USER MOD reduce.3.24.130724 H: found=0, std=0, add=812, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 831 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 Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0142) USER MOD Single : A 17 ASN : amide:sc= 0.488 X(o=0.49,f=0) USER MOD Single : A 29 SER OG : rot 76:sc= 0.275 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : A 41 GLN :FLIP amide:sc= -0.116 F(o=-1.5!,f=-0.12) USER MOD Single : A 42 ASN : amide:sc= -0.228 X(o=-0.23,f=-0.037) USER MOD Single : A 43 ASN :FLIP amide:sc= -0.104 F(o=-1.1,f=-0.1) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -170:sc= 0 (180deg=-0.169) USER MOD Single : A 49 THR OG1 : rot -69:sc= 1.14 USER MOD Single : A 50 MET CE :methyl 159:sc=-0.00829 (180deg=-1.03) USER MOD Single : A 51 THR OG1 : rot -89:sc= 0.00212 USER MOD Single : A 52 THR OG1 : rot -160:sc= 1.59 USER MOD Single : A 54 MET CE :methyl -157:sc= -0.179 (180deg=-1.02) USER MOD Single : A 55 CYS SG : rot 180:sc=-0.00272 USER MOD Single : A 60 MET CE :methyl 169:sc= 0 (180deg=-0.0674) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 154:sc= 1.26 (180deg=1.15) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 ASN : amide:sc= -0.213 X(o=-0.21,f=-0.12) USER MOD Single : A 83 THR OG1 : rot 82:sc= 0.986 USER MOD Single : A 89 THR OG1 : rot 67:sc= 0.652 USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 2 13.407 -3.301 -17.151 1.00 0.00 N ATOM 2 CA MET A 2 14.768 -3.180 -16.642 1.00 0.00 C ATOM 3 C MET A 2 14.919 -1.757 -16.176 1.00 0.00 C ATOM 4 O MET A 2 14.848 -0.824 -16.979 1.00 0.00 O ATOM 5 CB MET A 2 15.817 -3.448 -17.714 1.00 0.00 C ATOM 6 CG MET A 2 15.631 -4.820 -18.370 1.00 0.00 C ATOM 7 SD MET A 2 17.017 -5.350 -19.408 1.00 0.00 S ATOM 8 CE MET A 2 18.147 -5.995 -18.143 1.00 0.00 C ATOM 0 HA MET A 2 14.922 -3.912 -15.850 1.00 0.00 H new ATOM 0 HB2 MET A 2 15.762 -2.671 -18.477 1.00 0.00 H new ATOM 0 HB3 MET A 2 16.811 -3.390 -17.271 1.00 0.00 H new ATOM 0 HG2 MET A 2 15.473 -5.564 -17.589 1.00 0.00 H new ATOM 0 HG3 MET A 2 14.726 -4.799 -18.977 1.00 0.00 H new ATOM 0 HE1 MET A 2 19.055 -6.363 -18.620 1.00 0.00 H new ATOM 0 HE2 MET A 2 18.402 -5.199 -17.443 1.00 0.00 H new ATOM 0 HE3 MET A 2 17.664 -6.811 -17.605 1.00 0.00 H new ATOM 18 N SER A 3 15.087 -1.572 -14.882 1.00 0.00 N ATOM 19 CA SER A 3 15.430 -0.293 -14.309 1.00 0.00 C ATOM 20 C SER A 3 16.139 -0.621 -12.994 1.00 0.00 C ATOM 21 O SER A 3 16.338 -1.800 -12.688 1.00 0.00 O ATOM 22 CB SER A 3 14.141 0.518 -14.215 1.00 0.00 C ATOM 23 OG SER A 3 14.400 1.892 -14.010 1.00 0.00 O ATOM 0 H SER A 3 14.987 -2.317 -14.193 1.00 0.00 H new ATOM 0 HA SER A 3 16.111 0.333 -14.886 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.563 0.390 -15.130 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.531 0.137 -13.396 1.00 0.00 H new ATOM 0 HG SER A 3 13.552 2.380 -13.957 1.00 0.00 H new ATOM 29 N LYS A 4 16.668 0.361 -12.279 1.00 0.00 N ATOM 30 CA LYS A 4 17.487 0.165 -11.089 1.00 0.00 C ATOM 31 C LYS A 4 17.390 1.470 -10.326 1.00 0.00 C ATOM 32 O LYS A 4 17.060 2.495 -10.926 1.00 0.00 O ATOM 33 CB LYS A 4 18.953 -0.111 -11.446 1.00 0.00 C ATOM 34 CG LYS A 4 19.337 -1.576 -11.674 1.00 0.00 C ATOM 35 CD LYS A 4 20.809 -1.774 -12.029 1.00 0.00 C ATOM 36 CE LYS A 4 21.201 -1.008 -13.299 1.00 0.00 C ATOM 37 NZ LYS A 4 21.976 0.210 -12.987 1.00 0.00 N ATOM 0 H LYS A 4 16.536 1.344 -12.516 1.00 0.00 H new ATOM 0 HA LYS A 4 17.140 -0.694 -10.515 1.00 0.00 H new ATOM 0 HB2 LYS A 4 19.196 0.450 -12.349 1.00 0.00 H new ATOM 0 HB3 LYS A 4 19.579 0.285 -10.647 1.00 0.00 H new ATOM 0 HG2 LYS A 4 19.109 -2.147 -10.774 1.00 0.00 H new ATOM 0 HG3 LYS A 4 18.721 -1.984 -12.475 1.00 0.00 H new ATOM 0 HD2 LYS A 4 21.431 -1.441 -11.198 1.00 0.00 H new ATOM 0 HD3 LYS A 4 21.008 -2.836 -12.170 1.00 0.00 H new ATOM 0 HE2 LYS A 4 21.789 -1.657 -13.948 1.00 0.00 H new ATOM 0 HE3 LYS A 4 20.302 -0.735 -13.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 22.222 0.700 -13.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 21.405 0.841 -12.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 22.847 -0.052 -12.482 1.00 0.00 H new ATOM 51 N LYS A 5 17.701 1.433 -9.031 1.00 0.00 N ATOM 52 CA LYS A 5 17.186 2.369 -8.045 1.00 0.00 C ATOM 53 C LYS A 5 15.671 2.536 -8.264 1.00 0.00 C ATOM 54 O LYS A 5 15.192 3.307 -9.089 1.00 0.00 O ATOM 55 CB LYS A 5 18.050 3.627 -8.090 1.00 0.00 C ATOM 56 CG LYS A 5 17.295 4.836 -7.558 1.00 0.00 C ATOM 57 CD LYS A 5 18.141 6.093 -7.500 1.00 0.00 C ATOM 58 CE LYS A 5 17.217 7.151 -6.903 1.00 0.00 C ATOM 59 NZ LYS A 5 17.776 8.506 -7.016 1.00 0.00 N ATOM 0 H LYS A 5 18.331 0.736 -8.635 1.00 0.00 H new ATOM 0 HA LYS A 5 17.263 2.019 -7.015 1.00 0.00 H new ATOM 0 HB2 LYS A 5 18.953 3.471 -7.500 1.00 0.00 H new ATOM 0 HB3 LYS A 5 18.367 3.816 -9.115 1.00 0.00 H new ATOM 0 HG2 LYS A 5 16.426 5.020 -8.190 1.00 0.00 H new ATOM 0 HG3 LYS A 5 16.921 4.612 -6.559 1.00 0.00 H new ATOM 0 HD2 LYS A 5 19.027 5.946 -6.882 1.00 0.00 H new ATOM 0 HD3 LYS A 5 18.488 6.384 -8.492 1.00 0.00 H new ATOM 0 HE2 LYS A 5 16.252 7.115 -7.409 1.00 0.00 H new ATOM 0 HE3 LYS A 5 17.036 6.921 -5.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 17.114 9.191 -6.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 18.684 8.550 -6.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 17.925 8.737 -8.019 1.00 0.00 H new ATOM 73 N VAL A 6 14.903 1.734 -7.543 1.00 0.00 N ATOM 74 CA VAL A 6 13.456 1.795 -7.607 1.00 0.00 C ATOM 75 C VAL A 6 13.018 2.997 -6.758 1.00 0.00 C ATOM 76 O VAL A 6 13.618 3.299 -5.725 1.00 0.00 O ATOM 77 CB VAL A 6 12.902 0.446 -7.128 1.00 0.00 C ATOM 78 CG1 VAL A 6 11.366 0.417 -7.141 1.00 0.00 C ATOM 79 CG2 VAL A 6 13.439 -0.730 -7.945 1.00 0.00 C ATOM 0 H VAL A 6 15.265 1.028 -6.902 1.00 0.00 H new ATOM 0 HA VAL A 6 13.066 1.948 -8.613 1.00 0.00 H new ATOM 0 HB VAL A 6 13.248 0.337 -6.100 1.00 0.00 H new ATOM 0 HG11 VAL A 6 11.018 -0.556 -6.795 1.00 0.00 H new ATOM 0 HG12 VAL A 6 10.982 1.196 -6.482 1.00 0.00 H new ATOM 0 HG13 VAL A 6 11.007 0.591 -8.156 1.00 0.00 H new ATOM 0 HG21 VAL A 6 13.016 -1.660 -7.565 1.00 0.00 H new ATOM 0 HG22 VAL A 6 13.159 -0.604 -8.991 1.00 0.00 H new ATOM 0 HG23 VAL A 6 14.525 -0.765 -7.862 1.00 0.00 H new ATOM 89 N THR A 7 11.980 3.708 -7.185 1.00 0.00 N ATOM 90 CA THR A 7 11.573 4.988 -6.624 1.00 0.00 C ATOM 91 C THR A 7 10.169 4.890 -6.028 1.00 0.00 C ATOM 92 O THR A 7 9.421 3.956 -6.317 1.00 0.00 O ATOM 93 CB THR A 7 11.634 6.003 -7.772 1.00 0.00 C ATOM 94 OG1 THR A 7 10.865 5.528 -8.861 1.00 0.00 O ATOM 95 CG2 THR A 7 13.079 6.224 -8.217 1.00 0.00 C ATOM 0 H THR A 7 11.383 3.400 -7.952 1.00 0.00 H new ATOM 0 HA THR A 7 12.229 5.296 -5.810 1.00 0.00 H new ATOM 0 HB THR A 7 11.230 6.954 -7.424 1.00 0.00 H new ATOM 0 HG1 THR A 7 10.902 6.176 -9.595 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.102 6.947 -9.032 1.00 0.00 H new ATOM 0 HG22 THR A 7 13.664 6.603 -7.379 1.00 0.00 H new ATOM 0 HG23 THR A 7 13.503 5.280 -8.558 1.00 0.00 H new ATOM 103 N LYS A 8 9.778 5.868 -5.205 1.00 0.00 N ATOM 104 CA LYS A 8 8.465 5.876 -4.575 1.00 0.00 C ATOM 105 C LYS A 8 7.357 5.902 -5.626 1.00 0.00 C ATOM 106 O LYS A 8 6.305 5.313 -5.412 1.00 0.00 O ATOM 107 CB LYS A 8 8.371 7.038 -3.568 1.00 0.00 C ATOM 108 CG LYS A 8 9.004 8.365 -4.017 1.00 0.00 C ATOM 109 CD LYS A 8 8.648 9.591 -3.160 1.00 0.00 C ATOM 110 CE LYS A 8 9.124 9.441 -1.708 1.00 0.00 C ATOM 111 NZ LYS A 8 9.521 10.729 -1.102 1.00 0.00 N ATOM 0 H LYS A 8 10.362 6.668 -4.962 1.00 0.00 H new ATOM 0 HA LYS A 8 8.326 4.953 -4.012 1.00 0.00 H new ATOM 0 HB2 LYS A 8 7.319 7.216 -3.345 1.00 0.00 H new ATOM 0 HB3 LYS A 8 8.846 6.727 -2.638 1.00 0.00 H new ATOM 0 HG2 LYS A 8 10.088 8.248 -4.020 1.00 0.00 H new ATOM 0 HG3 LYS A 8 8.702 8.562 -5.046 1.00 0.00 H new ATOM 0 HD2 LYS A 8 9.098 10.482 -3.598 1.00 0.00 H new ATOM 0 HD3 LYS A 8 7.568 9.740 -3.173 1.00 0.00 H new ATOM 0 HE2 LYS A 8 8.327 8.995 -1.113 1.00 0.00 H new ATOM 0 HE3 LYS A 8 9.969 8.753 -1.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 9.834 10.570 -0.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 10.300 11.145 -1.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 8.709 11.379 -1.105 1.00 0.00 H new ATOM 125 N GLU A 9 7.616 6.526 -6.771 1.00 0.00 N ATOM 126 CA GLU A 9 6.689 6.561 -7.887 1.00 0.00 C ATOM 127 C GLU A 9 6.504 5.170 -8.510 1.00 0.00 C ATOM 128 O GLU A 9 5.376 4.759 -8.787 1.00 0.00 O ATOM 129 CB GLU A 9 7.208 7.596 -8.886 1.00 0.00 C ATOM 130 CG GLU A 9 6.136 7.982 -9.910 1.00 0.00 C ATOM 131 CD GLU A 9 6.180 9.469 -10.250 1.00 0.00 C ATOM 132 OE1 GLU A 9 7.238 9.982 -10.673 1.00 0.00 O ATOM 133 OE2 GLU A 9 5.146 10.146 -10.050 1.00 0.00 O ATOM 0 H GLU A 9 8.487 7.026 -6.948 1.00 0.00 H new ATOM 0 HA GLU A 9 5.695 6.855 -7.551 1.00 0.00 H new ATOM 0 HB2 GLU A 9 7.537 8.486 -8.350 1.00 0.00 H new ATOM 0 HB3 GLU A 9 8.079 7.196 -9.405 1.00 0.00 H new ATOM 0 HG2 GLU A 9 6.276 7.398 -10.819 1.00 0.00 H new ATOM 0 HG3 GLU A 9 5.151 7.729 -9.517 1.00 0.00 H new ATOM 141 N ASP A 10 7.593 4.412 -8.671 1.00 0.00 N ATOM 142 CA ASP A 10 7.549 3.083 -9.288 1.00 0.00 C ATOM 143 C ASP A 10 6.847 2.124 -8.335 1.00 0.00 C ATOM 144 O ASP A 10 6.067 1.273 -8.768 1.00 0.00 O ATOM 145 CB ASP A 10 8.960 2.552 -9.604 1.00 0.00 C ATOM 146 CG ASP A 10 9.533 3.016 -10.948 1.00 0.00 C ATOM 147 OD1 ASP A 10 10.741 2.760 -11.167 1.00 0.00 O ATOM 148 OD2 ASP A 10 8.809 3.604 -11.780 1.00 0.00 O ATOM 0 H ASP A 10 8.526 4.701 -8.378 1.00 0.00 H new ATOM 0 HA ASP A 10 7.006 3.159 -10.230 1.00 0.00 H new ATOM 0 HB2 ASP A 10 9.637 2.864 -8.809 1.00 0.00 H new ATOM 0 HB3 ASP A 10 8.934 1.462 -9.592 1.00 0.00 H new ATOM 154 N VAL A 11 7.089 2.288 -7.028 1.00 0.00 N ATOM 155 CA VAL A 11 6.378 1.577 -5.965 1.00 0.00 C ATOM 156 C VAL A 11 4.875 1.840 -6.039 1.00 0.00 C ATOM 157 O VAL A 11 4.100 0.890 -5.910 1.00 0.00 O ATOM 158 CB VAL A 11 6.999 1.907 -4.591 1.00 0.00 C ATOM 159 CG1 VAL A 11 6.242 1.276 -3.409 1.00 0.00 C ATOM 160 CG2 VAL A 11 8.451 1.409 -4.528 1.00 0.00 C ATOM 0 H VAL A 11 7.798 2.931 -6.676 1.00 0.00 H new ATOM 0 HA VAL A 11 6.496 0.503 -6.107 1.00 0.00 H new ATOM 0 HB VAL A 11 6.941 2.991 -4.498 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.733 1.549 -2.475 1.00 0.00 H new ATOM 0 HG12 VAL A 11 5.215 1.640 -3.399 1.00 0.00 H new ATOM 0 HG13 VAL A 11 6.241 0.191 -3.515 1.00 0.00 H new ATOM 0 HG21 VAL A 11 8.876 1.649 -3.553 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.472 0.330 -4.678 1.00 0.00 H new ATOM 0 HG23 VAL A 11 9.037 1.895 -5.308 1.00 0.00 H new ATOM 170 N LEU A 12 4.440 3.078 -6.298 1.00 0.00 N ATOM 171 CA LEU A 12 3.027 3.411 -6.368 1.00 0.00 C ATOM 172 C LEU A 12 2.438 2.744 -7.596 1.00 0.00 C ATOM 173 O LEU A 12 1.413 2.069 -7.499 1.00 0.00 O ATOM 174 CB LEU A 12 2.850 4.934 -6.420 1.00 0.00 C ATOM 175 CG LEU A 12 3.005 5.591 -5.038 1.00 0.00 C ATOM 176 CD1 LEU A 12 3.342 7.077 -5.191 1.00 0.00 C ATOM 177 CD2 LEU A 12 1.727 5.457 -4.201 1.00 0.00 C ATOM 0 H LEU A 12 5.061 3.870 -6.463 1.00 0.00 H new ATOM 0 HA LEU A 12 2.505 3.050 -5.482 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.583 5.359 -7.105 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.864 5.169 -6.822 1.00 0.00 H new ATOM 0 HG LEU A 12 3.815 5.074 -4.524 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.449 7.529 -4.205 1.00 0.00 H new ATOM 0 HD12 LEU A 12 4.276 7.183 -5.742 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.541 7.578 -5.735 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.875 5.933 -3.232 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.900 5.941 -4.720 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.496 4.402 -4.055 1.00 0.00 H new ATOM 189 N ASN A 13 3.107 2.876 -8.744 1.00 0.00 N ATOM 190 CA ASN A 13 2.648 2.265 -9.981 1.00 0.00 C ATOM 191 C ASN A 13 2.626 0.750 -9.917 1.00 0.00 C ATOM 192 O ASN A 13 1.935 0.117 -10.718 1.00 0.00 O ATOM 193 CB ASN A 13 3.556 2.673 -11.142 1.00 0.00 C ATOM 194 CG ASN A 13 2.738 3.453 -12.148 1.00 0.00 C ATOM 195 OD1 ASN A 13 1.907 2.880 -12.849 1.00 0.00 O ATOM 196 ND2 ASN A 13 2.901 4.759 -12.193 1.00 0.00 N ATOM 0 H ASN A 13 3.974 3.406 -8.836 1.00 0.00 H new ATOM 0 HA ASN A 13 1.629 2.620 -10.133 1.00 0.00 H new ATOM 0 HB2 ASN A 13 4.385 3.280 -10.778 1.00 0.00 H new ATOM 0 HB3 ASN A 13 3.989 1.790 -11.611 1.00 0.00 H new ATOM 0 HD21 ASN A 13 2.329 5.323 -12.822 1.00 0.00 H new ATOM 0 HD22 ASN A 13 3.599 5.207 -11.599 1.00 0.00 H new ATOM 203 N ALA A 14 3.394 0.146 -9.020 1.00 0.00 N ATOM 204 CA ALA A 14 3.387 -1.282 -8.839 1.00 0.00 C ATOM 205 C ALA A 14 2.234 -1.690 -7.928 1.00 0.00 C ATOM 206 O ALA A 14 1.485 -2.601 -8.292 1.00 0.00 O ATOM 207 CB ALA A 14 4.733 -1.726 -8.300 1.00 0.00 C ATOM 0 H ALA A 14 4.036 0.641 -8.402 1.00 0.00 H new ATOM 0 HA ALA A 14 3.229 -1.781 -9.795 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.731 -2.807 -8.162 1.00 0.00 H new ATOM 0 HB2 ALA A 14 5.516 -1.452 -9.007 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.921 -1.238 -7.343 1.00 0.00 H new ATOM 213 N LEU A 15 2.076 -1.001 -6.786 1.00 0.00 N ATOM 214 CA LEU A 15 1.038 -1.291 -5.795 1.00 0.00 C ATOM 215 C LEU A 15 -0.356 -1.130 -6.397 1.00 0.00 C ATOM 216 O LEU A 15 -1.256 -1.870 -6.017 1.00 0.00 O ATOM 217 CB LEU A 15 1.146 -0.380 -4.558 1.00 0.00 C ATOM 218 CG LEU A 15 2.130 -0.822 -3.464 1.00 0.00 C ATOM 219 CD1 LEU A 15 2.129 0.230 -2.344 1.00 0.00 C ATOM 220 CD2 LEU A 15 1.759 -2.189 -2.874 1.00 0.00 C ATOM 0 H LEU A 15 2.675 -0.218 -6.526 1.00 0.00 H new ATOM 0 HA LEU A 15 1.193 -2.325 -5.486 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.433 0.617 -4.893 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.156 -0.293 -4.111 1.00 0.00 H new ATOM 0 HG LEU A 15 3.119 -0.913 -3.913 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.824 -0.072 -1.560 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.436 1.194 -2.750 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.126 0.316 -1.926 1.00 0.00 H new ATOM 0 HD21 LEU A 15 2.482 -2.461 -2.105 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.763 -2.137 -2.434 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.769 -2.941 -3.663 1.00 0.00 H new ATOM 232 N LYS A 16 -0.498 -0.271 -7.415 1.00 0.00 N ATOM 233 CA LYS A 16 -1.648 -0.109 -8.315 1.00 0.00 C ATOM 234 C LYS A 16 -2.151 -1.407 -8.982 1.00 0.00 C ATOM 235 O LYS A 16 -2.971 -1.323 -9.899 1.00 0.00 O ATOM 236 CB LYS A 16 -1.287 0.978 -9.352 1.00 0.00 C ATOM 237 CG LYS A 16 -1.616 2.391 -8.854 1.00 0.00 C ATOM 238 CD LYS A 16 -1.370 3.456 -9.934 1.00 0.00 C ATOM 239 CE LYS A 16 -1.824 4.855 -9.497 1.00 0.00 C ATOM 240 NZ LYS A 16 -3.294 4.982 -9.408 1.00 0.00 N ATOM 0 H LYS A 16 0.250 0.382 -7.650 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.501 0.197 -7.709 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -0.224 0.916 -9.585 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -1.828 0.787 -10.279 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -2.658 2.430 -8.538 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -1.008 2.617 -7.978 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -0.308 3.482 -10.178 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -1.899 3.174 -10.844 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -1.385 5.087 -8.527 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -1.443 5.592 -10.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -3.543 5.960 -9.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -3.720 4.739 -10.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.655 4.336 -8.677 1.00 0.00 H new ATOM 254 N ASN A 17 -1.700 -2.590 -8.580 1.00 0.00 N ATOM 255 CA ASN A 17 -2.068 -3.893 -9.111 1.00 0.00 C ATOM 256 C ASN A 17 -2.446 -4.864 -7.981 1.00 0.00 C ATOM 257 O ASN A 17 -2.674 -6.035 -8.278 1.00 0.00 O ATOM 258 CB ASN A 17 -0.900 -4.455 -9.942 1.00 0.00 C ATOM 259 CG ASN A 17 -0.581 -3.620 -11.178 1.00 0.00 C ATOM 260 OD1 ASN A 17 -1.096 -3.847 -12.268 1.00 0.00 O ATOM 261 ND2 ASN A 17 0.261 -2.610 -11.041 1.00 0.00 N ATOM 0 H ASN A 17 -1.021 -2.667 -7.823 1.00 0.00 H new ATOM 0 HA ASN A 17 -2.943 -3.778 -9.751 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -0.012 -4.514 -9.313 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -1.140 -5.472 -10.251 1.00 0.00 H new ATOM 0 HD21 ASN A 17 0.483 -2.019 -11.842 1.00 0.00 H new ATOM 0 HD22 ASN A 17 0.689 -2.422 -10.134 1.00 0.00 H new ATOM 268 N VAL A 18 -2.484 -4.424 -6.716 1.00 0.00 N ATOM 269 CA VAL A 18 -2.855 -5.222 -5.551 1.00 0.00 C ATOM 270 C VAL A 18 -4.204 -4.706 -5.074 1.00 0.00 C ATOM 271 O VAL A 18 -4.292 -3.607 -4.523 1.00 0.00 O ATOM 272 CB VAL A 18 -1.734 -5.166 -4.487 1.00 0.00 C ATOM 273 CG1 VAL A 18 -2.201 -5.358 -3.035 1.00 0.00 C ATOM 274 CG2 VAL A 18 -0.751 -6.289 -4.808 1.00 0.00 C ATOM 0 H VAL A 18 -2.247 -3.463 -6.472 1.00 0.00 H new ATOM 0 HA VAL A 18 -2.961 -6.281 -5.785 1.00 0.00 H new ATOM 0 HB VAL A 18 -1.305 -4.165 -4.539 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.342 -5.302 -2.366 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.914 -4.576 -2.776 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -2.678 -6.333 -2.932 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.058 -6.284 -4.078 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -1.268 -7.248 -4.770 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.340 -6.138 -5.806 1.00 0.00 H new ATOM 284 N ILE A 19 -5.250 -5.489 -5.332 1.00 0.00 N ATOM 285 CA ILE A 19 -6.582 -5.248 -4.806 1.00 0.00 C ATOM 286 C ILE A 19 -6.620 -5.754 -3.361 1.00 0.00 C ATOM 287 O ILE A 19 -6.195 -6.875 -3.079 1.00 0.00 O ATOM 288 CB ILE A 19 -7.629 -5.948 -5.694 1.00 0.00 C ATOM 289 CG1 ILE A 19 -7.613 -5.460 -7.164 1.00 0.00 C ATOM 290 CG2 ILE A 19 -9.047 -5.833 -5.122 1.00 0.00 C ATOM 291 CD1 ILE A 19 -7.940 -3.970 -7.358 1.00 0.00 C ATOM 0 H ILE A 19 -5.190 -6.319 -5.921 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.820 -4.184 -4.812 1.00 0.00 H new ATOM 0 HB ILE A 19 -7.337 -6.998 -5.694 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.628 -5.658 -7.586 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.329 -6.051 -7.735 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -9.748 -6.342 -5.783 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -9.080 -6.294 -4.135 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -9.322 -4.781 -5.041 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.904 -3.725 -8.419 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -8.938 -3.763 -6.972 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -7.210 -3.364 -6.821 1.00 0.00 H new ATOM 303 N ASP A 20 -7.167 -4.943 -2.465 1.00 0.00 N ATOM 304 CA ASP A 20 -7.647 -5.334 -1.143 1.00 0.00 C ATOM 305 C ASP A 20 -9.058 -5.887 -1.337 1.00 0.00 C ATOM 306 O ASP A 20 -9.932 -5.174 -1.839 1.00 0.00 O ATOM 307 CB ASP A 20 -7.675 -4.114 -0.208 1.00 0.00 C ATOM 308 CG ASP A 20 -8.158 -4.430 1.210 1.00 0.00 C ATOM 309 OD1 ASP A 20 -7.783 -3.671 2.132 1.00 0.00 O ATOM 310 OD2 ASP A 20 -8.910 -5.403 1.410 1.00 0.00 O ATOM 0 H ASP A 20 -7.295 -3.948 -2.647 1.00 0.00 H new ATOM 0 HA ASP A 20 -6.993 -6.080 -0.690 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -6.673 -3.687 -0.153 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -8.323 -3.352 -0.641 1.00 0.00 H new ATOM 316 N PHE A 21 -9.272 -7.156 -0.986 1.00 0.00 N ATOM 317 CA PHE A 21 -10.550 -7.855 -1.119 1.00 0.00 C ATOM 318 C PHE A 21 -11.686 -7.223 -0.305 1.00 0.00 C ATOM 319 O PHE A 21 -12.845 -7.376 -0.681 1.00 0.00 O ATOM 320 CB PHE A 21 -10.371 -9.315 -0.676 1.00 0.00 C ATOM 321 CG PHE A 21 -9.891 -10.266 -1.756 1.00 0.00 C ATOM 322 CD1 PHE A 21 -8.528 -10.329 -2.106 1.00 0.00 C ATOM 323 CD2 PHE A 21 -10.815 -11.111 -2.402 1.00 0.00 C ATOM 324 CE1 PHE A 21 -8.098 -11.229 -3.095 1.00 0.00 C ATOM 325 CE2 PHE A 21 -10.385 -12.011 -3.391 1.00 0.00 C ATOM 326 CZ PHE A 21 -9.024 -12.073 -3.734 1.00 0.00 C ATOM 0 H PHE A 21 -8.538 -7.743 -0.589 1.00 0.00 H new ATOM 0 HA PHE A 21 -10.838 -7.785 -2.168 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -9.661 -9.342 0.151 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -11.323 -9.680 -0.291 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -7.814 -9.685 -1.614 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -11.861 -11.066 -2.135 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -7.053 -11.273 -3.366 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -11.098 -12.653 -3.886 1.00 0.00 H new ATOM 0 HZ PHE A 21 -8.689 -12.769 -4.489 1.00 0.00 H new ATOM 336 N GLU A 22 -11.382 -6.544 0.806 1.00 0.00 N ATOM 337 CA GLU A 22 -12.380 -6.017 1.729 1.00 0.00 C ATOM 338 C GLU A 22 -13.229 -4.927 1.057 1.00 0.00 C ATOM 339 O GLU A 22 -14.425 -4.817 1.336 1.00 0.00 O ATOM 340 CB GLU A 22 -11.633 -5.518 2.979 1.00 0.00 C ATOM 341 CG GLU A 22 -12.487 -5.382 4.246 1.00 0.00 C ATOM 342 CD GLU A 22 -13.299 -4.098 4.385 1.00 0.00 C ATOM 343 OE1 GLU A 22 -14.373 -4.153 5.035 1.00 0.00 O ATOM 344 OE2 GLU A 22 -12.811 -3.016 3.979 1.00 0.00 O ATOM 0 H GLU A 22 -10.422 -6.345 1.089 1.00 0.00 H new ATOM 0 HA GLU A 22 -13.089 -6.789 2.026 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -10.811 -6.203 3.187 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -11.191 -4.548 2.754 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -13.175 -6.227 4.286 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -11.829 -5.465 5.111 1.00 0.00 H new ATOM 352 N LEU A 23 -12.639 -4.177 0.116 1.00 0.00 N ATOM 353 CA LEU A 23 -13.333 -3.216 -0.746 1.00 0.00 C ATOM 354 C LEU A 23 -13.454 -3.723 -2.180 1.00 0.00 C ATOM 355 O LEU A 23 -14.383 -3.363 -2.909 1.00 0.00 O ATOM 356 CB LEU A 23 -12.566 -1.879 -0.780 1.00 0.00 C ATOM 357 CG LEU A 23 -13.214 -0.732 0.012 1.00 0.00 C ATOM 358 CD1 LEU A 23 -14.560 -0.325 -0.590 1.00 0.00 C ATOM 359 CD2 LEU A 23 -13.362 -1.041 1.502 1.00 0.00 C ATOM 0 H LEU A 23 -11.637 -4.225 -0.070 1.00 0.00 H new ATOM 0 HA LEU A 23 -14.331 -3.081 -0.328 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.561 -2.045 -0.391 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -12.459 -1.567 -1.819 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.528 0.111 -0.069 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -14.989 0.488 -0.005 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -14.414 0.006 -1.618 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -15.238 -1.179 -0.577 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -13.826 -0.193 2.005 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -13.987 -1.925 1.630 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -12.379 -1.226 1.935 1.00 0.00 H new ATOM 371 N GLY A 24 -12.487 -4.516 -2.625 1.00 0.00 N ATOM 372 CA GLY A 24 -12.273 -4.809 -4.025 1.00 0.00 C ATOM 373 C GLY A 24 -11.744 -3.571 -4.749 1.00 0.00 C ATOM 374 O GLY A 24 -12.223 -3.285 -5.844 1.00 0.00 O ATOM 0 H GLY A 24 -11.821 -4.979 -2.007 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.564 -5.630 -4.128 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -13.207 -5.135 -4.483 1.00 0.00 H new ATOM 378 N LEU A 25 -10.797 -2.827 -4.162 1.00 0.00 N ATOM 379 CA LEU A 25 -10.090 -1.720 -4.816 1.00 0.00 C ATOM 380 C LEU A 25 -8.601 -1.815 -4.497 1.00 0.00 C ATOM 381 O LEU A 25 -8.238 -2.550 -3.581 1.00 0.00 O ATOM 382 CB LEU A 25 -10.647 -0.358 -4.357 1.00 0.00 C ATOM 383 CG LEU A 25 -11.154 0.540 -5.499 1.00 0.00 C ATOM 384 CD1 LEU A 25 -10.147 0.749 -6.636 1.00 0.00 C ATOM 385 CD2 LEU A 25 -12.465 0.006 -6.078 1.00 0.00 C ATOM 0 H LEU A 25 -10.496 -2.982 -3.200 1.00 0.00 H new ATOM 0 HA LEU A 25 -10.240 -1.796 -5.893 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -11.465 -0.531 -3.657 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -9.868 0.174 -3.812 1.00 0.00 H new ATOM 0 HG LEU A 25 -11.312 1.514 -5.037 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -10.586 1.394 -7.397 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -9.245 1.216 -6.242 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -9.893 -0.214 -7.079 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -12.800 0.660 -6.883 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -12.307 -0.999 -6.469 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -13.223 -0.024 -5.295 1.00 0.00 H new ATOM 397 N ASP A 26 -7.737 -1.090 -5.220 1.00 0.00 N ATOM 398 CA ASP A 26 -6.296 -1.193 -4.977 1.00 0.00 C ATOM 399 C ASP A 26 -5.915 -0.343 -3.779 1.00 0.00 C ATOM 400 O ASP A 26 -6.519 0.699 -3.515 1.00 0.00 O ATOM 401 CB ASP A 26 -5.432 -0.905 -6.222 1.00 0.00 C ATOM 402 CG ASP A 26 -4.512 0.310 -6.099 1.00 0.00 C ATOM 403 OD1 ASP A 26 -3.445 0.207 -5.470 1.00 0.00 O ATOM 404 OD2 ASP A 26 -4.824 1.364 -6.690 1.00 0.00 O ATOM 0 H ASP A 26 -8.004 -0.441 -5.960 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.076 -2.235 -4.743 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -4.823 -1.784 -6.435 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -6.091 -0.759 -7.078 1.00 0.00 H new ATOM 410 N VAL A 27 -4.892 -0.772 -3.055 1.00 0.00 N ATOM 411 CA VAL A 27 -4.408 -0.123 -1.860 1.00 0.00 C ATOM 412 C VAL A 27 -4.033 1.350 -2.073 1.00 0.00 C ATOM 413 O VAL A 27 -4.274 2.173 -1.186 1.00 0.00 O ATOM 414 CB VAL A 27 -3.233 -0.928 -1.285 1.00 0.00 C ATOM 415 CG1 VAL A 27 -3.697 -2.302 -0.777 1.00 0.00 C ATOM 416 CG2 VAL A 27 -2.078 -1.092 -2.283 1.00 0.00 C ATOM 0 H VAL A 27 -4.363 -1.610 -3.297 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.227 -0.106 -1.141 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.851 -0.350 -0.444 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.844 -2.849 -0.376 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -4.443 -2.167 0.007 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -4.134 -2.866 -1.601 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.277 -1.669 -1.821 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.435 -1.614 -3.171 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.700 -0.110 -2.567 1.00 0.00 H new ATOM 426 N VAL A 28 -3.422 1.725 -3.202 1.00 0.00 N ATOM 427 CA VAL A 28 -3.091 3.109 -3.538 1.00 0.00 C ATOM 428 C VAL A 28 -4.397 3.895 -3.684 1.00 0.00 C ATOM 429 O VAL A 28 -4.500 5.004 -3.151 1.00 0.00 O ATOM 430 CB VAL A 28 -2.201 3.192 -4.800 1.00 0.00 C ATOM 431 CG1 VAL A 28 -1.734 4.631 -5.048 1.00 0.00 C ATOM 432 CG2 VAL A 28 -0.951 2.317 -4.661 1.00 0.00 C ATOM 0 H VAL A 28 -3.139 1.059 -3.921 1.00 0.00 H new ATOM 0 HA VAL A 28 -2.500 3.555 -2.738 1.00 0.00 H new ATOM 0 HB VAL A 28 -2.810 2.841 -5.633 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -1.110 4.662 -5.941 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.601 5.276 -5.189 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.158 4.980 -4.191 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.348 2.398 -5.565 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.367 2.651 -3.803 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.248 1.278 -4.515 1.00 0.00 H new ATOM 442 N SER A 29 -5.422 3.307 -4.312 1.00 0.00 N ATOM 443 CA SER A 29 -6.746 3.917 -4.392 1.00 0.00 C ATOM 444 C SER A 29 -7.332 4.095 -2.986 1.00 0.00 C ATOM 445 O SER A 29 -7.811 5.173 -2.651 1.00 0.00 O ATOM 446 CB SER A 29 -7.685 3.140 -5.318 1.00 0.00 C ATOM 447 OG SER A 29 -7.248 3.267 -6.663 1.00 0.00 O ATOM 0 H SER A 29 -5.354 2.401 -4.775 1.00 0.00 H new ATOM 0 HA SER A 29 -6.638 4.905 -4.840 1.00 0.00 H new ATOM 0 HB2 SER A 29 -7.706 2.089 -5.031 1.00 0.00 H new ATOM 0 HB3 SER A 29 -8.703 3.518 -5.219 1.00 0.00 H new ATOM 0 HG SER A 29 -6.462 2.700 -6.807 1.00 0.00 H new ATOM 453 N LEU A 30 -7.199 3.100 -2.109 1.00 0.00 N ATOM 454 CA LEU A 30 -7.580 3.174 -0.700 1.00 0.00 C ATOM 455 C LEU A 30 -6.726 4.155 0.113 1.00 0.00 C ATOM 456 O LEU A 30 -7.115 4.494 1.231 1.00 0.00 O ATOM 457 CB LEU A 30 -7.545 1.768 -0.085 1.00 0.00 C ATOM 458 CG LEU A 30 -8.841 0.961 -0.282 1.00 0.00 C ATOM 459 CD1 LEU A 30 -8.554 -0.507 -0.588 1.00 0.00 C ATOM 460 CD2 LEU A 30 -9.707 1.046 0.978 1.00 0.00 C ATOM 0 H LEU A 30 -6.811 2.193 -2.368 1.00 0.00 H new ATOM 0 HA LEU A 30 -8.595 3.569 -0.660 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -6.715 1.213 -0.522 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -7.343 1.855 0.983 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.367 1.394 -1.133 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.495 -1.042 -0.720 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -7.964 -0.580 -1.502 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.998 -0.949 0.239 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -10.622 0.472 0.830 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -9.156 0.639 1.826 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -9.960 2.088 1.176 1.00 0.00 H new ATOM 472 N GLY A 31 -5.607 4.650 -0.422 1.00 0.00 N ATOM 473 CA GLY A 31 -4.819 5.718 0.191 1.00 0.00 C ATOM 474 C GLY A 31 -4.108 5.279 1.471 1.00 0.00 C ATOM 475 O GLY A 31 -3.861 6.111 2.340 1.00 0.00 O ATOM 0 H GLY A 31 -5.219 4.315 -1.304 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -4.078 6.072 -0.526 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -5.473 6.560 0.416 1.00 0.00 H new ATOM 479 N LEU A 32 -3.843 3.979 1.630 1.00 0.00 N ATOM 480 CA LEU A 32 -3.377 3.390 2.886 1.00 0.00 C ATOM 481 C LEU A 32 -1.930 3.772 3.193 1.00 0.00 C ATOM 482 O LEU A 32 -1.580 3.949 4.356 1.00 0.00 O ATOM 483 CB LEU A 32 -3.493 1.862 2.801 1.00 0.00 C ATOM 484 CG LEU A 32 -4.948 1.367 2.684 1.00 0.00 C ATOM 485 CD1 LEU A 32 -5.003 0.149 1.764 1.00 0.00 C ATOM 486 CD2 LEU A 32 -5.576 1.048 4.039 1.00 0.00 C ATOM 0 H LEU A 32 -3.948 3.298 0.878 1.00 0.00 H new ATOM 0 HA LEU A 32 -4.002 3.777 3.691 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -2.926 1.509 1.940 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -3.036 1.420 3.686 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.537 2.179 2.256 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -6.033 -0.199 1.683 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -4.633 0.423 0.776 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -4.382 -0.647 2.176 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.600 0.704 3.894 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -4.998 0.267 4.533 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -5.579 1.945 4.659 1.00 0.00 H new ATOM 498 N VAL A 33 -1.080 3.893 2.176 1.00 0.00 N ATOM 499 CA VAL A 33 0.312 4.300 2.318 1.00 0.00 C ATOM 500 C VAL A 33 0.381 5.661 3.024 1.00 0.00 C ATOM 501 O VAL A 33 -0.418 6.566 2.766 1.00 0.00 O ATOM 502 CB VAL A 33 0.962 4.294 0.916 1.00 0.00 C ATOM 503 CG1 VAL A 33 2.341 4.957 0.876 1.00 0.00 C ATOM 504 CG2 VAL A 33 1.125 2.859 0.376 1.00 0.00 C ATOM 0 H VAL A 33 -1.348 3.706 1.210 1.00 0.00 H new ATOM 0 HA VAL A 33 0.874 3.607 2.944 1.00 0.00 H new ATOM 0 HB VAL A 33 0.277 4.871 0.295 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.735 4.915 -0.139 1.00 0.00 H new ATOM 0 HG12 VAL A 33 2.254 5.997 1.189 1.00 0.00 H new ATOM 0 HG13 VAL A 33 3.017 4.431 1.550 1.00 0.00 H new ATOM 0 HG21 VAL A 33 1.585 2.892 -0.612 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.759 2.285 1.053 1.00 0.00 H new ATOM 0 HG23 VAL A 33 0.147 2.384 0.305 1.00 0.00 H new ATOM 514 N TYR A 34 1.367 5.794 3.907 1.00 0.00 N ATOM 515 CA TYR A 34 1.745 7.013 4.594 1.00 0.00 C ATOM 516 C TYR A 34 3.071 7.490 3.999 1.00 0.00 C ATOM 517 O TYR A 34 3.089 8.468 3.247 1.00 0.00 O ATOM 518 CB TYR A 34 1.842 6.749 6.105 1.00 0.00 C ATOM 519 CG TYR A 34 0.534 6.558 6.845 1.00 0.00 C ATOM 520 CD1 TYR A 34 -0.426 7.585 6.819 1.00 0.00 C ATOM 521 CD2 TYR A 34 0.323 5.418 7.648 1.00 0.00 C ATOM 522 CE1 TYR A 34 -1.575 7.495 7.616 1.00 0.00 C ATOM 523 CE2 TYR A 34 -0.829 5.323 8.448 1.00 0.00 C ATOM 524 CZ TYR A 34 -1.774 6.372 8.446 1.00 0.00 C ATOM 525 OH TYR A 34 -2.878 6.333 9.236 1.00 0.00 O ATOM 0 H TYR A 34 1.954 5.004 4.174 1.00 0.00 H new ATOM 0 HA TYR A 34 0.998 7.795 4.460 1.00 0.00 H new ATOM 0 HB2 TYR A 34 2.453 5.859 6.257 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.374 7.583 6.563 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -0.277 8.445 6.183 1.00 0.00 H new ATOM 0 HD2 TYR A 34 1.047 4.617 7.648 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -2.309 8.287 7.595 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -0.991 4.450 9.063 1.00 0.00 H new ATOM 0 HH TYR A 34 -2.882 5.499 9.751 1.00 0.00 H new ATOM 535 N ASP A 35 4.168 6.772 4.258 1.00 0.00 N ATOM 536 CA ASP A 35 5.518 7.129 3.813 1.00 0.00 C ATOM 537 C ASP A 35 6.039 6.072 2.851 1.00 0.00 C ATOM 538 O ASP A 35 5.705 4.899 3.019 1.00 0.00 O ATOM 539 CB ASP A 35 6.480 7.214 5.005 1.00 0.00 C ATOM 540 CG ASP A 35 7.692 8.073 4.641 1.00 0.00 C ATOM 541 OD1 ASP A 35 7.535 9.317 4.602 1.00 0.00 O ATOM 542 OD2 ASP A 35 8.783 7.507 4.409 1.00 0.00 O ATOM 0 H ASP A 35 4.141 5.906 4.796 1.00 0.00 H new ATOM 0 HA ASP A 35 5.465 8.100 3.320 1.00 0.00 H new ATOM 0 HB2 ASP A 35 5.967 7.641 5.867 1.00 0.00 H new ATOM 0 HB3 ASP A 35 6.806 6.214 5.292 1.00 0.00 H new ATOM 548 N ILE A 36 6.878 6.463 1.892 1.00 0.00 N ATOM 549 CA ILE A 36 7.611 5.575 0.998 1.00 0.00 C ATOM 550 C ILE A 36 9.015 6.158 0.956 1.00 0.00 C ATOM 551 O ILE A 36 9.199 7.336 0.626 1.00 0.00 O ATOM 552 CB ILE A 36 7.019 5.533 -0.434 1.00 0.00 C ATOM 553 CG1 ILE A 36 5.482 5.422 -0.522 1.00 0.00 C ATOM 554 CG2 ILE A 36 7.674 4.370 -1.215 1.00 0.00 C ATOM 555 CD1 ILE A 36 4.947 5.880 -1.885 1.00 0.00 C ATOM 0 H ILE A 36 7.072 7.448 1.712 1.00 0.00 H new ATOM 0 HA ILE A 36 7.570 4.547 1.358 1.00 0.00 H new ATOM 0 HB ILE A 36 7.251 6.503 -0.874 1.00 0.00 H new ATOM 0 HG12 ILE A 36 5.183 4.389 -0.344 1.00 0.00 H new ATOM 0 HG13 ILE A 36 5.030 6.025 0.266 1.00 0.00 H new ATOM 0 HG21 ILE A 36 7.263 4.333 -2.224 1.00 0.00 H new ATOM 0 HG22 ILE A 36 8.751 4.528 -1.267 1.00 0.00 H new ATOM 0 HG23 ILE A 36 7.470 3.429 -0.705 1.00 0.00 H new ATOM 0 HD11 ILE A 36 3.861 5.784 -1.901 1.00 0.00 H new ATOM 0 HD12 ILE A 36 5.222 6.921 -2.052 1.00 0.00 H new ATOM 0 HD13 ILE A 36 5.377 5.260 -2.672 1.00 0.00 H new ATOM 567 N GLN A 37 10.009 5.335 1.248 1.00 0.00 N ATOM 568 CA GLN A 37 11.404 5.679 1.090 1.00 0.00 C ATOM 569 C GLN A 37 12.120 4.456 0.548 1.00 0.00 C ATOM 570 O GLN A 37 11.786 3.335 0.929 1.00 0.00 O ATOM 571 CB GLN A 37 11.983 6.139 2.428 1.00 0.00 C ATOM 572 CG GLN A 37 11.821 5.165 3.598 1.00 0.00 C ATOM 573 CD GLN A 37 12.172 5.827 4.922 1.00 0.00 C ATOM 574 OE1 GLN A 37 13.248 5.601 5.484 1.00 0.00 O ATOM 575 NE2 GLN A 37 11.285 6.661 5.438 1.00 0.00 N ATOM 0 H GLN A 37 9.861 4.392 1.608 1.00 0.00 H new ATOM 0 HA GLN A 37 11.531 6.506 0.392 1.00 0.00 H new ATOM 0 HB2 GLN A 37 13.046 6.339 2.292 1.00 0.00 H new ATOM 0 HB3 GLN A 37 11.513 7.084 2.700 1.00 0.00 H new ATOM 0 HG2 GLN A 37 10.794 4.802 3.632 1.00 0.00 H new ATOM 0 HG3 GLN A 37 12.461 4.297 3.442 1.00 0.00 H new ATOM 0 HE21 GLN A 37 10.403 6.831 4.954 1.00 0.00 H new ATOM 0 HE22 GLN A 37 11.483 7.134 6.320 1.00 0.00 H new ATOM 584 N ILE A 38 13.073 4.659 -0.360 1.00 0.00 N ATOM 585 CA ILE A 38 13.884 3.579 -0.880 1.00 0.00 C ATOM 586 C ILE A 38 15.356 3.921 -0.678 1.00 0.00 C ATOM 587 O ILE A 38 15.870 4.909 -1.220 1.00 0.00 O ATOM 588 CB ILE A 38 13.515 3.267 -2.333 1.00 0.00 C ATOM 589 CG1 ILE A 38 12.011 2.995 -2.537 1.00 0.00 C ATOM 590 CG2 ILE A 38 14.320 2.052 -2.791 1.00 0.00 C ATOM 591 CD1 ILE A 38 11.229 4.255 -2.864 1.00 0.00 C ATOM 0 H ILE A 38 13.298 5.575 -0.749 1.00 0.00 H new ATOM 0 HA ILE A 38 13.687 2.658 -0.331 1.00 0.00 H new ATOM 0 HB ILE A 38 13.753 4.149 -2.927 1.00 0.00 H new ATOM 0 HG12 ILE A 38 11.882 2.272 -3.343 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.602 2.542 -1.634 1.00 0.00 H new ATOM 0 HG21 ILE A 38 14.068 1.817 -3.825 1.00 0.00 H new ATOM 0 HG22 ILE A 38 15.385 2.273 -2.718 1.00 0.00 H new ATOM 0 HG23 ILE A 38 14.082 1.198 -2.157 1.00 0.00 H new ATOM 0 HD11 ILE A 38 10.176 4.006 -2.997 1.00 0.00 H new ATOM 0 HD12 ILE A 38 11.332 4.969 -2.047 1.00 0.00 H new ATOM 0 HD13 ILE A 38 11.617 4.696 -3.782 1.00 0.00 H new ATOM 603 N ASP A 39 16.015 3.089 0.127 1.00 0.00 N ATOM 604 CA ASP A 39 17.422 3.240 0.481 1.00 0.00 C ATOM 605 C ASP A 39 18.287 3.065 -0.771 1.00 0.00 C ATOM 606 O ASP A 39 17.835 2.532 -1.790 1.00 0.00 O ATOM 607 CB ASP A 39 17.787 2.205 1.559 1.00 0.00 C ATOM 608 CG ASP A 39 18.935 2.664 2.459 1.00 0.00 C ATOM 609 OD1 ASP A 39 18.735 2.734 3.700 1.00 0.00 O ATOM 610 OD2 ASP A 39 20.023 2.998 1.947 1.00 0.00 O ATOM 0 H ASP A 39 15.576 2.276 0.559 1.00 0.00 H new ATOM 0 HA ASP A 39 17.604 4.237 0.883 1.00 0.00 H new ATOM 0 HB2 ASP A 39 16.909 2.002 2.173 1.00 0.00 H new ATOM 0 HB3 ASP A 39 18.063 1.267 1.077 1.00 0.00 H new ATOM 616 N ASP A 40 19.563 3.434 -0.701 1.00 0.00 N ATOM 617 CA ASP A 40 20.562 3.243 -1.753 1.00 0.00 C ATOM 618 C ASP A 40 20.748 1.765 -2.096 1.00 0.00 C ATOM 619 O ASP A 40 21.333 1.440 -3.126 1.00 0.00 O ATOM 620 CB ASP A 40 21.914 3.834 -1.326 1.00 0.00 C ATOM 621 CG ASP A 40 22.124 5.218 -1.926 1.00 0.00 C ATOM 622 OD1 ASP A 40 21.920 6.218 -1.201 1.00 0.00 O ATOM 623 OD2 ASP A 40 22.495 5.306 -3.116 1.00 0.00 O ATOM 0 H ASP A 40 19.947 3.894 0.124 1.00 0.00 H new ATOM 0 HA ASP A 40 20.196 3.761 -2.639 1.00 0.00 H new ATOM 0 HB2 ASP A 40 21.960 3.895 -0.239 1.00 0.00 H new ATOM 0 HB3 ASP A 40 22.720 3.171 -1.642 1.00 0.00 H new ATOM 629 N GLN A 41 20.256 0.850 -1.262 1.00 0.00 N ATOM 630 CA GLN A 41 20.300 -0.596 -1.471 1.00 0.00 C ATOM 631 C GLN A 41 18.931 -1.134 -1.904 1.00 0.00 C ATOM 632 O GLN A 41 18.600 -2.286 -1.624 1.00 0.00 O ATOM 633 CB GLN A 41 20.861 -1.252 -0.198 1.00 0.00 C ATOM 634 CG GLN A 41 22.254 -0.749 0.237 1.00 0.00 C ATOM 635 CD GLN A 41 23.365 -0.976 -0.797 1.00 0.00 C ATOM 636 OE1 GLN A 41 23.331 -0.283 -1.919 1.00 0.00 O flip ATOM 637 NE2 GLN A 41 24.282 -1.769 -0.596 1.00 0.00 N flip ATOM 0 H GLN A 41 19.798 1.106 -0.388 1.00 0.00 H new ATOM 0 HA GLN A 41 20.968 -0.849 -2.294 1.00 0.00 H new ATOM 0 HB2 GLN A 41 20.159 -1.083 0.619 1.00 0.00 H new ATOM 0 HB3 GLN A 41 20.913 -2.329 -0.356 1.00 0.00 H new ATOM 0 HG2 GLN A 41 22.190 0.317 0.454 1.00 0.00 H new ATOM 0 HG3 GLN A 41 22.532 -1.247 1.166 1.00 0.00 H new ATOM 0 HE21 GLN A 41 24.311 -2.306 0.271 1.00 0.00 H new ATOM 0 HE22 GLN A 41 25.014 -1.890 -1.296 1.00 0.00 H new ATOM 646 N ASN A 42 18.115 -0.293 -2.556 1.00 0.00 N ATOM 647 CA ASN A 42 16.774 -0.582 -3.070 1.00 0.00 C ATOM 648 C ASN A 42 15.911 -1.244 -1.997 1.00 0.00 C ATOM 649 O ASN A 42 15.073 -2.109 -2.286 1.00 0.00 O ATOM 650 CB ASN A 42 16.786 -1.440 -4.353 1.00 0.00 C ATOM 651 CG ASN A 42 17.906 -1.217 -5.332 1.00 0.00 C ATOM 652 OD1 ASN A 42 19.019 -1.716 -5.167 1.00 0.00 O ATOM 653 ND2 ASN A 42 17.575 -0.582 -6.440 1.00 0.00 N ATOM 0 H ASN A 42 18.395 0.669 -2.749 1.00 0.00 H new ATOM 0 HA ASN A 42 16.339 0.380 -3.340 1.00 0.00 H new ATOM 0 HB2 ASN A 42 16.804 -2.488 -4.055 1.00 0.00 H new ATOM 0 HB3 ASN A 42 15.845 -1.274 -4.877 1.00 0.00 H new ATOM 0 HD21 ASN A 42 18.252 -0.491 -7.198 1.00 0.00 H new ATOM 0 HD22 ASN A 42 16.642 -0.182 -6.539 1.00 0.00 H new ATOM 660 N ASN A 43 16.116 -0.870 -0.738 1.00 0.00 N ATOM 661 CA ASN A 43 15.309 -1.376 0.352 1.00 0.00 C ATOM 662 C ASN A 43 13.983 -0.622 0.232 1.00 0.00 C ATOM 663 O ASN A 43 13.968 0.558 0.584 1.00 0.00 O ATOM 664 CB ASN A 43 15.955 -1.090 1.724 1.00 0.00 C ATOM 665 CG ASN A 43 17.439 -1.384 1.925 1.00 0.00 C ATOM 666 OD1 ASN A 43 18.051 -2.265 1.156 1.00 0.00 O flip ATOM 667 ND2 ASN A 43 18.066 -0.784 2.789 1.00 0.00 N flip ATOM 0 H ASN A 43 16.842 -0.213 -0.452 1.00 0.00 H new ATOM 0 HA ASN A 43 15.194 -2.458 0.291 1.00 0.00 H new ATOM 0 HB2 ASN A 43 15.797 -0.035 1.947 1.00 0.00 H new ATOM 0 HB3 ASN A 43 15.404 -1.660 2.471 1.00 0.00 H new ATOM 0 HD21 ASN A 43 17.592 -0.103 3.383 1.00 0.00 H new ATOM 0 HD22 ASN A 43 19.062 -0.965 2.915 1.00 0.00 H new ATOM 674 N VAL A 44 12.907 -1.180 -0.347 1.00 0.00 N ATOM 675 CA VAL A 44 11.632 -0.457 -0.293 1.00 0.00 C ATOM 676 C VAL A 44 11.145 -0.445 1.151 1.00 0.00 C ATOM 677 O VAL A 44 10.945 -1.516 1.734 1.00 0.00 O ATOM 678 CB VAL A 44 10.618 -1.097 -1.251 1.00 0.00 C ATOM 679 CG1 VAL A 44 9.181 -0.619 -1.012 1.00 0.00 C ATOM 680 CG2 VAL A 44 11.006 -0.718 -2.669 1.00 0.00 C ATOM 0 H VAL A 44 12.891 -2.078 -0.831 1.00 0.00 H new ATOM 0 HA VAL A 44 11.759 0.575 -0.621 1.00 0.00 H new ATOM 0 HB VAL A 44 10.641 -2.174 -1.082 1.00 0.00 H new ATOM 0 HG11 VAL A 44 8.512 -1.108 -1.721 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.878 -0.870 0.005 1.00 0.00 H new ATOM 0 HG13 VAL A 44 9.129 0.461 -1.150 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.299 -1.162 -3.370 1.00 0.00 H new ATOM 0 HG22 VAL A 44 10.988 0.367 -2.773 1.00 0.00 H new ATOM 0 HG23 VAL A 44 12.009 -1.087 -2.883 1.00 0.00 H new ATOM 690 N LYS A 45 10.940 0.744 1.732 1.00 0.00 N ATOM 691 CA LYS A 45 10.513 0.845 3.107 1.00 0.00 C ATOM 692 C LYS A 45 9.271 1.721 3.121 1.00 0.00 C ATOM 693 O LYS A 45 9.328 2.876 2.688 1.00 0.00 O ATOM 694 CB LYS A 45 11.712 1.360 3.905 1.00 0.00 C ATOM 695 CG LYS A 45 11.393 1.545 5.385 1.00 0.00 C ATOM 696 CD LYS A 45 12.581 2.136 6.148 1.00 0.00 C ATOM 697 CE LYS A 45 12.018 2.880 7.352 1.00 0.00 C ATOM 698 NZ LYS A 45 13.069 3.454 8.210 1.00 0.00 N ATOM 0 H LYS A 45 11.066 1.640 1.261 1.00 0.00 H new ATOM 0 HA LYS A 45 10.221 -0.094 3.577 1.00 0.00 H new ATOM 0 HB2 LYS A 45 12.541 0.661 3.800 1.00 0.00 H new ATOM 0 HB3 LYS A 45 12.042 2.311 3.486 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.529 2.200 5.492 1.00 0.00 H new ATOM 0 HG3 LYS A 45 11.121 0.584 5.822 1.00 0.00 H new ATOM 0 HD2 LYS A 45 13.264 1.348 6.467 1.00 0.00 H new ATOM 0 HD3 LYS A 45 13.150 2.812 5.510 1.00 0.00 H new ATOM 0 HE2 LYS A 45 11.362 3.678 7.006 1.00 0.00 H new ATOM 0 HE3 LYS A 45 11.406 2.197 7.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 12.630 3.948 9.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 13.682 2.692 8.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 13.638 4.127 7.658 1.00 0.00 H new ATOM 712 N VAL A 46 8.132 1.156 3.512 1.00 0.00 N ATOM 713 CA VAL A 46 6.827 1.796 3.369 1.00 0.00 C ATOM 714 C VAL A 46 6.091 1.734 4.703 1.00 0.00 C ATOM 715 O VAL A 46 5.821 0.649 5.225 1.00 0.00 O ATOM 716 CB VAL A 46 6.002 1.151 2.233 1.00 0.00 C ATOM 717 CG1 VAL A 46 4.835 2.053 1.815 1.00 0.00 C ATOM 718 CG2 VAL A 46 6.849 0.837 0.994 1.00 0.00 C ATOM 0 H VAL A 46 8.088 0.232 3.941 1.00 0.00 H new ATOM 0 HA VAL A 46 6.970 2.840 3.092 1.00 0.00 H new ATOM 0 HB VAL A 46 5.621 0.213 2.637 1.00 0.00 H new ATOM 0 HG11 VAL A 46 4.273 1.573 1.014 1.00 0.00 H new ATOM 0 HG12 VAL A 46 4.179 2.219 2.670 1.00 0.00 H new ATOM 0 HG13 VAL A 46 5.222 3.009 1.464 1.00 0.00 H new ATOM 0 HG21 VAL A 46 6.219 0.385 0.228 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.285 1.758 0.609 1.00 0.00 H new ATOM 0 HG23 VAL A 46 7.645 0.144 1.264 1.00 0.00 H new ATOM 728 N LEU A 47 5.735 2.895 5.247 1.00 0.00 N ATOM 729 CA LEU A 47 4.765 2.963 6.331 1.00 0.00 C ATOM 730 C LEU A 47 3.398 2.839 5.660 1.00 0.00 C ATOM 731 O LEU A 47 3.018 3.724 4.882 1.00 0.00 O ATOM 732 CB LEU A 47 4.908 4.276 7.133 1.00 0.00 C ATOM 733 CG LEU A 47 5.435 4.057 8.561 1.00 0.00 C ATOM 734 CD1 LEU A 47 6.914 3.661 8.556 1.00 0.00 C ATOM 735 CD2 LEU A 47 5.272 5.336 9.392 1.00 0.00 C ATOM 0 H LEU A 47 6.105 3.799 4.954 1.00 0.00 H new ATOM 0 HA LEU A 47 4.915 2.169 7.062 1.00 0.00 H new ATOM 0 HB2 LEU A 47 5.583 4.947 6.602 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.939 4.772 7.182 1.00 0.00 H new ATOM 0 HG LEU A 47 4.852 3.248 9.001 1.00 0.00 H new ATOM 0 HD11 LEU A 47 7.255 3.514 9.581 1.00 0.00 H new ATOM 0 HD12 LEU A 47 7.041 2.735 7.995 1.00 0.00 H new ATOM 0 HD13 LEU A 47 7.501 4.452 8.089 1.00 0.00 H new ATOM 0 HD21 LEU A 47 5.649 5.165 10.400 1.00 0.00 H new ATOM 0 HD22 LEU A 47 5.833 6.146 8.927 1.00 0.00 H new ATOM 0 HD23 LEU A 47 4.217 5.607 9.440 1.00 0.00 H new ATOM 747 N MET A 48 2.672 1.759 5.915 1.00 0.00 N ATOM 748 CA MET A 48 1.296 1.544 5.479 1.00 0.00 C ATOM 749 C MET A 48 0.444 1.254 6.720 1.00 0.00 C ATOM 750 O MET A 48 0.900 1.417 7.853 1.00 0.00 O ATOM 751 CB MET A 48 1.225 0.437 4.399 1.00 0.00 C ATOM 752 CG MET A 48 0.067 0.690 3.413 1.00 0.00 C ATOM 753 SD MET A 48 -0.232 -0.543 2.119 1.00 0.00 S ATOM 754 CE MET A 48 -1.282 -1.728 3.011 1.00 0.00 C ATOM 0 H MET A 48 3.040 0.975 6.454 1.00 0.00 H new ATOM 0 HA MET A 48 0.894 2.435 4.996 1.00 0.00 H new ATOM 0 HB2 MET A 48 2.168 0.397 3.853 1.00 0.00 H new ATOM 0 HB3 MET A 48 1.092 -0.533 4.878 1.00 0.00 H new ATOM 0 HG2 MET A 48 -0.850 0.794 3.994 1.00 0.00 H new ATOM 0 HG3 MET A 48 0.246 1.649 2.926 1.00 0.00 H new ATOM 0 HE1 MET A 48 -1.405 -2.629 2.410 1.00 0.00 H new ATOM 0 HE2 MET A 48 -0.814 -1.986 3.961 1.00 0.00 H new ATOM 0 HE3 MET A 48 -2.258 -1.281 3.197 1.00 0.00 H new ATOM 764 N THR A 49 -0.812 0.887 6.520 1.00 0.00 N ATOM 765 CA THR A 49 -1.800 0.510 7.520 1.00 0.00 C ATOM 766 C THR A 49 -2.822 -0.347 6.766 1.00 0.00 C ATOM 767 O THR A 49 -2.818 -0.347 5.536 1.00 0.00 O ATOM 768 CB THR A 49 -2.405 1.787 8.153 1.00 0.00 C ATOM 769 OG1 THR A 49 -3.506 1.513 9.009 1.00 0.00 O ATOM 770 CG2 THR A 49 -2.824 2.853 7.134 1.00 0.00 C ATOM 0 H THR A 49 -1.199 0.841 5.577 1.00 0.00 H new ATOM 0 HA THR A 49 -1.389 -0.058 8.355 1.00 0.00 H new ATOM 0 HB THR A 49 -1.582 2.190 8.743 1.00 0.00 H new ATOM 0 HG1 THR A 49 -4.266 1.202 8.475 1.00 0.00 H new ATOM 0 HG21 THR A 49 -3.238 3.715 7.658 1.00 0.00 H new ATOM 0 HG22 THR A 49 -1.955 3.164 6.554 1.00 0.00 H new ATOM 0 HG23 THR A 49 -3.578 2.440 6.464 1.00 0.00 H new ATOM 778 N MET A 50 -3.701 -1.049 7.478 1.00 0.00 N ATOM 779 CA MET A 50 -4.955 -1.555 6.918 1.00 0.00 C ATOM 780 C MET A 50 -6.048 -0.520 7.209 1.00 0.00 C ATOM 781 O MET A 50 -5.817 0.409 7.991 1.00 0.00 O ATOM 782 CB MET A 50 -5.274 -2.933 7.516 1.00 0.00 C ATOM 783 CG MET A 50 -5.013 -4.038 6.490 1.00 0.00 C ATOM 784 SD MET A 50 -3.417 -3.921 5.645 1.00 0.00 S ATOM 785 CE MET A 50 -2.936 -5.640 5.764 1.00 0.00 C ATOM 0 H MET A 50 -3.565 -1.284 8.461 1.00 0.00 H new ATOM 0 HA MET A 50 -4.883 -1.693 5.839 1.00 0.00 H new ATOM 0 HB2 MET A 50 -4.663 -3.101 8.403 1.00 0.00 H new ATOM 0 HB3 MET A 50 -6.316 -2.965 7.836 1.00 0.00 H new ATOM 0 HG2 MET A 50 -5.073 -5.003 6.992 1.00 0.00 H new ATOM 0 HG3 MET A 50 -5.807 -4.017 5.743 1.00 0.00 H new ATOM 0 HE1 MET A 50 -2.186 -5.861 5.005 1.00 0.00 H new ATOM 0 HE2 MET A 50 -2.520 -5.834 6.752 1.00 0.00 H new ATOM 0 HE3 MET A 50 -3.809 -6.274 5.608 1.00 0.00 H new ATOM 795 N THR A 51 -7.243 -0.692 6.643 1.00 0.00 N ATOM 796 CA THR A 51 -8.420 0.109 6.980 1.00 0.00 C ATOM 797 C THR A 51 -8.778 -0.065 8.465 1.00 0.00 C ATOM 798 O THR A 51 -9.099 0.908 9.157 1.00 0.00 O ATOM 799 CB THR A 51 -9.552 -0.337 6.045 1.00 0.00 C ATOM 800 OG1 THR A 51 -9.146 -0.108 4.712 1.00 0.00 O ATOM 801 CG2 THR A 51 -10.943 0.247 6.308 1.00 0.00 C ATOM 0 H THR A 51 -7.423 -1.399 5.930 1.00 0.00 H new ATOM 0 HA THR A 51 -8.234 1.174 6.839 1.00 0.00 H new ATOM 0 HB THR A 51 -9.701 -1.397 6.252 1.00 0.00 H new ATOM 0 HG1 THR A 51 -9.404 0.798 4.442 1.00 0.00 H new ATOM 0 HG21 THR A 51 -11.648 -0.150 5.577 1.00 0.00 H new ATOM 0 HG22 THR A 51 -11.268 -0.026 7.312 1.00 0.00 H new ATOM 0 HG23 THR A 51 -10.904 1.333 6.222 1.00 0.00 H new ATOM 809 N THR A 52 -8.723 -1.300 8.979 1.00 0.00 N ATOM 810 CA THR A 52 -8.897 -1.593 10.397 1.00 0.00 C ATOM 811 C THR A 52 -8.198 -2.918 10.723 1.00 0.00 C ATOM 812 O THR A 52 -8.001 -3.752 9.837 1.00 0.00 O ATOM 813 CB THR A 52 -10.396 -1.533 10.821 1.00 0.00 C ATOM 814 OG1 THR A 52 -10.799 -2.548 11.725 1.00 0.00 O ATOM 815 CG2 THR A 52 -11.441 -1.545 9.694 1.00 0.00 C ATOM 0 H THR A 52 -8.554 -2.130 8.411 1.00 0.00 H new ATOM 0 HA THR A 52 -8.419 -0.821 11.000 1.00 0.00 H new ATOM 0 HB THR A 52 -10.393 -0.551 11.294 1.00 0.00 H new ATOM 0 HG1 THR A 52 -11.774 -2.644 11.696 1.00 0.00 H new ATOM 0 HG21 THR A 52 -12.441 -1.499 10.125 1.00 0.00 H new ATOM 0 HG22 THR A 52 -11.286 -0.683 9.045 1.00 0.00 H new ATOM 0 HG23 THR A 52 -11.338 -2.461 9.112 1.00 0.00 H new ATOM 823 N PRO A 53 -7.852 -3.174 11.995 1.00 0.00 N ATOM 824 CA PRO A 53 -7.308 -4.458 12.417 1.00 0.00 C ATOM 825 C PRO A 53 -8.320 -5.603 12.318 1.00 0.00 C ATOM 826 O PRO A 53 -7.918 -6.764 12.439 1.00 0.00 O ATOM 827 CB PRO A 53 -6.812 -4.235 13.847 1.00 0.00 C ATOM 828 CG PRO A 53 -7.673 -3.083 14.351 1.00 0.00 C ATOM 829 CD PRO A 53 -7.928 -2.242 13.108 1.00 0.00 C ATOM 0 HA PRO A 53 -6.501 -4.776 11.757 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -6.939 -5.128 14.459 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -5.752 -3.982 13.869 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -8.605 -3.443 14.788 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -7.160 -2.509 15.123 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -8.905 -1.760 13.152 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -7.186 -1.450 13.010 1.00 0.00 H new ATOM 837 N MET A 54 -9.602 -5.317 12.067 1.00 0.00 N ATOM 838 CA MET A 54 -10.612 -6.349 11.852 1.00 0.00 C ATOM 839 C MET A 54 -10.642 -6.848 10.397 1.00 0.00 C ATOM 840 O MET A 54 -11.531 -7.633 10.056 1.00 0.00 O ATOM 841 CB MET A 54 -11.989 -5.832 12.313 1.00 0.00 C ATOM 842 CG MET A 54 -12.724 -4.979 11.270 1.00 0.00 C ATOM 843 SD MET A 54 -13.727 -3.654 11.967 1.00 0.00 S ATOM 844 CE MET A 54 -14.613 -3.126 10.478 1.00 0.00 C ATOM 0 H MET A 54 -9.964 -4.365 12.008 1.00 0.00 H new ATOM 0 HA MET A 54 -10.345 -7.217 12.455 1.00 0.00 H new ATOM 0 HB2 MET A 54 -12.615 -6.685 12.575 1.00 0.00 H new ATOM 0 HB3 MET A 54 -11.858 -5.242 13.220 1.00 0.00 H new ATOM 0 HG2 MET A 54 -11.990 -4.544 10.591 1.00 0.00 H new ATOM 0 HG3 MET A 54 -13.365 -5.628 10.673 1.00 0.00 H new ATOM 0 HE1 MET A 54 -14.954 -2.098 10.603 1.00 0.00 H new ATOM 0 HE2 MET A 54 -13.946 -3.186 9.618 1.00 0.00 H new ATOM 0 HE3 MET A 54 -15.473 -3.776 10.316 1.00 0.00 H new ATOM 854 N CYS A 55 -9.759 -6.360 9.511 1.00 0.00 N ATOM 855 CA CYS A 55 -9.777 -6.746 8.104 1.00 0.00 C ATOM 856 C CYS A 55 -9.669 -8.271 7.942 1.00 0.00 C ATOM 857 O CYS A 55 -9.031 -8.951 8.751 1.00 0.00 O ATOM 858 CB CYS A 55 -8.710 -5.981 7.314 1.00 0.00 C ATOM 859 SG CYS A 55 -9.306 -4.285 7.059 1.00 0.00 S ATOM 0 H CYS A 55 -9.024 -5.695 9.752 1.00 0.00 H new ATOM 0 HA CYS A 55 -10.740 -6.464 7.679 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -7.765 -5.975 7.858 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -8.524 -6.467 6.356 1.00 0.00 H new ATOM 0 HG CYS A 55 -8.419 -3.609 6.392 1.00 0.00 H new ATOM 865 N PRO A 56 -10.327 -8.826 6.916 1.00 0.00 N ATOM 866 CA PRO A 56 -10.969 -10.127 7.024 1.00 0.00 C ATOM 867 C PRO A 56 -9.975 -11.271 6.833 1.00 0.00 C ATOM 868 O PRO A 56 -9.997 -12.277 7.549 1.00 0.00 O ATOM 869 CB PRO A 56 -12.034 -10.100 5.929 1.00 0.00 C ATOM 870 CG PRO A 56 -11.444 -9.190 4.845 1.00 0.00 C ATOM 871 CD PRO A 56 -10.630 -8.181 5.649 1.00 0.00 C ATOM 0 HA PRO A 56 -11.395 -10.303 8.012 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -12.233 -11.100 5.543 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -12.980 -9.709 6.304 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -10.820 -9.747 4.146 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -12.223 -8.704 4.258 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -9.716 -7.909 5.122 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -11.194 -7.261 5.805 1.00 0.00 H new ATOM 879 N LEU A 57 -9.078 -11.085 5.872 1.00 0.00 N ATOM 880 CA LEU A 57 -7.963 -11.944 5.545 1.00 0.00 C ATOM 881 C LEU A 57 -6.770 -11.031 5.360 1.00 0.00 C ATOM 882 O LEU A 57 -6.133 -10.999 4.309 1.00 0.00 O ATOM 883 CB LEU A 57 -8.260 -12.888 4.360 1.00 0.00 C ATOM 884 CG LEU A 57 -9.210 -12.355 3.269 1.00 0.00 C ATOM 885 CD1 LEU A 57 -8.642 -11.190 2.453 1.00 0.00 C ATOM 886 CD2 LEU A 57 -9.586 -13.495 2.329 1.00 0.00 C ATOM 0 H LEU A 57 -9.120 -10.269 5.261 1.00 0.00 H new ATOM 0 HA LEU A 57 -7.751 -12.652 6.346 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -7.313 -13.149 3.888 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -8.683 -13.810 4.758 1.00 0.00 H new ATOM 0 HG LEU A 57 -10.083 -11.963 3.790 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -9.374 -10.876 1.709 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -8.419 -10.355 3.117 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -7.728 -11.508 1.952 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -10.258 -13.122 1.556 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.685 -13.896 1.865 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -10.084 -14.283 2.894 1.00 0.00 H new ATOM 898 N ALA A 58 -6.475 -10.253 6.405 1.00 0.00 N ATOM 899 CA ALA A 58 -5.381 -9.308 6.341 1.00 0.00 C ATOM 900 C ALA A 58 -4.052 -10.015 6.035 1.00 0.00 C ATOM 901 O ALA A 58 -3.161 -9.374 5.505 1.00 0.00 O ATOM 902 CB ALA A 58 -5.277 -8.499 7.635 1.00 0.00 C ATOM 0 H ALA A 58 -6.978 -10.265 7.292 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.590 -8.617 5.524 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.447 -7.797 7.559 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.204 -7.949 7.796 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.106 -9.174 8.473 1.00 0.00 H new ATOM 908 N GLY A 59 -3.909 -11.317 6.318 1.00 0.00 N ATOM 909 CA GLY A 59 -2.713 -12.082 5.989 1.00 0.00 C ATOM 910 C GLY A 59 -2.482 -12.146 4.488 1.00 0.00 C ATOM 911 O GLY A 59 -1.361 -11.924 4.033 1.00 0.00 O ATOM 0 H GLY A 59 -4.630 -11.867 6.785 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.847 -11.629 6.472 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.807 -13.093 6.386 1.00 0.00 H new ATOM 915 N MET A 60 -3.545 -12.391 3.720 1.00 0.00 N ATOM 916 CA MET A 60 -3.499 -12.308 2.268 1.00 0.00 C ATOM 917 C MET A 60 -3.087 -10.899 1.871 1.00 0.00 C ATOM 918 O MET A 60 -2.142 -10.760 1.109 1.00 0.00 O ATOM 919 CB MET A 60 -4.857 -12.657 1.654 1.00 0.00 C ATOM 920 CG MET A 60 -4.922 -14.080 1.097 1.00 0.00 C ATOM 921 SD MET A 60 -6.377 -14.385 0.056 1.00 0.00 S ATOM 922 CE MET A 60 -5.876 -13.519 -1.461 1.00 0.00 C ATOM 0 H MET A 60 -4.459 -12.652 4.091 1.00 0.00 H new ATOM 0 HA MET A 60 -2.772 -13.028 1.891 1.00 0.00 H new ATOM 0 HB2 MET A 60 -5.632 -12.535 2.411 1.00 0.00 H new ATOM 0 HB3 MET A 60 -5.078 -11.951 0.854 1.00 0.00 H new ATOM 0 HG2 MET A 60 -4.021 -14.275 0.515 1.00 0.00 H new ATOM 0 HG3 MET A 60 -4.924 -14.787 1.927 1.00 0.00 H new ATOM 0 HE1 MET A 60 -6.565 -13.769 -2.267 1.00 0.00 H new ATOM 0 HE2 MET A 60 -5.895 -12.443 -1.289 1.00 0.00 H new ATOM 0 HE3 MET A 60 -4.867 -13.824 -1.738 1.00 0.00 H new ATOM 932 N ILE A 61 -3.764 -9.873 2.395 1.00 0.00 N ATOM 933 CA ILE A 61 -3.504 -8.479 2.032 1.00 0.00 C ATOM 934 C ILE A 61 -2.024 -8.130 2.285 1.00 0.00 C ATOM 935 O ILE A 61 -1.379 -7.542 1.418 1.00 0.00 O ATOM 936 CB ILE A 61 -4.500 -7.534 2.752 1.00 0.00 C ATOM 937 CG1 ILE A 61 -5.972 -7.898 2.419 1.00 0.00 C ATOM 938 CG2 ILE A 61 -4.234 -6.065 2.370 1.00 0.00 C ATOM 939 CD1 ILE A 61 -7.017 -7.137 3.244 1.00 0.00 C ATOM 0 H ILE A 61 -4.508 -9.987 3.083 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.674 -8.337 0.965 1.00 0.00 H new ATOM 0 HB ILE A 61 -4.346 -7.660 3.824 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.151 -7.704 1.361 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -6.113 -8.968 2.575 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.945 -5.420 2.887 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -3.219 -5.792 2.659 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.350 -5.942 1.293 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -8.017 -7.453 2.946 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -6.870 -7.350 4.303 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -6.908 -6.066 3.070 1.00 0.00 H new ATOM 951 N LEU A 62 -1.453 -8.527 3.429 1.00 0.00 N ATOM 952 CA LEU A 62 -0.037 -8.325 3.745 1.00 0.00 C ATOM 953 C LEU A 62 0.851 -9.019 2.718 1.00 0.00 C ATOM 954 O LEU A 62 1.830 -8.422 2.259 1.00 0.00 O ATOM 955 CB LEU A 62 0.321 -8.870 5.143 1.00 0.00 C ATOM 956 CG LEU A 62 -0.292 -8.111 6.330 1.00 0.00 C ATOM 957 CD1 LEU A 62 -0.089 -8.907 7.626 1.00 0.00 C ATOM 958 CD2 LEU A 62 0.279 -6.710 6.500 1.00 0.00 C ATOM 0 H LEU A 62 -1.969 -9.003 4.169 1.00 0.00 H new ATOM 0 HA LEU A 62 0.136 -7.249 3.726 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.005 -9.912 5.199 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.406 -8.860 5.250 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.355 -8.003 6.114 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.527 -8.360 8.461 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -0.573 -9.880 7.535 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.977 -9.047 7.804 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.194 -6.226 7.354 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.354 -6.773 6.668 1.00 0.00 H new ATOM 0 HD23 LEU A 62 0.086 -6.127 5.600 1.00 0.00 H new ATOM 970 N SER A 63 0.535 -10.278 2.400 1.00 0.00 N ATOM 971 CA SER A 63 1.276 -11.103 1.463 1.00 0.00 C ATOM 972 C SER A 63 1.246 -10.472 0.070 1.00 0.00 C ATOM 973 O SER A 63 2.273 -10.466 -0.606 1.00 0.00 O ATOM 974 CB SER A 63 0.663 -12.511 1.470 1.00 0.00 C ATOM 975 OG SER A 63 1.579 -13.510 1.051 1.00 0.00 O ATOM 0 H SER A 63 -0.269 -10.758 2.804 1.00 0.00 H new ATOM 0 HA SER A 63 2.323 -11.175 1.757 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.312 -12.745 2.475 1.00 0.00 H new ATOM 0 HB3 SER A 63 -0.209 -12.526 0.816 1.00 0.00 H new ATOM 0 HG SER A 63 1.141 -14.386 1.075 1.00 0.00 H new ATOM 981 N ASP A 64 0.092 -9.945 -0.348 1.00 0.00 N ATOM 982 CA ASP A 64 -0.143 -9.348 -1.657 1.00 0.00 C ATOM 983 C ASP A 64 0.595 -8.023 -1.783 1.00 0.00 C ATOM 984 O ASP A 64 1.295 -7.806 -2.769 1.00 0.00 O ATOM 985 CB ASP A 64 -1.646 -9.159 -1.923 1.00 0.00 C ATOM 986 CG ASP A 64 -2.134 -10.119 -3.000 1.00 0.00 C ATOM 987 OD1 ASP A 64 -2.178 -11.349 -2.727 1.00 0.00 O ATOM 988 OD2 ASP A 64 -2.501 -9.677 -4.108 1.00 0.00 O ATOM 0 H ASP A 64 -0.737 -9.924 0.246 1.00 0.00 H new ATOM 0 HA ASP A 64 0.245 -10.033 -2.410 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -2.206 -9.325 -1.002 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -1.838 -8.132 -2.232 1.00 0.00 H new ATOM 994 N ALA A 65 0.497 -7.151 -0.774 1.00 0.00 N ATOM 995 CA ALA A 65 1.226 -5.889 -0.744 1.00 0.00 C ATOM 996 C ALA A 65 2.723 -6.163 -0.907 1.00 0.00 C ATOM 997 O ALA A 65 3.364 -5.613 -1.804 1.00 0.00 O ATOM 998 CB ALA A 65 0.921 -5.135 0.554 1.00 0.00 C ATOM 0 H ALA A 65 -0.092 -7.305 0.044 1.00 0.00 H new ATOM 0 HA ALA A 65 0.906 -5.255 -1.571 1.00 0.00 H new ATOM 0 HB1 ALA A 65 1.471 -4.194 0.566 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -0.148 -4.931 0.614 1.00 0.00 H new ATOM 0 HB3 ALA A 65 1.223 -5.742 1.407 1.00 0.00 H new ATOM 1004 N GLU A 66 3.270 -7.064 -0.087 1.00 0.00 N ATOM 1005 CA GLU A 66 4.656 -7.471 -0.151 1.00 0.00 C ATOM 1006 C GLU A 66 5.001 -8.066 -1.523 1.00 0.00 C ATOM 1007 O GLU A 66 6.083 -7.811 -2.050 1.00 0.00 O ATOM 1008 CB GLU A 66 4.911 -8.468 0.987 1.00 0.00 C ATOM 1009 CG GLU A 66 6.402 -8.540 1.280 1.00 0.00 C ATOM 1010 CD GLU A 66 6.750 -9.714 2.195 1.00 0.00 C ATOM 1011 OE1 GLU A 66 6.629 -10.880 1.755 1.00 0.00 O ATOM 1012 OE2 GLU A 66 7.179 -9.494 3.352 1.00 0.00 O ATOM 0 H GLU A 66 2.743 -7.533 0.650 1.00 0.00 H new ATOM 0 HA GLU A 66 5.306 -6.605 -0.027 1.00 0.00 H new ATOM 0 HB2 GLU A 66 4.369 -8.160 1.881 1.00 0.00 H new ATOM 0 HB3 GLU A 66 4.537 -9.454 0.711 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.951 -8.635 0.343 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.725 -7.609 1.746 1.00 0.00 H new ATOM 1020 N GLU A 67 4.096 -8.856 -2.107 1.00 0.00 N ATOM 1021 CA GLU A 67 4.246 -9.480 -3.418 1.00 0.00 C ATOM 1022 C GLU A 67 4.384 -8.432 -4.520 1.00 0.00 C ATOM 1023 O GLU A 67 5.249 -8.550 -5.387 1.00 0.00 O ATOM 1024 CB GLU A 67 3.081 -10.460 -3.659 1.00 0.00 C ATOM 1025 CG GLU A 67 3.012 -11.016 -5.083 1.00 0.00 C ATOM 1026 CD GLU A 67 2.001 -12.161 -5.163 1.00 0.00 C ATOM 1027 OE1 GLU A 67 0.804 -11.932 -5.468 1.00 0.00 O ATOM 1028 OE2 GLU A 67 2.410 -13.314 -4.899 1.00 0.00 O ATOM 0 H GLU A 67 3.208 -9.085 -1.661 1.00 0.00 H new ATOM 0 HA GLU A 67 5.171 -10.056 -3.442 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.171 -11.292 -2.960 1.00 0.00 H new ATOM 0 HB3 GLU A 67 2.143 -9.954 -3.433 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.728 -10.224 -5.776 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.996 -11.370 -5.389 1.00 0.00 H new ATOM 1036 N ALA A 68 3.564 -7.386 -4.490 1.00 0.00 N ATOM 1037 CA ALA A 68 3.660 -6.349 -5.506 1.00 0.00 C ATOM 1038 C ALA A 68 4.951 -5.579 -5.336 1.00 0.00 C ATOM 1039 O ALA A 68 5.575 -5.191 -6.322 1.00 0.00 O ATOM 1040 CB ALA A 68 2.478 -5.385 -5.486 1.00 0.00 C ATOM 0 H ALA A 68 2.840 -7.237 -3.787 1.00 0.00 H new ATOM 0 HA ALA A 68 3.645 -6.852 -6.473 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.607 -4.635 -6.266 1.00 0.00 H new ATOM 0 HB2 ALA A 68 1.555 -5.937 -5.663 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.426 -4.893 -4.515 1.00 0.00 H new ATOM 1046 N ILE A 69 5.347 -5.331 -4.095 1.00 0.00 N ATOM 1047 CA ILE A 69 6.513 -4.559 -3.743 1.00 0.00 C ATOM 1048 C ILE A 69 7.781 -5.310 -4.137 1.00 0.00 C ATOM 1049 O ILE A 69 8.660 -4.717 -4.749 1.00 0.00 O ATOM 1050 CB ILE A 69 6.398 -4.183 -2.248 1.00 0.00 C ATOM 1051 CG1 ILE A 69 5.333 -3.073 -2.086 1.00 0.00 C ATOM 1052 CG2 ILE A 69 7.752 -3.733 -1.706 1.00 0.00 C ATOM 1053 CD1 ILE A 69 5.048 -2.653 -0.637 1.00 0.00 C ATOM 0 H ILE A 69 4.840 -5.679 -3.281 1.00 0.00 H new ATOM 0 HA ILE A 69 6.575 -3.623 -4.298 1.00 0.00 H new ATOM 0 HB ILE A 69 6.088 -5.055 -1.673 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.657 -2.195 -2.646 1.00 0.00 H new ATOM 0 HG13 ILE A 69 4.402 -3.415 -2.539 1.00 0.00 H new ATOM 0 HG21 ILE A 69 7.654 -3.472 -0.652 1.00 0.00 H new ATOM 0 HG22 ILE A 69 8.474 -4.542 -1.813 1.00 0.00 H new ATOM 0 HG23 ILE A 69 8.097 -2.863 -2.265 1.00 0.00 H new ATOM 0 HD11 ILE A 69 4.289 -1.871 -0.627 1.00 0.00 H new ATOM 0 HD12 ILE A 69 4.689 -3.514 -0.073 1.00 0.00 H new ATOM 0 HD13 ILE A 69 5.963 -2.276 -0.181 1.00 0.00 H new ATOM 1065 N LYS A 70 7.914 -6.598 -3.827 1.00 0.00 N ATOM 1066 CA LYS A 70 9.155 -7.326 -4.083 1.00 0.00 C ATOM 1067 C LYS A 70 9.398 -7.553 -5.574 1.00 0.00 C ATOM 1068 O LYS A 70 10.521 -7.890 -5.949 1.00 0.00 O ATOM 1069 CB LYS A 70 9.182 -8.643 -3.293 1.00 0.00 C ATOM 1070 CG LYS A 70 8.201 -9.693 -3.834 1.00 0.00 C ATOM 1071 CD LYS A 70 8.103 -10.948 -2.957 1.00 0.00 C ATOM 1072 CE LYS A 70 7.432 -10.604 -1.623 1.00 0.00 C ATOM 1073 NZ LYS A 70 7.253 -11.772 -0.749 1.00 0.00 N ATOM 0 H LYS A 70 7.178 -7.159 -3.398 1.00 0.00 H new ATOM 0 HA LYS A 70 9.979 -6.704 -3.732 1.00 0.00 H new ATOM 0 HB2 LYS A 70 10.192 -9.053 -3.316 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.945 -8.438 -2.249 1.00 0.00 H new ATOM 0 HG2 LYS A 70 7.212 -9.243 -3.923 1.00 0.00 H new ATOM 0 HG3 LYS A 70 8.510 -9.984 -4.838 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.531 -11.719 -3.473 1.00 0.00 H new ATOM 0 HD3 LYS A 70 9.098 -11.356 -2.779 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.032 -9.857 -1.103 1.00 0.00 H new ATOM 0 HE3 LYS A 70 6.460 -10.152 -1.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 7.223 -11.462 0.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 6.362 -12.252 -0.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 8.047 -12.430 -0.882 1.00 0.00 H new ATOM 1087 N LYS A 71 8.402 -7.384 -6.447 1.00 0.00 N ATOM 1088 CA LYS A 71 8.484 -7.799 -7.831 1.00 0.00 C ATOM 1089 C LYS A 71 8.877 -6.701 -8.781 1.00 0.00 C ATOM 1090 O LYS A 71 8.944 -6.942 -9.986 1.00 0.00 O ATOM 1091 CB LYS A 71 7.122 -8.364 -8.207 1.00 0.00 C ATOM 1092 CG LYS A 71 7.097 -9.832 -7.784 1.00 0.00 C ATOM 1093 CD LYS A 71 6.083 -10.570 -8.635 1.00 0.00 C ATOM 1094 CE LYS A 71 4.683 -10.545 -8.029 1.00 0.00 C ATOM 1095 NZ LYS A 71 3.646 -10.777 -9.050 1.00 0.00 N ATOM 0 H LYS A 71 7.512 -6.950 -6.201 1.00 0.00 H new ATOM 0 HA LYS A 71 9.278 -8.541 -7.920 1.00 0.00 H new ATOM 0 HB2 LYS A 71 6.327 -7.809 -7.710 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.952 -8.272 -9.280 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.085 -10.276 -7.905 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.836 -9.916 -6.729 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.053 -10.123 -9.629 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.403 -11.604 -8.760 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.608 -11.307 -7.253 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.511 -9.582 -7.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.707 -10.753 -8.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.702 -10.035 -9.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 3.796 -11.707 -9.492 1.00 0.00 H new ATOM 1109 N ILE A 72 9.154 -5.513 -8.271 1.00 0.00 N ATOM 1110 CA ILE A 72 9.426 -4.341 -9.092 1.00 0.00 C ATOM 1111 C ILE A 72 10.880 -4.382 -9.621 1.00 0.00 C ATOM 1112 O ILE A 72 11.551 -3.354 -9.695 1.00 0.00 O ATOM 1113 CB ILE A 72 9.022 -3.047 -8.340 1.00 0.00 C ATOM 1114 CG1 ILE A 72 7.738 -3.194 -7.499 1.00 0.00 C ATOM 1115 CG2 ILE A 72 8.824 -1.898 -9.340 1.00 0.00 C ATOM 1116 CD1 ILE A 72 7.522 -1.978 -6.588 1.00 0.00 C ATOM 0 H ILE A 72 9.197 -5.331 -7.268 1.00 0.00 H new ATOM 0 HA ILE A 72 8.803 -4.346 -9.987 1.00 0.00 H new ATOM 0 HB ILE A 72 9.840 -2.835 -7.651 1.00 0.00 H new ATOM 0 HG12 ILE A 72 6.880 -3.312 -8.160 1.00 0.00 H new ATOM 0 HG13 ILE A 72 7.800 -4.098 -6.893 1.00 0.00 H new ATOM 0 HG21 ILE A 72 8.540 -0.993 -8.803 1.00 0.00 H new ATOM 0 HG22 ILE A 72 9.754 -1.722 -9.881 1.00 0.00 H new ATOM 0 HG23 ILE A 72 8.037 -2.162 -10.047 1.00 0.00 H new ATOM 0 HD11 ILE A 72 6.608 -2.115 -6.009 1.00 0.00 H new ATOM 0 HD12 ILE A 72 8.369 -1.876 -5.910 1.00 0.00 H new ATOM 0 HD13 ILE A 72 7.435 -1.078 -7.197 1.00 0.00 H new ATOM 1128 N GLU A 73 11.361 -5.582 -9.976 1.00 0.00 N ATOM 1129 CA GLU A 73 12.657 -5.937 -10.562 1.00 0.00 C ATOM 1130 C GLU A 73 13.841 -5.082 -10.087 1.00 0.00 C ATOM 1131 O GLU A 73 14.718 -4.711 -10.864 1.00 0.00 O ATOM 1132 CB GLU A 73 12.514 -6.051 -12.094 1.00 0.00 C ATOM 1133 CG GLU A 73 12.299 -4.711 -12.814 1.00 0.00 C ATOM 1134 CD GLU A 73 11.763 -4.899 -14.237 1.00 0.00 C ATOM 1135 OE1 GLU A 73 12.541 -4.908 -15.220 1.00 0.00 O ATOM 1136 OE2 GLU A 73 10.524 -5.011 -14.413 1.00 0.00 O ATOM 0 H GLU A 73 10.788 -6.416 -9.844 1.00 0.00 H new ATOM 0 HA GLU A 73 12.936 -6.918 -10.178 1.00 0.00 H new ATOM 0 HB2 GLU A 73 13.409 -6.526 -12.496 1.00 0.00 H new ATOM 0 HB3 GLU A 73 11.675 -6.709 -12.320 1.00 0.00 H new ATOM 0 HG2 GLU A 73 11.600 -4.101 -12.242 1.00 0.00 H new ATOM 0 HG3 GLU A 73 13.242 -4.165 -12.852 1.00 0.00 H new ATOM 1144 N GLY A 74 13.918 -4.829 -8.784 1.00 0.00 N ATOM 1145 CA GLY A 74 14.860 -3.893 -8.189 1.00 0.00 C ATOM 1146 C GLY A 74 14.834 -3.940 -6.657 1.00 0.00 C ATOM 1147 O GLY A 74 15.862 -3.707 -6.032 1.00 0.00 O ATOM 0 H GLY A 74 13.312 -5.281 -8.099 1.00 0.00 H new ATOM 0 HA2 GLY A 74 15.866 -4.120 -8.541 1.00 0.00 H new ATOM 0 HA3 GLY A 74 14.626 -2.882 -8.524 1.00 0.00 H new ATOM 1151 N VAL A 75 13.661 -4.212 -6.070 1.00 0.00 N ATOM 1152 CA VAL A 75 13.204 -4.194 -4.678 1.00 0.00 C ATOM 1153 C VAL A 75 13.865 -5.187 -3.749 1.00 0.00 C ATOM 1154 O VAL A 75 13.337 -6.249 -3.422 1.00 0.00 O ATOM 1155 CB VAL A 75 11.695 -4.124 -4.545 1.00 0.00 C ATOM 1156 CG1 VAL A 75 11.262 -3.998 -3.095 1.00 0.00 C ATOM 1157 CG2 VAL A 75 11.226 -2.936 -5.374 1.00 0.00 C ATOM 0 H VAL A 75 12.884 -4.497 -6.667 1.00 0.00 H new ATOM 0 HA VAL A 75 13.579 -3.243 -4.300 1.00 0.00 H new ATOM 0 HB VAL A 75 11.242 -5.046 -4.909 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.174 -3.951 -3.043 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.615 -4.863 -2.533 1.00 0.00 H new ATOM 0 HG13 VAL A 75 11.686 -3.090 -2.666 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.142 -2.850 -5.305 1.00 0.00 H new ATOM 0 HG22 VAL A 75 11.687 -2.024 -4.996 1.00 0.00 H new ATOM 0 HG23 VAL A 75 11.513 -3.083 -6.415 1.00 0.00 H new ATOM 1167 N ASN A 76 15.136 -4.935 -3.566 1.00 0.00 N ATOM 1168 CA ASN A 76 16.094 -5.831 -2.984 1.00 0.00 C ATOM 1169 C ASN A 76 15.612 -6.390 -1.656 1.00 0.00 C ATOM 1170 O ASN A 76 15.515 -7.600 -1.467 1.00 0.00 O ATOM 1171 CB ASN A 76 17.392 -5.060 -2.782 1.00 0.00 C ATOM 1172 CG ASN A 76 18.400 -5.856 -1.975 1.00 0.00 C ATOM 1173 OD1 ASN A 76 18.808 -6.935 -2.391 1.00 0.00 O ATOM 1174 ND2 ASN A 76 18.801 -5.348 -0.825 1.00 0.00 N ATOM 0 H ASN A 76 15.552 -4.044 -3.837 1.00 0.00 H new ATOM 0 HA ASN A 76 16.242 -6.679 -3.653 1.00 0.00 H new ATOM 0 HB2 ASN A 76 17.820 -4.809 -3.752 1.00 0.00 H new ATOM 0 HB3 ASN A 76 17.181 -4.119 -2.274 1.00 0.00 H new ATOM 0 HD21 ASN A 76 19.473 -5.856 -0.250 1.00 0.00 H new ATOM 0 HD22 ASN A 76 18.439 -4.447 -0.512 1.00 0.00 H new ATOM 1181 N ASN A 77 15.325 -5.462 -0.752 1.00 0.00 N ATOM 1182 CA ASN A 77 14.824 -5.736 0.587 1.00 0.00 C ATOM 1183 C ASN A 77 13.519 -4.974 0.806 1.00 0.00 C ATOM 1184 O ASN A 77 13.228 -4.030 0.064 1.00 0.00 O ATOM 1185 CB ASN A 77 15.870 -5.290 1.602 1.00 0.00 C ATOM 1186 CG ASN A 77 15.651 -5.981 2.930 1.00 0.00 C ATOM 1187 OD1 ASN A 77 16.007 -7.140 3.095 1.00 0.00 O ATOM 1188 ND2 ASN A 77 15.053 -5.285 3.867 1.00 0.00 N ATOM 0 H ASN A 77 15.439 -4.466 -0.938 1.00 0.00 H new ATOM 0 HA ASN A 77 14.633 -6.802 0.707 1.00 0.00 H new ATOM 0 HB2 ASN A 77 16.868 -5.517 1.228 1.00 0.00 H new ATOM 0 HB3 ASN A 77 15.818 -4.209 1.735 1.00 0.00 H new ATOM 0 HD21 ASN A 77 14.868 -5.708 4.777 1.00 0.00 H new ATOM 0 HD22 ASN A 77 14.773 -4.321 3.686 1.00 0.00 H new ATOM 1195 N VAL A 78 12.735 -5.367 1.809 1.00 0.00 N ATOM 1196 CA VAL A 78 11.327 -5.014 1.919 1.00 0.00 C ATOM 1197 C VAL A 78 11.024 -4.770 3.401 1.00 0.00 C ATOM 1198 O VAL A 78 11.280 -5.648 4.229 1.00 0.00 O ATOM 1199 CB VAL A 78 10.482 -6.152 1.291 1.00 0.00 C ATOM 1200 CG1 VAL A 78 9.038 -5.692 1.085 1.00 0.00 C ATOM 1201 CG2 VAL A 78 11.049 -6.611 -0.065 1.00 0.00 C ATOM 0 H VAL A 78 13.069 -5.948 2.578 1.00 0.00 H new ATOM 0 HA VAL A 78 11.077 -4.102 1.376 1.00 0.00 H new ATOM 0 HB VAL A 78 10.517 -6.991 1.986 1.00 0.00 H new ATOM 0 HG11 VAL A 78 8.458 -6.502 0.643 1.00 0.00 H new ATOM 0 HG12 VAL A 78 8.603 -5.416 2.046 1.00 0.00 H new ATOM 0 HG13 VAL A 78 9.022 -4.829 0.419 1.00 0.00 H new ATOM 0 HG21 VAL A 78 10.426 -7.409 -0.469 1.00 0.00 H new ATOM 0 HG22 VAL A 78 11.057 -5.771 -0.759 1.00 0.00 H new ATOM 0 HG23 VAL A 78 12.066 -6.978 0.072 1.00 0.00 H new ATOM 1211 N GLU A 79 10.589 -3.556 3.756 1.00 0.00 N ATOM 1212 CA GLU A 79 10.538 -3.060 5.132 1.00 0.00 C ATOM 1213 C GLU A 79 9.209 -2.316 5.326 1.00 0.00 C ATOM 1214 O GLU A 79 9.137 -1.084 5.314 1.00 0.00 O ATOM 1215 CB GLU A 79 11.747 -2.142 5.379 1.00 0.00 C ATOM 1216 CG GLU A 79 13.120 -2.795 5.178 1.00 0.00 C ATOM 1217 CD GLU A 79 13.718 -3.404 6.447 1.00 0.00 C ATOM 1218 OE1 GLU A 79 14.008 -4.623 6.469 1.00 0.00 O ATOM 1219 OE2 GLU A 79 14.080 -2.631 7.361 1.00 0.00 O ATOM 0 H GLU A 79 10.254 -2.875 3.075 1.00 0.00 H new ATOM 0 HA GLU A 79 10.587 -3.878 5.851 1.00 0.00 H new ATOM 0 HB2 GLU A 79 11.671 -1.282 4.713 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.690 -1.761 6.399 1.00 0.00 H new ATOM 0 HG2 GLU A 79 13.031 -3.575 4.422 1.00 0.00 H new ATOM 0 HG3 GLU A 79 13.811 -2.048 4.787 1.00 0.00 H new ATOM 1227 N VAL A 80 8.119 -3.065 5.423 1.00 0.00 N ATOM 1228 CA VAL A 80 6.761 -2.531 5.457 1.00 0.00 C ATOM 1229 C VAL A 80 6.286 -2.472 6.910 1.00 0.00 C ATOM 1230 O VAL A 80 6.135 -3.509 7.563 1.00 0.00 O ATOM 1231 CB VAL A 80 5.808 -3.307 4.509 1.00 0.00 C ATOM 1232 CG1 VAL A 80 5.461 -2.435 3.300 1.00 0.00 C ATOM 1233 CG2 VAL A 80 6.350 -4.633 3.959 1.00 0.00 C ATOM 0 H VAL A 80 8.153 -4.083 5.482 1.00 0.00 H new ATOM 0 HA VAL A 80 6.754 -1.513 5.068 1.00 0.00 H new ATOM 0 HB VAL A 80 4.947 -3.546 5.134 1.00 0.00 H new ATOM 0 HG11 VAL A 80 4.792 -2.983 2.636 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.970 -1.523 3.638 1.00 0.00 H new ATOM 0 HG13 VAL A 80 6.374 -2.178 2.763 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.603 -5.090 3.309 1.00 0.00 H new ATOM 0 HG22 VAL A 80 7.260 -4.446 3.390 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.572 -5.307 4.787 1.00 0.00 H new ATOM 1243 N GLU A 81 6.109 -1.270 7.464 1.00 0.00 N ATOM 1244 CA GLU A 81 5.524 -1.105 8.790 1.00 0.00 C ATOM 1245 C GLU A 81 4.014 -1.030 8.631 1.00 0.00 C ATOM 1246 O GLU A 81 3.479 -0.220 7.871 1.00 0.00 O ATOM 1247 CB GLU A 81 6.083 0.124 9.509 1.00 0.00 C ATOM 1248 CG GLU A 81 5.671 0.245 10.993 1.00 0.00 C ATOM 1249 CD GLU A 81 6.235 -0.827 11.941 1.00 0.00 C ATOM 1250 OE1 GLU A 81 5.919 -0.799 13.156 1.00 0.00 O ATOM 1251 OE2 GLU A 81 6.923 -1.782 11.507 1.00 0.00 O ATOM 0 H GLU A 81 6.365 -0.394 7.009 1.00 0.00 H new ATOM 0 HA GLU A 81 5.785 -1.958 9.417 1.00 0.00 H new ATOM 0 HB2 GLU A 81 7.171 0.100 9.449 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.754 1.019 8.980 1.00 0.00 H new ATOM 0 HG2 GLU A 81 5.983 1.224 11.357 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.583 0.216 11.051 1.00 0.00 H new ATOM 1259 N LEU A 82 3.337 -1.912 9.353 1.00 0.00 N ATOM 1260 CA LEU A 82 1.892 -2.001 9.395 1.00 0.00 C ATOM 1261 C LEU A 82 1.420 -1.192 10.592 1.00 0.00 C ATOM 1262 O LEU A 82 1.323 -1.700 11.707 1.00 0.00 O ATOM 1263 CB LEU A 82 1.465 -3.468 9.453 1.00 0.00 C ATOM 1264 CG LEU A 82 -0.061 -3.615 9.392 1.00 0.00 C ATOM 1265 CD1 LEU A 82 -0.630 -3.256 8.012 1.00 0.00 C ATOM 1266 CD2 LEU A 82 -0.403 -5.059 9.746 1.00 0.00 C ATOM 0 H LEU A 82 3.797 -2.605 9.943 1.00 0.00 H new ATOM 0 HA LEU A 82 1.432 -1.589 8.497 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.917 -4.012 8.624 1.00 0.00 H new ATOM 0 HB3 LEU A 82 1.838 -3.920 10.372 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.512 -2.919 10.099 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -1.713 -3.377 8.022 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -0.382 -2.221 7.774 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -0.199 -3.915 7.258 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -1.484 -5.196 9.711 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.071 -5.731 9.031 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -0.041 -5.283 10.749 1.00 0.00 H new ATOM 1278 N THR A 83 1.207 0.091 10.349 1.00 0.00 N ATOM 1279 CA THR A 83 1.005 1.101 11.363 1.00 0.00 C ATOM 1280 C THR A 83 -0.455 1.060 11.823 1.00 0.00 C ATOM 1281 O THR A 83 -1.332 1.539 11.107 1.00 0.00 O ATOM 1282 CB THR A 83 1.386 2.468 10.760 1.00 0.00 C ATOM 1283 OG1 THR A 83 2.490 2.398 9.874 1.00 0.00 O ATOM 1284 CG2 THR A 83 1.735 3.421 11.886 1.00 0.00 C ATOM 0 H THR A 83 1.169 0.467 9.402 1.00 0.00 H new ATOM 0 HA THR A 83 1.631 0.923 12.238 1.00 0.00 H new ATOM 0 HB THR A 83 0.526 2.815 10.186 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.184 2.098 8.993 1.00 0.00 H new ATOM 0 HG21 THR A 83 2.006 4.391 11.470 1.00 0.00 H new ATOM 0 HG22 THR A 83 0.875 3.536 12.545 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.576 3.022 12.453 1.00 0.00 H new ATOM 1292 N PHE A 84 -0.749 0.457 12.979 1.00 0.00 N ATOM 1293 CA PHE A 84 -2.127 0.134 13.352 1.00 0.00 C ATOM 1294 C PHE A 84 -2.709 1.061 14.415 1.00 0.00 C ATOM 1295 O PHE A 84 -3.903 1.010 14.704 1.00 0.00 O ATOM 1296 CB PHE A 84 -2.213 -1.336 13.814 1.00 0.00 C ATOM 1297 CG PHE A 84 -2.901 -2.285 12.849 1.00 0.00 C ATOM 1298 CD1 PHE A 84 -4.111 -1.931 12.214 1.00 0.00 C ATOM 1299 CD2 PHE A 84 -2.331 -3.546 12.594 1.00 0.00 C ATOM 1300 CE1 PHE A 84 -4.662 -2.775 11.238 1.00 0.00 C ATOM 1301 CE2 PHE A 84 -2.942 -4.428 11.688 1.00 0.00 C ATOM 1302 CZ PHE A 84 -4.083 -4.028 10.975 1.00 0.00 C ATOM 0 H PHE A 84 -0.051 0.184 13.671 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.734 0.284 12.459 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -1.202 -1.701 13.997 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -2.741 -1.369 14.767 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -4.612 -1.012 12.479 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -1.420 -3.837 13.097 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -5.535 -2.460 10.686 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.533 -5.416 11.539 1.00 0.00 H new ATOM 0 HZ PHE A 84 -4.513 -4.679 10.229 1.00 0.00 H new ATOM 1312 N ASP A 85 -1.865 1.869 15.057 1.00 0.00 N ATOM 1313 CA ASP A 85 -2.288 2.857 16.046 1.00 0.00 C ATOM 1314 C ASP A 85 -2.950 4.090 15.429 1.00 0.00 C ATOM 1315 O ASP A 85 -3.942 4.559 16.006 1.00 0.00 O ATOM 1316 CB ASP A 85 -1.167 3.342 16.987 1.00 0.00 C ATOM 1317 CG ASP A 85 0.173 2.621 16.910 1.00 0.00 C ATOM 1318 OD1 ASP A 85 0.188 1.372 17.010 1.00 0.00 O ATOM 1319 OD2 ASP A 85 1.198 3.310 16.729 1.00 0.00 O ATOM 0 H ASP A 85 -0.857 1.855 14.902 1.00 0.00 H new ATOM 0 HA ASP A 85 -3.018 2.301 16.634 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -0.993 4.399 16.787 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -1.531 3.268 18.012 1.00 0.00 H new ATOM 1325 N PRO A 86 -2.437 4.695 14.346 1.00 0.00 N ATOM 1326 CA PRO A 86 -3.074 5.874 13.804 1.00 0.00 C ATOM 1327 C PRO A 86 -4.417 5.496 13.171 1.00 0.00 C ATOM 1328 O PRO A 86 -4.581 4.379 12.667 1.00 0.00 O ATOM 1329 CB PRO A 86 -2.094 6.484 12.802 1.00 0.00 C ATOM 1330 CG PRO A 86 -1.259 5.291 12.364 1.00 0.00 C ATOM 1331 CD PRO A 86 -1.213 4.419 13.612 1.00 0.00 C ATOM 0 HA PRO A 86 -3.302 6.611 14.574 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -2.612 6.944 11.960 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -1.480 7.259 13.260 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -1.715 4.767 11.524 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -0.261 5.593 12.047 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.148 3.364 13.347 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.336 4.651 14.217 1.00 0.00 H new ATOM 1339 N PRO A 87 -5.393 6.412 13.164 1.00 0.00 N ATOM 1340 CA PRO A 87 -6.566 6.312 12.314 1.00 0.00 C ATOM 1341 C PRO A 87 -6.134 6.626 10.874 1.00 0.00 C ATOM 1342 O PRO A 87 -5.438 7.618 10.653 1.00 0.00 O ATOM 1343 CB PRO A 87 -7.549 7.322 12.907 1.00 0.00 C ATOM 1344 CG PRO A 87 -6.650 8.404 13.505 1.00 0.00 C ATOM 1345 CD PRO A 87 -5.370 7.662 13.898 1.00 0.00 C ATOM 0 HA PRO A 87 -7.036 5.329 12.277 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -8.211 7.730 12.144 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -8.182 6.864 13.667 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -6.445 9.194 12.783 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -7.117 8.876 14.370 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -4.486 8.247 13.645 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -5.337 7.483 14.973 1.00 0.00 H new ATOM 1353 N TRP A 88 -6.509 5.770 9.919 1.00 0.00 N ATOM 1354 CA TRP A 88 -6.262 5.900 8.482 1.00 0.00 C ATOM 1355 C TRP A 88 -7.086 7.078 7.951 1.00 0.00 C ATOM 1356 O TRP A 88 -6.646 8.207 8.131 1.00 0.00 O ATOM 1357 CB TRP A 88 -6.466 4.519 7.829 1.00 0.00 C ATOM 1358 CG TRP A 88 -6.870 4.403 6.394 1.00 0.00 C ATOM 1359 CD1 TRP A 88 -6.149 4.720 5.289 1.00 0.00 C ATOM 1360 CD2 TRP A 88 -8.153 3.930 5.906 1.00 0.00 C ATOM 1361 NE1 TRP A 88 -6.882 4.414 4.154 1.00 0.00 N ATOM 1362 CE2 TRP A 88 -8.106 3.900 4.488 1.00 0.00 C ATOM 1363 CE3 TRP A 88 -9.360 3.554 6.529 1.00 0.00 C ATOM 1364 CZ2 TRP A 88 -9.206 3.513 3.726 1.00 0.00 C ATOM 1365 CZ3 TRP A 88 -10.516 3.329 5.761 1.00 0.00 C ATOM 1366 CH2 TRP A 88 -10.437 3.320 4.359 1.00 0.00 C ATOM 0 H TRP A 88 -7.023 4.918 10.143 1.00 0.00 H new ATOM 0 HA TRP A 88 -5.237 6.164 8.223 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -5.532 3.969 7.944 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -7.219 3.995 8.417 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -5.156 5.145 5.294 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -6.554 4.553 3.198 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -9.397 3.438 7.602 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -9.109 3.364 2.661 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -11.465 3.163 6.249 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -11.328 3.164 3.769 1.00 0.00 H new ATOM 1377 N THR A 89 -8.279 6.853 7.396 1.00 0.00 N ATOM 1378 CA THR A 89 -9.319 7.799 6.976 1.00 0.00 C ATOM 1379 C THR A 89 -10.187 7.017 5.975 1.00 0.00 C ATOM 1380 O THR A 89 -9.645 6.529 4.990 1.00 0.00 O ATOM 1381 CB THR A 89 -8.739 9.132 6.413 1.00 0.00 C ATOM 1382 OG1 THR A 89 -8.524 10.085 7.434 1.00 0.00 O ATOM 1383 CG2 THR A 89 -9.619 9.857 5.404 1.00 0.00 C ATOM 0 H THR A 89 -8.574 5.895 7.208 1.00 0.00 H new ATOM 0 HA THR A 89 -9.919 8.145 7.818 1.00 0.00 H new ATOM 0 HB THR A 89 -7.823 8.793 5.930 1.00 0.00 H new ATOM 0 HG1 THR A 89 -7.809 9.773 8.027 1.00 0.00 H new ATOM 0 HG21 THR A 89 -9.122 10.770 5.077 1.00 0.00 H new ATOM 0 HG22 THR A 89 -9.794 9.211 4.544 1.00 0.00 H new ATOM 0 HG23 THR A 89 -10.572 10.109 5.868 1.00 0.00 H new ATOM 1391 N PRO A 90 -11.509 6.862 6.153 1.00 0.00 N ATOM 1392 CA PRO A 90 -12.389 6.254 5.154 1.00 0.00 C ATOM 1393 C PRO A 90 -12.799 7.264 4.083 1.00 0.00 C ATOM 1394 O PRO A 90 -13.692 6.967 3.297 1.00 0.00 O ATOM 1395 CB PRO A 90 -13.584 5.754 5.970 1.00 0.00 C ATOM 1396 CG PRO A 90 -13.742 6.837 7.042 1.00 0.00 C ATOM 1397 CD PRO A 90 -12.339 7.441 7.200 1.00 0.00 C ATOM 0 HA PRO A 90 -11.908 5.448 4.600 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.480 5.658 5.357 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -13.392 4.775 6.409 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -14.466 7.593 6.737 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -14.099 6.415 7.981 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -12.374 8.527 7.109 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -11.930 7.216 8.185 1.00 0.00 H new ATOM 1405 N GLU A 91 -12.169 8.431 4.018 1.00 0.00 N ATOM 1406 CA GLU A 91 -12.313 9.479 3.029 1.00 0.00 C ATOM 1407 C GLU A 91 -11.186 9.511 1.990 1.00 0.00 C ATOM 1408 O GLU A 91 -11.168 10.404 1.150 1.00 0.00 O ATOM 1409 CB GLU A 91 -12.460 10.841 3.728 1.00 0.00 C ATOM 1410 CG GLU A 91 -13.685 11.588 3.211 1.00 0.00 C ATOM 1411 CD GLU A 91 -13.453 13.048 2.829 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -13.461 13.343 1.606 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -13.307 13.909 3.729 1.00 0.00 O ATOM 0 H GLU A 91 -11.481 8.686 4.726 1.00 0.00 H new ATOM 0 HA GLU A 91 -13.219 9.255 2.465 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -12.546 10.694 4.805 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -11.565 11.440 3.558 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -14.070 11.059 2.339 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -14.461 11.550 3.975 1.00 0.00 H new ATOM 1421 N ARG A 92 -10.199 8.608 2.058 1.00 0.00 N ATOM 1422 CA ARG A 92 -9.070 8.647 1.125 1.00 0.00 C ATOM 1423 C ARG A 92 -9.420 8.024 -0.223 1.00 0.00 C ATOM 1424 O ARG A 92 -8.747 8.320 -1.211 1.00 0.00 O ATOM 1425 CB ARG A 92 -7.841 7.896 1.645 1.00 0.00 C ATOM 1426 CG ARG A 92 -7.428 8.302 3.065 1.00 0.00 C ATOM 1427 CD ARG A 92 -5.906 8.183 3.219 1.00 0.00 C ATOM 1428 NE ARG A 92 -5.301 9.372 3.831 1.00 0.00 N ATOM 1429 CZ ARG A 92 -3.988 9.624 3.846 1.00 0.00 C ATOM 1430 NH1 ARG A 92 -3.099 8.694 3.510 1.00 0.00 N ATOM 1431 NH2 ARG A 92 -3.563 10.834 4.179 1.00 0.00 N ATOM 0 H ARG A 92 -10.160 7.851 2.741 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.844 9.708 1.019 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.046 6.826 1.627 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.005 8.072 0.968 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.744 9.326 3.267 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -7.927 7.665 3.795 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -5.674 7.309 3.828 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -5.458 8.017 2.239 1.00 0.00 H new ATOM 0 HE ARG A 92 -5.922 10.050 4.273 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -3.414 7.764 3.233 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -2.102 8.910 3.529 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -4.235 11.562 4.421 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -2.564 11.037 4.194 1.00 0.00 H new ATOM 1445 N MET A 93 -10.389 7.106 -0.274 1.00 0.00 N ATOM 1446 CA MET A 93 -10.714 6.364 -1.492 1.00 0.00 C ATOM 1447 C MET A 93 -11.157 7.304 -2.617 1.00 0.00 C ATOM 1448 O MET A 93 -11.384 8.497 -2.394 1.00 0.00 O ATOM 1449 CB MET A 93 -11.760 5.260 -1.263 1.00 0.00 C ATOM 1450 CG MET A 93 -11.493 4.347 -0.058 1.00 0.00 C ATOM 1451 SD MET A 93 -12.541 2.879 -0.065 1.00 0.00 S ATOM 1452 CE MET A 93 -14.076 3.540 0.626 1.00 0.00 C ATOM 0 H MET A 93 -10.969 6.858 0.528 1.00 0.00 H new ATOM 0 HA MET A 93 -9.793 5.867 -1.796 1.00 0.00 H new ATOM 0 HB2 MET A 93 -12.736 5.727 -1.135 1.00 0.00 H new ATOM 0 HB3 MET A 93 -11.817 4.644 -2.160 1.00 0.00 H new ATOM 0 HG2 MET A 93 -10.446 4.043 -0.060 1.00 0.00 H new ATOM 0 HG3 MET A 93 -11.661 4.906 0.863 1.00 0.00 H new ATOM 0 HE1 MET A 93 -14.821 2.746 0.683 1.00 0.00 H new ATOM 0 HE2 MET A 93 -13.886 3.932 1.625 1.00 0.00 H new ATOM 0 HE3 MET A 93 -14.448 4.341 -0.013 1.00 0.00 H new ATOM 1462 N SER A 94 -11.310 6.784 -3.840 1.00 0.00 N ATOM 1463 CA SER A 94 -11.781 7.607 -4.949 1.00 0.00 C ATOM 1464 C SER A 94 -13.114 8.277 -4.586 1.00 0.00 C ATOM 1465 O SER A 94 -13.927 7.676 -3.879 1.00 0.00 O ATOM 1466 CB SER A 94 -11.961 6.741 -6.193 1.00 0.00 C ATOM 1467 OG SER A 94 -10.716 6.170 -6.543 1.00 0.00 O ATOM 0 H SER A 94 -11.117 5.812 -4.081 1.00 0.00 H new ATOM 0 HA SER A 94 -11.042 8.382 -5.151 1.00 0.00 H new ATOM 0 HB2 SER A 94 -12.694 5.957 -6.003 1.00 0.00 H new ATOM 0 HB3 SER A 94 -12.344 7.342 -7.018 1.00 0.00 H new ATOM 0 HG SER A 94 -10.825 5.611 -7.341 1.00 0.00 H new ATOM 1473 N PRO A 95 -13.372 9.495 -5.079 1.00 0.00 N ATOM 1474 CA PRO A 95 -14.510 10.290 -4.633 1.00 0.00 C ATOM 1475 C PRO A 95 -15.842 9.632 -5.007 1.00 0.00 C ATOM 1476 O PRO A 95 -16.822 9.752 -4.280 1.00 0.00 O ATOM 1477 CB PRO A 95 -14.295 11.655 -5.289 1.00 0.00 C ATOM 1478 CG PRO A 95 -13.503 11.331 -6.558 1.00 0.00 C ATOM 1479 CD PRO A 95 -12.580 10.229 -6.056 1.00 0.00 C ATOM 0 HA PRO A 95 -14.567 10.381 -3.548 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -15.243 12.140 -5.522 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -13.743 12.330 -4.635 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -14.147 10.991 -7.369 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -12.950 12.194 -6.930 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -12.258 9.581 -6.871 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -11.679 10.643 -5.604 1.00 0.00 H new ATOM 1487 N GLU A 96 -15.847 8.838 -6.079 1.00 0.00 N ATOM 1488 CA GLU A 96 -16.990 8.075 -6.528 1.00 0.00 C ATOM 1489 C GLU A 96 -17.336 6.992 -5.504 1.00 0.00 C ATOM 1490 O GLU A 96 -18.518 6.705 -5.294 1.00 0.00 O ATOM 1491 CB GLU A 96 -16.613 7.466 -7.882 1.00 0.00 C ATOM 1492 CG GLU A 96 -17.798 6.778 -8.556 1.00 0.00 C ATOM 1493 CD GLU A 96 -17.408 6.035 -9.827 1.00 0.00 C ATOM 1494 OE1 GLU A 96 -16.377 5.316 -9.833 1.00 0.00 O ATOM 1495 OE2 GLU A 96 -18.163 6.151 -10.818 1.00 0.00 O ATOM 0 H GLU A 96 -15.025 8.711 -6.670 1.00 0.00 H new ATOM 0 HA GLU A 96 -17.874 8.705 -6.632 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -16.230 8.249 -8.536 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -15.808 6.745 -7.742 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -18.251 6.076 -7.855 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -18.556 7.523 -8.795 1.00 0.00 H new ATOM 1503 N LEU A 97 -16.319 6.394 -4.861 1.00 0.00 N ATOM 1504 CA LEU A 97 -16.541 5.404 -3.818 1.00 0.00 C ATOM 1505 C LEU A 97 -17.049 6.059 -2.549 1.00 0.00 C ATOM 1506 O LEU A 97 -17.849 5.434 -1.866 1.00 0.00 O ATOM 1507 CB LEU A 97 -15.290 4.597 -3.435 1.00 0.00 C ATOM 1508 CG LEU A 97 -14.983 3.379 -4.314 1.00 0.00 C ATOM 1509 CD1 LEU A 97 -13.680 2.765 -3.809 1.00 0.00 C ATOM 1510 CD2 LEU A 97 -16.060 2.294 -4.233 1.00 0.00 C ATOM 0 H LEU A 97 -15.336 6.586 -5.053 1.00 0.00 H new ATOM 0 HA LEU A 97 -17.274 4.721 -4.247 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -14.429 5.265 -3.460 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -15.401 4.258 -2.405 1.00 0.00 H new ATOM 0 HG LEU A 97 -14.929 3.721 -5.348 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -13.430 1.893 -4.414 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -12.879 3.500 -3.884 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -13.799 2.463 -2.769 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -15.784 1.459 -4.877 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -16.148 1.945 -3.204 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -17.015 2.705 -4.560 1.00 0.00 H new ATOM 1522 N ARG A 98 -16.602 7.276 -2.217 1.00 0.00 N ATOM 1523 CA ARG A 98 -17.062 7.969 -1.012 1.00 0.00 C ATOM 1524 C ARG A 98 -18.588 8.028 -1.038 1.00 0.00 C ATOM 1525 O ARG A 98 -19.233 7.607 -0.082 1.00 0.00 O ATOM 1526 CB ARG A 98 -16.436 9.373 -0.882 1.00 0.00 C ATOM 1527 CG ARG A 98 -14.905 9.346 -0.750 1.00 0.00 C ATOM 1528 CD ARG A 98 -14.246 10.727 -0.860 1.00 0.00 C ATOM 1529 NE ARG A 98 -12.857 10.607 -1.331 1.00 0.00 N ATOM 1530 CZ ARG A 98 -11.859 11.500 -1.286 1.00 0.00 C ATOM 1531 NH1 ARG A 98 -11.984 12.671 -0.665 1.00 0.00 N ATOM 1532 NH2 ARG A 98 -10.716 11.185 -1.886 1.00 0.00 N ATOM 0 H ARG A 98 -15.922 7.800 -2.768 1.00 0.00 H new ATOM 0 HA ARG A 98 -16.737 7.415 -0.131 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -16.708 9.967 -1.755 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -16.860 9.873 -0.011 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -14.641 8.904 0.211 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -14.495 8.696 -1.523 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -14.815 11.353 -1.547 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -14.264 11.222 0.111 1.00 0.00 H new ATOM 0 HE ARG A 98 -12.618 9.710 -1.755 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -12.861 12.912 -0.203 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -11.203 13.327 -0.651 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -10.620 10.287 -2.361 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -9.935 11.841 -1.872 1.00 0.00 H new ATOM 1546 N GLU A 99 -19.157 8.448 -2.164 1.00 0.00 N ATOM 1547 CA GLU A 99 -20.599 8.501 -2.357 1.00 0.00 C ATOM 1548 C GLU A 99 -21.232 7.105 -2.447 1.00 0.00 C ATOM 1549 O GLU A 99 -22.272 6.862 -1.827 1.00 0.00 O ATOM 1550 CB GLU A 99 -20.886 9.319 -3.624 1.00 0.00 C ATOM 1551 CG GLU A 99 -20.568 10.805 -3.420 1.00 0.00 C ATOM 1552 CD GLU A 99 -21.508 11.439 -2.393 1.00 0.00 C ATOM 1553 OE1 GLU A 99 -21.119 11.557 -1.204 1.00 0.00 O ATOM 1554 OE2 GLU A 99 -22.654 11.753 -2.779 1.00 0.00 O ATOM 0 H GLU A 99 -18.624 8.764 -2.974 1.00 0.00 H new ATOM 0 HA GLU A 99 -21.052 8.978 -1.488 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -20.293 8.930 -4.451 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -21.934 9.205 -3.902 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -19.536 10.916 -3.088 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -20.656 11.332 -4.370 1.00 0.00 H new ATOM 1562 N LYS A 100 -20.626 6.191 -3.215 1.00 0.00 N ATOM 1563 CA LYS A 100 -21.200 4.876 -3.512 1.00 0.00 C ATOM 1564 C LYS A 100 -21.221 3.969 -2.286 1.00 0.00 C ATOM 1565 O LYS A 100 -22.127 3.146 -2.177 1.00 0.00 O ATOM 1566 CB LYS A 100 -20.433 4.241 -4.681 1.00 0.00 C ATOM 1567 CG LYS A 100 -21.111 3.047 -5.378 1.00 0.00 C ATOM 1568 CD LYS A 100 -20.679 1.649 -4.890 1.00 0.00 C ATOM 1569 CE LYS A 100 -20.607 0.724 -6.114 1.00 0.00 C ATOM 1570 NZ LYS A 100 -20.441 -0.706 -5.797 1.00 0.00 N ATOM 0 H LYS A 100 -19.717 6.346 -3.650 1.00 0.00 H new ATOM 0 HA LYS A 100 -22.242 5.008 -3.803 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -20.249 5.013 -5.428 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -19.460 3.915 -4.314 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -22.189 3.139 -5.247 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -20.912 3.115 -6.448 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -19.710 1.701 -4.393 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -21.391 1.262 -4.161 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -21.517 0.849 -6.701 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -19.776 1.041 -6.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -20.402 -1.255 -6.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -19.558 -0.843 -5.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -21.245 -1.030 -5.223 1.00 0.00 H new ATOM 1584 N PHE A 101 -20.235 4.066 -1.394 1.00 0.00 N ATOM 1585 CA PHE A 101 -20.280 3.401 -0.101 1.00 0.00 C ATOM 1586 C PHE A 101 -21.152 4.203 0.857 1.00 0.00 C ATOM 1587 O PHE A 101 -22.035 3.615 1.484 1.00 0.00 O ATOM 1588 CB PHE A 101 -18.871 3.111 0.443 1.00 0.00 C ATOM 1589 CG PHE A 101 -18.373 1.769 -0.060 1.00 0.00 C ATOM 1590 CD1 PHE A 101 -18.192 1.550 -1.440 1.00 0.00 C ATOM 1591 CD2 PHE A 101 -18.210 0.695 0.838 1.00 0.00 C ATOM 1592 CE1 PHE A 101 -17.924 0.258 -1.924 1.00 0.00 C ATOM 1593 CE2 PHE A 101 -17.916 -0.593 0.355 1.00 0.00 C ATOM 1594 CZ PHE A 101 -17.803 -0.818 -1.028 1.00 0.00 C ATOM 0 H PHE A 101 -19.386 4.608 -1.552 1.00 0.00 H new ATOM 0 HA PHE A 101 -20.742 2.421 -0.216 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -18.185 3.900 0.133 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -18.888 3.114 1.533 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -18.260 2.379 -2.129 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -18.311 0.861 1.900 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -17.811 0.092 -2.985 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -17.777 -1.410 1.048 1.00 0.00 H new ATOM 0 HZ PHE A 101 -17.624 -1.815 -1.401 1.00 0.00 H new ATOM 1604 N GLY A 102 -20.954 5.516 0.951 1.00 0.00 N ATOM 1605 CA GLY A 102 -21.708 6.382 1.840 1.00 0.00 C ATOM 1606 C GLY A 102 -20.838 6.783 3.013 1.00 0.00 C ATOM 1607 O GLY A 102 -21.077 6.376 4.150 1.00 0.00 O ATOM 0 H GLY A 102 -20.253 6.011 0.401 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -22.044 7.269 1.303 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -22.601 5.868 2.195 1.00 0.00 H new ATOM 1611 N VAL A 103 -19.788 7.539 2.718 1.00 0.00 N ATOM 1612 CA VAL A 103 -19.079 8.334 3.700 1.00 0.00 C ATOM 1613 C VAL A 103 -20.039 9.466 4.037 1.00 0.00 C ATOM 1614 O VAL A 103 -20.367 9.596 5.235 1.00 0.00 O ATOM 1615 CB VAL A 103 -17.729 8.787 3.122 1.00 0.00 C ATOM 1616 CG1 VAL A 103 -16.924 9.585 4.153 1.00 0.00 C ATOM 1617 CG2 VAL A 103 -16.884 7.569 2.703 1.00 0.00 C ATOM 0 H VAL A 103 -19.404 7.615 1.776 1.00 0.00 H new ATOM 0 HA VAL A 103 -18.814 7.798 4.611 1.00 0.00 H new ATOM 0 HB VAL A 103 -17.946 9.415 2.258 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -15.974 9.892 3.715 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -17.488 10.469 4.450 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -16.736 8.963 5.028 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -15.932 7.909 2.296 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -16.702 6.936 3.572 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -17.420 6.998 1.944 1.00 0.00 H new TER 1627 VAL A 103