 14.052 4.940 1.00 0.00 C ATOM 652 CG PRO A 40 2.631 14.349 3.488 1.00 0.00 C ATOM 653 CD PRO A 40 2.246 13.075 2.731 1.00 0.00 C ATOM 0 HA PRO A 40 0.967 12.460 5.696 1.00 0.00 H new ATOM 0 HB2 PRO A 40 1.989 14.962 5.479 1.00 0.00 H new ATOM 0 HB3 PRO A 40 3.077 13.588 5.481 1.00 0.00 H new ATOM 0 HG2 PRO A 40 2.094 15.217 3.106 1.00 0.00 H new ATOM 0 HG3 PRO A 40 3.695 14.564 3.390 1.00 0.00 H new ATOM 0 HD2 PRO A 40 1.797 13.316 1.768 1.00 0.00 H new ATOM 0 HD3 PRO A 40 3.125 12.463 2.529 1.00 0.00 H new ATOM 661 N VAL A 41 -1.094 13.926 5.789 1.00 0.00 N ATOM 662 CA VAL A 41 -2.436 14.573 5.789 1.00 0.00 C ATOM 663 C VAL A 41 -2.399 15.999 5.227 1.00 0.00 C ATOM 664 O VAL A 41 -3.208 16.364 4.373 1.00 0.00 O ATOM 665 CB VAL A 41 -3.051 14.591 7.209 1.00 0.00 C ATOM 666 CG1 VAL A 41 -4.342 15.417 7.321 1.00 0.00 C ATOM 667 CG2 VAL A 41 -3.396 13.173 7.661 1.00 0.00 C ATOM 0 H VAL A 41 -0.846 13.520 6.691 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.064 13.969 5.133 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.287 15.051 7.836 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.710 15.380 8.346 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.137 16.452 7.047 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.096 15.006 6.650 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.827 13.205 8.662 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.116 12.736 6.969 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -2.491 12.565 7.675 1.00 0.00 H new ATOM 677 N ALA A 42 -1.438 16.797 5.694 1.00 0.00 N ATOM 678 CA ALA A 42 -1.247 18.191 5.282 1.00 0.00 C ATOM 679 C ALA A 42 -0.854 18.371 3.795 1.00 0.00 C ATOM 680 O ALA A 42 -1.130 19.422 3.209 1.00 0.00 O ATOM 681 CB ALA A 42 -0.196 18.816 6.208 1.00 0.00 C ATOM 0 H ALA A 42 -0.755 16.487 6.385 1.00 0.00 H new ATOM 0 HA ALA A 42 -2.208 18.698 5.372 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -0.033 19.856 5.924 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.547 18.772 7.239 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.740 18.265 6.120 1.00 0.00 H new ATOM 687 N GLY A 43 -0.236 17.359 3.170 1.00 0.00 N ATOM 688 CA GLY A 43 0.170 17.361 1.755 1.00 0.00 C ATOM 689 C GLY A 43 -0.832 16.677 0.820 1.00 0.00 C ATOM 690 O GLY A 43 -0.935 17.045 -0.352 1.00 0.00 O ATOM 0 H GLY A 43 0.003 16.490 3.648 1.00 0.00 H new ATOM 0 HA2 GLY A 43 0.311 18.392 1.429 1.00 0.00 H new ATOM 0 HA3 GLY A 43 1.135 16.863 1.664 1.00 0.00 H new ATOM 694 N GLN A 44 -1.593 15.702 1.325 1.00 0.00 N ATOM 695 CA GLN A 44 -2.643 14.994 0.590 1.00 0.00 C ATOM 696 C GLN A 44 -3.740 15.927 0.046 1.00 0.00 C ATOM 697 O GLN A 44 -4.020 16.996 0.600 1.00 0.00 O ATOM 698 CB GLN A 44 -3.334 13.970 1.510 1.00 0.00 C ATOM 699 CG GLN A 44 -2.615 12.628 1.695 1.00 0.00 C ATOM 700 CD GLN A 44 -3.458 11.700 2.574 1.00 0.00 C ATOM 701 OE1 GLN A 44 -4.572 11.341 2.234 1.00 0.00 O ATOM 702 NE2 GLN A 44 -2.993 11.284 3.731 1.00 0.00 N ATOM 0 H GLN A 44 -1.492 15.374 2.286 1.00 0.00 H new ATOM 0 HA GLN A 44 -2.142 14.515 -0.251 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -3.465 14.426 2.491 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -4.330 13.773 1.114 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.439 12.163 0.725 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -1.639 12.789 2.153 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -2.064 11.570 4.040 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -3.561 10.676 4.320 1.00 0.00 H new ATOM 711 N LYS A 45 -4.419 15.460 -1.005 1.00 0.00 N ATOM 712 CA LYS A 45 -5.663 15.990 -1.586 1.00 0.00 C ATOM 713 C LYS A 45 -6.521 14.793 -1.991 1.00 0.00 C ATOM 714 O LYS A 45 -6.000 13.740 -2.366 1.00 0.00 O ATOM 715 CB LYS A 45 -5.454 16.907 -2.805 1.00 0.00 C ATOM 716 CG LYS A 45 -4.493 18.078 -2.604 1.00 0.00 C ATOM 717 CD LYS A 45 -5.032 19.159 -1.655 1.00 0.00 C ATOM 718 CE LYS A 45 -3.968 20.208 -1.307 1.00 0.00 C ATOM 719 NZ LYS A 45 -2.838 19.628 -0.530 1.00 0.00 N ATOM 0 H LYS A 45 -4.091 14.639 -1.513 1.00 0.00 H new ATOM 0 HA LYS A 45 -6.141 16.615 -0.831 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -5.088 16.300 -3.633 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -6.423 17.305 -3.106 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -3.549 17.699 -2.212 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -4.277 18.531 -3.572 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -5.888 19.651 -2.117 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -5.390 18.690 -0.739 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -3.585 20.652 -2.225 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -4.427 21.012 -0.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -2.570 20.281 0.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -3.130 18.718 -0.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -2.024 19.479 -1.160 1.00 0.00 H new ATOM 733 N LEU A 46 -7.831 14.982 -1.915 1.00 0.00 N ATOM 734 CA LEU A 46 -8.861 13.953 -2.042 1.00 0.00 C ATOM 735 C LEU A 46 -9.916 14.412 -3.046 1.00 0.00 C ATOM 736 O LEU A 46 -10.511 15.470 -2.858 1.00 0.00 O ATOM 737 CB LEU A 46 -9.470 13.688 -0.645 1.00 0.00 C ATOM 738 CG LEU A 46 -9.192 12.295 -0.066 1.00 0.00 C ATOM 739 CD1 LEU A 46 -9.811 11.213 -0.945 1.00 0.00 C ATOM 740 CD2 LEU A 46 -7.699 12.027 0.100 1.00 0.00 C ATOM 0 H LEU A 46 -8.228 15.908 -1.754 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.436 13.021 -2.414 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -9.086 14.436 0.049 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -10.549 13.831 -0.703 1.00 0.00 H new ATOM 0 HG LEU A 46 -9.650 12.268 0.923 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -9.602 10.233 -0.517 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -10.889 11.362 -1.001 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -9.384 11.270 -1.946 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.552 11.029 0.513 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -7.207 12.094 -0.870 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -7.270 12.766 0.776 1.00 0.00 H new ATOM 752 N ILE A 47 -10.126 13.653 -4.120 1.00 0.00 N ATOM 753 CA ILE A 47 -10.936 14.050 -5.280 1.00 0.00 C ATOM 754 C ILE A 47 -11.927 12.938 -5.660 1.00 0.00 C ATOM 755 O ILE A 47 -11.538 11.781 -5.837 1.00 0.00 O ATOM 756 CB ILE A 47 -9.988 14.458 -6.432 1.00 0.00 C ATOM 757 CG1 ILE A 47 -9.124 15.697 -6.072 1.00 0.00 C ATOM 758 CG2 ILE A 47 -10.740 14.821 -7.710 1.00 0.00 C ATOM 759 CD1 ILE A 47 -7.678 15.335 -5.761 1.00 0.00 C ATOM 0 H ILE A 47 -9.728 12.718 -4.214 1.00 0.00 H new ATOM 0 HA ILE A 47 -11.553 14.916 -5.040 1.00 0.00 H new ATOM 0 HB ILE A 47 -9.363 13.579 -6.591 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -9.147 16.404 -6.901 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -9.561 16.202 -5.211 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -10.026 15.099 -8.485 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -11.324 13.963 -8.045 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -11.408 15.660 -7.513 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -7.121 16.239 -5.516 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -7.649 14.650 -4.913 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -7.228 14.856 -6.630 1.00 0.00 H new ATOM 771 N TYR A 48 -13.210 13.291 -5.783 1.00 0.00 N ATOM 772 CA TYR A 48 -14.293 12.405 -6.228 1.00 0.00 C ATOM 773 C TYR A 48 -15.173 13.094 -7.274 1.00 0.00 C ATOM 774 O TYR A 48 -15.434 14.293 -7.165 1.00 0.00 O ATOM 775 CB TYR A 48 -15.138 11.959 -5.027 1.00 0.00 C ATOM 776 CG TYR A 48 -16.091 10.798 -5.271 1.00 0.00 C ATOM 777 CD1 TYR A 48 -15.589 9.536 -5.646 1.00 0.00 C ATOM 778 CD2 TYR A 48 -17.477 10.959 -5.061 1.00 0.00 C ATOM 779 CE1 TYR A 48 -16.460 8.439 -5.787 1.00 0.00 C ATOM 780 CE2 TYR A 48 -18.352 9.864 -5.209 1.00 0.00 C ATOM 781 CZ TYR A 48 -17.844 8.595 -5.567 1.00 0.00 C ATOM 782 OH TYR A 48 -18.673 7.521 -5.696 1.00 0.00 O ATOM 0 H TYR A 48 -13.536 14.234 -5.568 1.00 0.00 H new ATOM 0 HA TYR A 48 -13.846 11.526 -6.692 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -14.463 11.684 -4.216 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -15.720 12.813 -4.681 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -14.532 9.410 -5.826 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -17.870 11.927 -4.785 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -16.066 7.473 -6.065 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -19.412 9.995 -5.049 1.00 0.00 H new ATOM 0 HH TYR A 48 -19.595 7.795 -5.510 1.00 0.00 H new ATOM 792 N ALA A 49 -15.655 12.352 -8.278 1.00 0.00 N ATOM 793 CA ALA A 49 -16.509 12.866 -9.359 1.00 0.00 C ATOM 794 C ALA A 49 -15.974 14.154 -10.049 1.00 0.00 C ATOM 795 O ALA A 49 -16.746 14.993 -10.519 1.00 0.00 O ATOM 796 CB ALA A 49 -17.929 12.997 -8.788 1.00 0.00 C ATOM 0 H ALA A 49 -15.459 11.355 -8.365 1.00 0.00 H new ATOM 0 HA ALA A 49 -16.509 12.160 -10.190 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -18.598 13.377 -9.560 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -18.278 12.020 -8.454 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -17.920 13.687 -7.944 1.00 0.00 H new ATOM 802 N GLY A 50 -14.648 14.328 -10.086 1.00 0.00 N ATOM 803 CA GLY A 50 -13.929 15.494 -10.612 1.00 0.00 C ATOM 804 C GLY A 50 -13.893 16.728 -9.696 1.00 0.00 C ATOM 805 O GLY A 50 -13.548 17.812 -10.169 1.00 0.00 O ATOM 0 H GLY A 50 -14.010 13.617 -9.728 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -12.903 15.197 -10.830 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -14.385 15.781 -11.559 1.00 0.00 H new ATOM 809 N LYS A 51 -14.244 16.599 -8.408 1.00 0.00 N ATOM 810 CA LYS A 51 -14.298 17.684 -7.406 1.00 0.00 C ATOM 811 C LYS A 51 -13.521 17.322 -6.136 1.00 0.00 C ATOM 812 O LYS A 51 -13.627 16.203 -5.633 1.00 0.00 O ATOM 813 CB LYS A 51 -15.764 17.992 -7.045 1.00 0.00 C ATOM 814 CG LYS A 51 -16.583 18.499 -8.247 1.00 0.00 C ATOM 815 CD LYS A 51 -18.027 18.869 -7.873 1.00 0.00 C ATOM 816 CE LYS A 51 -18.093 20.133 -7.004 1.00 0.00 C ATOM 817 NZ LYS A 51 -19.498 20.517 -6.705 1.00 0.00 N ATOM 0 H LYS A 51 -14.511 15.697 -8.015 1.00 0.00 H new ATOM 0 HA LYS A 51 -13.832 18.565 -7.846 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -16.232 17.092 -6.647 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -15.788 18.741 -6.253 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -16.089 19.371 -8.675 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -16.599 17.730 -9.020 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -18.608 19.024 -8.782 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -18.487 18.038 -7.339 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -17.555 19.963 -6.071 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -17.592 20.954 -7.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -19.506 21.374 -6.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -20.004 20.703 -7.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -19.968 19.743 -6.195 1.00 0.00 H new ATOM 831 N ILE A 52 -12.738 18.263 -5.604 1.00 0.00 N ATOM 832 CA ILE A 52 -11.988 18.082 -4.353 1.00 0.00 C ATOM 833 C ILE A 52 -12.939 18.050 -3.146 1.00 0.00 C ATOM 834 O ILE A 52 -13.790 18.928 -2.979 1.00 0.00 O ATOM 835 CB ILE A 52 -10.905 19.167 -4.191 1.00 0.00 C ATOM 836 CG1 ILE A 52 -10.152 19.326 -5.532 1.00 0.00 C ATOM 837 CG2 ILE A 52 -9.973 18.810 -3.021 1.00 0.00 C ATOM 838 CD1 ILE A 52 -8.695 19.747 -5.450 1.00 0.00 C ATOM 0 H ILE A 52 -12.604 19.180 -6.030 1.00 0.00 H new ATOM 0 HA ILE A 52 -11.479 17.119 -4.400 1.00 0.00 H new ATOM 0 HB ILE A 52 -11.356 20.129 -3.947 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -10.202 18.377 -6.065 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -10.685 20.060 -6.137 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -9.211 19.582 -2.914 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -10.553 18.743 -2.101 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.493 17.851 -3.218 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -8.281 19.823 -6.455 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -8.623 20.715 -4.954 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -8.133 19.006 -4.882 1.00 0.00 H new ATOM 850 N LEU A 53 -12.786 17.029 -2.308 1.00 0.00 N ATOM 851 CA LEU A 53 -13.517 16.822 -1.062 1.00 0.00 C ATOM 852 C LEU A 53 -13.033 17.795 0.031 1.00 0.00 C ATOM 853 O LEU A 53 -11.833 17.893 0.301 1.00 0.00 O ATOM 854 CB LEU A 53 -13.330 15.363 -0.608 1.00 0.00 C ATOM 855 CG LEU A 53 -13.632 14.266 -1.641 1.00 0.00 C ATOM 856 CD1 LEU A 53 -13.550 12.896 -0.967 1.00 0.00 C ATOM 857 CD2 LEU A 53 -15.035 14.417 -2.209 1.00 0.00 C ATOM 0 H LEU A 53 -12.113 16.284 -2.490 1.00 0.00 H new ATOM 0 HA LEU A 53 -14.575 17.019 -1.232 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -12.299 15.241 -0.276 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -13.966 15.194 0.261 1.00 0.00 H new ATOM 0 HG LEU A 53 -12.901 14.356 -2.445 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -13.764 12.117 -1.699 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -12.549 12.749 -0.563 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -14.279 12.844 -0.158 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -15.220 13.627 -2.937 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -15.764 14.345 -1.402 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -15.128 15.388 -2.696 1.00 0.00 H new ATOM 869 N ASN A 54 -13.957 18.518 0.664 1.00 0.00 N ATOM 870 CA ASN A 54 -13.660 19.482 1.731 1.00 0.00 C ATOM 871 C ASN A 54 -13.198 18.778 3.024 1.00 0.00 C ATOM 872 O ASN A 54 -13.942 17.972 3.581 1.00 0.00 O ATOM 873 CB ASN A 54 -14.915 20.330 1.996 1.00 0.00 C ATOM 874 CG ASN A 54 -14.641 21.516 2.912 1.00 0.00 C ATOM 875 OD1 ASN A 54 -14.178 21.384 4.037 1.00 0.00 O ATOM 876 ND2 ASN A 54 -14.897 22.723 2.460 1.00 0.00 N ATOM 0 H ASN A 54 -14.952 18.451 0.448 1.00 0.00 H new ATOM 0 HA ASN A 54 -12.840 20.122 1.407 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -15.310 20.693 1.047 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -15.685 19.702 2.443 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -14.710 23.537 3.045 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -15.283 22.846 1.524 1.00 0.00 H new ATOM 883 N ASP A 55 -12.005 19.115 3.526 1.00 0.00 N ATOM 884 CA ASP A 55 -11.377 18.542 4.730 1.00 0.00 C ATOM 885 C ASP A 55 -12.304 18.462 5.961 1.00 0.00 C ATOM 886 O ASP A 55 -12.283 17.467 6.688 1.00 0.00 O ATOM 887 CB ASP A 55 -10.134 19.365 5.099 1.00 0.00 C ATOM 888 CG ASP A 55 -9.042 19.299 4.026 1.00 0.00 C ATOM 889 OD1 ASP A 55 -9.060 20.126 3.083 1.00 0.00 O ATOM 890 OD2 ASP A 55 -8.154 18.420 4.127 1.00 0.00 O ATOM 0 H ASP A 55 -11.421 19.827 3.087 1.00 0.00 H new ATOM 0 HA ASP A 55 -11.121 17.515 4.470 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -10.424 20.404 5.253 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -9.731 19.003 6.045 1.00 0.00 H new ATOM 895 N ASP A 56 -13.107 19.503 6.200 1.00 0.00 N ATOM 896 CA ASP A 56 -13.984 19.650 7.371 1.00 0.00 C ATOM 897 C ASP A 56 -15.395 19.052 7.175 1.00 0.00 C ATOM 898 O ASP A 56 -16.124 18.847 8.149 1.00 0.00 O ATOM 899 CB ASP A 56 -14.073 21.148 7.709 1.00 0.00 C ATOM 900 CG ASP A 56 -14.775 21.421 9.051 1.00 0.00 C ATOM 901 OD1 ASP A 56 -14.242 21.008 10.110 1.00 0.00 O ATOM 902 OD2 ASP A 56 -15.836 22.093 9.059 1.00 0.00 O ATOM 0 H ASP A 56 -13.168 20.296 5.562 1.00 0.00 H new ATOM 0 HA ASP A 56 -13.547 19.082 8.192 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -13.068 21.568 7.739 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -14.610 21.663 6.913 1.00 0.00 H new ATOM 907 N THR A 57 -15.793 18.746 5.936 1.00 0.00 N ATOM 908 CA THR A 57 -17.101 18.152 5.606 1.00 0.00 C ATOM 909 C THR A 57 -17.061 16.624 5.762 1.00 0.00 C ATOM 910 O THR A 57 -16.033 15.983 5.524 1.00 0.00 O ATOM 911 CB THR A 57 -17.536 18.582 4.191 1.00 0.00 C ATOM 912 OG1 THR A 57 -17.615 19.995 4.145 1.00 0.00 O ATOM 913 CG2 THR A 57 -18.919 18.089 3.789 1.00 0.00 C ATOM 0 H THR A 57 -15.207 18.906 5.116 1.00 0.00 H new ATOM 0 HA THR A 57 -17.849 18.522 6.308 1.00 0.00 H new ATOM 0 HB THR A 57 -16.795 18.153 3.516 1.00 0.00 H new ATOM 0 HG1 THR A 57 -17.889 20.278 3.248 1.00 0.00 H new ATOM 0 HG21 THR A 57 -19.150 18.434 2.781 1.00 0.00 H new ATOM 0 HG22 THR A 57 -18.938 16.999 3.813 1.00 0.00 H new ATOM 0 HG23 THR A 57 -19.661 18.480 4.485 1.00 0.00 H new ATOM 921 N ALA A 58 -18.174 16.018 6.194 1.00 0.00 N ATOM 922 CA ALA A 58 -18.267 14.570 6.384 1.00 0.00 C ATOM 923 C ALA A 58 -18.400 13.784 5.062 1.00 0.00 C ATOM 924 O ALA A 58 -18.904 14.301 4.063 1.00 0.00 O ATOM 925 CB ALA A 58 -19.404 14.261 7.357 1.00 0.00 C ATOM 0 H ALA A 58 -19.033 16.519 6.421 1.00 0.00 H new ATOM 0 HA ALA A 58 -17.325 14.228 6.813 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -19.477 13.183 7.501 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -19.205 14.743 8.314 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -20.343 14.637 6.950 1.00 0.00 H new ATOM 931 N LEU A 59 -17.987 12.512 5.054 1.00 0.00 N ATOM 932 CA LEU A 59 -17.997 11.659 3.850 1.00 0.00 C ATOM 933 C LEU A 59 -19.418 11.351 3.341 1.00 0.00 C ATOM 934 O LEU A 59 -19.636 11.272 2.127 1.00 0.00 O ATOM 935 CB LEU A 59 -17.238 10.354 4.146 1.00 0.00 C ATOM 936 CG LEU A 59 -15.744 10.560 4.445 1.00 0.00 C ATOM 937 CD1 LEU A 59 -15.129 9.261 4.946 1.00 0.00 C ATOM 938 CD2 LEU A 59 -14.967 10.957 3.194 1.00 0.00 C ATOM 0 H LEU A 59 -17.633 12.038 5.885 1.00 0.00 H new ATOM 0 HA LEU A 59 -17.500 12.212 3.053 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -17.704 9.858 4.997 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -17.339 9.684 3.292 1.00 0.00 H new ATOM 0 HG LEU A 59 -15.681 11.352 5.191 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -14.071 9.416 5.155 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -15.637 8.946 5.858 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -15.239 8.489 4.184 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -13.916 11.093 3.447 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -15.061 10.173 2.443 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -15.368 11.889 2.797 1.00 0.00 H new ATOM 950 N LYS A 60 -20.391 11.240 4.258 1.00 0.00 N ATOM 951 CA LYS A 60 -21.826 11.082 3.969 1.00 0.00 C ATOM 952 C LYS A 60 -22.365 12.144 2.996 1.00 0.00 C ATOM 953 O LYS A 60 -23.202 11.833 2.151 1.00 0.00 O ATOM 954 CB LYS A 60 -22.580 11.081 5.309 1.00 0.00 C ATOM 955 CG LYS A 60 -24.085 10.799 5.155 1.00 0.00 C ATOM 956 CD LYS A 60 -24.801 10.636 6.504 1.00 0.00 C ATOM 957 CE LYS A 60 -24.798 11.935 7.322 1.00 0.00 C ATOM 958 NZ LYS A 60 -25.563 11.785 8.589 1.00 0.00 N ATOM 0 H LYS A 60 -20.194 11.258 5.259 1.00 0.00 H new ATOM 0 HA LYS A 60 -21.985 10.135 3.452 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -22.141 10.330 5.965 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -22.445 12.047 5.795 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -24.548 11.615 4.599 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -24.222 9.893 4.564 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -25.830 10.319 6.332 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -24.316 9.846 7.078 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -23.771 12.221 7.548 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -25.230 12.741 6.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -25.540 12.681 9.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -26.549 11.536 8.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -25.135 11.033 9.166 1.00 0.00 H new ATOM 972 N GLU A 61 -21.848 13.372 3.064 1.00 0.00 N ATOM 973 CA GLU A 61 -22.252 14.513 2.233 1.00 0.00 C ATOM 974 C GLU A 61 -21.878 14.364 0.742 1.00 0.00 C ATOM 975 O GLU A 61 -22.434 15.065 -0.106 1.00 0.00 O ATOM 976 CB GLU A 61 -21.609 15.792 2.785 1.00 0.00 C ATOM 977 CG GLU A 61 -21.894 16.061 4.269 1.00 0.00 C ATOM 978 CD GLU A 61 -23.383 16.360 4.532 1.00 0.00 C ATOM 979 OE1 GLU A 61 -23.825 17.513 4.307 1.00 0.00 O ATOM 980 OE2 GLU A 61 -24.122 15.445 4.971 1.00 0.00 O ATOM 0 H GLU A 61 -21.108 13.611 3.724 1.00 0.00 H new ATOM 0 HA GLU A 61 -23.340 14.559 2.279 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -20.530 15.732 2.641 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -21.962 16.642 2.201 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -21.590 15.196 4.858 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -21.291 16.904 4.606 1.00 0.00 H new ATOM 987 N TYR A 62 -20.966 13.440 0.413 1.00 0.00 N ATOM 988 CA TYR A 62 -20.472 13.158 -0.943 1.00 0.00 C ATOM 989 C TYR A 62 -20.966 11.808 -1.493 1.00 0.00 C ATOM 990 O TYR A 62 -20.717 11.484 -2.657 1.00 0.00 O ATOM 991 CB TYR A 62 -18.939 13.225 -0.933 1.00 0.00 C ATOM 992 CG TYR A 62 -18.394 14.625 -0.736 1.00 0.00 C ATOM 993 CD1 TYR A 62 -18.359 15.511 -1.831 1.00 0.00 C ATOM 994 CD2 TYR A 62 -17.904 15.034 0.520 1.00 0.00 C ATOM 995 CE1 TYR A 62 -17.822 16.803 -1.680 1.00 0.00 C ATOM 996 CE2 TYR A 62 -17.361 16.325 0.675 1.00 0.00 C ATOM 997 CZ TYR A 62 -17.323 17.213 -0.424 1.00 0.00 C ATOM 998 OH TYR A 62 -16.795 18.457 -0.268 1.00 0.00 O ATOM 0 H TYR A 62 -20.532 12.841 1.116 1.00 0.00 H new ATOM 0 HA TYR A 62 -20.875 13.914 -1.616 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -18.561 12.582 -0.138 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -18.560 12.826 -1.874 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -18.746 15.198 -2.789 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -17.944 14.359 1.362 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -17.792 17.479 -2.522 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -16.974 16.636 1.634 1.00 0.00 H new ATOM 0 HH TYR A 62 -16.933 18.758 0.655 1.00 0.00 H new ATOM 1008 N LYS A 63 -21.692 11.037 -0.669 1.00 0.00 N ATOM 1009 CA LYS A 63 -22.316 9.736 -0.973 1.00 0.00 C ATOM 1010 C LYS A 63 -21.369 8.728 -1.661 1.00 0.00 C ATOM 1011 O LYS A 63 -21.783 7.966 -2.539 1.00 0.00 O ATOM 1012 CB LYS A 63 -23.633 9.958 -1.750 1.00 0.00 C ATOM 1013 CG LYS A 63 -24.627 10.885 -1.029 1.00 0.00 C ATOM 1014 CD LYS A 63 -25.937 11.001 -1.820 1.00 0.00 C ATOM 1015 CE LYS A 63 -26.898 11.964 -1.114 1.00 0.00 C ATOM 1016 NZ LYS A 63 -28.183 12.092 -1.852 1.00 0.00 N ATOM 0 H LYS A 63 -21.872 11.324 0.293 1.00 0.00 H new ATOM 0 HA LYS A 63 -22.552 9.258 -0.022 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -23.401 10.379 -2.728 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -24.110 8.993 -1.923 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -24.833 10.499 -0.031 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -24.184 11.873 -0.903 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -25.731 11.357 -2.829 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -26.400 10.019 -1.917 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -27.092 11.609 -0.102 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -26.430 12.944 -1.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -28.809 12.751 -1.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -27.999 12.455 -2.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -28.640 11.160 -1.917 1.00 0.00 H new ATOM 1030 N ILE A 64 -20.088 8.740 -1.275 1.00 0.00 N ATOM 1031 CA ILE A 64 -19.021 7.883 -1.823 1.00 0.00 C ATOM 1032 C ILE A 64 -19.387 6.400 -1.642 1.00 0.00 C ATOM 1033 O ILE A 64 -19.877 5.996 -0.584 1.00 0.00 O ATOM 1034 CB ILE A 64 -17.652 8.214 -1.178 1.00 0.00 C ATOM 1035 CG1 ILE A 64 -17.327 9.722 -1.286 1.00 0.00 C ATOM 1036 CG2 ILE A 64 -16.524 7.389 -1.832 1.00 0.00 C ATOM 1037 CD1 ILE A 64 -16.069 10.123 -0.514 1.00 0.00 C ATOM 0 H ILE A 64 -19.750 9.368 -0.546 1.00 0.00 H new ATOM 0 HA ILE A 64 -18.929 8.082 -2.891 1.00 0.00 H new ATOM 0 HB ILE A 64 -17.719 7.951 -0.122 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -17.201 9.986 -2.336 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -18.174 10.297 -0.912 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -15.572 7.638 -1.363 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -16.727 6.326 -1.699 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -16.475 7.619 -2.896 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -15.896 11.193 -0.630 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -16.200 9.889 0.543 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -15.212 9.573 -0.903 1.00 0.00 H new ATOM 1049 N ASP A 65 -19.168 5.593 -2.680 1.00 0.00 N ATOM 1050 CA ASP A 65 -19.515 4.165 -2.705 1.00 0.00 C ATOM 1051 C ASP A 65 -18.288 3.263 -2.445 1.00 0.00 C ATOM 1052 O ASP A 65 -17.144 3.658 -2.676 1.00 0.00 O ATOM 1053 CB ASP A 65 -20.178 3.856 -4.055 1.00 0.00 C ATOM 1054 CG ASP A 65 -20.929 2.523 -4.045 1.00 0.00 C ATOM 1055 OD1 ASP A 65 -20.307 1.484 -4.361 1.00 0.00 O ATOM 1056 OD2 ASP A 65 -22.141 2.495 -3.735 1.00 0.00 O ATOM 0 H ASP A 65 -18.736 5.916 -3.546 1.00 0.00 H new ATOM 0 HA ASP A 65 -20.213 3.948 -1.896 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -20.871 4.658 -4.308 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -19.416 3.835 -4.834 1.00 0.00 H new ATOM 1061 N GLU A 66 -18.518 2.036 -1.971 1.00 0.00 N ATOM 1062 CA GLU A 66 -17.457 1.054 -1.684 1.00 0.00 C ATOM 1063 C GLU A 66 -16.970 0.300 -2.938 1.00 0.00 C ATOM 1064 O GLU A 66 -15.837 -0.187 -2.962 1.00 0.00 O ATOM 1065 CB GLU A 66 -17.952 0.035 -0.643 1.00 0.00 C ATOM 1066 CG GLU A 66 -18.279 0.685 0.708 1.00 0.00 C ATOM 1067 CD GLU A 66 -18.661 -0.374 1.759 1.00 0.00 C ATOM 1068 OE1 GLU A 66 -19.790 -0.920 1.704 1.00 0.00 O ATOM 1069 OE2 GLU A 66 -17.833 -0.647 2.661 1.00 0.00 O ATOM 0 H GLU A 66 -19.456 1.688 -1.772 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.610 1.620 -1.297 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -18.841 -0.467 -1.025 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -17.190 -0.731 -0.499 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -17.418 1.254 1.058 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -19.100 1.392 0.585 1.00 0.00 H new ATOM 1076 N LYS A 67 -17.804 0.189 -3.980 1.00 0.00 N ATOM 1077 CA LYS A 67 -17.492 -0.460 -5.266 1.00 0.00 C ATOM 1078 C LYS A 67 -16.764 0.486 -6.227 1.00 0.00 C ATOM 1079 O LYS A 67 -15.867 0.055 -6.956 1.00 0.00 O ATOM 1080 CB LYS A 67 -18.790 -0.973 -5.916 1.00 0.00 C ATOM 1081 CG LYS A 67 -19.576 -1.924 -4.993 1.00 0.00 C ATOM 1082 CD LYS A 67 -20.877 -2.443 -5.631 1.00 0.00 C ATOM 1083 CE LYS A 67 -22.134 -1.687 -5.168 1.00 0.00 C ATOM 1084 NZ LYS A 67 -22.132 -0.253 -5.554 1.00 0.00 N ATOM 0 H LYS A 67 -18.753 0.563 -3.952 1.00 0.00 H new ATOM 0 HA LYS A 67 -16.823 -1.296 -5.062 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.421 -0.124 -6.180 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -18.548 -1.491 -6.844 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -18.943 -2.772 -4.731 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -19.815 -1.405 -4.065 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -20.796 -2.366 -6.715 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -20.991 -3.501 -5.394 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -23.016 -2.169 -5.591 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -22.217 -1.764 -4.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -23.004 0.199 -5.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -21.308 0.220 -5.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -22.082 -0.172 -6.590 1.00 0.00 H new ATOM 1098 N ASN A 68 -17.145 1.767 -6.231 1.00 0.00 N ATOM 1099 CA ASN A 68 -16.461 2.833 -6.973 1.00 0.00 C ATOM 1100 C ASN A 68 -15.136 3.242 -6.287 1.00 0.00 C ATOM 1101 O ASN A 68 -14.850 2.817 -5.165 1.00 0.00 O ATOM 1102 CB ASN A 68 -17.432 4.023 -7.132 1.00 0.00 C ATOM 1103 CG ASN A 68 -17.017 5.005 -8.220 1.00 0.00 C ATOM 1104 OD1 ASN A 68 -16.247 4.694 -9.119 1.00 0.00 O ATOM 1105 ND2 ASN A 68 -17.498 6.223 -8.173 1.00 0.00 N ATOM 0 H ASN A 68 -17.955 2.100 -5.708 1.00 0.00 H new ATOM 0 HA ASN A 68 -16.182 2.472 -7.963 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -18.428 3.641 -7.359 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -17.502 4.554 -6.182 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -17.230 6.905 -8.883 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -18.140 6.489 -7.427 1.00 0.00 H new ATOM 1112 N PHE A 69 -14.336 4.089 -6.943 1.00 0.00 N ATOM 1113 CA PHE A 69 -13.039 4.563 -6.443 1.00 0.00 C ATOM 1114 C PHE A 69 -12.990 6.085 -6.220 1.00 0.00 C ATOM 1115 O PHE A 69 -13.642 6.863 -6.921 1.00 0.00 O ATOM 1116 CB PHE A 69 -11.907 4.092 -7.373 1.00 0.00 C ATOM 1117 CG PHE A 69 -11.855 4.765 -8.735 1.00 0.00 C ATOM 1118 CD1 PHE A 69 -12.626 4.266 -9.803 1.00 0.00 C ATOM 1119 CD2 PHE A 69 -11.027 5.887 -8.940 1.00 0.00 C ATOM 1120 CE1 PHE A 69 -12.573 4.885 -11.064 1.00 0.00 C ATOM 1121 CE2 PHE A 69 -10.974 6.507 -10.202 1.00 0.00 C ATOM 1122 CZ PHE A 69 -11.746 6.005 -11.264 1.00 0.00 C ATOM 0 H PHE A 69 -14.577 4.473 -7.857 1.00 0.00 H new ATOM 0 HA PHE A 69 -12.896 4.119 -5.458 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -10.955 4.257 -6.869 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -12.007 3.017 -7.522 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -13.260 3.405 -9.653 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -10.431 6.272 -8.126 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -13.168 4.500 -11.880 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -10.340 7.368 -10.355 1.00 0.00 H new ATOM 0 HZ PHE A 69 -11.704 6.479 -12.233 1.00 0.00 H new ATOM 1132 N VAL A 70 -12.170 6.502 -5.255 1.00 0.00 N ATOM 1133 CA VAL A 70 -11.763 7.886 -4.969 1.00 0.00 C ATOM 1134 C VAL A 70 -10.339 8.087 -5.501 1.00 0.00 C ATOM 1135 O VAL A 70 -9.565 7.128 -5.588 1.00 0.00 O ATOM 1136 CB VAL A 70 -11.878 8.175 -3.447 1.00 0.00 C ATOM 1137 CG1 VAL A 70 -10.547 8.229 -2.689 1.00 0.00 C ATOM 1138 CG2 VAL A 70 -12.614 9.492 -3.181 1.00 0.00 C ATOM 0 H VAL A 70 -11.742 5.841 -4.607 1.00 0.00 H new ATOM 0 HA VAL A 70 -12.421 8.597 -5.468 1.00 0.00 H new ATOM 0 HB VAL A 70 -12.437 7.318 -3.070 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -10.736 8.436 -1.636 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -10.035 7.271 -2.784 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -9.922 9.018 -3.107 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -12.677 9.663 -2.106 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -12.071 10.313 -3.648 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -13.619 9.438 -3.599 1.00 0.00 H new ATOM 1148 N VAL A 71 -9.957 9.325 -5.809 1.00 0.00 N ATOM 1149 CA VAL A 71 -8.583 9.664 -6.214 1.00 0.00 C ATOM 1150 C VAL A 71 -7.867 10.387 -5.079 1.00 0.00 C ATOM 1151 O VAL A 71 -8.387 11.347 -4.507 1.00 0.00 O ATOM 1152 CB VAL A 71 -8.557 10.478 -7.519 1.00 0.00 C ATOM 1153 CG1 VAL A 71 -7.131 10.893 -7.905 1.00 0.00 C ATOM 1154 CG2 VAL A 71 -9.102 9.643 -8.683 1.00 0.00 C ATOM 0 H VAL A 71 -10.588 10.126 -5.787 1.00 0.00 H new ATOM 0 HA VAL A 71 -8.047 8.737 -6.419 1.00 0.00 H new ATOM 0 HB VAL A 71 -9.169 11.362 -7.340 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -7.157 11.466 -8.832 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -6.703 11.506 -7.112 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -6.518 10.002 -8.046 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -9.076 10.234 -9.598 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -8.488 8.751 -8.810 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -10.130 9.349 -8.470 1.00 0.00 H new ATOM 1164 N VAL A 72 -6.653 9.928 -4.774 1.00 0.00 N ATOM 1165 CA VAL A 72 -5.729 10.542 -3.813 1.00 0.00 C ATOM 1166 C VAL A 72 -4.455 11.006 -4.522 1.00 0.00 C ATOM 1167 O VAL A 72 -3.903 10.318 -5.384 1.00 0.00 O ATOM 1168 CB VAL A 72 -5.444 9.604 -2.620 1.00 0.00 C ATOM 1169 CG1 VAL A 72 -4.899 8.227 -3.034 1.00 0.00 C ATOM 1170 CG2 VAL A 72 -4.483 10.256 -1.613 1.00 0.00 C ATOM 0 H VAL A 72 -6.269 9.087 -5.204 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.204 11.427 -3.390 1.00 0.00 H new ATOM 0 HB VAL A 72 -6.413 9.438 -2.149 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -4.723 7.623 -2.144 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -5.625 7.726 -3.675 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -3.963 8.355 -3.577 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -4.303 9.570 -0.785 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -3.539 10.485 -2.107 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -4.925 11.176 -1.232 1.00 0.00 H new ATOM 1180 N MET A 73 -3.985 12.190 -4.143 1.00 0.00 N ATOM 1181 CA MET A 73 -2.719 12.781 -4.579 1.00 0.00 C ATOM 1182 C MET A 73 -2.020 13.493 -3.426 1.00 0.00 C ATOM 1183 O MET A 73 -2.607 13.687 -2.363 1.00 0.00 O ATOM 1184 CB MET A 73 -2.962 13.715 -5.772 1.00 0.00 C ATOM 1185 CG MET A 73 -3.785 14.959 -5.436 1.00 0.00 C ATOM 1186 SD MET A 73 -4.044 16.109 -6.813 1.00 0.00 S ATOM 1187 CE MET A 73 -2.355 16.724 -7.048 1.00 0.00 C ATOM 0 H MET A 73 -4.495 12.791 -3.496 1.00 0.00 H new ATOM 0 HA MET A 73 -2.050 11.985 -4.907 1.00 0.00 H new ATOM 0 HB2 MET A 73 -1.999 14.028 -6.176 1.00 0.00 H new ATOM 0 HB3 MET A 73 -3.471 13.157 -6.558 1.00 0.00 H new ATOM 0 HG2 MET A 73 -4.758 14.641 -5.061 1.00 0.00 H new ATOM 0 HG3 MET A 73 -3.291 15.494 -4.625 1.00 0.00 H new ATOM 0 HE1 MET A 73 -2.331 17.406 -7.898 1.00 0.00 H new ATOM 0 HE2 MET A 73 -2.032 17.252 -6.151 1.00 0.00 H new ATOM 0 HE3 MET A 73 -1.685 15.885 -7.237 1.00 0.00 H new ATOM 1197 N VAL A 74 -0.778 13.910 -3.659 1.00 0.00 N ATOM 1198 CA VAL A 74 0.015 14.752 -2.761 1.00 0.00 C ATOM 1199 C VAL A 74 0.590 15.930 -3.563 1.00 0.00 C ATOM 1200 O VAL A 74 1.236 15.729 -4.595 1.00 0.00 O ATOM 1201 CB VAL A 74 1.081 13.914 -2.018 1.00 0.00 C ATOM 1202 CG1 VAL A 74 2.026 13.124 -2.935 1.00 0.00 C ATOM 1203 CG2 VAL A 74 1.921 14.768 -1.063 1.00 0.00 C ATOM 0 H VAL A 74 -0.275 13.662 -4.511 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.612 15.173 -1.975 1.00 0.00 H new ATOM 0 HB VAL A 74 0.493 13.189 -1.455 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.740 12.566 -2.328 1.00 0.00 H new ATOM 0 HG12 VAL A 74 1.446 12.430 -3.544 1.00 0.00 H new ATOM 0 HG13 VAL A 74 2.564 13.814 -3.585 1.00 0.00 H new ATOM 0 HG21 VAL A 74 2.657 14.138 -0.563 1.00 0.00 H new ATOM 0 HG22 VAL A 74 2.434 15.547 -1.627 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.271 15.228 -0.319 1.00 0.00 H new ATOM 1872 N GLU B 283 0.863 22.475 -10.470 1.00 0.00 N ATOM 1873 CA GLU B 283 -0.048 22.023 -9.404 1.00 0.00 C ATOM 1874 C GLU B 283 -1.503 21.925 -9.902 1.00 0.00 C ATOM 1875 O GLU B 283 -2.196 20.946 -9.625 1.00 0.00 O ATOM 1876 CB GLU B 283 0.071 22.967 -8.196 1.00 0.00 C ATOM 1877 CG GLU B 283 -0.722 22.477 -6.980 1.00 0.00 C ATOM 1878 CD GLU B 283 -0.545 23.432 -5.785 1.00 0.00 C ATOM 1879 OE1 GLU B 283 -1.318 24.414 -5.666 1.00 0.00 O ATOM 1880 OE2 GLU B 283 0.367 23.207 -4.954 1.00 0.00 O ATOM 0 HA GLU B 283 0.243 21.018 -9.098 1.00 0.00 H new ATOM 0 HB2 GLU B 283 1.121 23.069 -7.922 1.00 0.00 H new ATOM 0 HB3 GLU B 283 -0.282 23.959 -8.479 1.00 0.00 H new ATOM 0 HG2 GLU B 283 -1.779 22.402 -7.237 1.00 0.00 H new ATOM 0 HG3 GLU B 283 -0.389 21.477 -6.703 1.00 0.00 H new ATOM 1887 N GLU B 284 -1.957 22.912 -10.679 1.00 0.00 N ATOM 1888 CA GLU B 284 -3.315 22.957 -11.231 1.00 0.00 C ATOM 1889 C GLU B 284 -3.574 21.854 -12.271 1.00 0.00 C ATOM 1890 O GLU B 284 -4.624 21.212 -12.216 1.00 0.00 O ATOM 1891 CB GLU B 284 -3.613 24.337 -11.831 1.00 0.00 C ATOM 1892 CG GLU B 284 -3.582 25.455 -10.779 1.00 0.00 C ATOM 1893 CD GLU B 284 -3.980 26.809 -11.398 1.00 0.00 C ATOM 1894 OE1 GLU B 284 -5.196 27.110 -11.485 1.00 0.00 O ATOM 1895 OE2 GLU B 284 -3.080 27.593 -11.791 1.00 0.00 O ATOM 0 H GLU B 284 -1.385 23.713 -10.946 1.00 0.00 H new ATOM 0 HA GLU B 284 -3.994 22.774 -10.398 1.00 0.00 H new ATOM 0 HB2 GLU B 284 -2.883 24.556 -12.611 1.00 0.00 H new ATOM 0 HB3 GLU B 284 -4.593 24.318 -12.308 1.00 0.00 H new ATOM 0 HG2 GLU B 284 -4.262 25.210 -9.963 1.00 0.00 H new ATOM 0 HG3 GLU B 284 -2.583 25.527 -10.350 1.00 0.00 H new ATOM 1902 N GLU B 285 -2.641 21.576 -13.192 1.00 0.00 N ATOM 1903 CA GLU B 285 -2.792 20.449 -14.126 1.00 0.00 C ATOM 1904 C GLU B 285 -2.660 19.081 -13.432 1.00 0.00 C ATOM 1905 O GLU B 285 -3.351 18.138 -13.817 1.00 0.00 O ATOM 1906 CB GLU B 285 -1.816 20.541 -15.313 1.00 0.00 C ATOM 1907 CG GLU B 285 -2.345 21.392 -16.478 1.00 0.00 C ATOM 1908 CD GLU B 285 -2.167 22.908 -16.282 1.00 0.00 C ATOM 1909 OE1 GLU B 285 -1.077 23.429 -16.634 1.00 0.00 O ATOM 1910 OE2 GLU B 285 -3.128 23.594 -15.859 1.00 0.00 O ATOM 0 H GLU B 285 -1.780 22.110 -13.311 1.00 0.00 H new ATOM 0 HA GLU B 285 -3.808 20.527 -14.514 1.00 0.00 H new ATOM 0 HB2 GLU B 285 -0.873 20.962 -14.965 1.00 0.00 H new ATOM 0 HB3 GLU B 285 -1.602 19.536 -15.676 1.00 0.00 H new ATOM 0 HG2 GLU B 285 -1.834 21.093 -17.393 1.00 0.00 H new ATOM 0 HG3 GLU B 285 -3.404 21.177 -16.619 1.00 0.00 H new ATOM 1917 N GLN B 286 -1.839 18.960 -12.382 1.00 0.00 N ATOM 1918 CA GLN B 286 -1.740 17.748 -11.557 1.00 0.00 C ATOM 1919 C GLN B 286 -3.072 17.455 -10.839 1.00 0.00 C ATOM 1920 O GLN B 286 -3.552 16.320 -10.851 1.00 0.00 O ATOM 1921 CB GLN B 286 -0.556 17.907 -10.588 1.00 0.00 C ATOM 1922 CG GLN B 286 -0.103 16.584 -9.960 1.00 0.00 C ATOM 1923 CD GLN B 286 1.104 16.763 -9.036 1.00 0.00 C ATOM 1924 OE1 GLN B 286 2.081 17.428 -9.356 1.00 0.00 O ATOM 1925 NE2 GLN B 286 1.108 16.166 -7.864 1.00 0.00 N ATOM 0 H GLN B 286 -1.217 19.709 -12.077 1.00 0.00 H new ATOM 0 HA GLN B 286 -1.549 16.879 -12.186 1.00 0.00 H new ATOM 0 HB2 GLN B 286 0.283 18.354 -11.121 1.00 0.00 H new ATOM 0 HB3 GLN B 286 -0.835 18.601 -9.795 1.00 0.00 H new ATOM 0 HG2 GLN B 286 -0.929 16.151 -9.396 1.00 0.00 H new ATOM 0 HG3 GLN B 286 0.149 15.877 -10.750 1.00 0.00 H new ATOM 0 HE21 GLN B 286 0.306 15.606 -7.574 1.00 0.00 H new ATOM 0 HE22 GLN B 286 1.913 16.263 -7.245 1.00 0.00 H new ATOM 1934 N ILE B 287 -3.708 18.487 -10.272 1.00 0.00 N ATOM 1935 CA ILE B 287 -5.075 18.441 -9.739 1.00 0.00 C ATOM 1936 C ILE B 287 -6.085 18.069 -10.839 1.00 0.00 C ATOM 1937 O ILE B 287 -6.884 17.158 -10.642 1.00 0.00 O ATOM 1938 CB ILE B 287 -5.409 19.776 -9.029 1.00 0.00 C ATOM 1939 CG1 ILE B 287 -4.682 19.826 -7.663 1.00 0.00 C ATOM 1940 CG2 ILE B 287 -6.925 19.952 -8.839 1.00 0.00 C ATOM 1941 CD1 ILE B 287 -4.670 21.212 -7.001 1.00 0.00 C ATOM 0 H ILE B 287 -3.273 19.404 -10.168 1.00 0.00 H new ATOM 0 HA ILE B 287 -5.147 17.653 -8.990 1.00 0.00 H new ATOM 0 HB ILE B 287 -5.064 20.597 -9.657 1.00 0.00 H new ATOM 0 HG12 ILE B 287 -5.158 19.117 -6.986 1.00 0.00 H new ATOM 0 HG13 ILE B 287 -3.653 19.493 -7.800 1.00 0.00 H new ATOM 0 HG21 ILE B 287 -7.121 20.900 -8.338 1.00 0.00 H new ATOM 0 HG22 ILE B 287 -7.417 19.948 -9.812 1.00 0.00 H new ATOM 0 HG23 ILE B 287 -7.313 19.134 -8.233 1.00 0.00 H new ATOM 0 HD11 ILE B 287 -4.141 21.156 -6.050 1.00 0.00 H new ATOM 0 HD12 ILE B 287 -4.166 21.923 -7.655 1.00 0.00 H new ATOM 0 HD13 ILE B 287 -5.695 21.541 -6.828 1.00 0.00 H new ATOM 1953 N ALA B 288 -6.062 18.719 -12.006 1.00 0.00 N ATOM 1954 CA ALA B 288 -6.994 18.416 -13.098 1.00 0.00 C ATOM 1955 C ALA B 288 -6.854 16.977 -13.644 1.00 0.00 C ATOM 1956 O ALA B 288 -7.855 16.350 -13.995 1.00 0.00 O ATOM 1957 CB ALA B 288 -6.822 19.458 -14.204 1.00 0.00 C ATOM 0 H ALA B 288 -5.401 19.466 -12.221 1.00 0.00 H new ATOM 0 HA ALA B 288 -8.006 18.468 -12.697 1.00 0.00 H new ATOM 0 HB1 ALA B 288 -7.511 19.240 -15.020 1.00 0.00 H new ATOM 0 HB2 ALA B 288 -7.034 20.450 -13.805 1.00 0.00 H new ATOM 0 HB3 ALA B 288 -5.798 19.428 -14.576 1.00 0.00 H new ATOM 1963 N TYR B 289 -5.641 16.415 -13.664 1.00 0.00 N ATOM 1964 CA TYR B 289 -5.391 14.999 -13.953 1.00 0.00 C ATOM 1965 C TYR B 289 -6.069 14.079 -12.918 1.00 0.00 C ATOM 1966 O TYR B 289 -6.736 13.109 -13.288 1.00 0.00 O ATOM 1967 CB TYR B 289 -3.874 14.762 -14.036 1.00 0.00 C ATOM 1968 CG TYR B 289 -3.476 13.340 -14.388 1.00 0.00 C ATOM 1969 CD1 TYR B 289 -3.839 12.796 -15.636 1.00 0.00 C ATOM 1970 CD2 TYR B 289 -2.733 12.564 -13.475 1.00 0.00 C ATOM 1971 CE1 TYR B 289 -3.469 11.479 -15.970 1.00 0.00 C ATOM 1972 CE2 TYR B 289 -2.365 11.244 -13.803 1.00 0.00 C ATOM 1973 CZ TYR B 289 -2.732 10.698 -15.052 1.00 0.00 C ATOM 1974 OH TYR B 289 -2.363 9.428 -15.377 1.00 0.00 O ATOM 0 H TYR B 289 -4.788 16.942 -13.476 1.00 0.00 H new ATOM 0 HA TYR B 289 -5.836 14.745 -14.915 1.00 0.00 H new ATOM 0 HB2 TYR B 289 -3.454 15.438 -14.781 1.00 0.00 H new ATOM 0 HB3 TYR B 289 -3.425 15.025 -13.078 1.00 0.00 H new ATOM 0 HD1 TYR B 289 -4.403 13.391 -16.339 1.00 0.00 H new ATOM 0 HD2 TYR B 289 -2.445 12.982 -12.522 1.00 0.00 H new ATOM 0 HE1 TYR B 289 -3.749 11.066 -16.928 1.00 0.00 H new ATOM 0 HE2 TYR B 289 -1.802 10.650 -13.099 1.00 0.00 H new ATOM 0 HH TYR B 289 -1.862 9.033 -14.634 1.00 0.00 H new ATOM 1984 N ALA B 290 -5.974 14.420 -11.627 1.00 0.00 N ATOM 1985 CA ALA B 290 -6.704 13.759 -10.545 1.00 0.00 C ATOM 1986 C ALA B 290 -8.238 13.827 -10.725 1.00 0.00 C ATOM 1987 O ALA B 290 -8.922 12.806 -10.617 1.00 0.00 O ATOM 1988 CB ALA B 290 -6.268 14.374 -9.208 1.00 0.00 C ATOM 0 H ALA B 290 -5.375 15.179 -11.302 1.00 0.00 H new ATOM 0 HA ALA B 290 -6.456 12.698 -10.563 1.00 0.00 H new ATOM 0 HB1 ALA B 290 -6.805 13.890 -8.392 1.00 0.00 H new ATOM 0 HB2 ALA B 290 -5.196 14.229 -9.073 1.00 0.00 H new ATOM 0 HB3 ALA B 290 -6.493 15.441 -9.208 1.00 0.00 H new ATOM 1994 N MET B 291 -8.779 15.015 -11.035 1.00 0.00 N ATOM 1995 CA MET B 291 -10.188 15.249 -11.354 1.00 0.00 C ATOM 1996 C MET B 291 -10.658 14.340 -12.487 1.00 0.00 C ATOM 1997 O MET B 291 -11.609 13.589 -12.289 1.00 0.00 O ATOM 1998 CB MET B 291 -10.444 16.728 -11.695 1.00 0.00 C ATOM 1999 CG MET B 291 -10.226 17.668 -10.505 1.00 0.00 C ATOM 2000 SD MET B 291 -10.475 19.421 -10.900 1.00 0.00 S ATOM 2001 CE MET B 291 -10.609 20.085 -9.219 1.00 0.00 C ATOM 0 H MET B 291 -8.222 15.869 -11.071 1.00 0.00 H new ATOM 0 HA MET B 291 -10.770 15.004 -10.466 1.00 0.00 H new ATOM 0 HB2 MET B 291 -9.785 17.026 -12.510 1.00 0.00 H new ATOM 0 HB3 MET B 291 -11.467 16.839 -12.055 1.00 0.00 H new ATOM 0 HG2 MET B 291 -10.907 17.386 -9.702 1.00 0.00 H new ATOM 0 HG3 MET B 291 -9.213 17.531 -10.127 1.00 0.00 H new ATOM 0 HE1 MET B 291 -10.588 21.174 -9.255 1.00 0.00 H new ATOM 0 HE2 MET B 291 -11.546 19.755 -8.771 1.00 0.00 H new ATOM 0 HE3 MET B 291 -9.773 19.726 -8.618 1.00 0.00 H new ATOM 2011 N GLN B 292 -9.981 14.361 -13.640 1.00 0.00 N ATOM 2012 CA GLN B 292 -10.344 13.582 -14.828 1.00 0.00 C ATOM 2013 C GLN B 292 -10.593 12.100 -14.511 1.00 0.00 C ATOM 2014 O GLN B 292 -11.612 11.555 -14.927 1.00 0.00 O ATOM 2015 CB GLN B 292 -9.259 13.749 -15.906 1.00 0.00 C ATOM 2016 CG GLN B 292 -9.619 13.061 -17.236 1.00 0.00 C ATOM 2017 CD GLN B 292 -10.798 13.733 -17.944 1.00 0.00 C ATOM 2018 OE1 GLN B 292 -11.947 13.323 -17.841 1.00 0.00 O ATOM 2019 NE2 GLN B 292 -10.570 14.795 -18.687 1.00 0.00 N ATOM 0 H GLN B 292 -9.147 14.933 -13.776 1.00 0.00 H new ATOM 0 HA GLN B 292 -11.290 13.971 -15.206 1.00 0.00 H new ATOM 0 HB2 GLN B 292 -9.094 14.811 -16.086 1.00 0.00 H new ATOM 0 HB3 GLN B 292 -8.320 13.339 -15.534 1.00 0.00 H new ATOM 0 HG2 GLN B 292 -8.750 13.072 -17.894 1.00 0.00 H new ATOM 0 HG3 GLN B 292 -9.861 12.015 -17.046 1.00 0.00 H new ATOM 0 HE21 GLN B 292 -9.620 15.153 -18.787 1.00 0.00 H new ATOM 0 HE22 GLN B 292 -11.343 15.260 -19.163 1.00 0.00 H new ATOM 2028 N MET B 293 -9.703 11.442 -13.763 1.00 0.00 N ATOM 2029 CA MET B 293 -9.867 10.020 -13.436 1.00 0.00 C ATOM 2030 C MET B 293 -11.174 9.743 -12.670 1.00 0.00 C ATOM 2031 O MET B 293 -11.983 8.926 -13.114 1.00 0.00 O ATOM 2032 CB MET B 293 -8.647 9.494 -12.666 1.00 0.00 C ATOM 2033 CG MET B 293 -7.406 9.406 -13.564 1.00 0.00 C ATOM 2034 SD MET B 293 -5.976 8.595 -12.794 1.00 0.00 S ATOM 2035 CE MET B 293 -5.511 9.857 -11.578 1.00 0.00 C ATOM 0 H MET B 293 -8.863 11.869 -13.373 1.00 0.00 H new ATOM 0 HA MET B 293 -9.937 9.478 -14.379 1.00 0.00 H new ATOM 0 HB2 MET B 293 -8.439 10.150 -11.821 1.00 0.00 H new ATOM 0 HB3 MET B 293 -8.871 8.509 -12.257 1.00 0.00 H new ATOM 0 HG2 MET B 293 -7.669 8.865 -14.473 1.00 0.00 H new ATOM 0 HG3 MET B 293 -7.118 10.413 -13.864 1.00 0.00 H new ATOM 0 HE1 MET B 293 -4.444 10.064 -11.658 1.00 0.00 H new ATOM 0 HE2 MET B 293 -6.073 10.771 -11.769 1.00 0.00 H new ATOM 0 HE3 MET B 293 -5.736 9.496 -10.575 1.00 0.00 H new ATOM 2045 N SER B 294 -11.422 10.433 -11.548 1.00 0.00 N ATOM 2046 CA SER B 294 -12.673 10.266 -10.781 1.00 0.00 C ATOM 2047 C SER B 294 -13.928 10.752 -11.526 1.00 0.00 C ATOM 2048 O SER B 294 -15.009 10.192 -11.342 1.00 0.00 O ATOM 2049 CB SER B 294 -12.587 10.953 -9.415 1.00 0.00 C ATOM 2050 OG SER B 294 -12.590 12.360 -9.545 1.00 0.00 O ATOM 0 H SER B 294 -10.775 11.113 -11.148 1.00 0.00 H new ATOM 0 HA SER B 294 -12.780 9.190 -10.644 1.00 0.00 H new ATOM 0 HB2 SER B 294 -13.428 10.641 -8.796 1.00 0.00 H new ATOM 0 HB3 SER B 294 -11.679 10.635 -8.903 1.00 0.00 H new ATOM 0 HG SER B 294 -12.264 12.607 -10.436 1.00 0.00 H new