USER MOD reduce.3.24.130724 H: found=0, std=0, add=708, rem=0, adj=22 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 54 ASN : amide:sc= 0.975 K(o=1.8,f=1.1) USER MOD Set 1.2: A 57 THR OG1 : rot 180:sc= 0.83 USER MOD Set 2.1: A 2 GLN : amide:sc= 0.95 K(o=2.1,f=-2.3) USER MOD Set 2.2: A 14 LYS NZ :NH3+ -177:sc= 1.11 (180deg=0) USER MOD Single : A 1 MET CE :methyl 171:sc= -0.404 (180deg=-0.731) USER MOD Single : A 1 MET N :NH3+ -167:sc= 2.12 (180deg=1.92) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.204 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 GLN : amide:sc= 0.952 K(o=0.95,f=0) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) 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+ 153:sc= 2.18 (180deg=1.78) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -116:sc= 0.937 (180deg=0.0255) USER MOD Single : A 36 LYS NZ :NH3+ 172:sc= 1.23 (180deg=1.14) USER MOD Single : A 44 GLN : amide:sc= 0.85 K(o=0.85,f=-3.2!) USER MOD Single : A 45 LYS NZ :NH3+ -137:sc= 0.625 (180deg=-0.062) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 174:sc= 1.33 (180deg=1.2) USER MOD Single : A 62 TYR OH : rot 150:sc= 0.564 USER MOD Single : A 63 LYS NZ :NH3+ -179:sc= 1.21 (180deg=1.15) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -0.111 X(o=-0.11,f=0) USER MOD Single : A 73 MET CE :methyl 173:sc= -0.718 (180deg=-0.801) USER MOD Single : B 286 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 289 TYR OH : rot 180:sc= 0 USER MOD Single : B 291 MET CE :methyl 173:sc= 0 (180deg=-0.0553) USER MOD Single : B 292 GLN : amide:sc= 0.522 K(o=0.52,f=-0.05) USER MOD Single : B 293 MET CE :methyl 173:sc= -0.335 (180deg=-0.449) USER MOD Single : B 294 SER OG : rot 50:sc= 0.399 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.442 -1.657 -3.286 1.00 0.00 N ATOM 2 CA MET A 1 -8.211 -1.604 -4.109 1.00 0.00 C ATOM 3 C MET A 1 -7.334 -0.444 -3.674 1.00 0.00 C ATOM 4 O MET A 1 -7.803 0.684 -3.553 1.00 0.00 O ATOM 5 CB MET A 1 -8.466 -1.555 -5.628 1.00 0.00 C ATOM 6 CG MET A 1 -9.172 -0.317 -6.182 1.00 0.00 C ATOM 7 SD MET A 1 -9.312 -0.374 -7.989 1.00 0.00 S ATOM 8 CE MET A 1 -8.184 0.960 -8.450 1.00 0.00 C ATOM 0 H1 MET A 1 -9.922 -2.567 -3.438 1.00 0.00 H new ATOM 0 H2 MET A 1 -9.192 -1.561 -2.281 1.00 0.00 H new ATOM 0 H3 MET A 1 -10.077 -0.881 -3.561 1.00 0.00 H new ATOM 0 HA MET A 1 -7.692 -2.546 -3.931 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.505 -1.650 -6.134 1.00 0.00 H new ATOM 0 HB3 MET A 1 -9.057 -2.430 -5.899 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.166 -0.239 -5.743 1.00 0.00 H new ATOM 0 HG3 MET A 1 -8.622 0.577 -5.888 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.033 0.952 -9.529 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.611 1.917 -8.151 1.00 0.00 H new ATOM 0 HE3 MET A 1 -7.227 0.817 -7.948 1.00 0.00 H new ATOM 20 N GLN A 2 -6.057 -0.709 -3.426 1.00 0.00 N ATOM 21 CA GLN A 2 -5.097 0.274 -2.931 1.00 0.00 C ATOM 22 C GLN A 2 -4.463 1.047 -4.100 1.00 0.00 C ATOM 23 O GLN A 2 -3.428 0.659 -4.646 1.00 0.00 O ATOM 24 CB GLN A 2 -4.060 -0.370 -1.999 1.00 0.00 C ATOM 25 CG GLN A 2 -4.625 -1.337 -0.944 1.00 0.00 C ATOM 26 CD GLN A 2 -3.505 -2.025 -0.169 1.00 0.00 C ATOM 27 OE1 GLN A 2 -2.936 -1.491 0.776 1.00 0.00 O ATOM 28 NE2 GLN A 2 -3.127 -3.231 -0.539 1.00 0.00 N ATOM 0 H GLN A 2 -5.650 -1.634 -3.566 1.00 0.00 H new ATOM 0 HA GLN A 2 -5.629 1.004 -2.322 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -3.335 -0.909 -2.609 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -3.517 0.423 -1.485 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -5.266 -0.791 -0.253 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -5.248 -2.087 -1.431 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -3.588 -3.692 -1.323 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -2.373 -3.704 -0.041 1.00 0.00 H new ATOM 37 N VAL A 3 -5.108 2.142 -4.508 1.00 0.00 N ATOM 38 CA VAL A 3 -4.577 3.099 -5.490 1.00 0.00 C ATOM 39 C VAL A 3 -3.389 3.838 -4.875 1.00 0.00 C ATOM 40 O VAL A 3 -3.531 4.511 -3.851 1.00 0.00 O ATOM 41 CB VAL A 3 -5.656 4.104 -5.945 1.00 0.00 C ATOM 42 CG1 VAL A 3 -5.113 5.117 -6.961 1.00 0.00 C ATOM 43 CG2 VAL A 3 -6.802 3.380 -6.652 1.00 0.00 C ATOM 0 H VAL A 3 -6.033 2.396 -4.160 1.00 0.00 H new ATOM 0 HA VAL A 3 -4.255 2.548 -6.373 1.00 0.00 H new ATOM 0 HB VAL A 3 -5.987 4.611 -5.039 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -5.909 5.803 -7.251 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -4.295 5.680 -6.512 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -4.749 4.589 -7.843 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -7.553 4.106 -6.965 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -6.417 2.856 -7.527 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -7.255 2.661 -5.969 1.00 0.00 H new ATOM 53 N THR A 4 -2.218 3.741 -5.501 1.00 0.00 N ATOM 54 CA THR A 4 -1.054 4.556 -5.126 1.00 0.00 C ATOM 55 C THR A 4 -1.197 5.952 -5.710 1.00 0.00 C ATOM 56 O THR A 4 -1.607 6.119 -6.860 1.00 0.00 O ATOM 57 CB THR A 4 0.238 3.970 -5.694 1.00 0.00 C ATOM 58 OG1 THR A 4 0.465 2.684 -5.157 1.00 0.00 O ATOM 59 CG2 THR A 4 1.456 4.840 -5.375 1.00 0.00 C ATOM 0 H THR A 4 -2.045 3.102 -6.277 1.00 0.00 H new ATOM 0 HA THR A 4 -1.010 4.577 -4.037 1.00 0.00 H new ATOM 0 HB THR A 4 0.113 3.924 -6.776 1.00 0.00 H new ATOM 0 HG1 THR A 4 1.294 2.316 -5.528 1.00 0.00 H new ATOM 0 HG21 THR A 4 2.350 4.383 -5.799 1.00 0.00 H new ATOM 0 HG22 THR A 4 1.317 5.832 -5.804 1.00 0.00 H new ATOM 0 HG23 THR A 4 1.569 4.925 -4.294 1.00 0.00 H new ATOM 67 N LEU A 5 -0.789 6.952 -4.936 1.00 0.00 N ATOM 68 CA LEU A 5 -0.857 8.366 -5.267 1.00 0.00 C ATOM 69 C LEU A 5 0.531 9.004 -5.286 1.00 0.00 C ATOM 70 O LEU A 5 1.419 8.614 -4.524 1.00 0.00 O ATOM 71 CB LEU A 5 -1.733 9.073 -4.219 1.00 0.00 C ATOM 72 CG LEU A 5 -3.102 8.422 -3.965 1.00 0.00 C ATOM 73 CD1 LEU A 5 -3.889 9.303 -3.008 1.00 0.00 C ATOM 74 CD2 LEU A 5 -3.895 8.256 -5.249 1.00 0.00 C ATOM 0 H LEU A 5 -0.382 6.787 -4.015 1.00 0.00 H new ATOM 0 HA LEU A 5 -1.286 8.472 -6.264 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -1.186 9.111 -3.277 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -1.892 10.103 -4.537 1.00 0.00 H new ATOM 0 HG LEU A 5 -2.936 7.431 -3.542 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -4.864 8.854 -2.818 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -3.344 9.398 -2.069 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -4.024 10.290 -3.450 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -4.856 7.792 -5.026 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -4.060 9.233 -5.703 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -3.339 7.623 -5.941 1.00 0.00 H new ATOM 86 N LYS A 6 0.666 10.049 -6.100 1.00 0.00 N ATOM 87 CA LYS A 6 1.813 10.962 -6.149 1.00 0.00 C ATOM 88 C LYS A 6 1.341 12.416 -6.148 1.00 0.00 C ATOM 89 O LYS A 6 0.495 12.793 -6.961 1.00 0.00 O ATOM 90 CB LYS A 6 2.719 10.622 -7.342 1.00 0.00 C ATOM 91 CG LYS A 6 3.999 11.469 -7.286 1.00 0.00 C ATOM 92 CD LYS A 6 5.173 10.790 -7.994 1.00 0.00 C ATOM 93 CE LYS A 6 6.438 11.580 -7.652 1.00 0.00 C ATOM 94 NZ LYS A 6 7.657 10.943 -8.217 1.00 0.00 N ATOM 0 H LYS A 6 -0.055 10.297 -6.778 1.00 0.00 H new ATOM 0 HA LYS A 6 2.418 10.832 -5.252 1.00 0.00 H new ATOM 0 HB2 LYS A 6 2.973 9.562 -7.326 1.00 0.00 H new ATOM 0 HB3 LYS A 6 2.190 10.809 -8.276 1.00 0.00 H new ATOM 0 HG2 LYS A 6 3.811 12.439 -7.746 1.00 0.00 H new ATOM 0 HG3 LYS A 6 4.264 11.656 -6.245 1.00 0.00 H new ATOM 0 HD2 LYS A 6 5.269 9.754 -7.669 1.00 0.00 H new ATOM 0 HD3 LYS A 6 5.012 10.772 -9.072 1.00 0.00 H new ATOM 0 HE2 LYS A 6 6.347 12.596 -8.037 1.00 0.00 H new ATOM 0 HE3 LYS A 6 6.537 11.657 -6.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 8.493 11.508 -7.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 7.758 9.983 -7.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 7.574 10.892 -9.252 1.00 0.00 H new ATOM 108 N THR A 7 1.847 13.202 -5.201 1.00 0.00 N ATOM 109 CA THR A 7 1.541 14.629 -5.029 1.00 0.00 C ATOM 110 C THR A 7 2.396 15.500 -5.956 1.00 0.00 C ATOM 111 O THR A 7 3.439 15.067 -6.457 1.00 0.00 O ATOM 112 CB THR A 7 1.744 15.081 -3.567 1.00 0.00 C ATOM 113 OG1 THR A 7 3.105 15.331 -3.280 1.00 0.00 O ATOM 114 CG2 THR A 7 1.262 14.071 -2.523 1.00 0.00 C ATOM 0 H THR A 7 2.506 12.855 -4.504 1.00 0.00 H new ATOM 0 HA THR A 7 0.491 14.758 -5.292 1.00 0.00 H new ATOM 0 HB THR A 7 1.141 15.986 -3.495 1.00 0.00 H new ATOM 0 HG1 THR A 7 3.195 15.617 -2.347 1.00 0.00 H new ATOM 0 HG21 THR A 7 1.442 14.467 -1.524 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.195 13.892 -2.656 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.805 13.134 -2.645 1.00 0.00 H new ATOM 122 N LEU A 8 2.015 16.769 -6.138 1.00 0.00 N ATOM 123 CA LEU A 8 2.838 17.749 -6.867 1.00 0.00 C ATOM 124 C LEU A 8 4.104 18.171 -6.101 1.00 0.00 C ATOM 125 O LEU A 8 5.088 18.579 -6.716 1.00 0.00 O ATOM 126 CB LEU A 8 1.989 18.960 -7.272 1.00 0.00 C ATOM 127 CG LEU A 8 0.754 18.614 -8.120 1.00 0.00 C ATOM 128 CD1 LEU A 8 0.112 19.884 -8.660 1.00 0.00 C ATOM 129 CD2 LEU A 8 1.061 17.759 -9.343 1.00 0.00 C ATOM 0 H LEU A 8 1.135 17.147 -5.788 1.00 0.00 H new ATOM 0 HA LEU A 8 3.197 17.255 -7.770 1.00 0.00 H new ATOM 0 HB2 LEU A 8 1.662 19.477 -6.370 1.00 0.00 H new ATOM 0 HB3 LEU A 8 2.614 19.657 -7.830 1.00 0.00 H new ATOM 0 HG LEU A 8 0.104 18.058 -7.444 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.761 19.624 -9.259 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -0.194 20.519 -7.829 1.00 0.00 H new ATOM 0 HD13 LEU A 8 0.831 20.420 -9.280 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.138 17.559 -9.888 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.758 18.289 -9.992 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.507 16.816 -9.025 1.00 0.00 H new ATOM 141 N GLN A 9 4.121 17.991 -4.775 1.00 0.00 N ATOM 142 CA GLN A 9 5.307 18.125 -3.915 1.00 0.00 C ATOM 143 C GLN A 9 6.256 16.906 -4.036 1.00 0.00 C ATOM 144 O GLN A 9 7.248 16.809 -3.312 1.00 0.00 O ATOM 145 CB GLN A 9 4.868 18.353 -2.455 1.00 0.00 C ATOM 146 CG GLN A 9 4.073 19.657 -2.278 1.00 0.00 C ATOM 147 CD GLN A 9 3.742 19.921 -0.810 1.00 0.00 C ATOM 148 OE1 GLN A 9 4.530 20.475 -0.052 1.00 0.00 O ATOM 149 NE2 GLN A 9 2.567 19.548 -0.344 1.00 0.00 N ATOM 0 H GLN A 9 3.282 17.740 -4.252 1.00 0.00 H new ATOM 0 HA GLN A 9 5.875 18.992 -4.253 1.00 0.00 H new ATOM 0 HB2 GLN A 9 4.258 17.512 -2.126 1.00 0.00 H new ATOM 0 HB3 GLN A 9 5.749 18.378 -1.813 1.00 0.00 H new ATOM 0 HG2 GLN A 9 4.649 20.492 -2.677 1.00 0.00 H new ATOM 0 HG3 GLN A 9 3.150 19.602 -2.855 1.00 0.00 H new ATOM 0 HE21 GLN A 9 1.898 19.086 -0.959 1.00 0.00 H new ATOM 0 HE22 GLN A 9 2.327 19.722 0.632 1.00 0.00 H new ATOM 158 N GLN A 10 5.964 15.979 -4.962 1.00 0.00 N ATOM 159 CA GLN A 10 6.714 14.757 -5.285 1.00 0.00 C ATOM 160 C GLN A 10 6.744 13.724 -4.141 1.00 0.00 C ATOM 161 O GLN A 10 7.608 12.843 -4.114 1.00 0.00 O ATOM 162 CB GLN A 10 8.108 15.089 -5.863 1.00 0.00 C ATOM 163 CG GLN A 10 8.112 16.145 -6.990 1.00 0.00 C ATOM 164 CD GLN A 10 8.713 17.485 -6.548 1.00 0.00 C ATOM 165 OE1 GLN A 10 9.906 17.600 -6.291 1.00 0.00 O ATOM 166 NE2 GLN A 10 7.942 18.549 -6.469 1.00 0.00 N ATOM 0 H GLN A 10 5.134 16.072 -5.548 1.00 0.00 H new ATOM 0 HA GLN A 10 6.161 14.251 -6.076 1.00 0.00 H new ATOM 0 HB2 GLN A 10 8.746 15.442 -5.053 1.00 0.00 H new ATOM 0 HB3 GLN A 10 8.555 14.171 -6.244 1.00 0.00 H new ATOM 0 HG2 GLN A 10 8.677 15.761 -7.839 1.00 0.00 H new ATOM 0 HG3 GLN A 10 7.090 16.306 -7.334 1.00 0.00 H new ATOM 0 HE21 GLN A 10 6.947 18.474 -6.679 1.00 0.00 H new ATOM 0 HE22 GLN A 10 8.340 19.448 -6.198 1.00 0.00 H new ATOM 175 N GLN A 11 5.772 13.786 -3.226 1.00 0.00 N ATOM 176 CA GLN A 11 5.555 12.781 -2.179 1.00 0.00 C ATOM 177 C GLN A 11 4.619 11.684 -2.700 1.00 0.00 C ATOM 178 O GLN A 11 3.847 11.919 -3.630 1.00 0.00 O ATOM 179 CB GLN A 11 4.961 13.441 -0.924 1.00 0.00 C ATOM 180 CG GLN A 11 5.830 14.584 -0.378 1.00 0.00 C ATOM 181 CD GLN A 11 5.278 15.133 0.936 1.00 0.00 C ATOM 182 OE1 GLN A 11 4.204 15.718 0.998 1.00 0.00 O ATOM 183 NE2 GLN A 11 5.983 14.978 2.039 1.00 0.00 N ATOM 0 H GLN A 11 5.099 14.552 -3.191 1.00 0.00 H new ATOM 0 HA GLN A 11 6.512 12.332 -1.912 1.00 0.00 H new ATOM 0 HB2 GLN A 11 3.969 13.827 -1.158 1.00 0.00 H new ATOM 0 HB3 GLN A 11 4.835 12.686 -0.148 1.00 0.00 H new ATOM 0 HG2 GLN A 11 6.848 14.226 -0.224 1.00 0.00 H new ATOM 0 HG3 GLN A 11 5.882 15.386 -1.115 1.00 0.00 H new ATOM 0 HE21 GLN A 11 6.880 14.493 2.007 1.00 0.00 H new ATOM 0 HE22 GLN A 11 5.632 15.343 2.924 1.00 0.00 H new ATOM 192 N THR A 12 4.660 10.486 -2.115 1.00 0.00 N ATOM 193 CA THR A 12 3.818 9.352 -2.530 1.00 0.00 C ATOM 194 C THR A 12 3.170 8.644 -1.338 1.00 0.00 C ATOM 195 O THR A 12 3.744 8.548 -0.249 1.00 0.00 O ATOM 196 CB THR A 12 4.585 8.351 -3.415 1.00 0.00 C ATOM 197 OG1 THR A 12 5.766 7.907 -2.775 1.00 0.00 O ATOM 198 CG2 THR A 12 4.988 8.952 -4.769 1.00 0.00 C ATOM 0 H THR A 12 5.280 10.269 -1.335 1.00 0.00 H new ATOM 0 HA THR A 12 3.016 9.777 -3.134 1.00 0.00 H new ATOM 0 HB THR A 12 3.900 7.520 -3.581 1.00 0.00 H new ATOM 0 HG1 THR A 12 6.234 7.271 -3.356 1.00 0.00 H new ATOM 0 HG21 THR A 12 5.525 8.205 -5.353 1.00 0.00 H new ATOM 0 HG22 THR A 12 4.094 9.261 -5.310 1.00 0.00 H new ATOM 0 HG23 THR A 12 5.631 9.817 -4.606 1.00 0.00 H new ATOM 206 N PHE A 13 1.940 8.174 -1.550 1.00 0.00 N ATOM 207 CA PHE A 13 1.032 7.585 -0.553 1.00 0.00 C ATOM 208 C PHE A 13 0.179 6.476 -1.197 1.00 0.00 C ATOM 209 O PHE A 13 0.262 6.255 -2.407 1.00 0.00 O ATOM 210 CB PHE A 13 0.127 8.695 0.021 1.00 0.00 C ATOM 211 CG PHE A 13 0.852 9.831 0.724 1.00 0.00 C ATOM 212 CD1 PHE A 13 1.196 9.711 2.085 1.00 0.00 C ATOM 213 CD2 PHE A 13 1.186 11.008 0.024 1.00 0.00 C ATOM 214 CE1 PHE A 13 1.885 10.751 2.736 1.00 0.00 C ATOM 215 CE2 PHE A 13 1.879 12.045 0.675 1.00 0.00 C ATOM 216 CZ PHE A 13 2.234 11.915 2.029 1.00 0.00 C ATOM 0 H PHE A 13 1.521 8.194 -2.480 1.00 0.00 H new ATOM 0 HA PHE A 13 1.615 7.140 0.253 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -0.466 9.114 -0.792 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -0.572 8.243 0.725 1.00 0.00 H new ATOM 0 HD1 PHE A 13 0.930 8.818 2.631 1.00 0.00 H new ATOM 0 HD2 PHE A 13 0.909 11.114 -1.015 1.00 0.00 H new ATOM 0 HE1 PHE A 13 2.146 10.655 3.780 1.00 0.00 H new ATOM 0 HE2 PHE A 13 2.139 12.943 0.133 1.00 0.00 H new ATOM 0 HZ PHE A 13 2.774 12.708 2.525 1.00 0.00 H new ATOM 226 N LYS A 14 -0.680 5.797 -0.428 1.00 0.00 N ATOM 227 CA LYS A 14 -1.702 4.874 -0.956 1.00 0.00 C ATOM 228 C LYS A 14 -3.068 5.100 -0.300 1.00 0.00 C ATOM 229 O LYS A 14 -3.146 5.541 0.848 1.00 0.00 O ATOM 230 CB LYS A 14 -1.235 3.409 -0.842 1.00 0.00 C ATOM 231 CG LYS A 14 -1.077 2.914 0.607 1.00 0.00 C ATOM 232 CD LYS A 14 -0.781 1.410 0.648 1.00 0.00 C ATOM 233 CE LYS A 14 -0.718 0.931 2.104 1.00 0.00 C ATOM 234 NZ LYS A 14 -0.643 -0.550 2.184 1.00 0.00 N ATOM 0 H LYS A 14 -0.689 5.871 0.589 1.00 0.00 H new ATOM 0 HA LYS A 14 -1.831 5.092 -2.016 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -1.951 2.769 -1.358 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -0.281 3.301 -1.358 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -0.270 3.460 1.095 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -1.988 3.124 1.168 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -1.555 0.863 0.109 1.00 0.00 H new ATOM 0 HD3 LYS A 14 0.164 1.202 0.146 1.00 0.00 H new ATOM 0 HE2 LYS A 14 0.151 1.368 2.595 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -1.598 1.282 2.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.653 -0.845 3.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -1.459 -0.966 1.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 0.236 -0.878 1.735 1.00 0.00 H new ATOM 248 N ILE A 15 -4.133 4.765 -1.025 1.00 0.00 N ATOM 249 CA ILE A 15 -5.538 4.872 -0.614 1.00 0.00 C ATOM 250 C ILE A 15 -6.290 3.612 -1.036 1.00 0.00 C ATOM 251 O ILE A 15 -6.425 3.326 -2.224 1.00 0.00 O ATOM 252 CB ILE A 15 -6.163 6.167 -1.191 1.00 0.00 C ATOM 253 CG1 ILE A 15 -5.791 7.387 -0.322 1.00 0.00 C ATOM 254 CG2 ILE A 15 -7.688 6.101 -1.387 1.00 0.00 C ATOM 255 CD1 ILE A 15 -6.443 7.453 1.066 1.00 0.00 C ATOM 0 H ILE A 15 -4.037 4.390 -1.969 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.610 4.945 0.471 1.00 0.00 H new ATOM 0 HB ILE A 15 -5.736 6.276 -2.188 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.709 7.399 -0.193 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -6.057 8.291 -0.869 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -8.044 7.047 -1.794 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -7.931 5.294 -2.078 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -8.170 5.914 -0.428 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -6.107 8.352 1.583 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -7.527 7.480 0.958 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -6.158 6.574 1.644 1.00 0.00 H new ATOM 267 N ASP A 16 -6.764 2.842 -0.056 1.00 0.00 N ATOM 268 CA ASP A 16 -7.685 1.727 -0.302 1.00 0.00 C ATOM 269 C ASP A 16 -9.108 2.254 -0.590 1.00 0.00 C ATOM 270 O ASP A 16 -9.779 2.785 0.302 1.00 0.00 O ATOM 271 CB ASP A 16 -7.698 0.732 0.866 1.00 0.00 C ATOM 272 CG ASP A 16 -8.559 -0.505 0.538 1.00 0.00 C ATOM 273 OD1 ASP A 16 -8.562 -0.962 -0.633 1.00 0.00 O ATOM 274 OD2 ASP A 16 -9.233 -1.030 1.457 1.00 0.00 O ATOM 0 H ASP A 16 -6.523 2.971 0.927 1.00 0.00 H new ATOM 0 HA ASP A 16 -7.327 1.191 -1.181 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -6.679 0.419 1.091 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -8.086 1.221 1.759 1.00 0.00 H new ATOM 279 N ILE A 17 -9.559 2.136 -1.838 1.00 0.00 N ATOM 280 CA ILE A 17 -10.819 2.672 -2.380 1.00 0.00 C ATOM 281 C ILE A 17 -11.649 1.573 -3.071 1.00 0.00 C ATOM 282 O ILE A 17 -11.104 0.594 -3.580 1.00 0.00 O ATOM 283 CB ILE A 17 -10.491 3.864 -3.315 1.00 0.00 C ATOM 284 CG1 ILE A 17 -11.727 4.488 -3.995 1.00 0.00 C ATOM 285 CG2 ILE A 17 -9.445 3.494 -4.391 1.00 0.00 C ATOM 286 CD1 ILE A 17 -12.787 5.034 -3.028 1.00 0.00 C ATOM 0 H ILE A 17 -9.025 1.633 -2.547 1.00 0.00 H new ATOM 0 HA ILE A 17 -11.447 3.038 -1.568 1.00 0.00 H new ATOM 0 HB ILE A 17 -10.071 4.618 -2.649 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -11.396 5.298 -4.645 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -12.191 3.736 -4.634 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -9.249 4.362 -5.021 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.520 3.180 -3.907 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -9.827 2.679 -5.005 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -13.617 5.452 -3.597 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -13.152 4.226 -2.394 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -12.345 5.812 -2.405 1.00 0.00 H new ATOM 298 N ASP A 18 -12.976 1.715 -3.098 1.00 0.00 N ATOM 299 CA ASP A 18 -13.886 0.785 -3.789 1.00 0.00 C ATOM 300 C ASP A 18 -14.017 1.126 -5.300 1.00 0.00 C ATOM 301 O ASP A 18 -14.428 2.243 -5.626 1.00 0.00 O ATOM 302 CB ASP A 18 -15.245 0.825 -3.075 1.00 0.00 C ATOM 303 CG ASP A 18 -16.199 -0.292 -3.537 1.00 0.00 C ATOM 304 OD1 ASP A 18 -16.315 -0.529 -4.760 1.00 0.00 O ATOM 305 OD2 ASP A 18 -16.825 -0.943 -2.666 1.00 0.00 O ATOM 0 H ASP A 18 -13.459 2.486 -2.637 1.00 0.00 H new ATOM 0 HA ASP A 18 -13.481 -0.226 -3.745 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -15.087 0.739 -2.000 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -15.714 1.793 -3.252 1.00 0.00 H new ATOM 310 N PRO A 19 -13.688 0.216 -6.244 1.00 0.00 N ATOM 311 CA PRO A 19 -13.725 0.500 -7.687 1.00 0.00 C ATOM 312 C PRO A 19 -15.132 0.651 -8.291 1.00 0.00 C ATOM 313 O PRO A 19 -15.263 1.209 -9.384 1.00 0.00 O ATOM 314 CB PRO A 19 -13.015 -0.682 -8.351 1.00 0.00 C ATOM 315 CG PRO A 19 -13.228 -1.834 -7.372 1.00 0.00 C ATOM 316 CD PRO A 19 -13.220 -1.144 -6.010 1.00 0.00 C ATOM 0 HA PRO A 19 -13.251 1.466 -7.859 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -13.440 -0.905 -9.329 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -11.955 -0.477 -8.503 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -14.171 -2.349 -7.556 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -12.437 -2.580 -7.450 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -13.869 -1.664 -5.306 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -12.219 -1.143 -5.579 1.00 0.00 H new ATOM 324 N GLU A 20 -16.185 0.161 -7.626 1.00 0.00 N ATOM 325 CA GLU A 20 -17.577 0.371 -8.040 1.00 0.00 C ATOM 326 C GLU A 20 -18.070 1.790 -7.702 1.00 0.00 C ATOM 327 O GLU A 20 -19.024 2.280 -8.310 1.00 0.00 O ATOM 328 CB GLU A 20 -18.488 -0.661 -7.355 1.00 0.00 C ATOM 329 CG GLU A 20 -18.158 -2.129 -7.678 1.00 0.00 C ATOM 330 CD GLU A 20 -18.257 -2.453 -9.182 1.00 0.00 C ATOM 331 OE1 GLU A 20 -19.222 -2.003 -9.847 1.00 0.00 O ATOM 332 OE2 GLU A 20 -17.377 -3.174 -9.711 1.00 0.00 O ATOM 0 H GLU A 20 -16.094 -0.398 -6.777 1.00 0.00 H new ATOM 0 HA GLU A 20 -17.618 0.248 -9.122 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -18.427 -0.519 -6.276 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -19.520 -0.463 -7.645 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -17.150 -2.354 -7.329 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -18.838 -2.778 -7.127 1.00 0.00 H new ATOM 339 N GLU A 21 -17.412 2.466 -6.754 1.00 0.00 N ATOM 340 CA GLU A 21 -17.606 3.887 -6.456 1.00 0.00 C ATOM 341 C GLU A 21 -16.844 4.791 -7.449 1.00 0.00 C ATOM 342 O GLU A 21 -16.168 4.335 -8.380 1.00 0.00 O ATOM 343 CB GLU A 21 -17.197 4.196 -5.004 1.00 0.00 C ATOM 344 CG GLU A 21 -17.952 3.399 -3.932 1.00 0.00 C ATOM 345 CD GLU A 21 -19.473 3.664 -3.944 1.00 0.00 C ATOM 346 OE1 GLU A 21 -19.895 4.846 -3.966 1.00 0.00 O ATOM 347 OE2 GLU A 21 -20.266 2.690 -3.914 1.00 0.00 O ATOM 0 H GLU A 21 -16.711 2.027 -6.157 1.00 0.00 H new ATOM 0 HA GLU A 21 -18.668 4.106 -6.571 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -16.130 4.002 -4.894 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -17.349 5.259 -4.818 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -17.773 2.335 -4.085 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -17.552 3.652 -2.950 1.00 0.00 H new ATOM 354 N THR A 22 -16.981 6.106 -7.273 1.00 0.00 N ATOM 355 CA THR A 22 -16.519 7.116 -8.230 1.00 0.00 C ATOM 356 C THR A 22 -15.203 7.787 -7.852 1.00 0.00 C ATOM 357 O THR A 22 -14.632 7.567 -6.782 1.00 0.00 O ATOM 358 CB THR A 22 -17.611 8.166 -8.476 1.00 0.00 C ATOM 359 OG1 THR A 22 -17.804 8.917 -7.297 1.00 0.00 O ATOM 360 CG2 THR A 22 -18.952 7.559 -8.885 1.00 0.00 C ATOM 0 H THR A 22 -17.424 6.508 -6.447 1.00 0.00 H new ATOM 0 HA THR A 22 -16.315 6.573 -9.153 1.00 0.00 H new ATOM 0 HB THR A 22 -17.267 8.789 -9.302 1.00 0.00 H new ATOM 0 HG1 THR A 22 -18.499 9.591 -7.448 1.00 0.00 H new ATOM 0 HG21 THR A 22 -19.679 8.356 -9.043 1.00 0.00 H new ATOM 0 HG22 THR A 22 -18.828 6.992 -9.808 1.00 0.00 H new ATOM 0 HG23 THR A 22 -19.307 6.896 -8.096 1.00 0.00 H new ATOM 368 N VAL A 23 -14.715 8.653 -8.738 1.00 0.00 N ATOM 369 CA VAL A 23 -13.570 9.537 -8.470 1.00 0.00 C ATOM 370 C VAL A 23 -13.848 10.451 -7.267 1.00 0.00 C ATOM 371 O VAL A 23 -12.943 10.703 -6.472 1.00 0.00 O ATOM 372 CB VAL A 23 -13.257 10.364 -9.728 1.00 0.00 C ATOM 373 CG1 VAL A 23 -12.123 11.378 -9.528 1.00 0.00 C ATOM 374 CG2 VAL A 23 -12.876 9.457 -10.903 1.00 0.00 C ATOM 0 H VAL A 23 -15.104 8.766 -9.674 1.00 0.00 H new ATOM 0 HA VAL A 23 -12.702 8.926 -8.221 1.00 0.00 H new ATOM 0 HB VAL A 23 -14.175 10.913 -9.941 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -11.957 11.925 -10.456 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -12.396 12.077 -8.738 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -11.210 10.852 -9.248 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -12.660 10.068 -11.779 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -11.993 8.873 -10.641 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -13.703 8.783 -11.126 1.00 0.00 H new ATOM 384 N LYS A 24 -15.098 10.890 -7.057 1.00 0.00 N ATOM 385 CA LYS A 24 -15.510 11.607 -5.838 1.00 0.00 C ATOM 386 C LYS A 24 -15.340 10.762 -4.565 1.00 0.00 C ATOM 387 O LYS A 24 -15.007 11.315 -3.522 1.00 0.00 O ATOM 388 CB LYS A 24 -16.948 12.132 -5.996 1.00 0.00 C ATOM 389 CG LYS A 24 -17.298 13.173 -4.920 1.00 0.00 C ATOM 390 CD LYS A 24 -18.713 13.731 -5.117 1.00 0.00 C ATOM 391 CE LYS A 24 -19.016 14.773 -4.032 1.00 0.00 C ATOM 392 NZ LYS A 24 -20.400 15.302 -4.149 1.00 0.00 N ATOM 0 H LYS A 24 -15.854 10.758 -7.729 1.00 0.00 H new ATOM 0 HA LYS A 24 -14.843 12.460 -5.713 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -17.066 12.577 -6.984 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -17.648 11.298 -5.936 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -17.219 12.718 -3.933 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -16.576 13.989 -4.953 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -18.801 14.184 -6.104 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -19.442 12.922 -5.071 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -18.880 14.324 -3.048 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -18.304 15.595 -4.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -20.568 16.003 -3.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -20.522 15.753 -5.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -21.080 14.521 -4.051 1.00 0.00 H new ATOM 406 N ALA A 25 -15.492 9.437 -4.630 1.00 0.00 N ATOM 407 CA ALA A 25 -15.171 8.543 -3.512 1.00 0.00 C ATOM 408 C ALA A 25 -13.651 8.364 -3.303 1.00 0.00 C ATOM 409 O ALA A 25 -13.188 8.343 -2.164 1.00 0.00 O ATOM 410 CB ALA A 25 -15.884 7.205 -3.707 1.00 0.00 C ATOM 0 H ALA A 25 -15.841 8.953 -5.457 1.00 0.00 H new ATOM 0 HA ALA A 25 -15.534 9.007 -2.595 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -15.645 6.541 -2.876 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -16.961 7.369 -3.743 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -15.555 6.750 -4.641 1.00 0.00 H new ATOM 416 N LEU A 26 -12.844 8.293 -4.371 1.00 0.00 N ATOM 417 CA LEU A 26 -11.379 8.350 -4.262 1.00 0.00 C ATOM 418 C LEU A 26 -10.962 9.622 -3.499 1.00 0.00 C ATOM 419 O LEU A 26 -10.296 9.556 -2.464 1.00 0.00 O ATOM 420 CB LEU A 26 -10.766 8.219 -5.673 1.00 0.00 C ATOM 421 CG LEU A 26 -9.240 8.382 -5.773 1.00 0.00 C ATOM 422 CD1 LEU A 26 -8.521 7.608 -4.678 1.00 0.00 C ATOM 423 CD2 LEU A 26 -8.755 7.864 -7.127 1.00 0.00 C ATOM 0 H LEU A 26 -13.185 8.195 -5.327 1.00 0.00 H new ATOM 0 HA LEU A 26 -10.989 7.517 -3.677 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -11.032 7.240 -6.072 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -11.232 8.963 -6.319 1.00 0.00 H new ATOM 0 HG LEU A 26 -9.015 9.443 -5.661 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -7.445 7.747 -4.781 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -8.843 7.974 -3.703 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -8.760 6.548 -4.765 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -7.673 7.981 -7.195 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -9.013 6.810 -7.227 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -9.232 8.432 -7.926 1.00 0.00 H new ATOM 435 N LYS A 27 -11.457 10.773 -3.957 1.00 0.00 N ATOM 436 CA LYS A 27 -11.366 12.062 -3.257 1.00 0.00 C ATOM 437 C LYS A 27 -11.840 11.998 -1.800 1.00 0.00 C ATOM 438 O LYS A 27 -11.144 12.536 -0.941 1.00 0.00 O ATOM 439 CB LYS A 27 -12.137 13.161 -3.998 1.00 0.00 C ATOM 440 CG LYS A 27 -11.507 13.617 -5.321 1.00 0.00 C ATOM 441 CD LYS A 27 -12.384 14.729 -5.907 1.00 0.00 C ATOM 442 CE LYS A 27 -11.651 15.540 -6.974 1.00 0.00 C ATOM 443 NZ LYS A 27 -12.401 16.785 -7.266 1.00 0.00 N ATOM 0 H LYS A 27 -11.946 10.840 -4.849 1.00 0.00 H new ATOM 0 HA LYS A 27 -10.304 12.308 -3.246 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -13.147 12.803 -4.198 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -12.230 14.025 -3.340 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.493 13.980 -5.155 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -11.436 12.781 -6.017 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -13.283 14.290 -6.340 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -12.708 15.394 -5.106 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -10.645 15.783 -6.631 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -11.544 14.948 -7.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -11.743 17.516 -7.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -13.114 16.597 -7.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -12.873 17.117 -6.401 1.00 0.00 H new ATOM 457 N GLU A 28 -12.980 11.364 -1.499 1.00 0.00 N ATOM 458 CA GLU A 28 -13.494 11.233 -0.122 1.00 0.00 C ATOM 459 C GLU A 28 -12.514 10.503 0.803 1.00 0.00 C ATOM 460 O GLU A 28 -12.279 10.960 1.919 1.00 0.00 O ATOM 461 CB GLU A 28 -14.930 10.652 -0.050 1.00 0.00 C ATOM 462 CG GLU A 28 -15.141 9.173 0.355 1.00 0.00 C ATOM 463 CD GLU A 28 -16.634 8.905 0.628 1.00 0.00 C ATOM 464 OE1 GLU A 28 -17.383 8.570 -0.322 1.00 0.00 O ATOM 465 OE2 GLU A 28 -17.072 9.023 1.799 1.00 0.00 O ATOM 0 H GLU A 28 -13.576 10.925 -2.201 1.00 0.00 H new ATOM 0 HA GLU A 28 -13.577 12.252 0.257 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -15.494 11.265 0.652 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -15.386 10.789 -1.031 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -14.785 8.516 -0.439 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -14.554 8.944 1.245 1.00 0.00 H new ATOM 472 N LYS A 29 -11.895 9.409 0.343 1.00 0.00 N ATOM 473 CA LYS A 29 -10.841 8.698 1.083 1.00 0.00 C ATOM 474 C LYS A 29 -9.573 9.533 1.261 1.00 0.00 C ATOM 475 O LYS A 29 -9.023 9.553 2.359 1.00 0.00 O ATOM 476 CB LYS A 29 -10.512 7.377 0.383 1.00 0.00 C ATOM 477 CG LYS A 29 -11.540 6.281 0.648 1.00 0.00 C ATOM 478 CD LYS A 29 -11.379 5.625 2.025 1.00 0.00 C ATOM 479 CE LYS A 29 -12.314 4.413 2.125 1.00 0.00 C ATOM 480 NZ LYS A 29 -12.139 3.690 3.412 1.00 0.00 N ATOM 0 H LYS A 29 -12.112 8.988 -0.560 1.00 0.00 H new ATOM 0 HA LYS A 29 -11.229 8.501 2.082 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -10.444 7.550 -0.691 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -9.532 7.033 0.713 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -12.542 6.704 0.568 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -11.454 5.517 -0.124 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -10.345 5.314 2.173 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -11.611 6.343 2.811 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -13.349 4.742 2.030 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -12.119 3.733 1.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -12.787 2.877 3.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -11.158 3.354 3.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -12.350 4.332 4.202 1.00 0.00 H new ATOM 494 N ILE A 30 -9.122 10.239 0.223 1.00 0.00 N ATOM 495 CA ILE A 30 -7.981 11.169 0.307 1.00 0.00 C ATOM 496 C ILE A 30 -8.258 12.264 1.349 1.00 0.00 C ATOM 497 O ILE A 30 -7.434 12.499 2.229 1.00 0.00 O ATOM 498 CB ILE A 30 -7.649 11.755 -1.084 1.00 0.00 C ATOM 499 CG1 ILE A 30 -7.134 10.647 -2.027 1.00 0.00 C ATOM 500 CG2 ILE A 30 -6.581 12.861 -0.973 1.00 0.00 C ATOM 501 CD1 ILE A 30 -7.195 11.006 -3.516 1.00 0.00 C ATOM 0 H ILE A 30 -9.536 10.186 -0.707 1.00 0.00 H new ATOM 0 HA ILE A 30 -7.100 10.620 0.639 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.565 12.183 -1.491 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -6.102 10.413 -1.764 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.719 9.743 -1.859 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -6.364 13.258 -1.965 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.952 13.663 -0.334 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.670 12.446 -0.541 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -6.815 10.173 -4.107 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -8.228 11.210 -3.799 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -6.586 11.891 -3.702 1.00 0.00 H new ATOM 513 N GLU A 31 -9.430 12.898 1.295 1.00 0.00 N ATOM 514 CA GLU A 31 -9.887 13.885 2.279 1.00 0.00 C ATOM 515 C GLU A 31 -9.959 13.279 3.697 1.00 0.00 C ATOM 516 O GLU A 31 -9.437 13.865 4.645 1.00 0.00 O ATOM 517 CB GLU A 31 -11.238 14.461 1.818 1.00 0.00 C ATOM 518 CG GLU A 31 -11.788 15.545 2.755 1.00 0.00 C ATOM 519 CD GLU A 31 -12.949 15.015 3.618 1.00 0.00 C ATOM 520 OE1 GLU A 31 -14.106 14.999 3.140 1.00 0.00 O ATOM 521 OE2 GLU A 31 -12.727 14.667 4.802 1.00 0.00 O ATOM 0 H GLU A 31 -10.106 12.737 0.548 1.00 0.00 H new ATOM 0 HA GLU A 31 -9.165 14.699 2.340 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -11.124 14.879 0.818 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -11.964 13.651 1.745 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -10.989 15.907 3.402 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -12.131 16.396 2.166 1.00 0.00 H new ATOM 528 N SER A 32 -10.541 12.082 3.837 1.00 0.00 N ATOM 529 CA SER A 32 -10.644 11.314 5.088 1.00 0.00 C ATOM 530 C SER A 32 -9.271 11.040 5.728 1.00 0.00 C ATOM 531 O SER A 32 -9.091 11.235 6.932 1.00 0.00 O ATOM 532 CB SER A 32 -11.404 9.998 4.829 1.00 0.00 C ATOM 533 OG SER A 32 -11.691 9.309 6.038 1.00 0.00 O ATOM 0 H SER A 32 -10.972 11.600 3.049 1.00 0.00 H new ATOM 0 HA SER A 32 -11.201 11.919 5.803 1.00 0.00 H new ATOM 0 HB2 SER A 32 -12.334 10.213 4.303 1.00 0.00 H new ATOM 0 HB3 SER A 32 -10.810 9.357 4.177 1.00 0.00 H new ATOM 0 HG SER A 32 -12.174 8.481 5.836 1.00 0.00 H new ATOM 539 N GLU A 33 -8.293 10.594 4.936 1.00 0.00 N ATOM 540 CA GLU A 33 -6.931 10.266 5.376 1.00 0.00 C ATOM 541 C GLU A 33 -6.087 11.519 5.677 1.00 0.00 C ATOM 542 O GLU A 33 -5.542 11.657 6.775 1.00 0.00 O ATOM 543 CB GLU A 33 -6.262 9.401 4.291 1.00 0.00 C ATOM 544 CG GLU A 33 -4.933 8.763 4.718 1.00 0.00 C ATOM 545 CD GLU A 33 -5.127 7.695 5.814 1.00 0.00 C ATOM 546 OE1 GLU A 33 -5.515 6.546 5.491 1.00 0.00 O ATOM 547 OE2 GLU A 33 -4.885 7.993 7.009 1.00 0.00 O ATOM 0 H GLU A 33 -8.430 10.446 3.936 1.00 0.00 H new ATOM 0 HA GLU A 33 -6.994 9.715 6.314 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.952 8.610 3.997 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -6.088 10.017 3.409 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.454 8.309 3.850 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -4.260 9.539 5.083 1.00 0.00 H new ATOM 554 N LYS A 34 -5.946 12.424 4.697 1.00 0.00 N ATOM 555 CA LYS A 34 -5.014 13.569 4.734 1.00 0.00 C ATOM 556 C LYS A 34 -5.582 14.817 5.430 1.00 0.00 C ATOM 557 O LYS A 34 -4.819 15.697 5.831 1.00 0.00 O ATOM 558 CB LYS A 34 -4.559 13.915 3.301 1.00 0.00 C ATOM 559 CG LYS A 34 -4.010 12.734 2.472 1.00 0.00 C ATOM 560 CD LYS A 34 -2.869 11.948 3.141 1.00 0.00 C ATOM 561 CE LYS A 34 -1.598 12.774 3.394 1.00 0.00 C ATOM 562 NZ LYS A 34 -0.888 13.116 2.133 1.00 0.00 N ATOM 0 H LYS A 34 -6.489 12.382 3.834 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.163 13.255 5.338 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -5.403 14.350 2.766 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -3.789 14.684 3.359 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -4.829 12.047 2.259 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -3.656 13.115 1.514 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -3.225 11.550 4.091 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -2.615 11.094 2.513 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -1.862 13.691 3.920 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -0.927 12.214 4.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 0.048 12.662 2.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -1.442 12.778 1.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -0.773 14.148 2.068 1.00 0.00 H new ATOM 576 N GLY A 35 -6.902 14.880 5.593 1.00 0.00 N ATOM 577 CA GLY A 35 -7.669 15.974 6.200 1.00 0.00 C ATOM 578 C GLY A 35 -8.156 17.017 5.183 1.00 0.00 C ATOM 579 O GLY A 35 -7.476 17.312 4.194 1.00 0.00 O ATOM 0 H GLY A 35 -7.507 14.119 5.285 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -8.530 15.557 6.722 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -7.051 16.469 6.949 1.00 0.00 H new ATOM 583 N LYS A 36 -9.309 17.643 5.466 1.00 0.00 N ATOM 584 CA LYS A 36 -9.918 18.712 4.642 1.00 0.00 C ATOM 585 C LYS A 36 -9.048 19.973 4.550 1.00 0.00 C ATOM 586 O LYS A 36 -9.136 20.712 3.574 1.00 0.00 O ATOM 587 CB LYS A 36 -11.301 19.108 5.194 1.00 0.00 C ATOM 588 CG LYS A 36 -12.332 17.973 5.242 1.00 0.00 C ATOM 589 CD LYS A 36 -13.597 18.402 6.003 1.00 0.00 C ATOM 590 CE LYS A 36 -14.730 17.366 5.932 1.00 0.00 C ATOM 591 NZ LYS A 36 -14.367 16.067 6.557 1.00 0.00 N ATOM 0 H LYS A 36 -9.861 17.418 6.293 1.00 0.00 H new ATOM 0 HA LYS A 36 -10.012 18.294 3.640 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -11.173 19.504 6.201 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.701 19.916 4.582 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -12.598 17.677 4.227 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -11.893 17.100 5.724 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -13.341 18.580 7.048 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -13.954 19.349 5.597 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -15.614 17.767 6.428 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -14.998 17.199 4.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -15.208 15.456 6.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -13.631 15.602 5.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -14.008 16.233 7.519 1.00 0.00 H new ATOM 605 N ASP A 37 -8.191 20.214 5.544 1.00 0.00 N ATOM 606 CA ASP A 37 -7.215 21.314 5.556 1.00 0.00 C ATOM 607 C ASP A 37 -6.133 21.168 4.470 1.00 0.00 C ATOM 608 O ASP A 37 -5.599 22.170 3.988 1.00 0.00 O ATOM 609 CB ASP A 37 -6.525 21.373 6.925 1.00 0.00 C ATOM 610 CG ASP A 37 -7.501 21.738 8.054 1.00 0.00 C ATOM 611 OD1 ASP A 37 -7.780 22.946 8.248 1.00 0.00 O ATOM 612 OD2 ASP A 37 -7.990 20.818 8.754 1.00 0.00 O ATOM 0 H ASP A 37 -8.153 19.638 6.385 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.771 22.229 5.352 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -6.068 20.407 7.141 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -5.720 22.107 6.892 1.00 0.00 H new ATOM 617 N ALA A 38 -5.814 19.928 4.083 1.00 0.00 N ATOM 618 CA ALA A 38 -4.774 19.597 3.112 1.00 0.00 C ATOM 619 C ALA A 38 -5.356 19.267 1.724 1.00 0.00 C ATOM 620 O ALA A 38 -4.884 19.797 0.717 1.00 0.00 O ATOM 621 CB ALA A 38 -3.945 18.436 3.676 1.00 0.00 C ATOM 0 H ALA A 38 -6.289 19.104 4.451 1.00 0.00 H new ATOM 0 HA ALA A 38 -4.133 20.465 2.959 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -3.161 18.171 2.967 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -3.493 18.737 4.621 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -4.591 17.574 3.841 1.00 0.00 H new ATOM 627 N PHE A 39 -6.381 18.406 1.668 1.00 0.00 N ATOM 628 CA PHE A 39 -6.988 17.887 0.434 1.00 0.00 C ATOM 629 C PHE A 39 -8.533 17.847 0.525 1.00 0.00 C ATOM 630 O PHE A 39 -9.119 16.765 0.618 1.00 0.00 O ATOM 631 CB PHE A 39 -6.382 16.504 0.120 1.00 0.00 C ATOM 632 CG PHE A 39 -4.922 16.519 -0.306 1.00 0.00 C ATOM 633 CD1 PHE A 39 -4.575 16.657 -1.665 1.00 0.00 C ATOM 634 CD2 PHE A 39 -3.902 16.393 0.655 1.00 0.00 C ATOM 635 CE1 PHE A 39 -3.224 16.672 -2.056 1.00 0.00 C ATOM 636 CE2 PHE A 39 -2.550 16.417 0.268 1.00 0.00 C ATOM 637 CZ PHE A 39 -2.210 16.553 -1.089 1.00 0.00 C ATOM 0 H PHE A 39 -6.826 18.039 2.509 1.00 0.00 H new ATOM 0 HA PHE A 39 -6.760 18.563 -0.390 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -6.480 15.873 1.003 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -6.970 16.038 -0.671 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -5.351 16.752 -2.410 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -4.159 16.277 1.698 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -2.965 16.775 -3.099 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -1.773 16.331 1.013 1.00 0.00 H new ATOM 0 HZ PHE A 39 -1.172 16.566 -1.388 1.00 0.00 H new ATOM 647 N PRO A 40 -9.233 18.997 0.464 1.00 0.00 N ATOM 648 CA PRO A 40 -10.697 19.030 0.414 1.00 0.00 C ATOM 649 C PRO A 40 -11.206 18.548 -0.955 1.00 0.00 C ATOM 650 O PRO A 40 -10.567 18.791 -1.978 1.00 0.00 O ATOM 651 CB PRO A 40 -11.065 20.494 0.672 1.00 0.00 C ATOM 652 CG PRO A 40 -9.877 21.270 0.101 1.00 0.00 C ATOM 653 CD PRO A 40 -8.684 20.340 0.329 1.00 0.00 C ATOM 0 HA PRO A 40 -11.154 18.367 1.149 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -11.997 20.766 0.177 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -11.199 20.692 1.735 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -10.015 21.490 -0.958 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -9.742 22.225 0.610 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -7.985 20.392 -0.506 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -8.133 20.627 1.225 1.00 0.00 H new ATOM 661 N VAL A 41 -12.373 17.897 -1.003 1.00 0.00 N ATOM 662 CA VAL A 41 -12.947 17.272 -2.221 1.00 0.00 C ATOM 663 C VAL A 41 -13.051 18.251 -3.398 1.00 0.00 C ATOM 664 O VAL A 41 -12.653 17.928 -4.521 1.00 0.00 O ATOM 665 CB VAL A 41 -14.333 16.666 -1.910 1.00 0.00 C ATOM 666 CG1 VAL A 41 -15.038 16.094 -3.148 1.00 0.00 C ATOM 667 CG2 VAL A 41 -14.201 15.545 -0.873 1.00 0.00 C ATOM 0 H VAL A 41 -12.966 17.782 -0.181 1.00 0.00 H new ATOM 0 HA VAL A 41 -12.261 16.481 -2.523 1.00 0.00 H new ATOM 0 HB VAL A 41 -14.939 17.488 -1.527 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -16.006 15.684 -2.859 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -15.184 16.886 -3.882 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -14.425 15.305 -3.583 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -15.185 15.126 -0.663 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -13.550 14.763 -1.263 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -13.774 15.948 0.046 1.00 0.00 H new ATOM 677 N ALA A 42 -13.578 19.450 -3.145 1.00 0.00 N ATOM 678 CA ALA A 42 -13.741 20.490 -4.164 1.00 0.00 C ATOM 679 C ALA A 42 -12.397 21.042 -4.699 1.00 0.00 C ATOM 680 O ALA A 42 -12.281 21.370 -5.884 1.00 0.00 O ATOM 681 CB ALA A 42 -14.601 21.617 -3.577 1.00 0.00 C ATOM 0 H ALA A 42 -13.906 19.729 -2.221 1.00 0.00 H new ATOM 0 HA ALA A 42 -14.234 20.041 -5.026 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -14.733 22.401 -4.323 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -15.575 21.220 -3.292 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -14.107 22.032 -2.698 1.00 0.00 H new ATOM 687 N GLY A 43 -11.370 21.117 -3.842 1.00 0.00 N ATOM 688 CA GLY A 43 -10.020 21.580 -4.193 1.00 0.00 C ATOM 689 C GLY A 43 -9.184 20.513 -4.905 1.00 0.00 C ATOM 690 O GLY A 43 -8.441 20.825 -5.836 1.00 0.00 O ATOM 0 H GLY A 43 -11.457 20.851 -2.861 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -10.099 22.458 -4.834 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -9.503 21.893 -3.286 1.00 0.00 H new ATOM 694 N GLN A 44 -9.321 19.244 -4.516 1.00 0.00 N ATOM 695 CA GLN A 44 -8.661 18.107 -5.164 1.00 0.00 C ATOM 696 C GLN A 44 -8.947 18.018 -6.675 1.00 0.00 C ATOM 697 O GLN A 44 -10.020 18.400 -7.158 1.00 0.00 O ATOM 698 CB GLN A 44 -9.121 16.794 -4.510 1.00 0.00 C ATOM 699 CG GLN A 44 -8.427 16.462 -3.184 1.00 0.00 C ATOM 700 CD GLN A 44 -8.875 15.087 -2.698 1.00 0.00 C ATOM 701 OE1 GLN A 44 -8.635 14.081 -3.344 1.00 0.00 O ATOM 702 NE2 GLN A 44 -9.550 14.974 -1.576 1.00 0.00 N ATOM 0 H GLN A 44 -9.906 18.972 -3.726 1.00 0.00 H new ATOM 0 HA GLN A 44 -7.590 18.263 -5.034 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -10.196 16.846 -4.339 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -8.949 15.976 -5.209 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -7.345 16.477 -3.315 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -8.668 17.218 -2.437 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -9.761 15.804 -1.022 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -9.863 14.056 -1.260 1.00 0.00 H new ATOM 711 N LYS A 45 -7.995 17.440 -7.409 1.00 0.00 N ATOM 712 CA LYS A 45 -8.075 17.002 -8.812 1.00 0.00 C ATOM 713 C LYS A 45 -7.318 15.679 -8.922 1.00 0.00 C ATOM 714 O LYS A 45 -6.369 15.428 -8.174 1.00 0.00 O ATOM 715 CB LYS A 45 -7.487 18.013 -9.815 1.00 0.00 C ATOM 716 CG LYS A 45 -8.000 19.450 -9.703 1.00 0.00 C ATOM 717 CD LYS A 45 -9.455 19.608 -10.165 1.00 0.00 C ATOM 718 CE LYS A 45 -10.028 20.983 -9.800 1.00 0.00 C ATOM 719 NZ LYS A 45 -10.170 21.150 -8.329 1.00 0.00 N ATOM 0 H LYS A 45 -7.075 17.249 -7.012 1.00 0.00 H new ATOM 0 HA LYS A 45 -9.129 16.902 -9.072 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -6.404 18.025 -9.694 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -7.691 17.654 -10.824 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -7.916 19.780 -8.667 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -7.363 20.104 -10.298 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -9.510 19.467 -11.245 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -10.066 18.828 -9.711 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -9.377 21.764 -10.193 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -11.001 21.109 -10.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -11.084 21.599 -8.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -10.127 20.219 -7.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -9.399 21.749 -7.972 1.00 0.00 H new ATOM 733 N LEU A 46 -7.738 14.858 -9.873 1.00 0.00 N ATOM 734 CA LEU A 46 -7.327 13.467 -10.041 1.00 0.00 C ATOM 735 C LEU A 46 -6.972 13.199 -11.506 1.00 0.00 C ATOM 736 O LEU A 46 -7.810 13.412 -12.378 1.00 0.00 O ATOM 737 CB LEU A 46 -8.485 12.560 -9.550 1.00 0.00 C ATOM 738 CG LEU A 46 -8.172 11.687 -8.327 1.00 0.00 C ATOM 739 CD1 LEU A 46 -7.010 10.749 -8.627 1.00 0.00 C ATOM 740 CD2 LEU A 46 -7.855 12.505 -7.076 1.00 0.00 C ATOM 0 H LEU A 46 -8.407 15.155 -10.584 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.435 13.251 -9.453 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -9.342 13.191 -9.314 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -8.786 11.909 -10.371 1.00 0.00 H new ATOM 0 HG LEU A 46 -9.075 11.112 -8.121 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -6.801 10.137 -7.750 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.271 10.104 -9.466 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -6.126 11.334 -8.880 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.642 11.832 -6.245 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.986 13.135 -7.264 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -8.710 13.132 -6.825 1.00 0.00 H new ATOM 752 N ILE A 47 -5.740 12.771 -11.789 1.00 0.00 N ATOM 753 CA ILE A 47 -5.176 12.670 -13.145 1.00 0.00 C ATOM 754 C ILE A 47 -4.537 11.291 -13.370 1.00 0.00 C ATOM 755 O ILE A 47 -3.639 10.887 -12.625 1.00 0.00 O ATOM 756 CB ILE A 47 -4.194 13.844 -13.381 1.00 0.00 C ATOM 757 CG1 ILE A 47 -4.910 15.219 -13.330 1.00 0.00 C ATOM 758 CG2 ILE A 47 -3.479 13.770 -14.734 1.00 0.00 C ATOM 759 CD1 ILE A 47 -4.637 15.967 -12.031 1.00 0.00 C ATOM 0 H ILE A 47 -5.086 12.476 -11.064 1.00 0.00 H new ATOM 0 HA ILE A 47 -5.971 12.754 -13.886 1.00 0.00 H new ATOM 0 HB ILE A 47 -3.467 13.751 -12.574 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -4.582 15.828 -14.173 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -5.984 15.071 -13.442 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -2.806 14.621 -14.837 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.906 12.845 -14.792 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -4.216 13.791 -15.537 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -5.160 16.923 -12.045 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -4.989 15.373 -11.188 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.566 16.141 -11.930 1.00 0.00 H new ATOM 771 N TYR A 48 -4.996 10.577 -14.404 1.00 0.00 N ATOM 772 CA TYR A 48 -4.422 9.307 -14.872 1.00 0.00 C ATOM 773 C TYR A 48 -4.227 9.302 -16.389 1.00 0.00 C ATOM 774 O TYR A 48 -5.003 9.919 -17.118 1.00 0.00 O ATOM 775 CB TYR A 48 -5.301 8.124 -14.445 1.00 0.00 C ATOM 776 CG TYR A 48 -4.669 6.744 -14.550 1.00 0.00 C ATOM 777 CD1 TYR A 48 -3.417 6.477 -13.957 1.00 0.00 C ATOM 778 CD2 TYR A 48 -5.364 5.706 -15.205 1.00 0.00 C ATOM 779 CE1 TYR A 48 -2.865 5.182 -14.017 1.00 0.00 C ATOM 780 CE2 TYR A 48 -4.820 4.408 -15.258 1.00 0.00 C ATOM 781 CZ TYR A 48 -3.569 4.142 -14.663 1.00 0.00 C ATOM 782 OH TYR A 48 -3.051 2.884 -14.707 1.00 0.00 O ATOM 0 H TYR A 48 -5.801 10.874 -14.956 1.00 0.00 H new ATOM 0 HA TYR A 48 -3.441 9.202 -14.408 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -5.609 8.282 -13.411 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -6.206 8.133 -15.052 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -2.880 7.268 -13.455 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -6.318 5.908 -15.668 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -1.903 4.985 -13.569 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -5.361 3.616 -15.754 1.00 0.00 H new ATOM 0 HH TYR A 48 -3.667 2.293 -15.189 1.00 0.00 H new ATOM 792 N ALA A 49 -3.194 8.605 -16.876 1.00 0.00 N ATOM 793 CA ALA A 49 -2.787 8.586 -18.285 1.00 0.00 C ATOM 794 C ALA A 49 -2.620 9.996 -18.922 1.00 0.00 C ATOM 795 O ALA A 49 -2.750 10.164 -20.137 1.00 0.00 O ATOM 796 CB ALA A 49 -3.772 7.666 -19.018 1.00 0.00 C ATOM 0 H ALA A 49 -2.602 8.023 -16.284 1.00 0.00 H new ATOM 0 HA ALA A 49 -1.776 8.189 -18.377 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -3.509 7.620 -20.075 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -3.724 6.666 -18.588 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -4.783 8.058 -18.913 1.00 0.00 H new ATOM 802 N GLY A 50 -2.359 11.022 -18.100 1.00 0.00 N ATOM 803 CA GLY A 50 -2.300 12.439 -18.482 1.00 0.00 C ATOM 804 C GLY A 50 -3.655 13.112 -18.759 1.00 0.00 C ATOM 805 O GLY A 50 -3.683 14.171 -19.386 1.00 0.00 O ATOM 0 H GLY A 50 -2.175 10.880 -17.107 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -1.797 12.990 -17.687 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -1.681 12.530 -19.374 1.00 0.00 H new ATOM 809 N LYS A 51 -4.773 12.532 -18.299 1.00 0.00 N ATOM 810 CA LYS A 51 -6.146 13.062 -18.416 1.00 0.00 C ATOM 811 C LYS A 51 -6.830 13.139 -17.046 1.00 0.00 C ATOM 812 O LYS A 51 -6.711 12.223 -16.230 1.00 0.00 O ATOM 813 CB LYS A 51 -6.971 12.175 -19.366 1.00 0.00 C ATOM 814 CG LYS A 51 -6.440 12.182 -20.811 1.00 0.00 C ATOM 815 CD LYS A 51 -7.313 11.340 -21.756 1.00 0.00 C ATOM 816 CE LYS A 51 -8.719 11.917 -21.992 1.00 0.00 C ATOM 817 NZ LYS A 51 -8.697 13.141 -22.838 1.00 0.00 N ATOM 0 H LYS A 51 -4.747 11.637 -17.811 1.00 0.00 H new ATOM 0 HA LYS A 51 -6.087 14.072 -18.822 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.971 11.152 -18.990 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -8.006 12.515 -19.364 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -6.399 13.208 -21.176 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.420 11.798 -20.823 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -6.805 11.246 -22.716 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -7.409 10.335 -21.346 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -9.343 11.161 -22.468 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -9.178 12.151 -21.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -9.668 13.491 -22.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -8.124 13.874 -22.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -8.284 12.915 -23.765 1.00 0.00 H new ATOM 831 N ILE A 52 -7.550 14.230 -16.780 1.00 0.00 N ATOM 832 CA ILE A 52 -8.300 14.421 -15.531 1.00 0.00 C ATOM 833 C ILE A 52 -9.525 13.494 -15.484 1.00 0.00 C ATOM 834 O ILE A 52 -10.343 13.471 -16.408 1.00 0.00 O ATOM 835 CB ILE A 52 -8.695 15.899 -15.341 1.00 0.00 C ATOM 836 CG1 ILE A 52 -7.470 16.791 -15.657 1.00 0.00 C ATOM 837 CG2 ILE A 52 -9.242 16.113 -13.920 1.00 0.00 C ATOM 838 CD1 ILE A 52 -7.355 18.097 -14.890 1.00 0.00 C ATOM 0 H ILE A 52 -7.632 15.013 -17.428 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.651 14.151 -14.698 1.00 0.00 H new ATOM 0 HB ILE A 52 -9.493 16.179 -16.029 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -6.568 16.208 -15.471 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -7.485 17.023 -16.722 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -9.520 17.159 -13.791 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -10.119 15.483 -13.769 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -8.476 15.848 -13.191 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -6.455 18.626 -15.205 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -8.229 18.716 -15.092 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -7.298 17.888 -13.822 1.00 0.00 H new ATOM 850 N LEU A 53 -9.638 12.721 -14.406 1.00 0.00 N ATOM 851 CA LEU A 53 -10.738 11.802 -14.125 1.00 0.00 C ATOM 852 C LEU A 53 -12.018 12.571 -13.744 1.00 0.00 C ATOM 853 O LEU A 53 -11.979 13.493 -12.925 1.00 0.00 O ATOM 854 CB LEU A 53 -10.330 10.850 -12.987 1.00 0.00 C ATOM 855 CG LEU A 53 -8.975 10.138 -13.122 1.00 0.00 C ATOM 856 CD1 LEU A 53 -8.793 9.152 -11.968 1.00 0.00 C ATOM 857 CD2 LEU A 53 -8.908 9.351 -14.421 1.00 0.00 C ATOM 0 H LEU A 53 -8.932 12.719 -13.670 1.00 0.00 H new ATOM 0 HA LEU A 53 -10.951 11.225 -15.025 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -10.322 11.418 -12.057 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -11.104 10.089 -12.889 1.00 0.00 H new ATOM 0 HG LEU A 53 -8.194 10.898 -13.109 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -7.831 8.649 -12.067 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -8.825 9.691 -11.021 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -9.593 8.412 -11.992 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -7.940 8.855 -14.496 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -9.701 8.603 -14.435 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -9.034 10.030 -15.265 1.00 0.00 H new ATOM 869 N ASN A 54 -13.158 12.194 -14.324 1.00 0.00 N ATOM 870 CA ASN A 54 -14.454 12.829 -14.065 1.00 0.00 C ATOM 871 C ASN A 54 -15.019 12.444 -12.684 1.00 0.00 C ATOM 872 O ASN A 54 -15.215 11.260 -12.414 1.00 0.00 O ATOM 873 CB ASN A 54 -15.440 12.422 -15.169 1.00 0.00 C ATOM 874 CG ASN A 54 -16.742 13.203 -15.076 1.00 0.00 C ATOM 875 OD1 ASN A 54 -16.761 14.420 -14.957 1.00 0.00 O ATOM 876 ND2 ASN A 54 -17.871 12.537 -15.106 1.00 0.00 N ATOM 0 H ASN A 54 -13.210 11.429 -14.996 1.00 0.00 H new ATOM 0 HA ASN A 54 -14.311 13.910 -14.065 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -14.984 12.590 -16.145 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -15.650 11.355 -15.095 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -18.758 13.034 -15.030 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -17.862 11.522 -15.205 1.00 0.00 H new ATOM 883 N ASP A 55 -15.332 13.431 -11.838 1.00 0.00 N ATOM 884 CA ASP A 55 -15.806 13.262 -10.451 1.00 0.00 C ATOM 885 C ASP A 55 -16.936 12.223 -10.297 1.00 0.00 C ATOM 886 O ASP A 55 -16.886 11.373 -9.406 1.00 0.00 O ATOM 887 CB ASP A 55 -16.271 14.618 -9.895 1.00 0.00 C ATOM 888 CG ASP A 55 -15.138 15.653 -9.824 1.00 0.00 C ATOM 889 OD1 ASP A 55 -14.837 16.292 -10.860 1.00 0.00 O ATOM 890 OD2 ASP A 55 -14.556 15.839 -8.730 1.00 0.00 O ATOM 0 H ASP A 55 -15.261 14.412 -12.108 1.00 0.00 H new ATOM 0 HA ASP A 55 -14.959 12.878 -9.883 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -17.073 15.007 -10.522 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -16.688 14.473 -8.898 1.00 0.00 H new ATOM 895 N ASP A 56 -17.949 12.284 -11.168 1.00 0.00 N ATOM 896 CA ASP A 56 -19.151 11.436 -11.138 1.00 0.00 C ATOM 897 C ASP A 56 -18.991 10.072 -11.850 1.00 0.00 C ATOM 898 O ASP A 56 -19.835 9.188 -11.688 1.00 0.00 O ATOM 899 CB ASP A 56 -20.303 12.242 -11.762 1.00 0.00 C ATOM 900 CG ASP A 56 -21.679 11.576 -11.574 1.00 0.00 C ATOM 901 OD1 ASP A 56 -22.127 11.426 -10.411 1.00 0.00 O ATOM 902 OD2 ASP A 56 -22.342 11.250 -12.589 1.00 0.00 O ATOM 0 H ASP A 56 -17.957 12.948 -11.942 1.00 0.00 H new ATOM 0 HA ASP A 56 -19.352 11.179 -10.098 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -20.324 13.237 -11.318 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -20.112 12.372 -12.827 1.00 0.00 H new ATOM 907 N THR A 57 -17.922 9.866 -12.628 1.00 0.00 N ATOM 908 CA THR A 57 -17.647 8.602 -13.337 1.00 0.00 C ATOM 909 C THR A 57 -16.958 7.595 -12.405 1.00 0.00 C ATOM 910 O THR A 57 -16.133 7.964 -11.562 1.00 0.00 O ATOM 911 CB THR A 57 -16.827 8.875 -14.613 1.00 0.00 C ATOM 912 OG1 THR A 57 -17.588 9.703 -15.471 1.00 0.00 O ATOM 913 CG2 THR A 57 -16.503 7.635 -15.433 1.00 0.00 C ATOM 0 H THR A 57 -17.211 10.580 -12.788 1.00 0.00 H new ATOM 0 HA THR A 57 -18.591 8.153 -13.646 1.00 0.00 H new ATOM 0 HB THR A 57 -15.893 9.318 -14.267 1.00 0.00 H new ATOM 0 HG1 THR A 57 -17.077 9.886 -16.287 1.00 0.00 H new ATOM 0 HG21 THR A 57 -15.924 7.921 -16.312 1.00 0.00 H new ATOM 0 HG22 THR A 57 -15.923 6.939 -14.827 1.00 0.00 H new ATOM 0 HG23 THR A 57 -17.429 7.155 -15.749 1.00 0.00 H new ATOM 921 N ALA A 58 -17.314 6.310 -12.518 1.00 0.00 N ATOM 922 CA ALA A 58 -16.767 5.255 -11.664 1.00 0.00 C ATOM 923 C ALA A 58 -15.313 4.878 -12.011 1.00 0.00 C ATOM 924 O ALA A 58 -14.897 4.959 -13.167 1.00 0.00 O ATOM 925 CB ALA A 58 -17.708 4.053 -11.672 1.00 0.00 C ATOM 0 H ALA A 58 -17.990 5.975 -13.205 1.00 0.00 H new ATOM 0 HA ALA A 58 -16.708 5.644 -10.647 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -17.300 3.267 -11.036 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -18.686 4.354 -11.296 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -17.811 3.678 -12.690 1.00 0.00 H new ATOM 931 N LEU A 59 -14.535 4.423 -11.023 1.00 0.00 N ATOM 932 CA LEU A 59 -13.102 4.116 -11.199 1.00 0.00 C ATOM 933 C LEU A 59 -12.852 2.964 -12.187 1.00 0.00 C ATOM 934 O LEU A 59 -11.896 3.005 -12.966 1.00 0.00 O ATOM 935 CB LEU A 59 -12.471 3.800 -9.834 1.00 0.00 C ATOM 936 CG LEU A 59 -12.460 4.994 -8.866 1.00 0.00 C ATOM 937 CD1 LEU A 59 -12.082 4.532 -7.466 1.00 0.00 C ATOM 938 CD2 LEU A 59 -11.429 6.039 -9.281 1.00 0.00 C ATOM 0 H LEU A 59 -14.876 4.255 -10.077 1.00 0.00 H new ATOM 0 HA LEU A 59 -12.632 4.999 -11.631 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -13.016 2.976 -9.374 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -11.447 3.459 -9.987 1.00 0.00 H new ATOM 0 HG LEU A 59 -13.461 5.425 -8.886 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -12.078 5.387 -6.790 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -12.807 3.797 -7.117 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -11.090 4.081 -7.487 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -11.448 6.869 -8.575 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -10.436 5.589 -9.285 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -11.665 6.406 -10.280 1.00 0.00 H new ATOM 950 N LYS A 60 -13.751 1.973 -12.209 1.00 0.00 N ATOM 951 CA LYS A 60 -13.776 0.863 -13.178 1.00 0.00 C ATOM 952 C LYS A 60 -13.808 1.300 -14.652 1.00 0.00 C ATOM 953 O LYS A 60 -13.316 0.568 -15.509 1.00 0.00 O ATOM 954 CB LYS A 60 -14.940 -0.085 -12.839 1.00 0.00 C ATOM 955 CG LYS A 60 -16.327 0.581 -12.903 1.00 0.00 C ATOM 956 CD LYS A 60 -17.429 -0.417 -12.536 1.00 0.00 C ATOM 957 CE LYS A 60 -18.798 0.272 -12.535 1.00 0.00 C ATOM 958 NZ LYS A 60 -19.879 -0.688 -12.196 1.00 0.00 N ATOM 0 H LYS A 60 -14.510 1.917 -11.530 1.00 0.00 H new ATOM 0 HA LYS A 60 -12.827 0.337 -13.077 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -14.921 -0.929 -13.529 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -14.787 -0.488 -11.838 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -16.359 1.431 -12.221 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -16.502 0.970 -13.906 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -17.431 -1.243 -13.247 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -17.229 -0.843 -11.553 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -18.796 1.091 -11.816 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -18.989 0.709 -13.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -20.780 -0.177 -12.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -19.961 -1.399 -12.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -19.654 -1.161 -11.297 1.00 0.00 H new ATOM 972 N GLU A 61 -14.308 2.501 -14.959 1.00 0.00 N ATOM 973 CA GLU A 61 -14.341 3.068 -16.316 1.00 0.00 C ATOM 974 C GLU A 61 -12.949 3.493 -16.828 1.00 0.00 C ATOM 975 O GLU A 61 -12.738 3.597 -18.039 1.00 0.00 O ATOM 976 CB GLU A 61 -15.266 4.293 -16.342 1.00 0.00 C ATOM 977 CG GLU A 61 -16.702 4.026 -15.872 1.00 0.00 C ATOM 978 CD GLU A 61 -17.473 3.118 -16.850 1.00 0.00 C ATOM 979 OE1 GLU A 61 -18.003 3.627 -17.868 1.00 0.00 O ATOM 980 OE2 GLU A 61 -17.562 1.890 -16.607 1.00 0.00 O ATOM 0 H GLU A 61 -14.711 3.122 -14.257 1.00 0.00 H new ATOM 0 HA GLU A 61 -14.710 2.280 -16.973 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -14.832 5.071 -15.714 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -15.298 4.685 -17.359 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.680 3.560 -14.887 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -17.230 4.974 -15.765 1.00 0.00 H new ATOM 987 N TYR A 62 -11.993 3.711 -15.916 1.00 0.00 N ATOM 988 CA TYR A 62 -10.612 4.129 -16.195 1.00 0.00 C ATOM 989 C TYR A 62 -9.593 2.991 -16.013 1.00 0.00 C ATOM 990 O TYR A 62 -8.415 3.154 -16.342 1.00 0.00 O ATOM 991 CB TYR A 62 -10.268 5.322 -15.291 1.00 0.00 C ATOM 992 CG TYR A 62 -11.079 6.568 -15.588 1.00 0.00 C ATOM 993 CD1 TYR A 62 -10.785 7.324 -16.740 1.00 0.00 C ATOM 994 CD2 TYR A 62 -12.103 6.985 -14.713 1.00 0.00 C ATOM 995 CE1 TYR A 62 -11.507 8.500 -17.019 1.00 0.00 C ATOM 996 CE2 TYR A 62 -12.824 8.165 -14.985 1.00 0.00 C ATOM 997 CZ TYR A 62 -12.530 8.921 -16.141 1.00 0.00 C ATOM 998 OH TYR A 62 -13.228 10.059 -16.402 1.00 0.00 O ATOM 0 H TYR A 62 -12.169 3.596 -14.918 1.00 0.00 H new ATOM 0 HA TYR A 62 -10.550 4.418 -17.244 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -10.427 5.036 -14.251 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -9.209 5.555 -15.400 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -10.003 7.000 -17.411 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -12.335 6.401 -13.835 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -11.279 9.079 -17.902 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -13.601 8.491 -14.310 1.00 0.00 H new ATOM 0 HH TYR A 62 -14.134 9.978 -16.038 1.00 0.00 H new ATOM 1008 N LYS A 63 -10.049 1.832 -15.511 1.00 0.00 N ATOM 1009 CA LYS A 63 -9.298 0.593 -15.260 1.00 0.00 C ATOM 1010 C LYS A 63 -7.919 0.813 -14.602 1.00 0.00 C ATOM 1011 O LYS A 63 -6.919 0.201 -14.981 1.00 0.00 O ATOM 1012 CB LYS A 63 -9.294 -0.251 -16.557 1.00 0.00 C ATOM 1013 CG LYS A 63 -9.675 -1.720 -16.312 1.00 0.00 C ATOM 1014 CD LYS A 63 -8.634 -2.561 -15.556 1.00 0.00 C ATOM 1015 CE LYS A 63 -7.352 -2.736 -16.381 1.00 0.00 C ATOM 1016 NZ LYS A 63 -6.370 -3.609 -15.694 1.00 0.00 N ATOM 0 H LYS A 63 -11.030 1.730 -15.250 1.00 0.00 H new ATOM 0 HA LYS A 63 -9.807 0.012 -14.491 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -9.991 0.186 -17.272 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -8.304 -0.208 -17.010 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -10.611 -1.745 -15.753 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -9.866 -2.192 -17.276 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -8.395 -2.081 -14.607 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -9.054 -3.539 -15.322 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -7.600 -3.163 -17.353 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -6.903 -1.760 -16.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -5.511 -3.689 -16.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -6.126 -3.198 -14.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -6.783 -4.553 -15.554 1.00 0.00 H new ATOM 1030 N ILE A 64 -7.882 1.698 -13.601 1.00 0.00 N ATOM 1031 CA ILE A 64 -6.714 1.989 -12.751 1.00 0.00 C ATOM 1032 C ILE A 64 -6.259 0.692 -12.056 1.00 0.00 C ATOM 1033 O ILE A 64 -7.091 -0.112 -11.628 1.00 0.00 O ATOM 1034 CB ILE A 64 -7.047 3.106 -11.725 1.00 0.00 C ATOM 1035 CG1 ILE A 64 -7.689 4.344 -12.397 1.00 0.00 C ATOM 1036 CG2 ILE A 64 -5.791 3.546 -10.944 1.00 0.00 C ATOM 1037 CD1 ILE A 64 -8.185 5.388 -11.393 1.00 0.00 C ATOM 0 H ILE A 64 -8.697 2.256 -13.347 1.00 0.00 H new ATOM 0 HA ILE A 64 -5.894 2.358 -13.367 1.00 0.00 H new ATOM 0 HB ILE A 64 -7.770 2.676 -11.032 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -6.960 4.807 -13.062 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -8.525 4.020 -13.017 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -6.059 4.329 -10.235 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -5.380 2.692 -10.404 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -5.045 3.928 -11.641 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -8.624 6.229 -11.930 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -8.937 4.940 -10.744 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -7.348 5.739 -10.790 1.00 0.00 H new ATOM 1049 N ASP A 65 -4.947 0.483 -11.939 1.00 0.00 N ATOM 1050 CA ASP A 65 -4.347 -0.727 -11.356 1.00 0.00 C ATOM 1051 C ASP A 65 -3.566 -0.418 -10.073 1.00 0.00 C ATOM 1052 O ASP A 65 -2.835 0.571 -9.999 1.00 0.00 O ATOM 1053 CB ASP A 65 -3.410 -1.397 -12.374 1.00 0.00 C ATOM 1054 CG ASP A 65 -4.151 -2.016 -13.567 1.00 0.00 C ATOM 1055 OD1 ASP A 65 -5.116 -2.789 -13.357 1.00 0.00 O ATOM 1056 OD2 ASP A 65 -3.737 -1.785 -14.728 1.00 0.00 O ATOM 0 H ASP A 65 -4.254 1.162 -12.252 1.00 0.00 H new ATOM 0 HA ASP A 65 -5.164 -1.403 -11.101 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -2.697 -0.659 -12.742 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -2.834 -2.173 -11.871 1.00 0.00 H new ATOM 1061 N GLU A 66 -3.648 -1.314 -9.083 1.00 0.00 N ATOM 1062 CA GLU A 66 -2.886 -1.227 -7.823 1.00 0.00 C ATOM 1063 C GLU A 66 -1.358 -1.271 -8.051 1.00 0.00 C ATOM 1064 O GLU A 66 -0.580 -0.750 -7.249 1.00 0.00 O ATOM 1065 CB GLU A 66 -3.274 -2.388 -6.891 1.00 0.00 C ATOM 1066 CG GLU A 66 -4.764 -2.417 -6.531 1.00 0.00 C ATOM 1067 CD GLU A 66 -5.076 -3.562 -5.549 1.00 0.00 C ATOM 1068 OE1 GLU A 66 -5.040 -4.749 -5.955 1.00 0.00 O ATOM 1069 OE2 GLU A 66 -5.387 -3.273 -4.369 1.00 0.00 O ATOM 0 H GLU A 66 -4.253 -2.134 -9.131 1.00 0.00 H new ATOM 0 HA GLU A 66 -3.137 -0.267 -7.372 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.006 -3.331 -7.368 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -2.689 -2.317 -5.974 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -5.052 -1.464 -6.087 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.358 -2.539 -7.437 1.00 0.00 H new ATOM 1076 N LYS A 67 -0.927 -1.884 -9.165 1.00 0.00 N ATOM 1077 CA LYS A 67 0.462 -2.005 -9.636 1.00 0.00 C ATOM 1078 C LYS A 67 1.108 -0.674 -10.042 1.00 0.00 C ATOM 1079 O LYS A 67 2.337 -0.584 -10.086 1.00 0.00 O ATOM 1080 CB LYS A 67 0.482 -2.943 -10.857 1.00 0.00 C ATOM 1081 CG LYS A 67 -0.214 -4.303 -10.651 1.00 0.00 C ATOM 1082 CD LYS A 67 0.353 -5.162 -9.510 1.00 0.00 C ATOM 1083 CE LYS A 67 1.832 -5.502 -9.731 1.00 0.00 C ATOM 1084 NZ LYS A 67 2.353 -6.400 -8.666 1.00 0.00 N ATOM 0 H LYS A 67 -1.582 -2.338 -9.802 1.00 0.00 H new ATOM 0 HA LYS A 67 1.041 -2.392 -8.798 1.00 0.00 H new ATOM 0 HB2 LYS A 67 0.007 -2.433 -11.695 1.00 0.00 H new ATOM 0 HB3 LYS A 67 1.519 -3.123 -11.140 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -1.272 -4.126 -10.460 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.148 -4.871 -11.579 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.240 -4.631 -8.565 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -0.223 -6.084 -9.429 1.00 0.00 H new ATOM 0 HE2 LYS A 67 1.955 -5.980 -10.703 1.00 0.00 H new ATOM 0 HE3 LYS A 67 2.418 -4.583 -9.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 3.356 -6.609 -8.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 2.259 -5.933 -7.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 1.810 -7.287 -8.663 1.00 0.00 H new ATOM 1098 N ASN A 68 0.298 0.338 -10.359 1.00 0.00 N ATOM 1099 CA ASN A 68 0.715 1.643 -10.880 1.00 0.00 C ATOM 1100 C ASN A 68 0.307 2.783 -9.923 1.00 0.00 C ATOM 1101 O ASN A 68 -0.355 2.550 -8.908 1.00 0.00 O ATOM 1102 CB ASN A 68 0.122 1.812 -12.295 1.00 0.00 C ATOM 1103 CG ASN A 68 0.682 0.803 -13.289 1.00 0.00 C ATOM 1104 OD1 ASN A 68 1.884 0.673 -13.472 1.00 0.00 O ATOM 1105 ND2 ASN A 68 -0.160 0.062 -13.975 1.00 0.00 N ATOM 0 H ASN A 68 -0.714 0.267 -10.255 1.00 0.00 H new ATOM 0 HA ASN A 68 1.802 1.692 -10.948 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -0.962 1.705 -12.246 1.00 0.00 H new ATOM 0 HB3 ASN A 68 0.327 2.821 -12.653 1.00 0.00 H new ATOM 0 HD21 ASN A 68 0.191 -0.614 -14.653 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -1.164 0.163 -13.829 1.00 0.00 H new ATOM 1112 N PHE A 69 0.686 4.025 -10.245 1.00 0.00 N ATOM 1113 CA PHE A 69 0.297 5.223 -9.491 1.00 0.00 C ATOM 1114 C PHE A 69 -0.571 6.184 -10.316 1.00 0.00 C ATOM 1115 O PHE A 69 -0.454 6.278 -11.541 1.00 0.00 O ATOM 1116 CB PHE A 69 1.535 5.921 -8.901 1.00 0.00 C ATOM 1117 CG PHE A 69 2.464 6.597 -9.895 1.00 0.00 C ATOM 1118 CD1 PHE A 69 3.528 5.878 -10.474 1.00 0.00 C ATOM 1119 CD2 PHE A 69 2.291 7.959 -10.215 1.00 0.00 C ATOM 1120 CE1 PHE A 69 4.408 6.515 -11.369 1.00 0.00 C ATOM 1121 CE2 PHE A 69 3.166 8.594 -11.115 1.00 0.00 C ATOM 1122 CZ PHE A 69 4.227 7.872 -11.690 1.00 0.00 C ATOM 0 H PHE A 69 1.280 4.229 -11.048 1.00 0.00 H new ATOM 0 HA PHE A 69 -0.330 4.896 -8.661 1.00 0.00 H new ATOM 0 HB2 PHE A 69 1.197 6.670 -8.185 1.00 0.00 H new ATOM 0 HB3 PHE A 69 2.110 5.183 -8.342 1.00 0.00 H new ATOM 0 HD1 PHE A 69 3.669 4.835 -10.231 1.00 0.00 H new ATOM 0 HD2 PHE A 69 1.483 8.518 -9.767 1.00 0.00 H new ATOM 0 HE1 PHE A 69 5.223 5.961 -11.810 1.00 0.00 H new ATOM 0 HE2 PHE A 69 3.023 9.635 -11.364 1.00 0.00 H new ATOM 0 HZ PHE A 69 4.902 8.359 -12.378 1.00 0.00 H new ATOM 1132 N VAL A 70 -1.427 6.922 -9.612 1.00 0.00 N ATOM 1133 CA VAL A 70 -2.224 8.058 -10.094 1.00 0.00 C ATOM 1134 C VAL A 70 -1.567 9.360 -9.613 1.00 0.00 C ATOM 1135 O VAL A 70 -0.785 9.351 -8.656 1.00 0.00 O ATOM 1136 CB VAL A 70 -3.688 7.893 -9.604 1.00 0.00 C ATOM 1137 CG1 VAL A 70 -4.141 8.912 -8.559 1.00 0.00 C ATOM 1138 CG2 VAL A 70 -4.685 7.949 -10.763 1.00 0.00 C ATOM 0 H VAL A 70 -1.596 6.733 -8.624 1.00 0.00 H new ATOM 0 HA VAL A 70 -2.255 8.094 -11.183 1.00 0.00 H new ATOM 0 HB VAL A 70 -3.682 6.911 -9.132 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -5.176 8.713 -8.281 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -3.507 8.834 -7.676 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -4.063 9.917 -8.973 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.698 7.830 -10.378 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -4.600 8.910 -11.270 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -4.468 7.147 -11.468 1.00 0.00 H new ATOM 1148 N VAL A 71 -1.921 10.495 -10.215 1.00 0.00 N ATOM 1149 CA VAL A 71 -1.479 11.822 -9.746 1.00 0.00 C ATOM 1150 C VAL A 71 -2.640 12.565 -9.091 1.00 0.00 C ATOM 1151 O VAL A 71 -3.694 12.763 -9.700 1.00 0.00 O ATOM 1152 CB VAL A 71 -0.817 12.643 -10.864 1.00 0.00 C ATOM 1153 CG1 VAL A 71 -0.283 13.976 -10.323 1.00 0.00 C ATOM 1154 CG2 VAL A 71 0.381 11.888 -11.453 1.00 0.00 C ATOM 0 H VAL A 71 -2.520 10.528 -11.040 1.00 0.00 H new ATOM 0 HA VAL A 71 -0.707 11.673 -8.991 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.579 12.815 -11.624 1.00 0.00 H new ATOM 0 HG11 VAL A 71 0.181 14.538 -11.134 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -1.106 14.555 -9.905 1.00 0.00 H new ATOM 0 HG13 VAL A 71 0.457 13.783 -9.546 1.00 0.00 H new ATOM 0 HG21 VAL A 71 0.836 12.486 -12.243 1.00 0.00 H new ATOM 0 HG22 VAL A 71 1.116 11.703 -10.669 1.00 0.00 H new ATOM 0 HG23 VAL A 71 0.044 10.937 -11.866 1.00 0.00 H new ATOM 1164 N VAL A 72 -2.439 12.971 -7.836 1.00 0.00 N ATOM 1165 CA VAL A 72 -3.346 13.835 -7.066 1.00 0.00 C ATOM 1166 C VAL A 72 -2.757 15.247 -6.972 1.00 0.00 C ATOM 1167 O VAL A 72 -1.555 15.427 -6.760 1.00 0.00 O ATOM 1168 CB VAL A 72 -3.664 13.246 -5.675 1.00 0.00 C ATOM 1169 CG1 VAL A 72 -2.414 12.989 -4.821 1.00 0.00 C ATOM 1170 CG2 VAL A 72 -4.645 14.136 -4.892 1.00 0.00 C ATOM 0 H VAL A 72 -1.611 12.699 -7.306 1.00 0.00 H new ATOM 0 HA VAL A 72 -4.299 13.892 -7.592 1.00 0.00 H new ATOM 0 HB VAL A 72 -4.130 12.281 -5.875 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -2.711 12.575 -3.857 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -1.762 12.282 -5.334 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -1.881 13.927 -4.665 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -4.845 13.689 -3.918 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -4.208 15.125 -4.754 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -5.578 14.226 -5.448 1.00 0.00 H new ATOM 1180 N MET A 73 -3.606 16.262 -7.103 1.00 0.00 N ATOM 1181 CA MET A 73 -3.270 17.664 -6.831 1.00 0.00 C ATOM 1182 C MET A 73 -4.416 18.375 -6.123 1.00 0.00 C ATOM 1183 O MET A 73 -5.526 17.850 -6.053 1.00 0.00 O ATOM 1184 CB MET A 73 -2.835 18.371 -8.118 1.00 0.00 C ATOM 1185 CG MET A 73 -3.927 18.537 -9.170 1.00 0.00 C ATOM 1186 SD MET A 73 -3.401 19.378 -10.688 1.00 0.00 S ATOM 1187 CE MET A 73 -3.083 21.053 -10.062 1.00 0.00 C ATOM 0 H MET A 73 -4.571 16.134 -7.408 1.00 0.00 H new ATOM 0 HA MET A 73 -2.421 17.697 -6.148 1.00 0.00 H new ATOM 0 HB2 MET A 73 -2.450 19.357 -7.859 1.00 0.00 H new ATOM 0 HB3 MET A 73 -2.010 17.812 -8.559 1.00 0.00 H new ATOM 0 HG2 MET A 73 -4.312 17.551 -9.432 1.00 0.00 H new ATOM 0 HG3 MET A 73 -4.754 19.095 -8.730 1.00 0.00 H new ATOM 0 HE1 MET A 73 -2.634 21.657 -10.850 1.00 0.00 H new ATOM 0 HE2 MET A 73 -4.022 21.508 -9.747 1.00 0.00 H new ATOM 0 HE3 MET A 73 -2.402 21.001 -9.212 1.00 0.00 H new ATOM 1197 N VAL A 74 -4.148 19.571 -5.600 1.00 0.00 N ATOM 1198 CA VAL A 74 -5.125 20.405 -4.898 1.00 0.00 C ATOM 1199 C VAL A 74 -5.033 21.858 -5.377 1.00 0.00 C ATOM 1200 O VAL A 74 -4.091 22.583 -5.052 1.00 0.00 O ATOM 1201 CB VAL A 74 -5.023 20.218 -3.368 1.00 0.00 C ATOM 1202 CG1 VAL A 74 -3.628 20.448 -2.769 1.00 0.00 C ATOM 1203 CG2 VAL A 74 -6.046 21.083 -2.625 1.00 0.00 C ATOM 0 H VAL A 74 -3.223 19.998 -5.654 1.00 0.00 H new ATOM 0 HA VAL A 74 -6.134 20.078 -5.150 1.00 0.00 H new ATOM 0 HB VAL A 74 -5.244 19.161 -3.222 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -3.665 20.292 -1.691 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.921 19.747 -3.213 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.306 21.468 -2.977 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -5.945 20.925 -1.551 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -5.870 22.134 -2.856 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -7.053 20.807 -2.939 1.00 0.00 H new ATOM 1872 N GLU B 283 -2.329 27.701 -12.305 1.00 0.00 N ATOM 1873 CA GLU B 283 -3.220 26.536 -12.176 1.00 0.00 C ATOM 1874 C GLU B 283 -3.150 25.603 -13.402 1.00 0.00 C ATOM 1875 O GLU B 283 -3.051 24.385 -13.253 1.00 0.00 O ATOM 1876 CB GLU B 283 -4.655 27.033 -11.935 1.00 0.00 C ATOM 1877 CG GLU B 283 -5.640 25.895 -11.646 1.00 0.00 C ATOM 1878 CD GLU B 283 -7.043 26.450 -11.337 1.00 0.00 C ATOM 1879 OE1 GLU B 283 -7.299 26.850 -10.176 1.00 0.00 O ATOM 1880 OE2 GLU B 283 -7.899 26.497 -12.255 1.00 0.00 O ATOM 0 HA GLU B 283 -2.889 25.939 -11.326 1.00 0.00 H new ATOM 0 HB2 GLU B 283 -4.657 27.730 -11.097 1.00 0.00 H new ATOM 0 HB3 GLU B 283 -4.994 27.587 -12.811 1.00 0.00 H new ATOM 0 HG2 GLU B 283 -5.690 25.225 -12.504 1.00 0.00 H new ATOM 0 HG3 GLU B 283 -5.283 25.305 -10.802 1.00 0.00 H new ATOM 1887 N GLU B 284 -3.159 26.162 -14.616 1.00 0.00 N ATOM 1888 CA GLU B 284 -3.059 25.392 -15.865 1.00 0.00 C ATOM 1889 C GLU B 284 -1.687 24.714 -16.026 1.00 0.00 C ATOM 1890 O GLU B 284 -1.613 23.558 -16.445 1.00 0.00 O ATOM 1891 CB GLU B 284 -3.336 26.290 -17.080 1.00 0.00 C ATOM 1892 CG GLU B 284 -4.749 26.889 -17.076 1.00 0.00 C ATOM 1893 CD GLU B 284 -5.008 27.687 -18.369 1.00 0.00 C ATOM 1894 OE1 GLU B 284 -4.698 28.903 -18.414 1.00 0.00 O ATOM 1895 OE2 GLU B 284 -5.532 27.107 -19.353 1.00 0.00 O ATOM 0 H GLU B 284 -3.236 27.168 -14.763 1.00 0.00 H new ATOM 0 HA GLU B 284 -3.814 24.608 -15.811 1.00 0.00 H new ATOM 0 HB2 GLU B 284 -2.605 27.098 -17.101 1.00 0.00 H new ATOM 0 HB3 GLU B 284 -3.196 25.710 -17.992 1.00 0.00 H new ATOM 0 HG2 GLU B 284 -5.487 26.092 -16.981 1.00 0.00 H new ATOM 0 HG3 GLU B 284 -4.870 27.540 -16.211 1.00 0.00 H new ATOM 1902 N GLU B 285 -0.595 25.399 -15.671 1.00 0.00 N ATOM 1903 CA GLU B 285 0.760 24.829 -15.694 1.00 0.00 C ATOM 1904 C GLU B 285 0.948 23.729 -14.635 1.00 0.00 C ATOM 1905 O GLU B 285 1.537 22.689 -14.928 1.00 0.00 O ATOM 1906 CB GLU B 285 1.804 25.937 -15.505 1.00 0.00 C ATOM 1907 CG GLU B 285 1.868 26.887 -16.708 1.00 0.00 C ATOM 1908 CD GLU B 285 2.912 27.998 -16.487 1.00 0.00 C ATOM 1909 OE1 GLU B 285 2.794 28.759 -15.497 1.00 0.00 O ATOM 1910 OE2 GLU B 285 3.855 28.120 -17.308 1.00 0.00 O ATOM 0 H GLU B 285 -0.624 26.369 -15.358 1.00 0.00 H new ATOM 0 HA GLU B 285 0.900 24.363 -16.669 1.00 0.00 H new ATOM 0 HB2 GLU B 285 1.567 26.507 -14.607 1.00 0.00 H new ATOM 0 HB3 GLU B 285 2.784 25.487 -15.348 1.00 0.00 H new ATOM 0 HG2 GLU B 285 2.118 26.323 -17.607 1.00 0.00 H new ATOM 0 HG3 GLU B 285 0.888 27.334 -16.874 1.00 0.00 H new ATOM 1917 N GLN B 286 0.401 23.910 -13.428 1.00 0.00 N ATOM 1918 CA GLN B 286 0.342 22.885 -12.378 1.00 0.00 C ATOM 1919 C GLN B 286 -0.431 21.639 -12.842 1.00 0.00 C ATOM 1920 O GLN B 286 0.045 20.518 -12.658 1.00 0.00 O ATOM 1921 CB GLN B 286 -0.299 23.470 -11.111 1.00 0.00 C ATOM 1922 CG GLN B 286 0.631 24.428 -10.355 1.00 0.00 C ATOM 1923 CD GLN B 286 -0.097 25.132 -9.209 1.00 0.00 C ATOM 1924 OE1 GLN B 286 -0.763 24.519 -8.384 1.00 0.00 O ATOM 1925 NE2 GLN B 286 -0.003 26.438 -9.090 1.00 0.00 N ATOM 0 H GLN B 286 -0.023 24.794 -13.147 1.00 0.00 H new ATOM 0 HA GLN B 286 1.363 22.573 -12.156 1.00 0.00 H new ATOM 0 HB2 GLN B 286 -1.212 23.999 -11.384 1.00 0.00 H new ATOM 0 HB3 GLN B 286 -0.589 22.655 -10.448 1.00 0.00 H new ATOM 0 HG2 GLN B 286 1.482 23.874 -9.960 1.00 0.00 H new ATOM 0 HG3 GLN B 286 1.028 25.172 -11.046 1.00 0.00 H new ATOM 0 HE21 GLN B 286 0.545 26.973 -9.763 1.00 0.00 H new ATOM 0 HE22 GLN B 286 -0.478 26.916 -8.324 1.00 0.00 H new ATOM 1934 N ILE B 287 -1.593 21.821 -13.483 1.00 0.00 N ATOM 1935 CA ILE B 287 -2.347 20.741 -14.136 1.00 0.00 C ATOM 1936 C ILE B 287 -1.488 20.032 -15.196 1.00 0.00 C ATOM 1937 O ILE B 287 -1.352 18.812 -15.146 1.00 0.00 O ATOM 1938 CB ILE B 287 -3.702 21.266 -14.677 1.00 0.00 C ATOM 1939 CG1 ILE B 287 -4.688 21.441 -13.494 1.00 0.00 C ATOM 1940 CG2 ILE B 287 -4.291 20.312 -15.732 1.00 0.00 C ATOM 1941 CD1 ILE B 287 -5.974 22.214 -13.820 1.00 0.00 C ATOM 0 H ILE B 287 -2.042 22.733 -13.564 1.00 0.00 H new ATOM 0 HA ILE B 287 -2.593 19.979 -13.396 1.00 0.00 H new ATOM 0 HB ILE B 287 -3.537 22.228 -15.163 1.00 0.00 H new ATOM 0 HG12 ILE B 287 -4.962 20.454 -13.122 1.00 0.00 H new ATOM 0 HG13 ILE B 287 -4.170 21.955 -12.684 1.00 0.00 H new ATOM 0 HG21 ILE B 287 -5.241 20.708 -16.091 1.00 0.00 H new ATOM 0 HG22 ILE B 287 -3.597 20.220 -16.567 1.00 0.00 H new ATOM 0 HG23 ILE B 287 -4.453 19.331 -15.285 1.00 0.00 H new ATOM 0 HD11 ILE B 287 -6.595 22.281 -12.927 1.00 0.00 H new ATOM 0 HD12 ILE B 287 -5.719 23.218 -14.160 1.00 0.00 H new ATOM 0 HD13 ILE B 287 -6.523 21.693 -14.605 1.00 0.00 H new ATOM 1953 N ALA B 288 -0.867 20.754 -16.133 1.00 0.00 N ATOM 1954 CA ALA B 288 -0.021 20.144 -17.164 1.00 0.00 C ATOM 1955 C ALA B 288 1.210 19.402 -16.592 1.00 0.00 C ATOM 1956 O ALA B 288 1.592 18.350 -17.108 1.00 0.00 O ATOM 1957 CB ALA B 288 0.387 21.229 -18.164 1.00 0.00 C ATOM 0 H ALA B 288 -0.935 21.770 -16.199 1.00 0.00 H new ATOM 0 HA ALA B 288 -0.603 19.371 -17.667 1.00 0.00 H new ATOM 0 HB1 ALA B 288 1.017 20.792 -18.938 1.00 0.00 H new ATOM 0 HB2 ALA B 288 -0.505 21.657 -18.621 1.00 0.00 H new ATOM 0 HB3 ALA B 288 0.940 22.012 -17.646 1.00 0.00 H new ATOM 1963 N TYR B 289 1.802 19.889 -15.497 1.00 0.00 N ATOM 1964 CA TYR B 289 2.840 19.180 -14.741 1.00 0.00 C ATOM 1965 C TYR B 289 2.314 17.864 -14.136 1.00 0.00 C ATOM 1966 O TYR B 289 2.965 16.823 -14.258 1.00 0.00 O ATOM 1967 CB TYR B 289 3.414 20.117 -13.669 1.00 0.00 C ATOM 1968 CG TYR B 289 4.518 19.507 -12.826 1.00 0.00 C ATOM 1969 CD1 TYR B 289 5.736 19.135 -13.427 1.00 0.00 C ATOM 1970 CD2 TYR B 289 4.335 19.324 -11.442 1.00 0.00 C ATOM 1971 CE1 TYR B 289 6.774 18.592 -12.646 1.00 0.00 C ATOM 1972 CE2 TYR B 289 5.370 18.780 -10.655 1.00 0.00 C ATOM 1973 CZ TYR B 289 6.595 18.416 -11.257 1.00 0.00 C ATOM 1974 OH TYR B 289 7.609 17.904 -10.506 1.00 0.00 O ATOM 0 H TYR B 289 1.570 20.801 -15.105 1.00 0.00 H new ATOM 0 HA TYR B 289 3.641 18.896 -15.424 1.00 0.00 H new ATOM 0 HB2 TYR B 289 3.799 21.013 -14.156 1.00 0.00 H new ATOM 0 HB3 TYR B 289 2.605 20.434 -13.011 1.00 0.00 H new ATOM 0 HD1 TYR B 289 5.874 19.267 -14.490 1.00 0.00 H new ATOM 0 HD2 TYR B 289 3.398 19.601 -10.982 1.00 0.00 H new ATOM 0 HE1 TYR B 289 7.708 18.310 -13.110 1.00 0.00 H new ATOM 0 HE2 TYR B 289 5.227 18.642 -9.594 1.00 0.00 H new ATOM 0 HH TYR B 289 7.326 17.847 -9.569 1.00 0.00 H new ATOM 1984 N ALA B 290 1.106 17.871 -13.561 1.00 0.00 N ATOM 1985 CA ALA B 290 0.408 16.664 -13.118 1.00 0.00 C ATOM 1986 C ALA B 290 0.194 15.656 -14.267 1.00 0.00 C ATOM 1987 O ALA B 290 0.488 14.468 -14.117 1.00 0.00 O ATOM 1988 CB ALA B 290 -0.923 17.060 -12.464 1.00 0.00 C ATOM 0 H ALA B 290 0.581 18.728 -13.389 1.00 0.00 H new ATOM 0 HA ALA B 290 1.033 16.156 -12.384 1.00 0.00 H new ATOM 0 HB1 ALA B 290 -1.446 16.163 -12.132 1.00 0.00 H new ATOM 0 HB2 ALA B 290 -0.730 17.705 -11.607 1.00 0.00 H new ATOM 0 HB3 ALA B 290 -1.540 17.593 -13.188 1.00 0.00 H new ATOM 1994 N MET B 291 -0.268 16.131 -15.433 1.00 0.00 N ATOM 1995 CA MET B 291 -0.413 15.337 -16.656 1.00 0.00 C ATOM 1996 C MET B 291 0.914 14.707 -17.096 1.00 0.00 C ATOM 1997 O MET B 291 0.940 13.520 -17.411 1.00 0.00 O ATOM 1998 CB MET B 291 -1.012 16.173 -17.802 1.00 0.00 C ATOM 1999 CG MET B 291 -2.429 16.678 -17.513 1.00 0.00 C ATOM 2000 SD MET B 291 -3.156 17.653 -18.857 1.00 0.00 S ATOM 2001 CE MET B 291 -4.887 17.649 -18.315 1.00 0.00 C ATOM 0 H MET B 291 -0.557 17.102 -15.552 1.00 0.00 H new ATOM 0 HA MET B 291 -1.104 14.528 -16.420 1.00 0.00 H new ATOM 0 HB2 MET B 291 -0.363 17.027 -17.996 1.00 0.00 H new ATOM 0 HB3 MET B 291 -1.027 15.571 -18.711 1.00 0.00 H new ATOM 0 HG2 MET B 291 -3.073 15.823 -17.309 1.00 0.00 H new ATOM 0 HG3 MET B 291 -2.409 17.285 -16.608 1.00 0.00 H new ATOM 0 HE1 MET B 291 -5.471 18.309 -18.956 1.00 0.00 H new ATOM 0 HE2 MET B 291 -5.286 16.636 -18.378 1.00 0.00 H new ATOM 0 HE3 MET B 291 -4.946 17.999 -17.284 1.00 0.00 H new ATOM 2011 N GLN B 292 2.024 15.452 -17.077 1.00 0.00 N ATOM 2012 CA GLN B 292 3.352 14.919 -17.399 1.00 0.00 C ATOM 2013 C GLN B 292 3.798 13.817 -16.432 1.00 0.00 C ATOM 2014 O GLN B 292 4.276 12.775 -16.880 1.00 0.00 O ATOM 2015 CB GLN B 292 4.390 16.050 -17.442 1.00 0.00 C ATOM 2016 CG GLN B 292 5.803 15.563 -17.818 1.00 0.00 C ATOM 2017 CD GLN B 292 5.876 14.877 -19.186 1.00 0.00 C ATOM 2018 OE1 GLN B 292 6.087 15.501 -20.217 1.00 0.00 O ATOM 2019 NE2 GLN B 292 5.703 13.573 -19.246 1.00 0.00 N ATOM 0 H GLN B 292 2.027 16.443 -16.837 1.00 0.00 H new ATOM 0 HA GLN B 292 3.278 14.462 -18.386 1.00 0.00 H new ATOM 0 HB2 GLN B 292 4.068 16.802 -18.162 1.00 0.00 H new ATOM 0 HB3 GLN B 292 4.428 16.537 -16.468 1.00 0.00 H new ATOM 0 HG2 GLN B 292 6.484 16.414 -17.812 1.00 0.00 H new ATOM 0 HG3 GLN B 292 6.153 14.869 -17.054 1.00 0.00 H new ATOM 0 HE21 GLN B 292 5.526 13.042 -18.393 1.00 0.00 H new ATOM 0 HE22 GLN B 292 5.746 13.094 -20.145 1.00 0.00 H new ATOM 2028 N MET B 293 3.661 14.018 -15.120 1.00 0.00 N ATOM 2029 CA MET B 293 4.005 12.970 -14.146 1.00 0.00 C ATOM 2030 C MET B 293 3.143 11.706 -14.329 1.00 0.00 C ATOM 2031 O MET B 293 3.662 10.590 -14.289 1.00 0.00 O ATOM 2032 CB MET B 293 3.903 13.486 -12.705 1.00 0.00 C ATOM 2033 CG MET B 293 5.010 14.496 -12.376 1.00 0.00 C ATOM 2034 SD MET B 293 5.285 14.752 -10.600 1.00 0.00 S ATOM 2035 CE MET B 293 3.672 15.415 -10.116 1.00 0.00 C ATOM 0 H MET B 293 3.319 14.885 -14.707 1.00 0.00 H new ATOM 0 HA MET B 293 5.042 12.695 -14.337 1.00 0.00 H new ATOM 0 HB2 MET B 293 2.930 13.953 -12.555 1.00 0.00 H new ATOM 0 HB3 MET B 293 3.962 12.645 -12.014 1.00 0.00 H new ATOM 0 HG2 MET B 293 5.941 14.158 -12.831 1.00 0.00 H new ATOM 0 HG3 MET B 293 4.761 15.453 -12.835 1.00 0.00 H new ATOM 0 HE1 MET B 293 3.629 15.511 -9.031 1.00 0.00 H new ATOM 0 HE2 MET B 293 3.529 16.394 -10.573 1.00 0.00 H new ATOM 0 HE3 MET B 293 2.885 14.740 -10.452 1.00 0.00 H new ATOM 2045 N SER B 294 1.845 11.871 -14.605 1.00 0.00 N ATOM 2046 CA SER B 294 0.925 10.793 -14.977 1.00 0.00 C ATOM 2047 C SER B 294 1.362 10.048 -16.252 1.00 0.00 C ATOM 2048 O SER B 294 1.437 8.818 -16.255 1.00 0.00 O ATOM 2049 CB SER B 294 -0.470 11.397 -15.131 1.00 0.00 C ATOM 2050 OG SER B 294 -1.421 10.375 -15.306 1.00 0.00 O ATOM 0 H SER B 294 1.393 12.785 -14.575 1.00 0.00 H new ATOM 0 HA SER B 294 0.927 10.038 -14.190 1.00 0.00 H new ATOM 0 HB2 SER B 294 -0.718 11.989 -14.250 1.00 0.00 H new ATOM 0 HB3 SER B 294 -0.490 12.074 -15.985 1.00 0.00 H new ATOM 0 HG SER B 294 -1.303 9.695 -14.610 1.00 0.00 H new