USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 836 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 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.0513 K(o=-0.051,f=-2.3!) USER MOD Single : A 12 ASN : amide:sc= -0.192 X(o=-0.19,f=-0.013) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0.13) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.1 USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 CYS SG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 LYS NZ :NH3+ -151:sc= 0.434 (180deg=-0.983) USER MOD Single : A 41 SER OG : rot 170:sc= -0.703 USER MOD Single : A 43 HIS : no HD1:sc= -0.101 X(o=-0.1,f=-0.32) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot -170:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -135:sc= 0.929 (180deg=0.118) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.0364 K(o=-0.036,f=-0.83) USER MOD Single : A 93 GLN : amide:sc= -0.158 X(o=-0.16,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.609 10.896 -14.069 1.00 0.00 N ATOM 2 CA GLY A 1 -17.205 11.940 -13.145 1.00 0.00 C ATOM 3 C GLY A 1 -15.807 11.722 -12.601 1.00 0.00 C ATOM 4 O GLY A 1 -14.853 11.568 -13.363 1.00 0.00 O ATOM 0 H1 GLY A 1 -18.571 11.090 -14.413 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.952 10.872 -14.875 1.00 0.00 H new ATOM 0 H3 GLY A 1 -17.594 9.977 -13.582 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.249 12.905 -13.650 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -17.912 11.981 -12.316 1.00 0.00 H new ATOM 8 N SER A 2 -15.684 11.711 -11.277 1.00 0.00 N ATOM 9 CA SER A 2 -14.392 11.517 -10.631 1.00 0.00 C ATOM 10 C SER A 2 -13.391 12.573 -11.089 1.00 0.00 C ATOM 11 O SER A 2 -13.737 13.490 -11.834 1.00 0.00 O ATOM 12 CB SER A 2 -13.850 10.119 -10.937 1.00 0.00 C ATOM 13 OG SER A 2 -13.475 9.446 -9.747 1.00 0.00 O ATOM 0 H SER A 2 -16.464 11.834 -10.631 1.00 0.00 H new ATOM 0 HA SER A 2 -14.533 11.618 -9.555 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.608 9.539 -11.463 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.989 10.196 -11.601 1.00 0.00 H new ATOM 0 HG SER A 2 -13.134 8.555 -9.969 1.00 0.00 H new ATOM 19 N SER A 3 -12.148 12.438 -10.636 1.00 0.00 N ATOM 20 CA SER A 3 -11.097 13.382 -10.995 1.00 0.00 C ATOM 21 C SER A 3 -10.626 13.152 -12.428 1.00 0.00 C ATOM 22 O SER A 3 -10.685 14.051 -13.265 1.00 0.00 O ATOM 23 CB SER A 3 -9.916 13.255 -10.031 1.00 0.00 C ATOM 24 OG SER A 3 -9.425 14.529 -9.655 1.00 0.00 O ATOM 0 H SER A 3 -11.845 11.684 -10.020 1.00 0.00 H new ATOM 0 HA SER A 3 -11.508 14.389 -10.923 1.00 0.00 H new ATOM 0 HB2 SER A 3 -10.225 12.704 -9.143 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.119 12.679 -10.501 1.00 0.00 H new ATOM 0 HG SER A 3 -8.672 14.420 -9.037 1.00 0.00 H new ATOM 30 N GLY A 4 -10.157 11.938 -12.702 1.00 0.00 N ATOM 31 CA GLY A 4 -9.682 11.609 -14.034 1.00 0.00 C ATOM 32 C GLY A 4 -10.272 10.315 -14.557 1.00 0.00 C ATOM 33 O GLY A 4 -11.223 9.782 -13.985 1.00 0.00 O ATOM 0 H GLY A 4 -10.098 11.177 -12.026 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.933 12.421 -14.717 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.595 11.529 -14.019 1.00 0.00 H new ATOM 37 N SER A 5 -9.708 9.808 -15.649 1.00 0.00 N ATOM 38 CA SER A 5 -10.189 8.571 -16.253 1.00 0.00 C ATOM 39 C SER A 5 -9.281 7.400 -15.887 1.00 0.00 C ATOM 40 O SER A 5 -9.741 6.269 -15.733 1.00 0.00 O ATOM 41 CB SER A 5 -10.264 8.717 -17.774 1.00 0.00 C ATOM 42 OG SER A 5 -11.403 9.467 -18.159 1.00 0.00 O ATOM 0 H SER A 5 -8.918 10.235 -16.133 1.00 0.00 H new ATOM 0 HA SER A 5 -11.188 8.370 -15.865 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.362 9.206 -18.140 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.301 7.730 -18.236 1.00 0.00 H new ATOM 0 HG SER A 5 -11.427 9.547 -19.135 1.00 0.00 H new ATOM 48 N SER A 6 -7.989 7.681 -15.750 1.00 0.00 N ATOM 49 CA SER A 6 -7.016 6.652 -15.406 1.00 0.00 C ATOM 50 C SER A 6 -6.973 5.565 -16.476 1.00 0.00 C ATOM 51 O SER A 6 -7.714 5.615 -17.457 1.00 0.00 O ATOM 52 CB SER A 6 -7.353 6.034 -14.048 1.00 0.00 C ATOM 53 OG SER A 6 -6.179 5.780 -13.297 1.00 0.00 O ATOM 0 H SER A 6 -7.592 8.613 -15.872 1.00 0.00 H new ATOM 0 HA SER A 6 -6.034 7.121 -15.349 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.006 6.706 -13.491 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.903 5.104 -14.195 1.00 0.00 H new ATOM 0 HG SER A 6 -6.422 5.387 -12.433 1.00 0.00 H new ATOM 59 N GLY A 7 -6.100 4.582 -16.278 1.00 0.00 N ATOM 60 CA GLY A 7 -5.976 3.496 -17.233 1.00 0.00 C ATOM 61 C GLY A 7 -5.537 3.976 -18.602 1.00 0.00 C ATOM 62 O GLY A 7 -6.167 3.657 -19.611 1.00 0.00 O ATOM 0 H GLY A 7 -5.476 4.518 -15.473 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.257 2.767 -16.859 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.933 2.982 -17.321 1.00 0.00 H new ATOM 66 N LYS A 8 -4.455 4.746 -18.639 1.00 0.00 N ATOM 67 CA LYS A 8 -3.932 5.272 -19.894 1.00 0.00 C ATOM 68 C LYS A 8 -2.461 4.908 -20.065 1.00 0.00 C ATOM 69 O LYS A 8 -1.622 5.267 -19.238 1.00 0.00 O ATOM 70 CB LYS A 8 -4.101 6.792 -19.944 1.00 0.00 C ATOM 71 CG LYS A 8 -5.547 7.247 -19.846 1.00 0.00 C ATOM 72 CD LYS A 8 -6.292 7.019 -21.151 1.00 0.00 C ATOM 73 CE LYS A 8 -6.743 8.333 -21.772 1.00 0.00 C ATOM 74 NZ LYS A 8 -7.850 8.961 -20.998 1.00 0.00 N ATOM 0 H LYS A 8 -3.923 5.020 -17.813 1.00 0.00 H new ATOM 0 HA LYS A 8 -4.497 4.823 -20.711 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -3.532 7.239 -19.129 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -3.673 7.166 -20.874 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -6.046 6.706 -19.042 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -5.580 8.305 -19.587 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -5.648 6.487 -21.851 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -7.159 6.384 -20.970 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -5.898 9.020 -21.821 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -7.070 8.157 -22.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.129 9.854 -21.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -8.665 8.316 -20.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -7.530 9.153 -20.027 1.00 0.00 H new ATOM 88 N TYR A 9 -2.154 4.194 -21.143 1.00 0.00 N ATOM 89 CA TYR A 9 -0.784 3.781 -21.422 1.00 0.00 C ATOM 90 C TYR A 9 -0.443 3.984 -22.895 1.00 0.00 C ATOM 91 O TYR A 9 -0.627 3.086 -23.717 1.00 0.00 O ATOM 92 CB TYR A 9 -0.583 2.314 -21.037 1.00 0.00 C ATOM 93 CG TYR A 9 -0.295 2.107 -19.568 1.00 0.00 C ATOM 94 CD1 TYR A 9 -1.270 2.349 -18.608 1.00 0.00 C ATOM 95 CD2 TYR A 9 0.952 1.671 -19.139 1.00 0.00 C ATOM 96 CE1 TYR A 9 -1.011 2.162 -17.264 1.00 0.00 C ATOM 97 CE2 TYR A 9 1.220 1.479 -17.797 1.00 0.00 C ATOM 98 CZ TYR A 9 0.235 1.727 -16.864 1.00 0.00 C ATOM 99 OH TYR A 9 0.498 1.539 -15.526 1.00 0.00 O ATOM 0 H TYR A 9 -2.836 3.889 -21.838 1.00 0.00 H new ATOM 0 HA TYR A 9 -0.116 4.401 -20.825 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -1.477 1.751 -21.306 1.00 0.00 H new ATOM 0 HB3 TYR A 9 0.240 1.903 -21.621 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -2.247 2.689 -18.918 1.00 0.00 H new ATOM 0 HD2 TYR A 9 1.726 1.479 -19.867 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -1.780 2.355 -16.531 1.00 0.00 H new ATOM 0 HE2 TYR A 9 2.194 1.137 -17.481 1.00 0.00 H new ATOM 0 HH TYR A 9 1.421 1.230 -15.414 1.00 0.00 H new ATOM 109 N THR A 10 0.057 5.172 -23.222 1.00 0.00 N ATOM 110 CA THR A 10 0.424 5.495 -24.594 1.00 0.00 C ATOM 111 C THR A 10 1.761 4.865 -24.969 1.00 0.00 C ATOM 112 O THR A 10 1.966 4.458 -26.112 1.00 0.00 O ATOM 113 CB THR A 10 0.509 7.018 -24.810 1.00 0.00 C ATOM 114 OG1 THR A 10 -0.554 7.672 -24.107 1.00 0.00 O ATOM 115 CG2 THR A 10 0.430 7.360 -26.290 1.00 0.00 C ATOM 0 H THR A 10 0.217 5.926 -22.554 1.00 0.00 H new ATOM 0 HA THR A 10 -0.359 5.088 -25.234 1.00 0.00 H new ATOM 0 HB THR A 10 1.468 7.365 -24.424 1.00 0.00 H new ATOM 0 HG1 THR A 10 -0.492 8.640 -24.248 1.00 0.00 H new ATOM 0 HG21 THR A 10 0.492 8.441 -26.418 1.00 0.00 H new ATOM 0 HG22 THR A 10 1.256 6.884 -26.818 1.00 0.00 H new ATOM 0 HG23 THR A 10 -0.515 7.000 -26.697 1.00 0.00 H new ATOM 123 N GLN A 11 2.666 4.788 -23.998 1.00 0.00 N ATOM 124 CA GLN A 11 3.983 4.207 -24.228 1.00 0.00 C ATOM 125 C GLN A 11 4.142 2.898 -23.462 1.00 0.00 C ATOM 126 O GLN A 11 4.302 2.897 -22.242 1.00 0.00 O ATOM 127 CB GLN A 11 5.078 5.191 -23.811 1.00 0.00 C ATOM 128 CG GLN A 11 6.245 5.250 -24.782 1.00 0.00 C ATOM 129 CD GLN A 11 5.943 6.088 -26.009 1.00 0.00 C ATOM 130 OE1 GLN A 11 4.925 5.893 -26.673 1.00 0.00 O ATOM 131 NE2 GLN A 11 6.829 7.028 -26.317 1.00 0.00 N ATOM 0 H GLN A 11 2.511 5.120 -23.046 1.00 0.00 H new ATOM 0 HA GLN A 11 4.078 3.998 -25.293 1.00 0.00 H new ATOM 0 HB2 GLN A 11 4.644 6.186 -23.717 1.00 0.00 H new ATOM 0 HB3 GLN A 11 5.450 4.911 -22.825 1.00 0.00 H new ATOM 0 HG2 GLN A 11 7.116 5.661 -24.272 1.00 0.00 H new ATOM 0 HG3 GLN A 11 6.505 4.238 -25.093 1.00 0.00 H new ATOM 0 HE21 GLN A 11 7.659 7.155 -25.739 1.00 0.00 H new ATOM 0 HE22 GLN A 11 6.679 7.623 -27.132 1.00 0.00 H new ATOM 140 N ASN A 12 4.096 1.785 -24.186 1.00 0.00 N ATOM 141 CA ASN A 12 4.234 0.468 -23.574 1.00 0.00 C ATOM 142 C ASN A 12 5.598 -0.138 -23.888 1.00 0.00 C ATOM 143 O ASN A 12 5.709 -1.330 -24.170 1.00 0.00 O ATOM 144 CB ASN A 12 3.124 -0.464 -24.065 1.00 0.00 C ATOM 145 CG ASN A 12 2.864 -1.609 -23.105 1.00 0.00 C ATOM 146 OD1 ASN A 12 2.172 -1.446 -22.100 1.00 0.00 O ATOM 147 ND2 ASN A 12 3.420 -2.776 -23.411 1.00 0.00 N ATOM 0 H ASN A 12 3.964 1.768 -25.197 1.00 0.00 H new ATOM 0 HA ASN A 12 4.149 0.586 -22.494 1.00 0.00 H new ATOM 0 HB2 ASN A 12 2.206 0.108 -24.201 1.00 0.00 H new ATOM 0 HB3 ASN A 12 3.396 -0.866 -25.041 1.00 0.00 H new ATOM 0 HD21 ASN A 12 3.281 -3.583 -22.802 1.00 0.00 H new ATOM 0 HD22 ASN A 12 3.986 -2.866 -24.255 1.00 0.00 H new ATOM 154 N ASN A 13 6.635 0.693 -23.837 1.00 0.00 N ATOM 155 CA ASN A 13 7.992 0.239 -24.115 1.00 0.00 C ATOM 156 C ASN A 13 8.675 -0.250 -22.842 1.00 0.00 C ATOM 157 O ASN A 13 9.571 -1.093 -22.889 1.00 0.00 O ATOM 158 CB ASN A 13 8.811 1.369 -24.744 1.00 0.00 C ATOM 159 CG ASN A 13 9.832 0.858 -25.741 1.00 0.00 C ATOM 160 OD1 ASN A 13 10.760 0.133 -25.381 1.00 0.00 O ATOM 161 ND2 ASN A 13 9.665 1.233 -27.004 1.00 0.00 N ATOM 0 H ASN A 13 6.561 1.684 -23.606 1.00 0.00 H new ATOM 0 HA ASN A 13 7.933 -0.593 -24.816 1.00 0.00 H new ATOM 0 HB2 ASN A 13 8.139 2.067 -25.242 1.00 0.00 H new ATOM 0 HB3 ASN A 13 9.322 1.925 -23.958 1.00 0.00 H new ATOM 0 HD21 ASN A 13 10.320 0.919 -27.720 1.00 0.00 H new ATOM 0 HD22 ASN A 13 8.882 1.835 -27.258 1.00 0.00 H new ATOM 168 N PHE A 14 8.244 0.284 -21.704 1.00 0.00 N ATOM 169 CA PHE A 14 8.813 -0.098 -20.416 1.00 0.00 C ATOM 170 C PHE A 14 7.872 -1.032 -19.661 1.00 0.00 C ATOM 171 O PHE A 14 6.655 -0.846 -19.673 1.00 0.00 O ATOM 172 CB PHE A 14 9.101 1.146 -19.573 1.00 0.00 C ATOM 173 CG PHE A 14 10.102 2.075 -20.197 1.00 0.00 C ATOM 174 CD1 PHE A 14 9.705 3.012 -21.138 1.00 0.00 C ATOM 175 CD2 PHE A 14 11.441 2.011 -19.844 1.00 0.00 C ATOM 176 CE1 PHE A 14 10.624 3.869 -21.714 1.00 0.00 C ATOM 177 CE2 PHE A 14 12.364 2.866 -20.417 1.00 0.00 C ATOM 178 CZ PHE A 14 11.955 3.795 -21.354 1.00 0.00 C ATOM 0 H PHE A 14 7.503 0.982 -21.647 1.00 0.00 H new ATOM 0 HA PHE A 14 9.748 -0.627 -20.602 1.00 0.00 H new ATOM 0 HB2 PHE A 14 8.169 1.687 -19.408 1.00 0.00 H new ATOM 0 HB3 PHE A 14 9.467 0.835 -18.594 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.666 3.073 -21.425 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.767 1.285 -19.113 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.301 4.596 -22.445 1.00 0.00 H new ATOM 0 HE2 PHE A 14 13.404 2.808 -20.132 1.00 0.00 H new ATOM 0 HZ PHE A 14 12.675 4.462 -21.804 1.00 0.00 H new ATOM 188 N ILE A 15 8.445 -2.036 -19.006 1.00 0.00 N ATOM 189 CA ILE A 15 7.658 -2.998 -18.245 1.00 0.00 C ATOM 190 C ILE A 15 8.199 -3.153 -16.827 1.00 0.00 C ATOM 191 O ILE A 15 9.411 -3.196 -16.614 1.00 0.00 O ATOM 192 CB ILE A 15 7.640 -4.378 -18.929 1.00 0.00 C ATOM 193 CG1 ILE A 15 6.748 -5.346 -18.150 1.00 0.00 C ATOM 194 CG2 ILE A 15 9.054 -4.928 -19.046 1.00 0.00 C ATOM 195 CD1 ILE A 15 6.664 -6.723 -18.772 1.00 0.00 C ATOM 0 H ILE A 15 9.451 -2.204 -18.987 1.00 0.00 H new ATOM 0 HA ILE A 15 6.641 -2.609 -18.203 1.00 0.00 H new ATOM 0 HB ILE A 15 7.230 -4.265 -19.933 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.127 -5.438 -17.132 1.00 0.00 H new ATOM 0 HG13 ILE A 15 5.745 -4.926 -18.079 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.026 -5.904 -19.531 1.00 0.00 H new ATOM 0 HG22 ILE A 15 9.662 -4.245 -19.639 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.488 -5.030 -18.051 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.015 -7.356 -18.167 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.256 -6.643 -19.780 1.00 0.00 H new ATOM 0 HD13 ILE A 15 7.660 -7.163 -18.818 1.00 0.00 H new ATOM 207 N THR A 16 7.292 -3.238 -15.859 1.00 0.00 N ATOM 208 CA THR A 16 7.677 -3.389 -14.462 1.00 0.00 C ATOM 209 C THR A 16 8.449 -4.685 -14.241 1.00 0.00 C ATOM 210 O THR A 16 8.366 -5.612 -15.045 1.00 0.00 O ATOM 211 CB THR A 16 6.447 -3.372 -13.535 1.00 0.00 C ATOM 212 OG1 THR A 16 5.252 -3.226 -14.310 1.00 0.00 O ATOM 213 CG2 THR A 16 6.545 -2.238 -12.526 1.00 0.00 C ATOM 0 H THR A 16 6.285 -3.205 -16.017 1.00 0.00 H new ATOM 0 HA THR A 16 8.318 -2.542 -14.218 1.00 0.00 H new ATOM 0 HB THR A 16 6.415 -4.317 -12.993 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.474 -3.218 -13.714 1.00 0.00 H new ATOM 0 HG21 THR A 16 5.665 -2.246 -11.883 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.440 -2.368 -11.918 1.00 0.00 H new ATOM 0 HG23 THR A 16 6.600 -1.286 -13.053 1.00 0.00 H new ATOM 221 N GLY A 17 9.199 -4.742 -13.145 1.00 0.00 N ATOM 222 CA GLY A 17 9.974 -5.930 -12.838 1.00 0.00 C ATOM 223 C GLY A 17 9.103 -7.152 -12.627 1.00 0.00 C ATOM 224 O GLY A 17 9.122 -8.084 -13.431 1.00 0.00 O ATOM 0 H GLY A 17 9.284 -3.987 -12.464 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.675 -6.123 -13.650 1.00 0.00 H new ATOM 0 HA3 GLY A 17 10.567 -5.751 -11.941 1.00 0.00 H new ATOM 228 N VAL A 18 8.337 -7.151 -11.540 1.00 0.00 N ATOM 229 CA VAL A 18 7.455 -8.268 -11.225 1.00 0.00 C ATOM 230 C VAL A 18 6.559 -8.612 -12.409 1.00 0.00 C ATOM 231 O VAL A 18 6.275 -9.782 -12.667 1.00 0.00 O ATOM 232 CB VAL A 18 6.573 -7.959 -10.001 1.00 0.00 C ATOM 233 CG1 VAL A 18 5.690 -9.151 -9.664 1.00 0.00 C ATOM 234 CG2 VAL A 18 7.435 -7.570 -8.809 1.00 0.00 C ATOM 0 H VAL A 18 8.310 -6.389 -10.863 1.00 0.00 H new ATOM 0 HA VAL A 18 8.094 -9.121 -10.997 1.00 0.00 H new ATOM 0 HB VAL A 18 5.926 -7.116 -10.244 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.074 -8.914 -8.797 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.047 -9.379 -10.514 1.00 0.00 H new ATOM 0 HG13 VAL A 18 6.315 -10.015 -9.440 1.00 0.00 H new ATOM 0 HG21 VAL A 18 6.796 -7.355 -7.953 1.00 0.00 H new ATOM 0 HG22 VAL A 18 8.107 -8.392 -8.563 1.00 0.00 H new ATOM 0 HG23 VAL A 18 8.020 -6.684 -9.057 1.00 0.00 H new ATOM 244 N ARG A 19 6.117 -7.585 -13.127 1.00 0.00 N ATOM 245 CA ARG A 19 5.252 -7.779 -14.285 1.00 0.00 C ATOM 246 C ARG A 19 5.888 -8.740 -15.285 1.00 0.00 C ATOM 247 O ARG A 19 5.196 -9.520 -15.938 1.00 0.00 O ATOM 248 CB ARG A 19 4.963 -6.438 -14.962 1.00 0.00 C ATOM 249 CG ARG A 19 3.509 -6.007 -14.866 1.00 0.00 C ATOM 250 CD ARG A 19 2.660 -6.666 -15.943 1.00 0.00 C ATOM 251 NE ARG A 19 1.389 -7.155 -15.415 1.00 0.00 N ATOM 252 CZ ARG A 19 0.348 -7.467 -16.178 1.00 0.00 C ATOM 253 NH1 ARG A 19 0.427 -7.342 -17.496 1.00 0.00 N ATOM 254 NH2 ARG A 19 -0.775 -7.905 -15.624 1.00 0.00 N ATOM 0 H ARG A 19 6.343 -6.611 -12.928 1.00 0.00 H new ATOM 0 HA ARG A 19 4.314 -8.213 -13.938 1.00 0.00 H new ATOM 0 HB2 ARG A 19 5.591 -5.670 -14.510 1.00 0.00 H new ATOM 0 HB3 ARG A 19 5.245 -6.503 -16.013 1.00 0.00 H new ATOM 0 HG2 ARG A 19 3.116 -6.265 -13.883 1.00 0.00 H new ATOM 0 HG3 ARG A 19 3.443 -4.923 -14.961 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.469 -5.950 -16.743 1.00 0.00 H new ATOM 0 HD3 ARG A 19 3.213 -7.496 -16.383 1.00 0.00 H new ATOM 0 HE ARG A 19 1.296 -7.263 -14.405 1.00 0.00 H new ATOM 0 HH11 ARG A 19 1.289 -7.006 -17.926 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -0.374 -7.582 -18.080 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -0.840 -8.002 -14.611 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -1.574 -8.144 -16.211 1.00 0.00 H new ATOM 268 N ALA A 20 7.211 -8.676 -15.399 1.00 0.00 N ATOM 269 CA ALA A 20 7.941 -9.541 -16.318 1.00 0.00 C ATOM 270 C ALA A 20 8.266 -10.882 -15.668 1.00 0.00 C ATOM 271 O ALA A 20 8.382 -11.900 -16.351 1.00 0.00 O ATOM 272 CB ALA A 20 9.216 -8.856 -16.786 1.00 0.00 C ATOM 0 H ALA A 20 7.799 -8.034 -14.867 1.00 0.00 H new ATOM 0 HA ALA A 20 7.305 -9.731 -17.183 1.00 0.00 H new ATOM 0 HB1 ALA A 20 9.751 -9.513 -17.472 1.00 0.00 H new ATOM 0 HB2 ALA A 20 8.963 -7.927 -17.297 1.00 0.00 H new ATOM 0 HB3 ALA A 20 9.848 -8.637 -15.926 1.00 0.00 H new ATOM 278 N ILE A 21 8.412 -10.874 -14.348 1.00 0.00 N ATOM 279 CA ILE A 21 8.723 -12.091 -13.607 1.00 0.00 C ATOM 280 C ILE A 21 7.526 -13.034 -13.572 1.00 0.00 C ATOM 281 O ILE A 21 7.683 -14.248 -13.448 1.00 0.00 O ATOM 282 CB ILE A 21 9.156 -11.775 -12.163 1.00 0.00 C ATOM 283 CG1 ILE A 21 10.378 -10.854 -12.164 1.00 0.00 C ATOM 284 CG2 ILE A 21 9.456 -13.061 -11.407 1.00 0.00 C ATOM 285 CD1 ILE A 21 10.649 -10.209 -10.823 1.00 0.00 C ATOM 0 H ILE A 21 8.320 -10.039 -13.769 1.00 0.00 H new ATOM 0 HA ILE A 21 9.549 -12.576 -14.128 1.00 0.00 H new ATOM 0 HB ILE A 21 8.338 -11.262 -11.658 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.255 -11.427 -12.466 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.234 -10.074 -12.911 1.00 0.00 H new ATOM 0 HG21 ILE A 21 9.761 -12.822 -10.388 1.00 0.00 H new ATOM 0 HG22 ILE A 21 8.563 -13.685 -11.381 1.00 0.00 H new ATOM 0 HG23 ILE A 21 10.260 -13.599 -11.909 1.00 0.00 H new ATOM 0 HD11 ILE A 21 11.529 -9.570 -10.898 1.00 0.00 H new ATOM 0 HD12 ILE A 21 9.789 -9.609 -10.528 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.825 -10.983 -10.076 1.00 0.00 H new ATOM 297 N ASN A 22 6.329 -12.468 -13.684 1.00 0.00 N ATOM 298 CA ASN A 22 5.104 -13.259 -13.667 1.00 0.00 C ATOM 299 C ASN A 22 4.684 -13.643 -15.082 1.00 0.00 C ATOM 300 O ASN A 22 4.024 -14.660 -15.289 1.00 0.00 O ATOM 301 CB ASN A 22 3.979 -12.480 -12.983 1.00 0.00 C ATOM 302 CG ASN A 22 3.896 -12.768 -11.496 1.00 0.00 C ATOM 303 OD1 ASN A 22 2.955 -13.408 -11.028 1.00 0.00 O ATOM 304 ND2 ASN A 22 4.885 -12.295 -10.747 1.00 0.00 N ATOM 0 H ASN A 22 6.181 -11.464 -13.788 1.00 0.00 H new ATOM 0 HA ASN A 22 5.299 -14.172 -13.105 1.00 0.00 H new ATOM 0 HB2 ASN A 22 4.136 -11.412 -13.135 1.00 0.00 H new ATOM 0 HB3 ASN A 22 3.028 -12.733 -13.453 1.00 0.00 H new ATOM 0 HD21 ASN A 22 4.885 -12.457 -9.740 1.00 0.00 H new ATOM 0 HD22 ASN A 22 5.645 -11.769 -11.179 1.00 0.00 H new ATOM 311 N GLU A 23 5.073 -12.822 -16.053 1.00 0.00 N ATOM 312 CA GLU A 23 4.737 -13.076 -17.449 1.00 0.00 C ATOM 313 C GLU A 23 5.771 -13.990 -18.100 1.00 0.00 C ATOM 314 O GLU A 23 5.444 -15.079 -18.572 1.00 0.00 O ATOM 315 CB GLU A 23 4.645 -11.759 -18.222 1.00 0.00 C ATOM 316 CG GLU A 23 3.387 -10.963 -17.921 1.00 0.00 C ATOM 317 CD GLU A 23 2.264 -11.253 -18.899 1.00 0.00 C ATOM 318 OE1 GLU A 23 2.498 -11.144 -20.120 1.00 0.00 O ATOM 319 OE2 GLU A 23 1.152 -11.589 -18.441 1.00 0.00 O ATOM 0 H GLU A 23 5.621 -11.976 -15.898 1.00 0.00 H new ATOM 0 HA GLU A 23 3.768 -13.574 -17.478 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.516 -11.148 -17.987 1.00 0.00 H new ATOM 0 HB3 GLU A 23 4.684 -11.971 -19.290 1.00 0.00 H new ATOM 0 HG2 GLU A 23 3.051 -11.191 -16.910 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.620 -9.899 -17.947 1.00 0.00 H new ATOM 326 N PHE A 24 7.021 -13.538 -18.122 1.00 0.00 N ATOM 327 CA PHE A 24 8.103 -14.314 -18.716 1.00 0.00 C ATOM 328 C PHE A 24 8.492 -15.483 -17.816 1.00 0.00 C ATOM 329 O PHE A 24 9.163 -16.419 -18.252 1.00 0.00 O ATOM 330 CB PHE A 24 9.321 -13.421 -18.966 1.00 0.00 C ATOM 331 CG PHE A 24 9.064 -12.322 -19.957 1.00 0.00 C ATOM 332 CD1 PHE A 24 8.381 -11.177 -19.580 1.00 0.00 C ATOM 333 CD2 PHE A 24 9.506 -12.434 -21.265 1.00 0.00 C ATOM 334 CE1 PHE A 24 8.144 -10.163 -20.489 1.00 0.00 C ATOM 335 CE2 PHE A 24 9.272 -11.423 -22.179 1.00 0.00 C ATOM 336 CZ PHE A 24 8.590 -10.287 -21.790 1.00 0.00 C ATOM 0 H PHE A 24 7.309 -12.639 -17.736 1.00 0.00 H new ATOM 0 HA PHE A 24 7.751 -14.713 -19.667 1.00 0.00 H new ATOM 0 HB2 PHE A 24 9.639 -12.980 -18.021 1.00 0.00 H new ATOM 0 HB3 PHE A 24 10.146 -14.037 -19.324 1.00 0.00 H new ATOM 0 HD1 PHE A 24 8.030 -11.076 -18.564 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.039 -13.321 -21.574 1.00 0.00 H new ATOM 0 HE1 PHE A 24 7.611 -9.275 -20.182 1.00 0.00 H new ATOM 0 HE2 PHE A 24 9.622 -11.522 -23.196 1.00 0.00 H new ATOM 0 HZ PHE A 24 8.406 -9.496 -22.502 1.00 0.00 H new ATOM 346 N CYS A 25 8.067 -15.422 -16.559 1.00 0.00 N ATOM 347 CA CYS A 25 8.371 -16.474 -15.597 1.00 0.00 C ATOM 348 C CYS A 25 9.878 -16.626 -15.416 1.00 0.00 C ATOM 349 O CYS A 25 10.466 -17.625 -15.832 1.00 0.00 O ATOM 350 CB CYS A 25 7.763 -17.802 -16.052 1.00 0.00 C ATOM 351 SG CYS A 25 6.092 -18.101 -15.430 1.00 0.00 S ATOM 0 H CYS A 25 7.511 -14.655 -16.182 1.00 0.00 H new ATOM 0 HA CYS A 25 7.935 -16.193 -14.639 1.00 0.00 H new ATOM 0 HB2 CYS A 25 7.743 -17.826 -17.142 1.00 0.00 H new ATOM 0 HB3 CYS A 25 8.411 -18.616 -15.727 1.00 0.00 H new ATOM 0 HG CYS A 25 5.663 -19.247 -15.871 1.00 0.00 H new ATOM 357 N LEU A 26 10.497 -15.630 -14.793 1.00 0.00 N ATOM 358 CA LEU A 26 11.936 -15.651 -14.558 1.00 0.00 C ATOM 359 C LEU A 26 12.245 -15.589 -13.065 1.00 0.00 C ATOM 360 O LEU A 26 11.347 -15.687 -12.229 1.00 0.00 O ATOM 361 CB LEU A 26 12.608 -14.481 -15.278 1.00 0.00 C ATOM 362 CG LEU A 26 12.243 -14.301 -16.752 1.00 0.00 C ATOM 363 CD1 LEU A 26 12.388 -12.844 -17.164 1.00 0.00 C ATOM 364 CD2 LEU A 26 13.108 -15.194 -17.629 1.00 0.00 C ATOM 0 H LEU A 26 10.025 -14.797 -14.441 1.00 0.00 H new ATOM 0 HA LEU A 26 12.330 -16.587 -14.954 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.358 -13.562 -14.748 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.688 -14.607 -15.205 1.00 0.00 H new ATOM 0 HG LEU A 26 11.202 -14.593 -16.887 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.124 -12.735 -18.216 1.00 0.00 H new ATOM 0 HD12 LEU A 26 11.725 -12.227 -16.558 1.00 0.00 H new ATOM 0 HD13 LEU A 26 13.419 -12.524 -17.014 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.834 -15.052 -18.674 1.00 0.00 H new ATOM 0 HD22 LEU A 26 14.157 -14.934 -17.490 1.00 0.00 H new ATOM 0 HD23 LEU A 26 12.953 -16.237 -17.351 1.00 0.00 H new ATOM 376 N LYS A 27 13.522 -15.423 -12.737 1.00 0.00 N ATOM 377 CA LYS A 27 13.951 -15.344 -11.345 1.00 0.00 C ATOM 378 C LYS A 27 14.166 -13.894 -10.924 1.00 0.00 C ATOM 379 O LYS A 27 14.552 -13.053 -11.736 1.00 0.00 O ATOM 380 CB LYS A 27 15.240 -16.143 -11.141 1.00 0.00 C ATOM 381 CG LYS A 27 15.126 -17.599 -11.557 1.00 0.00 C ATOM 382 CD LYS A 27 15.577 -18.533 -10.446 1.00 0.00 C ATOM 383 CE LYS A 27 14.656 -18.449 -9.239 1.00 0.00 C ATOM 384 NZ LYS A 27 15.040 -19.423 -8.180 1.00 0.00 N ATOM 0 H LYS A 27 14.278 -15.341 -13.416 1.00 0.00 H new ATOM 0 HA LYS A 27 13.164 -15.771 -10.723 1.00 0.00 H new ATOM 0 HB2 LYS A 27 16.042 -15.673 -11.710 1.00 0.00 H new ATOM 0 HB3 LYS A 27 15.524 -16.096 -10.090 1.00 0.00 H new ATOM 0 HG2 LYS A 27 14.093 -17.822 -11.824 1.00 0.00 H new ATOM 0 HG3 LYS A 27 15.730 -17.772 -12.447 1.00 0.00 H new ATOM 0 HD2 LYS A 27 15.599 -19.558 -10.817 1.00 0.00 H new ATOM 0 HD3 LYS A 27 16.594 -18.280 -10.147 1.00 0.00 H new ATOM 0 HE2 LYS A 27 14.684 -17.439 -8.831 1.00 0.00 H new ATOM 0 HE3 LYS A 27 13.629 -18.638 -9.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 14.388 -19.335 -7.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 14.989 -20.389 -8.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 16.011 -19.227 -7.863 1.00 0.00 H new ATOM 398 N SER A 28 13.916 -13.609 -9.650 1.00 0.00 N ATOM 399 CA SER A 28 14.080 -12.260 -9.122 1.00 0.00 C ATOM 400 C SER A 28 15.532 -11.806 -9.235 1.00 0.00 C ATOM 401 O SER A 28 15.813 -10.614 -9.361 1.00 0.00 O ATOM 402 CB SER A 28 13.628 -12.203 -7.662 1.00 0.00 C ATOM 403 OG SER A 28 12.508 -11.349 -7.508 1.00 0.00 O ATOM 0 H SER A 28 13.599 -14.295 -8.964 1.00 0.00 H new ATOM 0 HA SER A 28 13.460 -11.586 -9.713 1.00 0.00 H new ATOM 0 HB2 SER A 28 13.375 -13.206 -7.317 1.00 0.00 H new ATOM 0 HB3 SER A 28 14.448 -11.849 -7.038 1.00 0.00 H new ATOM 0 HG SER A 28 12.237 -11.331 -6.566 1.00 0.00 H new ATOM 409 N SER A 29 16.451 -12.765 -9.188 1.00 0.00 N ATOM 410 CA SER A 29 17.875 -12.465 -9.280 1.00 0.00 C ATOM 411 C SER A 29 18.276 -12.176 -10.724 1.00 0.00 C ATOM 412 O SER A 29 19.235 -11.446 -10.979 1.00 0.00 O ATOM 413 CB SER A 29 18.701 -13.631 -8.733 1.00 0.00 C ATOM 414 OG SER A 29 18.453 -13.827 -7.352 1.00 0.00 O ATOM 0 H SER A 29 16.235 -13.757 -9.087 1.00 0.00 H new ATOM 0 HA SER A 29 18.074 -11.577 -8.680 1.00 0.00 H new ATOM 0 HB2 SER A 29 18.459 -14.541 -9.282 1.00 0.00 H new ATOM 0 HB3 SER A 29 19.762 -13.435 -8.891 1.00 0.00 H new ATOM 0 HG SER A 29 18.991 -14.579 -7.026 1.00 0.00 H new ATOM 420 N ASP A 30 17.537 -12.754 -11.664 1.00 0.00 N ATOM 421 CA ASP A 30 17.813 -12.559 -13.082 1.00 0.00 C ATOM 422 C ASP A 30 17.470 -11.136 -13.512 1.00 0.00 C ATOM 423 O ASP A 30 18.269 -10.464 -14.165 1.00 0.00 O ATOM 424 CB ASP A 30 17.022 -13.564 -13.921 1.00 0.00 C ATOM 425 CG ASP A 30 17.622 -14.955 -13.877 1.00 0.00 C ATOM 426 OD1 ASP A 30 18.780 -15.087 -13.428 1.00 0.00 O ATOM 427 OD2 ASP A 30 16.935 -15.912 -14.292 1.00 0.00 O ATOM 0 H ASP A 30 16.741 -13.362 -11.469 1.00 0.00 H new ATOM 0 HA ASP A 30 18.878 -12.721 -13.245 1.00 0.00 H new ATOM 0 HB2 ASP A 30 15.994 -13.604 -13.561 1.00 0.00 H new ATOM 0 HB3 ASP A 30 16.985 -13.220 -14.955 1.00 0.00 H new ATOM 432 N LEU A 31 16.277 -10.684 -13.142 1.00 0.00 N ATOM 433 CA LEU A 31 15.827 -9.340 -13.491 1.00 0.00 C ATOM 434 C LEU A 31 16.845 -8.294 -13.050 1.00 0.00 C ATOM 435 O LEU A 31 17.325 -7.502 -13.860 1.00 0.00 O ATOM 436 CB LEU A 31 14.471 -9.053 -12.845 1.00 0.00 C ATOM 437 CG LEU A 31 13.242 -9.504 -13.635 1.00 0.00 C ATOM 438 CD1 LEU A 31 13.060 -8.645 -14.876 1.00 0.00 C ATOM 439 CD2 LEU A 31 13.362 -10.973 -14.013 1.00 0.00 C ATOM 0 H LEU A 31 15.604 -11.227 -12.601 1.00 0.00 H new ATOM 0 HA LEU A 31 15.725 -9.286 -14.575 1.00 0.00 H new ATOM 0 HB2 LEU A 31 14.447 -9.536 -11.868 1.00 0.00 H new ATOM 0 HB3 LEU A 31 14.393 -7.980 -12.672 1.00 0.00 H new ATOM 0 HG LEU A 31 12.362 -9.382 -13.003 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.181 -8.981 -15.425 1.00 0.00 H new ATOM 0 HD12 LEU A 31 12.928 -7.604 -14.582 1.00 0.00 H new ATOM 0 HD13 LEU A 31 13.941 -8.733 -15.512 1.00 0.00 H new ATOM 0 HD21 LEU A 31 12.479 -11.277 -14.575 1.00 0.00 H new ATOM 0 HD22 LEU A 31 14.251 -11.119 -14.627 1.00 0.00 H new ATOM 0 HD23 LEU A 31 13.442 -11.576 -13.109 1.00 0.00 H new ATOM 451 N GLU A 32 17.171 -8.298 -11.761 1.00 0.00 N ATOM 452 CA GLU A 32 18.134 -7.349 -11.214 1.00 0.00 C ATOM 453 C GLU A 32 19.459 -7.424 -11.967 1.00 0.00 C ATOM 454 O GLU A 32 20.207 -6.448 -12.025 1.00 0.00 O ATOM 455 CB GLU A 32 18.364 -7.623 -9.726 1.00 0.00 C ATOM 456 CG GLU A 32 19.021 -8.965 -9.449 1.00 0.00 C ATOM 457 CD GLU A 32 19.557 -9.070 -8.034 1.00 0.00 C ATOM 458 OE1 GLU A 32 19.146 -8.256 -7.181 1.00 0.00 O ATOM 459 OE2 GLU A 32 20.388 -9.967 -7.781 1.00 0.00 O ATOM 0 H GLU A 32 16.783 -8.947 -11.077 1.00 0.00 H new ATOM 0 HA GLU A 32 17.725 -6.346 -11.332 1.00 0.00 H new ATOM 0 HB2 GLU A 32 18.987 -6.830 -9.311 1.00 0.00 H new ATOM 0 HB3 GLU A 32 17.407 -7.582 -9.205 1.00 0.00 H new ATOM 0 HG2 GLU A 32 18.297 -9.762 -9.620 1.00 0.00 H new ATOM 0 HG3 GLU A 32 19.837 -9.119 -10.155 1.00 0.00 H new ATOM 466 N GLN A 33 19.742 -8.588 -12.542 1.00 0.00 N ATOM 467 CA GLN A 33 20.977 -8.790 -13.290 1.00 0.00 C ATOM 468 C GLN A 33 21.010 -7.909 -14.535 1.00 0.00 C ATOM 469 O GLN A 33 22.081 -7.551 -15.027 1.00 0.00 O ATOM 470 CB GLN A 33 21.123 -10.260 -13.687 1.00 0.00 C ATOM 471 CG GLN A 33 22.566 -10.700 -13.871 1.00 0.00 C ATOM 472 CD GLN A 33 22.930 -11.887 -13.000 1.00 0.00 C ATOM 473 OE1 GLN A 33 23.329 -11.725 -11.846 1.00 0.00 O ATOM 474 NE2 GLN A 33 22.795 -13.088 -13.549 1.00 0.00 N ATOM 0 H GLN A 33 19.133 -9.405 -12.504 1.00 0.00 H new ATOM 0 HA GLN A 33 21.811 -8.510 -12.647 1.00 0.00 H new ATOM 0 HB2 GLN A 33 20.657 -10.882 -12.923 1.00 0.00 H new ATOM 0 HB3 GLN A 33 20.578 -10.433 -14.615 1.00 0.00 H new ATOM 0 HG2 GLN A 33 22.733 -10.957 -14.917 1.00 0.00 H new ATOM 0 HG3 GLN A 33 23.229 -9.866 -13.638 1.00 0.00 H new ATOM 0 HE21 GLN A 33 22.461 -13.175 -14.509 1.00 0.00 H new ATOM 0 HE22 GLN A 33 23.025 -13.923 -13.011 1.00 0.00 H new ATOM 483 N LEU A 34 19.831 -7.564 -15.040 1.00 0.00 N ATOM 484 CA LEU A 34 19.724 -6.725 -16.229 1.00 0.00 C ATOM 485 C LEU A 34 20.038 -5.270 -15.898 1.00 0.00 C ATOM 486 O LEU A 34 20.363 -4.938 -14.757 1.00 0.00 O ATOM 487 CB LEU A 34 18.321 -6.832 -16.829 1.00 0.00 C ATOM 488 CG LEU A 34 17.878 -8.233 -17.253 1.00 0.00 C ATOM 489 CD1 LEU A 34 16.373 -8.273 -17.469 1.00 0.00 C ATOM 490 CD2 LEU A 34 18.611 -8.665 -18.514 1.00 0.00 C ATOM 0 H LEU A 34 18.936 -7.852 -14.645 1.00 0.00 H new ATOM 0 HA LEU A 34 20.452 -7.078 -16.959 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.606 -6.452 -16.100 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.268 -6.177 -17.699 1.00 0.00 H new ATOM 0 HG LEU A 34 18.129 -8.931 -16.454 1.00 0.00 H new ATOM 0 HD11 LEU A 34 16.075 -9.277 -17.770 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.865 -8.007 -16.542 1.00 0.00 H new ATOM 0 HD13 LEU A 34 16.099 -7.564 -18.250 1.00 0.00 H new ATOM 0 HD21 LEU A 34 18.283 -9.664 -18.801 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.391 -7.965 -19.320 1.00 0.00 H new ATOM 0 HD23 LEU A 34 19.684 -8.675 -18.325 1.00 0.00 H new ATOM 502 N ARG A 35 19.938 -4.405 -16.902 1.00 0.00 N ATOM 503 CA ARG A 35 20.210 -2.984 -16.717 1.00 0.00 C ATOM 504 C ARG A 35 19.148 -2.338 -15.832 1.00 0.00 C ATOM 505 O ARG A 35 17.964 -2.328 -16.169 1.00 0.00 O ATOM 506 CB ARG A 35 20.263 -2.273 -18.070 1.00 0.00 C ATOM 507 CG ARG A 35 21.581 -1.564 -18.334 1.00 0.00 C ATOM 508 CD ARG A 35 21.984 -1.663 -19.797 1.00 0.00 C ATOM 509 NE ARG A 35 22.914 -2.763 -20.036 1.00 0.00 N ATOM 510 CZ ARG A 35 24.172 -2.768 -19.609 1.00 0.00 C ATOM 511 NH1 ARG A 35 24.648 -1.737 -18.926 1.00 0.00 N ATOM 512 NH2 ARG A 35 24.956 -3.807 -19.866 1.00 0.00 N ATOM 0 H ARG A 35 19.671 -4.663 -17.852 1.00 0.00 H new ATOM 0 HA ARG A 35 21.177 -2.886 -16.225 1.00 0.00 H new ATOM 0 HB2 ARG A 35 20.087 -3.002 -18.861 1.00 0.00 H new ATOM 0 HB3 ARG A 35 19.452 -1.546 -18.121 1.00 0.00 H new ATOM 0 HG2 ARG A 35 21.495 -0.515 -18.050 1.00 0.00 H new ATOM 0 HG3 ARG A 35 22.361 -2.000 -17.710 1.00 0.00 H new ATOM 0 HD2 ARG A 35 21.093 -1.802 -20.410 1.00 0.00 H new ATOM 0 HD3 ARG A 35 22.443 -0.726 -20.111 1.00 0.00 H new ATOM 0 HE ARG A 35 22.579 -3.572 -20.560 1.00 0.00 H new ATOM 0 HH11 ARG A 35 24.048 -0.937 -18.727 1.00 0.00 H new ATOM 0 HH12 ARG A 35 25.614 -1.744 -18.600 1.00 0.00 H new ATOM 0 HH21 ARG A 35 24.593 -4.602 -20.392 1.00 0.00 H new ATOM 0 HH22 ARG A 35 25.922 -3.811 -19.538 1.00 0.00 H new ATOM 526 N LYS A 36 19.580 -1.798 -14.697 1.00 0.00 N ATOM 527 CA LYS A 36 18.669 -1.149 -13.763 1.00 0.00 C ATOM 528 C LYS A 36 18.291 0.246 -14.252 1.00 0.00 C ATOM 529 O LYS A 36 19.003 1.217 -13.997 1.00 0.00 O ATOM 530 CB LYS A 36 19.307 -1.058 -12.375 1.00 0.00 C ATOM 531 CG LYS A 36 18.970 -2.232 -11.472 1.00 0.00 C ATOM 532 CD LYS A 36 19.743 -3.480 -11.867 1.00 0.00 C ATOM 533 CE LYS A 36 21.233 -3.316 -11.611 1.00 0.00 C ATOM 534 NZ LYS A 36 22.003 -3.189 -12.880 1.00 0.00 N ATOM 0 H LYS A 36 20.556 -1.797 -14.402 1.00 0.00 H new ATOM 0 HA LYS A 36 17.763 -1.752 -13.701 1.00 0.00 H new ATOM 0 HB2 LYS A 36 20.390 -0.995 -12.485 1.00 0.00 H new ATOM 0 HB3 LYS A 36 18.981 -0.136 -11.894 1.00 0.00 H new ATOM 0 HG2 LYS A 36 19.198 -1.974 -10.438 1.00 0.00 H new ATOM 0 HG3 LYS A 36 17.900 -2.435 -11.521 1.00 0.00 H new ATOM 0 HD2 LYS A 36 19.368 -4.335 -11.305 1.00 0.00 H new ATOM 0 HD3 LYS A 36 19.575 -3.694 -12.922 1.00 0.00 H new ATOM 0 HE2 LYS A 36 21.401 -2.433 -10.995 1.00 0.00 H new ATOM 0 HE3 LYS A 36 21.601 -4.173 -11.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 22.964 -3.561 -12.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 21.527 -3.730 -13.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 22.056 -2.187 -13.155 1.00 0.00 H new ATOM 548 N ILE A 37 17.166 0.337 -14.953 1.00 0.00 N ATOM 549 CA ILE A 37 16.693 1.613 -15.475 1.00 0.00 C ATOM 550 C ILE A 37 15.770 2.306 -14.479 1.00 0.00 C ATOM 551 O ILE A 37 14.726 1.770 -14.107 1.00 0.00 O ATOM 552 CB ILE A 37 15.947 1.433 -16.810 1.00 0.00 C ATOM 553 CG1 ILE A 37 16.850 0.745 -17.836 1.00 0.00 C ATOM 554 CG2 ILE A 37 15.469 2.779 -17.335 1.00 0.00 C ATOM 555 CD1 ILE A 37 16.483 -0.701 -18.089 1.00 0.00 C ATOM 0 H ILE A 37 16.565 -0.458 -15.173 1.00 0.00 H new ATOM 0 HA ILE A 37 17.574 2.232 -15.641 1.00 0.00 H new ATOM 0 HB ILE A 37 15.076 0.801 -16.640 1.00 0.00 H new ATOM 0 HG12 ILE A 37 16.802 1.294 -18.777 1.00 0.00 H new ATOM 0 HG13 ILE A 37 17.883 0.794 -17.491 1.00 0.00 H new ATOM 0 HG21 ILE A 37 14.944 2.636 -18.279 1.00 0.00 H new ATOM 0 HG22 ILE A 37 14.794 3.234 -16.610 1.00 0.00 H new ATOM 0 HG23 ILE A 37 16.326 3.433 -17.493 1.00 0.00 H new ATOM 0 HD11 ILE A 37 17.164 -1.126 -18.826 1.00 0.00 H new ATOM 0 HD12 ILE A 37 16.559 -1.264 -17.159 1.00 0.00 H new ATOM 0 HD13 ILE A 37 15.461 -0.757 -18.465 1.00 0.00 H new ATOM 567 N ARG A 38 16.161 3.502 -14.051 1.00 0.00 N ATOM 568 CA ARG A 38 15.369 4.270 -13.098 1.00 0.00 C ATOM 569 C ARG A 38 14.971 5.621 -13.686 1.00 0.00 C ATOM 570 O ARG A 38 14.751 6.586 -12.954 1.00 0.00 O ATOM 571 CB ARG A 38 16.153 4.477 -11.801 1.00 0.00 C ATOM 572 CG ARG A 38 17.498 5.155 -12.003 1.00 0.00 C ATOM 573 CD ARG A 38 18.613 4.137 -12.186 1.00 0.00 C ATOM 574 NE ARG A 38 19.826 4.520 -11.470 1.00 0.00 N ATOM 575 CZ ARG A 38 20.661 5.464 -11.890 1.00 0.00 C ATOM 576 NH1 ARG A 38 20.413 6.119 -13.017 1.00 0.00 N ATOM 577 NH2 ARG A 38 21.745 5.756 -11.183 1.00 0.00 N ATOM 0 H ARG A 38 17.022 3.960 -14.349 1.00 0.00 H new ATOM 0 HA ARG A 38 14.462 3.707 -12.880 1.00 0.00 H new ATOM 0 HB2 ARG A 38 15.553 5.076 -11.116 1.00 0.00 H new ATOM 0 HB3 ARG A 38 16.311 3.510 -11.324 1.00 0.00 H new ATOM 0 HG2 ARG A 38 17.451 5.806 -12.876 1.00 0.00 H new ATOM 0 HG3 ARG A 38 17.720 5.789 -11.144 1.00 0.00 H new ATOM 0 HD2 ARG A 38 18.276 3.163 -11.833 1.00 0.00 H new ATOM 0 HD3 ARG A 38 18.837 4.031 -13.248 1.00 0.00 H new ATOM 0 HE ARG A 38 20.045 4.036 -10.599 1.00 0.00 H new ATOM 0 HH11 ARG A 38 19.580 5.898 -13.563 1.00 0.00 H new ATOM 0 HH12 ARG A 38 21.055 6.843 -13.338 1.00 0.00 H new ATOM 0 HH21 ARG A 38 21.938 5.255 -10.316 1.00 0.00 H new ATOM 0 HH22 ARG A 38 22.385 6.481 -11.507 1.00 0.00 H new ATOM 591 N ARG A 39 14.881 5.681 -15.010 1.00 0.00 N ATOM 592 CA ARG A 39 14.511 6.913 -15.696 1.00 0.00 C ATOM 593 C ARG A 39 15.480 8.040 -15.349 1.00 0.00 C ATOM 594 O ARG A 39 16.420 7.848 -14.578 1.00 0.00 O ATOM 595 CB ARG A 39 13.084 7.320 -15.324 1.00 0.00 C ATOM 596 CG ARG A 39 12.074 7.083 -16.434 1.00 0.00 C ATOM 597 CD ARG A 39 10.646 7.206 -15.924 1.00 0.00 C ATOM 598 NE ARG A 39 10.095 8.538 -16.158 1.00 0.00 N ATOM 599 CZ ARG A 39 8.793 8.804 -16.162 1.00 0.00 C ATOM 600 NH1 ARG A 39 7.914 7.835 -15.946 1.00 0.00 N ATOM 601 NH2 ARG A 39 8.368 10.042 -16.383 1.00 0.00 N ATOM 0 H ARG A 39 15.059 4.891 -15.630 1.00 0.00 H new ATOM 0 HA ARG A 39 14.561 6.731 -16.770 1.00 0.00 H new ATOM 0 HB2 ARG A 39 12.776 6.764 -14.439 1.00 0.00 H new ATOM 0 HB3 ARG A 39 13.075 8.376 -15.056 1.00 0.00 H new ATOM 0 HG2 ARG A 39 12.238 7.802 -17.236 1.00 0.00 H new ATOM 0 HG3 ARG A 39 12.225 6.091 -16.859 1.00 0.00 H new ATOM 0 HD2 ARG A 39 10.020 6.463 -16.417 1.00 0.00 H new ATOM 0 HD3 ARG A 39 10.622 6.986 -14.857 1.00 0.00 H new ATOM 0 HE ARG A 39 10.745 9.306 -16.328 1.00 0.00 H new ATOM 0 HH11 ARG A 39 8.237 6.882 -15.776 1.00 0.00 H new ATOM 0 HH12 ARG A 39 6.915 8.042 -15.950 1.00 0.00 H new ATOM 0 HH21 ARG A 39 9.041 10.790 -16.550 1.00 0.00 H new ATOM 0 HH22 ARG A 39 7.368 10.245 -16.386 1.00 0.00 H new ATOM 615 N ARG A 40 15.244 9.214 -15.924 1.00 0.00 N ATOM 616 CA ARG A 40 16.096 10.371 -15.678 1.00 0.00 C ATOM 617 C ARG A 40 15.385 11.392 -14.794 1.00 0.00 C ATOM 618 O ARG A 40 14.257 11.795 -15.078 1.00 0.00 O ATOM 619 CB ARG A 40 16.504 11.022 -17.000 1.00 0.00 C ATOM 620 CG ARG A 40 17.980 10.868 -17.326 1.00 0.00 C ATOM 621 CD ARG A 40 18.412 11.826 -18.424 1.00 0.00 C ATOM 622 NE ARG A 40 19.056 13.022 -17.886 1.00 0.00 N ATOM 623 CZ ARG A 40 19.182 14.157 -18.564 1.00 0.00 C ATOM 624 NH1 ARG A 40 18.710 14.251 -19.799 1.00 0.00 N ATOM 625 NH2 ARG A 40 19.780 15.202 -18.005 1.00 0.00 N ATOM 0 H ARG A 40 14.469 9.389 -16.564 1.00 0.00 H new ATOM 0 HA ARG A 40 16.991 10.027 -15.159 1.00 0.00 H new ATOM 0 HB2 ARG A 40 15.915 10.586 -17.807 1.00 0.00 H new ATOM 0 HB3 ARG A 40 16.258 12.083 -16.964 1.00 0.00 H new ATOM 0 HG2 ARG A 40 18.572 11.050 -16.429 1.00 0.00 H new ATOM 0 HG3 ARG A 40 18.180 9.843 -17.637 1.00 0.00 H new ATOM 0 HD2 ARG A 40 19.100 11.317 -19.099 1.00 0.00 H new ATOM 0 HD3 ARG A 40 17.543 12.117 -19.014 1.00 0.00 H new ATOM 0 HE ARG A 40 19.429 12.983 -16.938 1.00 0.00 H new ATOM 0 HH11 ARG A 40 18.249 13.450 -20.231 1.00 0.00 H new ATOM 0 HH12 ARG A 40 18.808 15.124 -20.317 1.00 0.00 H new ATOM 0 HH21 ARG A 40 20.143 15.134 -17.054 1.00 0.00 H new ATOM 0 HH22 ARG A 40 19.876 16.073 -18.526 1.00 0.00 H new ATOM 639 N SER A 41 16.052 11.804 -13.721 1.00 0.00 N ATOM 640 CA SER A 41 15.483 12.774 -12.793 1.00 0.00 C ATOM 641 C SER A 41 16.529 13.240 -11.784 1.00 0.00 C ATOM 642 O SER A 41 17.550 12.589 -11.564 1.00 0.00 O ATOM 643 CB SER A 41 14.285 12.168 -12.059 1.00 0.00 C ATOM 644 OG SER A 41 14.353 12.430 -10.668 1.00 0.00 O ATOM 0 H SER A 41 16.987 11.481 -13.473 1.00 0.00 H new ATOM 0 HA SER A 41 15.149 13.637 -13.369 1.00 0.00 H new ATOM 0 HB2 SER A 41 13.360 12.579 -12.465 1.00 0.00 H new ATOM 0 HB3 SER A 41 14.257 11.092 -12.229 1.00 0.00 H new ATOM 0 HG SER A 41 13.506 12.177 -10.246 1.00 0.00 H new ATOM 650 N PRO A 42 16.269 14.397 -11.156 1.00 0.00 N ATOM 651 CA PRO A 42 17.175 14.977 -10.160 1.00 0.00 C ATOM 652 C PRO A 42 17.209 14.169 -8.867 1.00 0.00 C ATOM 653 O PRO A 42 18.269 13.983 -8.267 1.00 0.00 O ATOM 654 CB PRO A 42 16.582 16.365 -9.907 1.00 0.00 C ATOM 655 CG PRO A 42 15.139 16.229 -10.250 1.00 0.00 C ATOM 656 CD PRO A 42 15.072 15.227 -11.369 1.00 0.00 C ATOM 0 HA PRO A 42 18.207 14.996 -10.510 1.00 0.00 H new ATOM 0 HB2 PRO A 42 16.715 16.669 -8.869 1.00 0.00 H new ATOM 0 HB3 PRO A 42 17.066 17.121 -10.525 1.00 0.00 H new ATOM 0 HG2 PRO A 42 14.563 15.891 -9.388 1.00 0.00 H new ATOM 0 HG3 PRO A 42 14.719 17.187 -10.558 1.00 0.00 H new ATOM 0 HD2 PRO A 42 14.159 14.634 -11.323 1.00 0.00 H new ATOM 0 HD3 PRO A 42 15.088 15.713 -12.345 1.00 0.00 H new ATOM 664 N HIS A 43 16.044 13.689 -8.444 1.00 0.00 N ATOM 665 CA HIS A 43 15.942 12.899 -7.222 1.00 0.00 C ATOM 666 C HIS A 43 14.762 11.934 -7.296 1.00 0.00 C ATOM 667 O HIS A 43 13.663 12.313 -7.699 1.00 0.00 O ATOM 668 CB HIS A 43 15.789 13.816 -6.008 1.00 0.00 C ATOM 669 CG HIS A 43 17.079 14.089 -5.297 1.00 0.00 C ATOM 670 ND1 HIS A 43 17.965 13.095 -4.937 1.00 0.00 N ATOM 671 CD2 HIS A 43 17.633 15.252 -4.882 1.00 0.00 C ATOM 672 CE1 HIS A 43 19.006 13.635 -4.329 1.00 0.00 C ATOM 673 NE2 HIS A 43 18.829 14.943 -4.283 1.00 0.00 N ATOM 0 H HIS A 43 15.158 13.833 -8.929 1.00 0.00 H new ATOM 0 HA HIS A 43 16.858 12.318 -7.117 1.00 0.00 H new ATOM 0 HB2 HIS A 43 15.354 14.762 -6.330 1.00 0.00 H new ATOM 0 HB3 HIS A 43 15.086 13.364 -5.308 1.00 0.00 H new ATOM 0 HD2 HIS A 43 17.212 16.240 -5.000 1.00 0.00 H new ATOM 0 HE1 HIS A 43 19.857 13.098 -3.936 1.00 0.00 H new ATOM 0 HE2 HIS A 43 19.476 15.615 -3.870 1.00 0.00 H new ATOM 681 N GLU A 44 15.000 10.686 -6.905 1.00 0.00 N ATOM 682 CA GLU A 44 13.957 9.667 -6.930 1.00 0.00 C ATOM 683 C GLU A 44 13.559 9.262 -5.514 1.00 0.00 C ATOM 684 O GLU A 44 14.380 9.282 -4.597 1.00 0.00 O ATOM 685 CB GLU A 44 14.432 8.438 -7.709 1.00 0.00 C ATOM 686 CG GLU A 44 13.303 7.512 -8.131 1.00 0.00 C ATOM 687 CD GLU A 44 13.776 6.391 -9.035 1.00 0.00 C ATOM 688 OE1 GLU A 44 14.523 5.513 -8.553 1.00 0.00 O ATOM 689 OE2 GLU A 44 13.400 6.391 -10.226 1.00 0.00 O ATOM 0 H GLU A 44 15.904 10.357 -6.568 1.00 0.00 H new ATOM 0 HA GLU A 44 13.084 10.089 -7.428 1.00 0.00 H new ATOM 0 HB2 GLU A 44 14.972 8.767 -8.597 1.00 0.00 H new ATOM 0 HB3 GLU A 44 15.139 7.880 -7.095 1.00 0.00 H new ATOM 0 HG2 GLU A 44 12.837 7.085 -7.243 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.537 8.091 -8.647 1.00 0.00 H new ATOM 696 N ASP A 45 12.293 8.894 -5.344 1.00 0.00 N ATOM 697 CA ASP A 45 11.785 8.484 -4.040 1.00 0.00 C ATOM 698 C ASP A 45 10.363 7.944 -4.157 1.00 0.00 C ATOM 699 O ASP A 45 9.406 8.586 -3.722 1.00 0.00 O ATOM 700 CB ASP A 45 11.819 9.660 -3.062 1.00 0.00 C ATOM 701 CG ASP A 45 11.551 9.232 -1.633 1.00 0.00 C ATOM 702 OD1 ASP A 45 12.338 8.423 -1.098 1.00 0.00 O ATOM 703 OD2 ASP A 45 10.554 9.706 -1.049 1.00 0.00 O ATOM 0 H ASP A 45 11.601 8.871 -6.093 1.00 0.00 H new ATOM 0 HA ASP A 45 12.427 7.689 -3.661 1.00 0.00 H new ATOM 0 HB2 ASP A 45 12.793 10.146 -3.116 1.00 0.00 H new ATOM 0 HB3 ASP A 45 11.077 10.400 -3.362 1.00 0.00 H new ATOM 708 N THR A 46 10.231 6.761 -4.748 1.00 0.00 N ATOM 709 CA THR A 46 8.926 6.136 -4.924 1.00 0.00 C ATOM 710 C THR A 46 9.055 4.623 -5.057 1.00 0.00 C ATOM 711 O THR A 46 9.029 4.083 -6.163 1.00 0.00 O ATOM 712 CB THR A 46 8.201 6.689 -6.166 1.00 0.00 C ATOM 713 OG1 THR A 46 9.158 7.121 -7.139 1.00 0.00 O ATOM 714 CG2 THR A 46 7.293 7.850 -5.790 1.00 0.00 C ATOM 0 H THR A 46 11.012 6.216 -5.113 1.00 0.00 H new ATOM 0 HA THR A 46 8.340 6.372 -4.036 1.00 0.00 H new ATOM 0 HB THR A 46 7.589 5.892 -6.588 1.00 0.00 H new ATOM 0 HG1 THR A 46 8.690 7.470 -7.926 1.00 0.00 H new ATOM 0 HG21 THR A 46 6.792 8.224 -6.683 1.00 0.00 H new ATOM 0 HG22 THR A 46 6.548 7.511 -5.071 1.00 0.00 H new ATOM 0 HG23 THR A 46 7.888 8.648 -5.347 1.00 0.00 H new ATOM 722 N GLU A 47 9.192 3.943 -3.922 1.00 0.00 N ATOM 723 CA GLU A 47 9.325 2.491 -3.914 1.00 0.00 C ATOM 724 C GLU A 47 10.540 2.051 -4.726 1.00 0.00 C ATOM 725 O GLU A 47 11.283 2.880 -5.250 1.00 0.00 O ATOM 726 CB GLU A 47 8.060 1.838 -4.474 1.00 0.00 C ATOM 727 CG GLU A 47 6.808 2.149 -3.671 1.00 0.00 C ATOM 728 CD GLU A 47 6.523 1.107 -2.606 1.00 0.00 C ATOM 729 OE1 GLU A 47 5.978 0.038 -2.952 1.00 0.00 O ATOM 730 OE2 GLU A 47 6.847 1.361 -1.427 1.00 0.00 O ATOM 0 H GLU A 47 9.214 4.374 -2.998 1.00 0.00 H new ATOM 0 HA GLU A 47 9.464 2.170 -2.882 1.00 0.00 H new ATOM 0 HB2 GLU A 47 7.914 2.170 -5.502 1.00 0.00 H new ATOM 0 HB3 GLU A 47 8.202 0.758 -4.505 1.00 0.00 H new ATOM 0 HG2 GLU A 47 6.917 3.125 -3.199 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.955 2.215 -4.346 1.00 0.00 H new ATOM 737 N SER A 48 10.735 0.740 -4.824 1.00 0.00 N ATOM 738 CA SER A 48 11.861 0.188 -5.568 1.00 0.00 C ATOM 739 C SER A 48 11.393 -0.886 -6.545 1.00 0.00 C ATOM 740 O SER A 48 11.078 -2.008 -6.147 1.00 0.00 O ATOM 741 CB SER A 48 12.897 -0.397 -4.607 1.00 0.00 C ATOM 742 OG SER A 48 14.146 0.258 -4.743 1.00 0.00 O ATOM 0 H SER A 48 10.128 0.040 -4.397 1.00 0.00 H new ATOM 0 HA SER A 48 12.320 0.997 -6.137 1.00 0.00 H new ATOM 0 HB2 SER A 48 12.542 -0.300 -3.581 1.00 0.00 H new ATOM 0 HB3 SER A 48 13.018 -1.462 -4.803 1.00 0.00 H new ATOM 0 HG SER A 48 14.790 -0.133 -4.117 1.00 0.00 H new ATOM 748 N PHE A 49 11.350 -0.535 -7.826 1.00 0.00 N ATOM 749 CA PHE A 49 10.920 -1.468 -8.861 1.00 0.00 C ATOM 750 C PHE A 49 11.949 -1.545 -9.985 1.00 0.00 C ATOM 751 O PHE A 49 12.234 -2.623 -10.509 1.00 0.00 O ATOM 752 CB PHE A 49 9.563 -1.045 -9.426 1.00 0.00 C ATOM 753 CG PHE A 49 9.505 0.401 -9.829 1.00 0.00 C ATOM 754 CD1 PHE A 49 9.164 1.378 -8.907 1.00 0.00 C ATOM 755 CD2 PHE A 49 9.790 0.783 -11.130 1.00 0.00 C ATOM 756 CE1 PHE A 49 9.111 2.709 -9.275 1.00 0.00 C ATOM 757 CE2 PHE A 49 9.738 2.112 -11.503 1.00 0.00 C ATOM 758 CZ PHE A 49 9.397 3.076 -10.575 1.00 0.00 C ATOM 0 H PHE A 49 11.608 0.389 -8.172 1.00 0.00 H new ATOM 0 HA PHE A 49 10.826 -2.455 -8.409 1.00 0.00 H new ATOM 0 HB2 PHE A 49 9.330 -1.665 -10.292 1.00 0.00 H new ATOM 0 HB3 PHE A 49 8.792 -1.237 -8.680 1.00 0.00 H new ATOM 0 HD1 PHE A 49 8.937 1.096 -7.889 1.00 0.00 H new ATOM 0 HD2 PHE A 49 10.056 0.033 -11.861 1.00 0.00 H new ATOM 0 HE1 PHE A 49 8.846 3.461 -8.547 1.00 0.00 H new ATOM 0 HE2 PHE A 49 9.964 2.397 -12.520 1.00 0.00 H new ATOM 0 HZ PHE A 49 9.354 4.115 -10.866 1.00 0.00 H new ATOM 768 N THR A 50 12.505 -0.394 -10.351 1.00 0.00 N ATOM 769 CA THR A 50 13.500 -0.330 -11.414 1.00 0.00 C ATOM 770 C THR A 50 12.975 -0.959 -12.699 1.00 0.00 C ATOM 771 O THR A 50 13.133 -2.159 -12.925 1.00 0.00 O ATOM 772 CB THR A 50 14.805 -1.040 -11.005 1.00 0.00 C ATOM 773 OG1 THR A 50 15.138 -0.711 -9.652 1.00 0.00 O ATOM 774 CG2 THR A 50 15.949 -0.643 -11.925 1.00 0.00 C ATOM 0 H THR A 50 12.283 0.507 -9.927 1.00 0.00 H new ATOM 0 HA THR A 50 13.707 0.726 -11.588 1.00 0.00 H new ATOM 0 HB THR A 50 14.649 -2.115 -11.089 1.00 0.00 H new ATOM 0 HG1 THR A 50 15.968 -1.167 -9.399 1.00 0.00 H new ATOM 0 HG21 THR A 50 16.859 -1.157 -11.616 1.00 0.00 H new ATOM 0 HG22 THR A 50 15.705 -0.922 -12.950 1.00 0.00 H new ATOM 0 HG23 THR A 50 16.104 0.434 -11.869 1.00 0.00 H new ATOM 782 N VAL A 51 12.349 -0.141 -13.540 1.00 0.00 N ATOM 783 CA VAL A 51 11.801 -0.618 -14.804 1.00 0.00 C ATOM 784 C VAL A 51 12.875 -1.295 -15.648 1.00 0.00 C ATOM 785 O VAL A 51 14.056 -0.962 -15.552 1.00 0.00 O ATOM 786 CB VAL A 51 11.177 0.534 -15.615 1.00 0.00 C ATOM 787 CG1 VAL A 51 9.902 1.027 -14.947 1.00 0.00 C ATOM 788 CG2 VAL A 51 12.175 1.670 -15.781 1.00 0.00 C ATOM 0 H VAL A 51 12.209 0.855 -13.368 1.00 0.00 H new ATOM 0 HA VAL A 51 11.025 -1.343 -14.559 1.00 0.00 H new ATOM 0 HB VAL A 51 10.919 0.160 -16.606 1.00 0.00 H new ATOM 0 HG11 VAL A 51 9.475 1.841 -15.534 1.00 0.00 H new ATOM 0 HG12 VAL A 51 9.184 0.209 -14.885 1.00 0.00 H new ATOM 0 HG13 VAL A 51 10.132 1.385 -13.944 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.718 2.475 -16.356 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.466 2.045 -14.800 1.00 0.00 H new ATOM 0 HG23 VAL A 51 13.058 1.305 -16.306 1.00 0.00 H new ATOM 798 N TYR A 52 12.457 -2.246 -16.475 1.00 0.00 N ATOM 799 CA TYR A 52 13.383 -2.973 -17.335 1.00 0.00 C ATOM 800 C TYR A 52 12.981 -2.842 -18.801 1.00 0.00 C ATOM 801 O TYR A 52 11.821 -2.576 -19.118 1.00 0.00 O ATOM 802 CB TYR A 52 13.431 -4.449 -16.937 1.00 0.00 C ATOM 803 CG TYR A 52 13.871 -4.677 -15.509 1.00 0.00 C ATOM 804 CD1 TYR A 52 15.079 -4.171 -15.044 1.00 0.00 C ATOM 805 CD2 TYR A 52 13.080 -5.399 -14.624 1.00 0.00 C ATOM 806 CE1 TYR A 52 15.485 -4.377 -13.740 1.00 0.00 C ATOM 807 CE2 TYR A 52 13.477 -5.609 -13.318 1.00 0.00 C ATOM 808 CZ TYR A 52 14.681 -5.097 -12.881 1.00 0.00 C ATOM 809 OH TYR A 52 15.082 -5.305 -11.581 1.00 0.00 O ATOM 0 H TYR A 52 11.482 -2.532 -16.568 1.00 0.00 H new ATOM 0 HA TYR A 52 14.374 -2.538 -17.208 1.00 0.00 H new ATOM 0 HB2 TYR A 52 12.443 -4.887 -17.078 1.00 0.00 H new ATOM 0 HB3 TYR A 52 14.112 -4.975 -17.606 1.00 0.00 H new ATOM 0 HD1 TYR A 52 15.711 -3.607 -15.714 1.00 0.00 H new ATOM 0 HD2 TYR A 52 12.138 -5.803 -14.963 1.00 0.00 H new ATOM 0 HE1 TYR A 52 16.427 -3.977 -13.395 1.00 0.00 H new ATOM 0 HE2 TYR A 52 12.849 -6.171 -12.643 1.00 0.00 H new ATOM 0 HH TYR A 52 14.402 -5.829 -11.109 1.00 0.00 H new ATOM 819 N LEU A 53 13.949 -3.032 -19.692 1.00 0.00 N ATOM 820 CA LEU A 53 13.698 -2.937 -21.126 1.00 0.00 C ATOM 821 C LEU A 53 13.086 -4.229 -21.659 1.00 0.00 C ATOM 822 O LEU A 53 13.578 -5.322 -21.378 1.00 0.00 O ATOM 823 CB LEU A 53 14.997 -2.629 -21.871 1.00 0.00 C ATOM 824 CG LEU A 53 14.978 -1.392 -22.771 1.00 0.00 C ATOM 825 CD1 LEU A 53 13.887 -1.515 -23.823 1.00 0.00 C ATOM 826 CD2 LEU A 53 14.782 -0.132 -21.941 1.00 0.00 C ATOM 0 H LEU A 53 14.914 -3.253 -19.447 1.00 0.00 H new ATOM 0 HA LEU A 53 12.989 -2.126 -21.293 1.00 0.00 H new ATOM 0 HB2 LEU A 53 15.793 -2.507 -21.137 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.256 -3.494 -22.482 1.00 0.00 H new ATOM 0 HG LEU A 53 15.939 -1.321 -23.280 1.00 0.00 H new ATOM 0 HD11 LEU A 53 13.888 -0.626 -24.454 1.00 0.00 H new ATOM 0 HD12 LEU A 53 14.071 -2.396 -24.437 1.00 0.00 H new ATOM 0 HD13 LEU A 53 12.918 -1.611 -23.333 1.00 0.00 H new ATOM 0 HD21 LEU A 53 14.771 0.738 -22.597 1.00 0.00 H new ATOM 0 HD22 LEU A 53 13.835 -0.194 -21.404 1.00 0.00 H new ATOM 0 HD23 LEU A 53 15.599 -0.037 -21.226 1.00 0.00 H new ATOM 838 N ARG A 54 12.013 -4.095 -22.430 1.00 0.00 N ATOM 839 CA ARG A 54 11.335 -5.252 -23.004 1.00 0.00 C ATOM 840 C ARG A 54 12.309 -6.110 -23.806 1.00 0.00 C ATOM 841 O ARG A 54 12.136 -7.323 -23.917 1.00 0.00 O ATOM 842 CB ARG A 54 10.179 -4.800 -23.899 1.00 0.00 C ATOM 843 CG ARG A 54 9.159 -5.893 -24.173 1.00 0.00 C ATOM 844 CD ARG A 54 7.966 -5.359 -24.950 1.00 0.00 C ATOM 845 NE ARG A 54 6.983 -6.402 -25.229 1.00 0.00 N ATOM 846 CZ ARG A 54 5.865 -6.194 -25.916 1.00 0.00 C ATOM 847 NH1 ARG A 54 5.590 -4.987 -26.390 1.00 0.00 N ATOM 848 NH2 ARG A 54 5.020 -7.195 -26.129 1.00 0.00 N ATOM 0 H ARG A 54 11.594 -3.197 -22.672 1.00 0.00 H new ATOM 0 HA ARG A 54 10.938 -5.853 -22.186 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.676 -3.955 -23.430 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.582 -4.445 -24.847 1.00 0.00 H new ATOM 0 HG2 ARG A 54 9.630 -6.699 -24.736 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.819 -6.320 -23.229 1.00 0.00 H new ATOM 0 HD2 ARG A 54 7.493 -4.558 -24.382 1.00 0.00 H new ATOM 0 HD3 ARG A 54 8.310 -4.925 -25.889 1.00 0.00 H new ATOM 0 HE ARG A 54 7.165 -7.342 -24.877 1.00 0.00 H new ATOM 0 HH11 ARG A 54 6.237 -4.216 -26.228 1.00 0.00 H new ATOM 0 HH12 ARG A 54 4.731 -4.830 -26.917 1.00 0.00 H new ATOM 0 HH21 ARG A 54 5.229 -8.125 -25.765 1.00 0.00 H new ATOM 0 HH22 ARG A 54 4.162 -7.035 -26.657 1.00 0.00 H new ATOM 862 N SER A 55 13.332 -5.471 -24.364 1.00 0.00 N ATOM 863 CA SER A 55 14.331 -6.174 -25.160 1.00 0.00 C ATOM 864 C SER A 55 15.250 -7.004 -24.268 1.00 0.00 C ATOM 865 O SER A 55 15.807 -8.013 -24.700 1.00 0.00 O ATOM 866 CB SER A 55 15.157 -5.179 -25.977 1.00 0.00 C ATOM 867 OG SER A 55 14.413 -4.680 -27.076 1.00 0.00 O ATOM 0 H SER A 55 13.491 -4.467 -24.279 1.00 0.00 H new ATOM 0 HA SER A 55 13.809 -6.846 -25.841 1.00 0.00 H new ATOM 0 HB2 SER A 55 15.470 -4.352 -25.340 1.00 0.00 H new ATOM 0 HB3 SER A 55 16.064 -5.664 -26.338 1.00 0.00 H new ATOM 0 HG SER A 55 14.962 -4.045 -27.581 1.00 0.00 H new ATOM 873 N ASP A 56 15.403 -6.570 -23.022 1.00 0.00 N ATOM 874 CA ASP A 56 16.253 -7.272 -22.067 1.00 0.00 C ATOM 875 C ASP A 56 15.552 -8.513 -21.524 1.00 0.00 C ATOM 876 O ASP A 56 16.104 -9.613 -21.550 1.00 0.00 O ATOM 877 CB ASP A 56 16.638 -6.343 -20.915 1.00 0.00 C ATOM 878 CG ASP A 56 17.730 -5.365 -21.299 1.00 0.00 C ATOM 879 OD1 ASP A 56 18.337 -5.546 -22.376 1.00 0.00 O ATOM 880 OD2 ASP A 56 17.980 -4.418 -20.524 1.00 0.00 O ATOM 0 H ASP A 56 14.950 -5.736 -22.649 1.00 0.00 H new ATOM 0 HA ASP A 56 17.158 -7.587 -22.587 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.757 -5.790 -20.589 1.00 0.00 H new ATOM 0 HB3 ASP A 56 16.972 -6.940 -20.067 1.00 0.00 H new ATOM 885 N VAL A 57 14.331 -8.329 -21.032 1.00 0.00 N ATOM 886 CA VAL A 57 13.553 -9.433 -20.483 1.00 0.00 C ATOM 887 C VAL A 57 13.298 -10.504 -21.537 1.00 0.00 C ATOM 888 O VAL A 57 13.267 -11.695 -21.231 1.00 0.00 O ATOM 889 CB VAL A 57 12.203 -8.945 -19.925 1.00 0.00 C ATOM 890 CG1 VAL A 57 11.455 -10.090 -19.259 1.00 0.00 C ATOM 891 CG2 VAL A 57 12.413 -7.796 -18.950 1.00 0.00 C ATOM 0 H VAL A 57 13.859 -7.425 -21.002 1.00 0.00 H new ATOM 0 HA VAL A 57 14.140 -9.861 -19.670 1.00 0.00 H new ATOM 0 HB VAL A 57 11.597 -8.581 -20.755 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.504 -9.726 -18.871 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.271 -10.878 -19.989 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.053 -10.487 -18.439 1.00 0.00 H new ATOM 0 HG21 VAL A 57 11.449 -7.464 -18.566 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.038 -8.131 -18.122 1.00 0.00 H new ATOM 0 HG23 VAL A 57 12.904 -6.969 -19.463 1.00 0.00 H new ATOM 901 N GLU A 58 13.117 -10.070 -22.781 1.00 0.00 N ATOM 902 CA GLU A 58 12.864 -10.993 -23.881 1.00 0.00 C ATOM 903 C GLU A 58 13.964 -12.048 -23.970 1.00 0.00 C ATOM 904 O GLU A 58 13.701 -13.245 -23.857 1.00 0.00 O ATOM 905 CB GLU A 58 12.766 -10.230 -25.204 1.00 0.00 C ATOM 906 CG GLU A 58 12.520 -11.126 -26.406 1.00 0.00 C ATOM 907 CD GLU A 58 12.464 -10.351 -27.709 1.00 0.00 C ATOM 908 OE1 GLU A 58 13.526 -9.878 -28.164 1.00 0.00 O ATOM 909 OE2 GLU A 58 11.358 -10.219 -28.273 1.00 0.00 O ATOM 0 H GLU A 58 13.141 -9.087 -23.051 1.00 0.00 H new ATOM 0 HA GLU A 58 11.916 -11.496 -23.689 1.00 0.00 H new ATOM 0 HB2 GLU A 58 11.959 -9.500 -25.134 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.689 -9.671 -25.361 1.00 0.00 H new ATOM 0 HG2 GLU A 58 13.311 -11.873 -26.466 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.583 -11.665 -26.267 1.00 0.00 H new ATOM 916 N ALA A 59 15.196 -11.594 -24.174 1.00 0.00 N ATOM 917 CA ALA A 59 16.335 -12.496 -24.277 1.00 0.00 C ATOM 918 C ALA A 59 16.517 -13.300 -22.994 1.00 0.00 C ATOM 919 O ALA A 59 16.854 -14.483 -23.032 1.00 0.00 O ATOM 920 CB ALA A 59 17.601 -11.715 -24.596 1.00 0.00 C ATOM 0 H ALA A 59 15.430 -10.606 -24.271 1.00 0.00 H new ATOM 0 HA ALA A 59 16.139 -13.196 -25.089 1.00 0.00 H new ATOM 0 HB1 ALA A 59 18.444 -12.402 -24.670 1.00 0.00 H new ATOM 0 HB2 ALA A 59 17.476 -11.191 -25.544 1.00 0.00 H new ATOM 0 HB3 ALA A 59 17.792 -10.991 -23.803 1.00 0.00 H new ATOM 926 N LYS A 60 16.293 -12.649 -21.857 1.00 0.00 N ATOM 927 CA LYS A 60 16.431 -13.302 -20.561 1.00 0.00 C ATOM 928 C LYS A 60 15.554 -14.548 -20.483 1.00 0.00 C ATOM 929 O LYS A 60 15.855 -15.485 -19.745 1.00 0.00 O ATOM 930 CB LYS A 60 16.060 -12.333 -19.436 1.00 0.00 C ATOM 931 CG LYS A 60 16.204 -12.929 -18.047 1.00 0.00 C ATOM 932 CD LYS A 60 17.647 -13.303 -17.748 1.00 0.00 C ATOM 933 CE LYS A 60 18.528 -12.069 -17.626 1.00 0.00 C ATOM 934 NZ LYS A 60 19.617 -12.064 -18.642 1.00 0.00 N ATOM 0 H LYS A 60 16.015 -11.669 -21.807 1.00 0.00 H new ATOM 0 HA LYS A 60 17.472 -13.604 -20.444 1.00 0.00 H new ATOM 0 HB2 LYS A 60 16.690 -11.447 -19.509 1.00 0.00 H new ATOM 0 HB3 LYS A 60 15.030 -12.004 -19.576 1.00 0.00 H new ATOM 0 HG2 LYS A 60 15.851 -12.213 -17.304 1.00 0.00 H new ATOM 0 HG3 LYS A 60 15.573 -13.814 -17.962 1.00 0.00 H new ATOM 0 HD2 LYS A 60 17.691 -13.876 -16.822 1.00 0.00 H new ATOM 0 HD3 LYS A 60 18.029 -13.947 -18.540 1.00 0.00 H new ATOM 0 HE2 LYS A 60 17.918 -11.174 -17.743 1.00 0.00 H new ATOM 0 HE3 LYS A 60 18.963 -12.030 -16.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 20.196 -11.208 -18.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 20.215 -12.905 -18.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 19.202 -12.076 -19.596 1.00 0.00 H new ATOM 948 N SER A 61 14.469 -14.551 -21.250 1.00 0.00 N ATOM 949 CA SER A 61 13.547 -15.680 -21.266 1.00 0.00 C ATOM 950 C SER A 61 14.045 -16.775 -22.205 1.00 0.00 C ATOM 951 O SER A 61 13.729 -17.952 -22.027 1.00 0.00 O ATOM 952 CB SER A 61 12.152 -15.221 -21.695 1.00 0.00 C ATOM 953 OG SER A 61 11.535 -16.181 -22.536 1.00 0.00 O ATOM 0 H SER A 61 14.207 -13.784 -21.869 1.00 0.00 H new ATOM 0 HA SER A 61 13.493 -16.087 -20.256 1.00 0.00 H new ATOM 0 HB2 SER A 61 11.533 -15.054 -20.813 1.00 0.00 H new ATOM 0 HB3 SER A 61 12.224 -14.268 -22.218 1.00 0.00 H new ATOM 0 HG SER A 61 10.719 -15.801 -22.923 1.00 0.00 H new ATOM 959 N LEU A 62 14.825 -16.379 -23.204 1.00 0.00 N ATOM 960 CA LEU A 62 15.369 -17.325 -24.172 1.00 0.00 C ATOM 961 C LEU A 62 16.634 -17.987 -23.635 1.00 0.00 C ATOM 962 O LEU A 62 16.907 -19.151 -23.925 1.00 0.00 O ATOM 963 CB LEU A 62 15.671 -16.616 -25.493 1.00 0.00 C ATOM 964 CG LEU A 62 14.564 -15.714 -26.040 1.00 0.00 C ATOM 965 CD1 LEU A 62 14.949 -15.163 -27.404 1.00 0.00 C ATOM 966 CD2 LEU A 62 13.248 -16.474 -26.122 1.00 0.00 C ATOM 0 H LEU A 62 15.095 -15.409 -23.365 1.00 0.00 H new ATOM 0 HA LEU A 62 14.622 -18.100 -24.345 1.00 0.00 H new ATOM 0 HB2 LEU A 62 16.570 -16.014 -25.362 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.900 -17.372 -26.244 1.00 0.00 H new ATOM 0 HG LEU A 62 14.434 -14.875 -25.356 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.149 -14.524 -27.777 1.00 0.00 H new ATOM 0 HD12 LEU A 62 15.867 -14.582 -27.316 1.00 0.00 H new ATOM 0 HD13 LEU A 62 15.107 -15.988 -28.098 1.00 0.00 H new ATOM 0 HD21 LEU A 62 12.472 -15.816 -26.513 1.00 0.00 H new ATOM 0 HD22 LEU A 62 13.364 -17.332 -26.784 1.00 0.00 H new ATOM 0 HD23 LEU A 62 12.964 -16.819 -25.128 1.00 0.00 H new ATOM 978 N GLU A 63 17.401 -17.236 -22.850 1.00 0.00 N ATOM 979 CA GLU A 63 18.636 -17.752 -22.273 1.00 0.00 C ATOM 980 C GLU A 63 18.341 -18.726 -21.136 1.00 0.00 C ATOM 981 O GLU A 63 19.151 -19.599 -20.824 1.00 0.00 O ATOM 982 CB GLU A 63 19.504 -16.601 -21.759 1.00 0.00 C ATOM 983 CG GLU A 63 18.965 -15.947 -20.498 1.00 0.00 C ATOM 984 CD GLU A 63 19.748 -16.335 -19.259 1.00 0.00 C ATOM 985 OE1 GLU A 63 19.871 -17.548 -18.990 1.00 0.00 O ATOM 986 OE2 GLU A 63 20.238 -15.425 -18.559 1.00 0.00 O ATOM 0 H GLU A 63 17.189 -16.270 -22.600 1.00 0.00 H new ATOM 0 HA GLU A 63 19.176 -18.286 -23.055 1.00 0.00 H new ATOM 0 HB2 GLU A 63 20.509 -16.975 -21.563 1.00 0.00 H new ATOM 0 HB3 GLU A 63 19.591 -15.846 -22.541 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.991 -14.864 -20.615 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.920 -16.228 -20.366 1.00 0.00 H new ATOM 993 N VAL A 64 17.173 -18.570 -20.519 1.00 0.00 N ATOM 994 CA VAL A 64 16.769 -19.435 -19.418 1.00 0.00 C ATOM 995 C VAL A 64 15.984 -20.640 -19.924 1.00 0.00 C ATOM 996 O VAL A 64 16.491 -21.762 -19.940 1.00 0.00 O ATOM 997 CB VAL A 64 15.911 -18.672 -18.391 1.00 0.00 C ATOM 998 CG1 VAL A 64 15.454 -19.605 -17.279 1.00 0.00 C ATOM 999 CG2 VAL A 64 16.685 -17.492 -17.823 1.00 0.00 C ATOM 0 H VAL A 64 16.491 -17.852 -20.764 1.00 0.00 H new ATOM 0 HA VAL A 64 17.683 -19.778 -18.934 1.00 0.00 H new ATOM 0 HB VAL A 64 15.026 -18.287 -18.897 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.849 -19.049 -16.563 1.00 0.00 H new ATOM 0 HG12 VAL A 64 14.860 -20.414 -17.704 1.00 0.00 H new ATOM 0 HG13 VAL A 64 16.325 -20.021 -16.772 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.064 -16.964 -17.099 1.00 0.00 H new ATOM 0 HG22 VAL A 64 17.589 -17.852 -17.331 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.958 -16.813 -18.631 1.00 0.00 H new ATOM 1009 N TRP A 65 14.746 -20.400 -20.339 1.00 0.00 N ATOM 1010 CA TRP A 65 13.890 -21.466 -20.847 1.00 0.00 C ATOM 1011 C TRP A 65 14.511 -22.124 -22.074 1.00 0.00 C ATOM 1012 O TRP A 65 14.239 -23.287 -22.371 1.00 0.00 O ATOM 1013 CB TRP A 65 12.506 -20.915 -21.195 1.00 0.00 C ATOM 1014 CG TRP A 65 11.606 -20.776 -20.005 1.00 0.00 C ATOM 1015 CD1 TRP A 65 11.389 -19.646 -19.269 1.00 0.00 C ATOM 1016 CD2 TRP A 65 10.804 -21.804 -19.413 1.00 0.00 C ATOM 1017 NE1 TRP A 65 10.500 -19.910 -18.255 1.00 0.00 N ATOM 1018 CE2 TRP A 65 10.125 -21.225 -18.322 1.00 0.00 C ATOM 1019 CE3 TRP A 65 10.590 -23.155 -19.699 1.00 0.00 C ATOM 1020 CZ2 TRP A 65 9.252 -21.954 -17.518 1.00 0.00 C ATOM 1021 CZ3 TRP A 65 9.723 -23.876 -18.900 1.00 0.00 C ATOM 1022 CH2 TRP A 65 9.062 -23.275 -17.821 1.00 0.00 C ATOM 0 H TRP A 65 14.312 -19.477 -20.334 1.00 0.00 H new ATOM 0 HA TRP A 65 13.788 -22.219 -20.066 1.00 0.00 H new ATOM 0 HB2 TRP A 65 12.620 -19.941 -21.671 1.00 0.00 H new ATOM 0 HB3 TRP A 65 12.033 -21.573 -21.924 1.00 0.00 H new ATOM 0 HD1 TRP A 65 11.848 -18.687 -19.456 1.00 0.00 H new ATOM 0 HE1 TRP A 65 10.172 -19.235 -17.564 1.00 0.00 H new ATOM 0 HE3 TRP A 65 11.093 -23.627 -20.530 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 8.743 -21.493 -16.685 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 9.552 -24.921 -19.111 1.00 0.00 H new ATOM 0 HH2 TRP A 65 8.389 -23.866 -17.217 1.00 0.00 H new ATOM 1033 N GLY A 66 15.349 -21.373 -22.783 1.00 0.00 N ATOM 1034 CA GLY A 66 15.996 -21.902 -23.970 1.00 0.00 C ATOM 1035 C GLY A 66 15.439 -21.307 -25.248 1.00 0.00 C ATOM 1036 O GLY A 66 16.191 -20.956 -26.156 1.00 0.00 O ATOM 0 H GLY A 66 15.591 -20.408 -22.557 1.00 0.00 H new ATOM 0 HA2 GLY A 66 17.066 -21.702 -23.916 1.00 0.00 H new ATOM 0 HA3 GLY A 66 15.875 -22.985 -23.994 1.00 0.00 H new ATOM 1040 N SER A 67 14.116 -21.196 -25.320 1.00 0.00 N ATOM 1041 CA SER A 67 13.458 -20.644 -26.498 1.00 0.00 C ATOM 1042 C SER A 67 12.141 -19.974 -26.122 1.00 0.00 C ATOM 1043 O SER A 67 11.567 -20.226 -25.062 1.00 0.00 O ATOM 1044 CB SER A 67 13.207 -21.746 -27.530 1.00 0.00 C ATOM 1045 OG SER A 67 13.340 -23.030 -26.947 1.00 0.00 O ATOM 0 H SER A 67 13.479 -21.481 -24.576 1.00 0.00 H new ATOM 0 HA SER A 67 14.116 -19.891 -26.932 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.207 -21.635 -27.949 1.00 0.00 H new ATOM 0 HB3 SER A 67 13.912 -21.643 -28.355 1.00 0.00 H new ATOM 0 HG SER A 67 13.173 -23.717 -27.626 1.00 0.00 H new ATOM 1051 N PRO A 68 11.648 -19.098 -27.010 1.00 0.00 N ATOM 1052 CA PRO A 68 10.393 -18.373 -26.794 1.00 0.00 C ATOM 1053 C PRO A 68 9.175 -19.286 -26.873 1.00 0.00 C ATOM 1054 O PRO A 68 8.122 -18.981 -26.313 1.00 0.00 O ATOM 1055 CB PRO A 68 10.371 -17.353 -27.936 1.00 0.00 C ATOM 1056 CG PRO A 68 11.211 -17.963 -29.004 1.00 0.00 C ATOM 1057 CD PRO A 68 12.279 -18.748 -28.294 1.00 0.00 C ATOM 0 HA PRO A 68 10.348 -17.924 -25.802 1.00 0.00 H new ATOM 0 HB2 PRO A 68 9.355 -17.173 -28.286 1.00 0.00 H new ATOM 0 HB3 PRO A 68 10.773 -16.392 -27.616 1.00 0.00 H new ATOM 0 HG2 PRO A 68 10.615 -18.609 -29.648 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.650 -17.195 -29.641 1.00 0.00 H new ATOM 0 HD2 PRO A 68 12.566 -19.637 -28.856 1.00 0.00 H new ATOM 0 HD3 PRO A 68 13.183 -18.157 -28.149 1.00 0.00 H new ATOM 1065 N GLU A 69 9.326 -20.408 -27.570 1.00 0.00 N ATOM 1066 CA GLU A 69 8.237 -21.366 -27.721 1.00 0.00 C ATOM 1067 C GLU A 69 7.925 -22.049 -26.393 1.00 0.00 C ATOM 1068 O GLU A 69 6.803 -22.499 -26.163 1.00 0.00 O ATOM 1069 CB GLU A 69 8.593 -22.415 -28.776 1.00 0.00 C ATOM 1070 CG GLU A 69 8.541 -21.888 -30.201 1.00 0.00 C ATOM 1071 CD GLU A 69 7.763 -22.798 -31.131 1.00 0.00 C ATOM 1072 OE1 GLU A 69 6.617 -23.157 -30.788 1.00 0.00 O ATOM 1073 OE2 GLU A 69 8.300 -23.153 -32.201 1.00 0.00 O ATOM 0 H GLU A 69 10.191 -20.676 -28.039 1.00 0.00 H new ATOM 0 HA GLU A 69 7.351 -20.821 -28.046 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.594 -22.795 -28.575 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.908 -23.258 -28.684 1.00 0.00 H new ATOM 0 HG2 GLU A 69 8.085 -20.898 -30.202 1.00 0.00 H new ATOM 0 HG3 GLU A 69 9.557 -21.771 -30.579 1.00 0.00 H new ATOM 1080 N ALA A 70 8.927 -22.123 -25.523 1.00 0.00 N ATOM 1081 CA ALA A 70 8.760 -22.750 -24.218 1.00 0.00 C ATOM 1082 C ALA A 70 7.883 -21.898 -23.307 1.00 0.00 C ATOM 1083 O ALA A 70 7.074 -22.421 -22.540 1.00 0.00 O ATOM 1084 CB ALA A 70 10.116 -22.992 -23.572 1.00 0.00 C ATOM 0 H ALA A 70 9.863 -21.757 -25.698 1.00 0.00 H new ATOM 0 HA ALA A 70 8.262 -23.709 -24.364 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.976 -23.461 -22.598 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.710 -23.648 -24.208 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.634 -22.041 -23.446 1.00 0.00 H new ATOM 1090 N LEU A 71 8.048 -20.583 -23.397 1.00 0.00 N ATOM 1091 CA LEU A 71 7.270 -19.657 -22.580 1.00 0.00 C ATOM 1092 C LEU A 71 5.879 -19.447 -23.169 1.00 0.00 C ATOM 1093 O LEU A 71 4.892 -19.358 -22.439 1.00 0.00 O ATOM 1094 CB LEU A 71 7.996 -18.315 -22.466 1.00 0.00 C ATOM 1095 CG LEU A 71 7.218 -17.187 -21.786 1.00 0.00 C ATOM 1096 CD1 LEU A 71 7.112 -17.439 -20.290 1.00 0.00 C ATOM 1097 CD2 LEU A 71 7.879 -15.844 -22.057 1.00 0.00 C ATOM 0 H LEU A 71 8.713 -20.134 -24.027 1.00 0.00 H new ATOM 0 HA LEU A 71 7.161 -20.091 -21.586 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.924 -18.472 -21.916 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.271 -17.987 -23.468 1.00 0.00 H new ATOM 0 HG LEU A 71 6.211 -17.164 -22.202 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.555 -16.627 -19.823 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.593 -18.382 -20.116 1.00 0.00 H new ATOM 0 HD13 LEU A 71 8.111 -17.490 -19.858 1.00 0.00 H new ATOM 0 HD21 LEU A 71 7.312 -15.054 -21.566 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.898 -15.855 -21.669 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.902 -15.660 -23.131 1.00 0.00 H new ATOM 1109 N ALA A 72 5.808 -19.371 -24.494 1.00 0.00 N ATOM 1110 CA ALA A 72 4.538 -19.177 -25.181 1.00 0.00 C ATOM 1111 C ALA A 72 3.522 -20.236 -24.767 1.00 0.00 C ATOM 1112 O ALA A 72 2.314 -20.003 -24.812 1.00 0.00 O ATOM 1113 CB ALA A 72 4.744 -19.201 -26.689 1.00 0.00 C ATOM 0 H ALA A 72 6.616 -19.441 -25.113 1.00 0.00 H new ATOM 0 HA ALA A 72 4.144 -18.202 -24.895 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.787 -19.055 -27.189 1.00 0.00 H new ATOM 0 HB2 ALA A 72 5.429 -18.403 -26.975 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.164 -20.163 -26.984 1.00 0.00 H new ATOM 1119 N ARG A 73 4.019 -21.401 -24.365 1.00 0.00 N ATOM 1120 CA ARG A 73 3.154 -22.497 -23.945 1.00 0.00 C ATOM 1121 C ARG A 73 2.197 -22.044 -22.847 1.00 0.00 C ATOM 1122 O ARG A 73 1.024 -22.415 -22.842 1.00 0.00 O ATOM 1123 CB ARG A 73 3.994 -23.677 -23.450 1.00 0.00 C ATOM 1124 CG ARG A 73 4.911 -24.260 -24.512 1.00 0.00 C ATOM 1125 CD ARG A 73 4.428 -25.624 -24.978 1.00 0.00 C ATOM 1126 NE ARG A 73 4.898 -25.941 -26.324 1.00 0.00 N ATOM 1127 CZ ARG A 73 4.594 -27.065 -26.963 1.00 0.00 C ATOM 1128 NH1 ARG A 73 3.825 -27.975 -26.381 1.00 0.00 N ATOM 1129 NH2 ARG A 73 5.060 -27.281 -28.186 1.00 0.00 N ATOM 0 H ARG A 73 5.016 -21.610 -24.321 1.00 0.00 H new ATOM 0 HA ARG A 73 2.567 -22.814 -24.807 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.596 -23.353 -22.601 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.328 -24.460 -23.088 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.962 -23.581 -25.363 1.00 0.00 H new ATOM 0 HG3 ARG A 73 5.922 -24.348 -24.113 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.776 -26.388 -24.283 1.00 0.00 H new ATOM 0 HD3 ARG A 73 3.338 -25.648 -24.959 1.00 0.00 H new ATOM 0 HE ARG A 73 5.492 -25.262 -26.799 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.465 -27.813 -25.440 1.00 0.00 H new ATOM 0 HH12 ARG A 73 3.593 -28.837 -26.874 1.00 0.00 H new ATOM 0 HH21 ARG A 73 5.652 -26.584 -28.637 1.00 0.00 H new ATOM 0 HH22 ARG A 73 4.826 -28.145 -28.676 1.00 0.00 H new ATOM 1143 N GLU A 74 2.707 -21.240 -21.919 1.00 0.00 N ATOM 1144 CA GLU A 74 1.896 -20.738 -20.816 1.00 0.00 C ATOM 1145 C GLU A 74 1.216 -19.425 -21.194 1.00 0.00 C ATOM 1146 O GLU A 74 0.131 -19.111 -20.703 1.00 0.00 O ATOM 1147 CB GLU A 74 2.761 -20.537 -19.569 1.00 0.00 C ATOM 1148 CG GLU A 74 3.025 -21.819 -18.798 1.00 0.00 C ATOM 1149 CD GLU A 74 1.833 -22.259 -17.971 1.00 0.00 C ATOM 1150 OE1 GLU A 74 0.708 -21.798 -18.261 1.00 0.00 O ATOM 1151 OE2 GLU A 74 2.023 -23.063 -17.036 1.00 0.00 O ATOM 0 H GLU A 74 3.676 -20.923 -21.909 1.00 0.00 H new ATOM 0 HA GLU A 74 1.125 -21.477 -20.600 1.00 0.00 H new ATOM 0 HB2 GLU A 74 3.714 -20.098 -19.865 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.272 -19.821 -18.909 1.00 0.00 H new ATOM 0 HG2 GLU A 74 3.289 -22.612 -19.498 1.00 0.00 H new ATOM 0 HG3 GLU A 74 3.884 -21.674 -18.142 1.00 0.00 H new ATOM 1158 N LYS A 75 1.862 -18.662 -22.069 1.00 0.00 N ATOM 1159 CA LYS A 75 1.321 -17.383 -22.514 1.00 0.00 C ATOM 1160 C LYS A 75 0.020 -17.581 -23.286 1.00 0.00 C ATOM 1161 O LYS A 75 -0.922 -16.801 -23.146 1.00 0.00 O ATOM 1162 CB LYS A 75 2.341 -16.653 -23.392 1.00 0.00 C ATOM 1163 CG LYS A 75 3.698 -16.482 -22.733 1.00 0.00 C ATOM 1164 CD LYS A 75 4.064 -15.015 -22.580 1.00 0.00 C ATOM 1165 CE LYS A 75 3.297 -14.365 -21.439 1.00 0.00 C ATOM 1166 NZ LYS A 75 2.302 -13.373 -21.934 1.00 0.00 N ATOM 0 H LYS A 75 2.761 -18.907 -22.484 1.00 0.00 H new ATOM 0 HA LYS A 75 1.111 -16.779 -21.631 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.466 -17.204 -24.324 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.947 -15.671 -23.653 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.690 -16.960 -21.753 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.459 -16.987 -23.328 1.00 0.00 H new ATOM 0 HD2 LYS A 75 5.135 -14.923 -22.399 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.852 -14.487 -23.510 1.00 0.00 H new ATOM 0 HE2 LYS A 75 2.786 -15.134 -20.860 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.997 -13.872 -20.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 2.358 -12.508 -21.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.506 -13.142 -22.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.346 -13.775 -21.862 1.00 0.00 H new ATOM 1180 N LYS A 76 -0.025 -18.631 -24.099 1.00 0.00 N ATOM 1181 CA LYS A 76 -1.211 -18.934 -24.892 1.00 0.00 C ATOM 1182 C LYS A 76 -2.421 -19.169 -23.992 1.00 0.00 C ATOM 1183 O LYS A 76 -3.462 -18.531 -24.156 1.00 0.00 O ATOM 1184 CB LYS A 76 -0.965 -20.167 -25.765 1.00 0.00 C ATOM 1185 CG LYS A 76 -2.170 -20.576 -26.593 1.00 0.00 C ATOM 1186 CD LYS A 76 -2.493 -19.541 -27.658 1.00 0.00 C ATOM 1187 CE LYS A 76 -1.475 -19.567 -28.787 1.00 0.00 C ATOM 1188 NZ LYS A 76 -1.991 -20.289 -29.983 1.00 0.00 N ATOM 0 H LYS A 76 0.746 -19.287 -24.226 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.417 -18.077 -25.534 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -0.127 -19.968 -26.433 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.673 -21.001 -25.127 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -1.977 -21.539 -27.067 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -3.033 -20.709 -25.940 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.489 -19.729 -28.060 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -2.514 -18.548 -27.208 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -1.214 -18.546 -29.064 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -0.560 -20.047 -28.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -1.268 -20.285 -30.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -2.216 -21.271 -29.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -2.850 -19.816 -30.330 1.00 0.00 H new ATOM 1202 N LEU A 77 -2.277 -20.087 -23.043 1.00 0.00 N ATOM 1203 CA LEU A 77 -3.358 -20.404 -22.116 1.00 0.00 C ATOM 1204 C LEU A 77 -3.829 -19.154 -21.380 1.00 0.00 C ATOM 1205 O LEU A 77 -5.010 -18.811 -21.413 1.00 0.00 O ATOM 1206 CB LEU A 77 -2.899 -21.460 -21.109 1.00 0.00 C ATOM 1207 CG LEU A 77 -3.061 -22.918 -21.544 1.00 0.00 C ATOM 1208 CD1 LEU A 77 -4.533 -23.269 -21.693 1.00 0.00 C ATOM 1209 CD2 LEU A 77 -2.315 -23.172 -22.845 1.00 0.00 C ATOM 0 H LEU A 77 -1.423 -20.625 -22.895 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.194 -20.800 -22.693 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.847 -21.284 -20.882 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.454 -21.315 -20.182 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.632 -23.558 -20.773 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.629 -24.310 -22.003 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.040 -23.126 -20.738 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.987 -22.623 -22.445 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.441 -24.214 -23.139 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.713 -22.524 -23.625 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.255 -22.961 -22.704 1.00 0.00 H new ATOM 1221 N ARG A 78 -2.896 -18.477 -20.718 1.00 0.00 N ATOM 1222 CA ARG A 78 -3.216 -17.264 -19.974 1.00 0.00 C ATOM 1223 C ARG A 78 -3.969 -16.270 -20.853 1.00 0.00 C ATOM 1224 O ARG A 78 -4.871 -15.573 -20.389 1.00 0.00 O ATOM 1225 CB ARG A 78 -1.938 -16.619 -19.436 1.00 0.00 C ATOM 1226 CG ARG A 78 -1.332 -17.359 -18.255 1.00 0.00 C ATOM 1227 CD ARG A 78 -0.274 -16.521 -17.555 1.00 0.00 C ATOM 1228 NE ARG A 78 -0.591 -16.305 -16.146 1.00 0.00 N ATOM 1229 CZ ARG A 78 -0.036 -15.351 -15.406 1.00 0.00 C ATOM 1230 NH1 ARG A 78 0.857 -14.529 -15.939 1.00 0.00 N ATOM 1231 NH2 ARG A 78 -0.376 -15.217 -14.130 1.00 0.00 N ATOM 0 H ARG A 78 -1.913 -18.748 -20.682 1.00 0.00 H new ATOM 0 HA ARG A 78 -3.857 -17.540 -19.136 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -1.202 -16.568 -20.238 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -2.157 -15.594 -19.138 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -2.118 -17.621 -17.546 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -0.889 -18.294 -18.599 1.00 0.00 H new ATOM 0 HD2 ARG A 78 0.694 -17.016 -17.637 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -0.183 -15.558 -18.058 1.00 0.00 H new ATOM 0 HE ARG A 78 -1.276 -16.920 -15.706 1.00 0.00 H new ATOM 0 HH11 ARG A 78 1.120 -14.628 -16.920 1.00 0.00 H new ATOM 0 HH12 ARG A 78 1.281 -13.798 -15.369 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -1.064 -15.847 -13.717 1.00 0.00 H new ATOM 0 HH22 ARG A 78 0.051 -14.484 -13.563 1.00 0.00 H new ATOM 1245 N LYS A 79 -3.593 -16.210 -22.126 1.00 0.00 N ATOM 1246 CA LYS A 79 -4.232 -15.303 -23.072 1.00 0.00 C ATOM 1247 C LYS A 79 -5.680 -15.710 -23.322 1.00 0.00 C ATOM 1248 O LYS A 79 -6.590 -14.886 -23.233 1.00 0.00 O ATOM 1249 CB LYS A 79 -3.460 -15.284 -24.393 1.00 0.00 C ATOM 1250 CG LYS A 79 -3.911 -14.190 -25.345 1.00 0.00 C ATOM 1251 CD LYS A 79 -3.286 -14.355 -26.720 1.00 0.00 C ATOM 1252 CE LYS A 79 -4.268 -13.998 -27.826 1.00 0.00 C ATOM 1253 NZ LYS A 79 -4.583 -15.170 -28.688 1.00 0.00 N ATOM 0 H LYS A 79 -2.848 -16.780 -22.527 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.224 -14.302 -22.640 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -2.398 -15.156 -24.182 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -3.573 -16.251 -24.884 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.997 -14.208 -25.433 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -3.641 -13.216 -24.936 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -2.403 -13.721 -26.798 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -2.951 -15.385 -26.847 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -5.188 -13.614 -27.385 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.850 -13.199 -28.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -5.255 -14.885 -29.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -3.709 -15.521 -29.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -5.005 -15.924 -28.109 1.00 0.00 H new ATOM 1267 N GLU A 80 -5.886 -16.986 -23.634 1.00 0.00 N ATOM 1268 CA GLU A 80 -7.225 -17.501 -23.897 1.00 0.00 C ATOM 1269 C GLU A 80 -8.115 -17.355 -22.666 1.00 0.00 C ATOM 1270 O GLU A 80 -9.336 -17.252 -22.778 1.00 0.00 O ATOM 1271 CB GLU A 80 -7.157 -18.970 -24.318 1.00 0.00 C ATOM 1272 CG GLU A 80 -6.304 -19.210 -25.553 1.00 0.00 C ATOM 1273 CD GLU A 80 -7.135 -19.495 -26.789 1.00 0.00 C ATOM 1274 OE1 GLU A 80 -7.766 -18.551 -27.309 1.00 0.00 O ATOM 1275 OE2 GLU A 80 -7.154 -20.660 -27.237 1.00 0.00 O ATOM 0 H GLU A 80 -5.144 -17.681 -23.711 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.658 -16.917 -24.709 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.758 -19.558 -23.491 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.167 -19.332 -24.509 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.679 -18.336 -25.734 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.633 -20.049 -25.369 1.00 0.00 H new ATOM 1282 N ALA A 81 -7.494 -17.348 -21.491 1.00 0.00 N ATOM 1283 CA ALA A 81 -8.228 -17.213 -20.239 1.00 0.00 C ATOM 1284 C ALA A 81 -8.990 -15.893 -20.189 1.00 0.00 C ATOM 1285 O ALA A 81 -10.196 -15.871 -19.945 1.00 0.00 O ATOM 1286 CB ALA A 81 -7.278 -17.322 -19.056 1.00 0.00 C ATOM 0 H ALA A 81 -6.484 -17.434 -21.380 1.00 0.00 H new ATOM 0 HA ALA A 81 -8.954 -18.024 -20.183 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -7.840 -17.219 -18.128 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -6.783 -18.293 -19.075 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -6.530 -16.532 -19.116 1.00 0.00 H new ATOM 1292 N GLU A 82 -8.277 -14.795 -20.420 1.00 0.00 N ATOM 1293 CA GLU A 82 -8.887 -13.471 -20.400 1.00 0.00 C ATOM 1294 C GLU A 82 -9.975 -13.356 -21.464 1.00 0.00 C ATOM 1295 O GLU A 82 -11.020 -12.746 -21.235 1.00 0.00 O ATOM 1296 CB GLU A 82 -7.825 -12.392 -20.622 1.00 0.00 C ATOM 1297 CG GLU A 82 -7.028 -12.056 -19.372 1.00 0.00 C ATOM 1298 CD GLU A 82 -6.482 -10.641 -19.392 1.00 0.00 C ATOM 1299 OE1 GLU A 82 -7.202 -9.720 -18.955 1.00 0.00 O ATOM 1300 OE2 GLU A 82 -5.332 -10.457 -19.845 1.00 0.00 O ATOM 0 H GLU A 82 -7.277 -14.796 -20.623 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.344 -13.325 -19.421 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -7.139 -12.724 -21.402 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -8.310 -11.487 -20.988 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.663 -12.184 -18.495 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.201 -12.759 -19.273 1.00 0.00 H new ATOM 1307 N ILE A 83 -9.721 -13.946 -22.627 1.00 0.00 N ATOM 1308 CA ILE A 83 -10.678 -13.911 -23.726 1.00 0.00 C ATOM 1309 C ILE A 83 -11.968 -14.633 -23.354 1.00 0.00 C ATOM 1310 O ILE A 83 -13.063 -14.174 -23.678 1.00 0.00 O ATOM 1311 CB ILE A 83 -10.094 -14.548 -25.001 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -8.800 -13.840 -25.404 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -11.110 -14.493 -26.132 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -7.988 -14.602 -26.428 1.00 0.00 C ATOM 0 H ILE A 83 -8.861 -14.454 -22.833 1.00 0.00 H new ATOM 0 HA ILE A 83 -10.896 -12.861 -23.922 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.864 -15.594 -24.796 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.043 -12.856 -25.804 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -8.190 -13.680 -24.515 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -10.683 -14.947 -27.027 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -12.008 -15.038 -25.841 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -11.368 -13.454 -26.339 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -7.085 -14.041 -26.667 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -7.714 -15.576 -26.023 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.580 -14.739 -27.333 1.00 0.00 H new ATOM 1326 N GLU A 84 -11.831 -15.766 -22.672 1.00 0.00 N ATOM 1327 CA GLU A 84 -12.987 -16.552 -22.256 1.00 0.00 C ATOM 1328 C GLU A 84 -13.832 -15.782 -21.245 1.00 0.00 C ATOM 1329 O GLU A 84 -15.037 -16.005 -21.130 1.00 0.00 O ATOM 1330 CB GLU A 84 -12.536 -17.883 -21.653 1.00 0.00 C ATOM 1331 CG GLU A 84 -11.928 -18.837 -22.667 1.00 0.00 C ATOM 1332 CD GLU A 84 -12.739 -20.107 -22.833 1.00 0.00 C ATOM 1333 OE1 GLU A 84 -13.166 -20.677 -21.807 1.00 0.00 O ATOM 1334 OE2 GLU A 84 -12.946 -20.532 -23.989 1.00 0.00 O ATOM 0 H GLU A 84 -10.932 -16.160 -22.396 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.597 -16.750 -23.137 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.806 -17.687 -20.868 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.391 -18.366 -21.180 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.847 -18.334 -23.630 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -10.916 -19.095 -22.356 1.00 0.00 H new ATOM 1341 N TYR A 85 -13.190 -14.877 -20.514 1.00 0.00 N ATOM 1342 CA TYR A 85 -13.881 -14.077 -19.510 1.00 0.00 C ATOM 1343 C TYR A 85 -14.688 -12.959 -20.165 1.00 0.00 C ATOM 1344 O TYR A 85 -15.906 -12.882 -20.004 1.00 0.00 O ATOM 1345 CB TYR A 85 -12.876 -13.483 -18.521 1.00 0.00 C ATOM 1346 CG TYR A 85 -13.487 -12.485 -17.563 1.00 0.00 C ATOM 1347 CD1 TYR A 85 -14.390 -12.890 -16.589 1.00 0.00 C ATOM 1348 CD2 TYR A 85 -13.159 -11.136 -17.633 1.00 0.00 C ATOM 1349 CE1 TYR A 85 -14.951 -11.981 -15.713 1.00 0.00 C ATOM 1350 CE2 TYR A 85 -13.713 -10.221 -16.760 1.00 0.00 C ATOM 1351 CZ TYR A 85 -14.609 -10.647 -15.802 1.00 0.00 C ATOM 1352 OH TYR A 85 -15.164 -9.739 -14.930 1.00 0.00 O ATOM 0 H TYR A 85 -12.193 -14.679 -20.598 1.00 0.00 H new ATOM 0 HA TYR A 85 -14.568 -14.730 -18.972 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.421 -14.291 -17.949 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -12.075 -12.996 -19.078 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -14.658 -13.934 -16.515 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.459 -10.798 -18.383 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -15.653 -12.313 -14.963 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -13.446 -9.177 -16.827 1.00 0.00 H new ATOM 0 HH TYR A 85 -14.818 -8.843 -15.126 1.00 0.00 H new ATOM 1362 N ARG A 86 -13.998 -12.096 -20.904 1.00 0.00 N ATOM 1363 CA ARG A 86 -14.649 -10.982 -21.583 1.00 0.00 C ATOM 1364 C ARG A 86 -15.679 -11.486 -22.589 1.00 0.00 C ATOM 1365 O ARG A 86 -16.643 -10.790 -22.905 1.00 0.00 O ATOM 1366 CB ARG A 86 -13.609 -10.112 -22.293 1.00 0.00 C ATOM 1367 CG ARG A 86 -12.805 -10.860 -23.344 1.00 0.00 C ATOM 1368 CD ARG A 86 -12.930 -10.205 -24.711 1.00 0.00 C ATOM 1369 NE ARG A 86 -12.059 -9.040 -24.840 1.00 0.00 N ATOM 1370 CZ ARG A 86 -12.141 -8.169 -25.840 1.00 0.00 C ATOM 1371 NH1 ARG A 86 -13.050 -8.331 -26.792 1.00 0.00 N ATOM 1372 NH2 ARG A 86 -11.313 -7.133 -25.889 1.00 0.00 N ATOM 0 H ARG A 86 -12.989 -12.147 -21.048 1.00 0.00 H new ATOM 0 HA ARG A 86 -15.163 -10.382 -20.833 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -14.114 -9.270 -22.766 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -12.926 -9.699 -21.551 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -11.756 -10.890 -23.048 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -13.150 -11.892 -23.401 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -12.682 -10.931 -25.485 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -13.965 -9.904 -24.876 1.00 0.00 H new ATOM 0 HE ARG A 86 -11.349 -8.887 -24.124 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -13.688 -9.126 -26.758 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -13.111 -7.661 -27.559 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -10.613 -7.005 -25.159 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -11.377 -6.465 -26.657 1.00 0.00 H new ATOM 1386 N GLU A 87 -15.466 -12.699 -23.089 1.00 0.00 N ATOM 1387 CA GLU A 87 -16.376 -13.294 -24.061 1.00 0.00 C ATOM 1388 C GLU A 87 -17.799 -13.350 -23.511 1.00 0.00 C ATOM 1389 O GLU A 87 -18.701 -12.688 -24.027 1.00 0.00 O ATOM 1390 CB GLU A 87 -15.908 -14.702 -24.436 1.00 0.00 C ATOM 1391 CG GLU A 87 -15.192 -14.768 -25.775 1.00 0.00 C ATOM 1392 CD GLU A 87 -16.055 -15.369 -26.868 1.00 0.00 C ATOM 1393 OE1 GLU A 87 -16.179 -16.612 -26.909 1.00 0.00 O ATOM 1394 OE2 GLU A 87 -16.605 -14.599 -27.682 1.00 0.00 O ATOM 0 H GLU A 87 -14.672 -13.288 -22.838 1.00 0.00 H new ATOM 0 HA GLU A 87 -16.373 -12.668 -24.953 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -15.241 -15.074 -23.658 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -16.771 -15.368 -24.461 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -14.886 -13.764 -26.069 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -14.283 -15.360 -25.668 1.00 0.00 H new ATOM 1401 N ARG A 88 -17.991 -14.143 -22.463 1.00 0.00 N ATOM 1402 CA ARG A 88 -19.304 -14.287 -21.844 1.00 0.00 C ATOM 1403 C ARG A 88 -19.882 -12.924 -21.473 1.00 0.00 C ATOM 1404 O ARG A 88 -21.094 -12.714 -21.536 1.00 0.00 O ATOM 1405 CB ARG A 88 -19.210 -15.170 -20.598 1.00 0.00 C ATOM 1406 CG ARG A 88 -18.052 -14.809 -19.682 1.00 0.00 C ATOM 1407 CD ARG A 88 -18.187 -15.479 -18.324 1.00 0.00 C ATOM 1408 NE ARG A 88 -17.443 -16.734 -18.256 1.00 0.00 N ATOM 1409 CZ ARG A 88 -17.681 -17.682 -17.356 1.00 0.00 C ATOM 1410 NH1 ARG A 88 -18.638 -17.518 -16.453 1.00 0.00 N ATOM 1411 NH2 ARG A 88 -16.961 -18.796 -17.359 1.00 0.00 N ATOM 0 H ARG A 88 -17.255 -14.696 -22.024 1.00 0.00 H new ATOM 0 HA ARG A 88 -19.969 -14.760 -22.566 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -20.142 -15.094 -20.038 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -19.107 -16.210 -20.907 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -17.112 -15.110 -20.146 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -18.012 -13.727 -19.553 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -17.828 -14.802 -17.549 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -19.240 -15.670 -18.117 1.00 0.00 H new ATOM 0 HE ARG A 88 -16.700 -16.891 -18.937 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -19.193 -16.663 -16.448 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -18.819 -18.247 -15.763 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -16.224 -18.925 -18.052 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -17.144 -19.523 -16.668 1.00 0.00 H new ATOM 1425 N LEU A 89 -19.008 -12.002 -21.086 1.00 0.00 N ATOM 1426 CA LEU A 89 -19.431 -10.660 -20.703 1.00 0.00 C ATOM 1427 C LEU A 89 -20.061 -9.930 -21.885 1.00 0.00 C ATOM 1428 O LEU A 89 -21.144 -9.357 -21.769 1.00 0.00 O ATOM 1429 CB LEU A 89 -18.240 -9.860 -20.172 1.00 0.00 C ATOM 1430 CG LEU A 89 -17.732 -10.255 -18.785 1.00 0.00 C ATOM 1431 CD1 LEU A 89 -16.507 -9.434 -18.412 1.00 0.00 C ATOM 1432 CD2 LEU A 89 -18.829 -10.081 -17.745 1.00 0.00 C ATOM 0 H LEU A 89 -18.002 -12.159 -21.029 1.00 0.00 H new ATOM 0 HA LEU A 89 -20.179 -10.753 -19.915 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.417 -9.958 -20.880 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -18.517 -8.806 -20.149 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.446 -11.307 -18.810 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -16.159 -9.729 -17.422 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -15.716 -9.609 -19.141 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -16.767 -8.375 -18.405 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -18.449 -10.367 -16.764 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -19.146 -9.038 -17.722 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -19.679 -10.713 -18.003 1.00 0.00 H new ATOM 1444 N PHE A 90 -19.376 -9.957 -23.024 1.00 0.00 N ATOM 1445 CA PHE A 90 -19.869 -9.299 -24.228 1.00 0.00 C ATOM 1446 C PHE A 90 -21.279 -9.772 -24.568 1.00 0.00 C ATOM 1447 O PHE A 90 -22.150 -8.969 -24.902 1.00 0.00 O ATOM 1448 CB PHE A 90 -18.930 -9.573 -25.405 1.00 0.00 C ATOM 1449 CG PHE A 90 -18.250 -8.341 -25.930 1.00 0.00 C ATOM 1450 CD1 PHE A 90 -18.963 -7.392 -26.645 1.00 0.00 C ATOM 1451 CD2 PHE A 90 -16.899 -8.132 -25.708 1.00 0.00 C ATOM 1452 CE1 PHE A 90 -18.340 -6.257 -27.129 1.00 0.00 C ATOM 1453 CE2 PHE A 90 -16.271 -6.998 -26.189 1.00 0.00 C ATOM 1454 CZ PHE A 90 -16.993 -6.060 -26.901 1.00 0.00 C ATOM 0 H PHE A 90 -18.478 -10.427 -23.138 1.00 0.00 H new ATOM 0 HA PHE A 90 -19.900 -8.226 -24.038 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -18.172 -10.292 -25.095 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -19.498 -10.036 -26.212 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -20.017 -7.541 -26.826 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -16.330 -8.863 -25.153 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -18.907 -5.525 -27.685 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -15.217 -6.846 -26.008 1.00 0.00 H new ATOM 0 HZ PHE A 90 -16.504 -5.174 -27.279 1.00 0.00 H new ATOM 1464 N ARG A 91 -21.496 -11.080 -24.479 1.00 0.00 N ATOM 1465 CA ARG A 91 -22.800 -11.660 -24.778 1.00 0.00 C ATOM 1466 C ARG A 91 -23.801 -11.347 -23.670 1.00 0.00 C ATOM 1467 O ARG A 91 -24.977 -11.101 -23.934 1.00 0.00 O ATOM 1468 CB ARG A 91 -22.678 -13.175 -24.957 1.00 0.00 C ATOM 1469 CG ARG A 91 -23.570 -13.731 -26.055 1.00 0.00 C ATOM 1470 CD ARG A 91 -23.399 -15.235 -26.202 1.00 0.00 C ATOM 1471 NE ARG A 91 -22.897 -15.602 -27.523 1.00 0.00 N ATOM 1472 CZ ARG A 91 -23.625 -15.533 -28.632 1.00 0.00 C ATOM 1473 NH1 ARG A 91 -24.881 -15.111 -28.579 1.00 0.00 N ATOM 1474 NH2 ARG A 91 -23.097 -15.884 -29.797 1.00 0.00 N ATOM 0 H ARG A 91 -20.786 -11.758 -24.202 1.00 0.00 H new ATOM 0 HA ARG A 91 -23.162 -11.219 -25.706 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -21.641 -13.424 -25.182 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -22.926 -13.665 -24.016 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -24.612 -13.502 -25.830 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -23.333 -13.242 -27.000 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -22.710 -15.598 -25.439 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -24.356 -15.727 -26.028 1.00 0.00 H new ATOM 0 HE ARG A 91 -21.934 -15.930 -27.599 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -25.290 -14.838 -27.685 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -25.438 -15.059 -29.432 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -22.131 -16.207 -29.842 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -23.657 -15.830 -30.648 1.00 0.00 H new ATOM 1488 N ASN A 92 -23.326 -11.359 -22.429 1.00 0.00 N ATOM 1489 CA ASN A 92 -24.180 -11.078 -21.280 1.00 0.00 C ATOM 1490 C ASN A 92 -24.890 -9.738 -21.447 1.00 0.00 C ATOM 1491 O ASN A 92 -26.024 -9.567 -20.999 1.00 0.00 O ATOM 1492 CB ASN A 92 -23.353 -11.073 -19.993 1.00 0.00 C ATOM 1493 CG ASN A 92 -24.163 -10.636 -18.788 1.00 0.00 C ATOM 1494 OD1 ASN A 92 -25.359 -10.913 -18.696 1.00 0.00 O ATOM 1495 ND2 ASN A 92 -23.513 -9.950 -17.855 1.00 0.00 N ATOM 0 H ASN A 92 -22.354 -11.560 -22.193 1.00 0.00 H new ATOM 0 HA ASN A 92 -24.933 -11.863 -21.216 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -22.954 -12.072 -19.817 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -22.500 -10.406 -20.115 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -24.006 -9.630 -17.021 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -22.521 -9.743 -17.972 1.00 0.00 H new ATOM 1502 N GLN A 93 -24.216 -8.793 -22.093 1.00 0.00 N ATOM 1503 CA GLN A 93 -24.783 -7.468 -22.318 1.00 0.00 C ATOM 1504 C GLN A 93 -25.279 -7.325 -23.753 1.00 0.00 C ATOM 1505 O GLN A 93 -24.486 -7.287 -24.694 1.00 0.00 O ATOM 1506 CB GLN A 93 -23.744 -6.387 -22.014 1.00 0.00 C ATOM 1507 CG GLN A 93 -23.903 -5.760 -20.639 1.00 0.00 C ATOM 1508 CD GLN A 93 -22.772 -4.811 -20.296 1.00 0.00 C ATOM 1509 OE1 GLN A 93 -22.194 -4.882 -19.210 1.00 0.00 O ATOM 1510 NE2 GLN A 93 -22.447 -3.916 -21.222 1.00 0.00 N ATOM 0 H GLN A 93 -23.277 -8.920 -22.470 1.00 0.00 H new ATOM 0 HA GLN A 93 -25.632 -7.345 -21.646 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -22.747 -6.820 -22.093 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -23.813 -5.605 -22.771 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -24.850 -5.221 -20.597 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -23.951 -6.548 -19.888 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -22.952 -3.892 -22.108 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -21.692 -3.252 -21.047 1.00 0.00 H new ATOM 1519 N LYS A 94 -26.596 -7.247 -23.914 1.00 0.00 N ATOM 1520 CA LYS A 94 -27.199 -7.107 -25.234 1.00 0.00 C ATOM 1521 C LYS A 94 -28.117 -5.890 -25.286 1.00 0.00 C ATOM 1522 O LYS A 94 -28.584 -5.408 -24.254 1.00 0.00 O ATOM 1523 CB LYS A 94 -27.986 -8.369 -25.593 1.00 0.00 C ATOM 1524 CG LYS A 94 -29.193 -8.607 -24.703 1.00 0.00 C ATOM 1525 CD LYS A 94 -29.581 -10.076 -24.670 1.00 0.00 C ATOM 1526 CE LYS A 94 -31.072 -10.254 -24.432 1.00 0.00 C ATOM 1527 NZ LYS A 94 -31.474 -11.687 -24.477 1.00 0.00 N ATOM 0 H LYS A 94 -27.266 -7.278 -23.146 1.00 0.00 H new ATOM 0 HA LYS A 94 -26.398 -6.967 -25.960 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -28.317 -8.298 -26.629 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -27.322 -9.231 -25.529 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -28.973 -8.265 -23.692 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -30.034 -8.016 -25.064 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -29.303 -10.548 -25.612 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -29.023 -10.583 -23.883 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -31.338 -9.833 -23.463 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -31.629 -9.697 -25.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -32.498 -11.766 -24.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -31.244 -12.083 -25.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -30.962 -12.215 -23.741 1.00 0.00 H new ATOM 1541 N ILE A 95 -28.372 -5.399 -26.494 1.00 0.00 N ATOM 1542 CA ILE A 95 -29.236 -4.240 -26.680 1.00 0.00 C ATOM 1543 C ILE A 95 -30.585 -4.445 -25.999 1.00 0.00 C ATOM 1544 O ILE A 95 -31.214 -3.490 -25.542 1.00 0.00 O ATOM 1545 CB ILE A 95 -29.468 -3.944 -28.174 1.00 0.00 C ATOM 1546 CG1 ILE A 95 -30.346 -2.703 -28.340 1.00 0.00 C ATOM 1547 CG2 ILE A 95 -30.103 -5.145 -28.859 1.00 0.00 C ATOM 1548 CD1 ILE A 95 -29.927 -1.815 -29.491 1.00 0.00 C ATOM 0 H ILE A 95 -27.993 -5.786 -27.358 1.00 0.00 H new ATOM 0 HA ILE A 95 -28.727 -3.391 -26.225 1.00 0.00 H new ATOM 0 HB ILE A 95 -28.504 -3.749 -28.645 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -31.379 -3.016 -28.491 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -30.320 -2.124 -27.417 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -30.261 -4.921 -29.914 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -29.443 -6.008 -28.766 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -31.060 -5.368 -28.388 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -30.594 -0.955 -29.548 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -28.905 -1.472 -29.332 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -29.980 -2.378 -30.423 1.00 0.00 H new ATOM 1560 N LEU A 96 -31.024 -5.697 -25.933 1.00 0.00 N ATOM 1561 CA LEU A 96 -32.298 -6.029 -25.305 1.00 0.00 C ATOM 1562 C LEU A 96 -33.458 -5.371 -26.045 1.00 0.00 C ATOM 1563 O LEU A 96 -33.738 -4.188 -25.851 1.00 0.00 O ATOM 1564 CB LEU A 96 -32.297 -5.590 -23.840 1.00 0.00 C ATOM 1565 CG LEU A 96 -32.867 -6.594 -22.837 1.00 0.00 C ATOM 1566 CD1 LEU A 96 -32.793 -6.037 -21.424 1.00 0.00 C ATOM 1567 CD2 LEU A 96 -34.302 -6.951 -23.197 1.00 0.00 C ATOM 0 H LEU A 96 -30.517 -6.499 -26.307 1.00 0.00 H new ATOM 0 HA LEU A 96 -32.428 -7.110 -25.353 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -31.271 -5.361 -23.551 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -32.865 -4.664 -23.759 1.00 0.00 H new ATOM 0 HG LEU A 96 -32.266 -7.502 -22.879 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -33.203 -6.765 -20.724 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -31.754 -5.832 -21.168 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -33.369 -5.114 -21.366 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -34.692 -7.666 -22.473 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -34.915 -6.050 -23.183 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -34.328 -7.393 -24.193 1.00 0.00 H new ATOM 1579 N ARG A 97 -34.129 -6.145 -26.891 1.00 0.00 N ATOM 1580 CA ARG A 97 -35.259 -5.637 -27.659 1.00 0.00 C ATOM 1581 C ARG A 97 -36.536 -6.397 -27.315 1.00 0.00 C ATOM 1582 O ARG A 97 -36.539 -7.259 -26.437 1.00 0.00 O ATOM 1583 CB ARG A 97 -34.975 -5.747 -29.158 1.00 0.00 C ATOM 1584 CG ARG A 97 -34.703 -7.169 -29.623 1.00 0.00 C ATOM 1585 CD ARG A 97 -33.242 -7.363 -29.996 1.00 0.00 C ATOM 1586 NE ARG A 97 -32.983 -8.703 -30.515 1.00 0.00 N ATOM 1587 CZ ARG A 97 -31.776 -9.256 -30.552 1.00 0.00 C ATOM 1588 NH1 ARG A 97 -30.722 -8.588 -30.102 1.00 0.00 N ATOM 1589 NH2 ARG A 97 -31.620 -10.481 -31.039 1.00 0.00 N ATOM 0 H ARG A 97 -33.910 -7.126 -27.062 1.00 0.00 H new ATOM 0 HA ARG A 97 -35.400 -4.588 -27.399 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -35.826 -5.349 -29.711 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -34.116 -5.123 -29.403 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -34.974 -7.869 -28.833 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -35.333 -7.399 -30.483 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -32.958 -6.623 -30.744 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -32.618 -7.187 -29.120 1.00 0.00 H new ATOM 0 HE ARG A 97 -33.772 -9.244 -30.868 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -30.837 -7.647 -29.726 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -29.796 -9.016 -30.132 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -32.428 -10.999 -31.385 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -30.692 -10.904 -31.067 1.00 0.00 H new ATOM 1603 N GLU A 98 -37.620 -6.071 -28.013 1.00 0.00 N ATOM 1604 CA GLU A 98 -38.903 -6.723 -27.780 1.00 0.00 C ATOM 1605 C GLU A 98 -38.779 -8.237 -27.926 1.00 0.00 C ATOM 1606 O GLU A 98 -37.963 -8.731 -28.704 1.00 0.00 O ATOM 1607 CB GLU A 98 -39.956 -6.190 -28.754 1.00 0.00 C ATOM 1608 CG GLU A 98 -39.743 -6.646 -30.188 1.00 0.00 C ATOM 1609 CD GLU A 98 -39.712 -5.490 -31.169 1.00 0.00 C ATOM 1610 OE1 GLU A 98 -40.796 -5.046 -31.599 1.00 0.00 O ATOM 1611 OE2 GLU A 98 -38.601 -5.028 -31.506 1.00 0.00 O ATOM 0 H GLU A 98 -37.635 -5.360 -28.744 1.00 0.00 H new ATOM 0 HA GLU A 98 -39.215 -6.498 -26.760 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -40.943 -6.512 -28.422 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -39.949 -5.100 -28.723 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -38.806 -7.199 -30.254 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -40.540 -7.335 -30.469 1.00 0.00 H new ATOM 1618 N TYR A 99 -39.592 -8.967 -27.171 1.00 0.00 N ATOM 1619 CA TYR A 99 -39.572 -10.424 -27.213 1.00 0.00 C ATOM 1620 C TYR A 99 -39.798 -10.931 -28.634 1.00 0.00 C ATOM 1621 O TYR A 99 -40.542 -10.330 -29.409 1.00 0.00 O ATOM 1622 CB TYR A 99 -40.640 -10.997 -26.280 1.00 0.00 C ATOM 1623 CG TYR A 99 -42.050 -10.834 -26.801 1.00 0.00 C ATOM 1624 CD1 TYR A 99 -42.749 -9.648 -26.614 1.00 0.00 C ATOM 1625 CD2 TYR A 99 -42.683 -11.867 -27.481 1.00 0.00 C ATOM 1626 CE1 TYR A 99 -44.037 -9.495 -27.087 1.00 0.00 C ATOM 1627 CE2 TYR A 99 -43.971 -11.723 -27.960 1.00 0.00 C ATOM 1628 CZ TYR A 99 -44.644 -10.536 -27.760 1.00 0.00 C ATOM 1629 OH TYR A 99 -45.927 -10.387 -28.235 1.00 0.00 O ATOM 0 H TYR A 99 -40.273 -8.573 -26.522 1.00 0.00 H new ATOM 0 HA TYR A 99 -38.590 -10.758 -26.879 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -40.441 -12.057 -26.121 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -40.562 -10.509 -25.309 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -42.276 -8.831 -26.089 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -42.159 -12.798 -27.638 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -44.566 -8.567 -26.931 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -44.448 -12.535 -28.488 1.00 0.00 H new ATOM 0 HH TYR A 99 -46.207 -11.211 -28.685 1.00 0.00 H new ATOM 1639 N ARG A 100 -39.149 -12.042 -28.969 1.00 0.00 N ATOM 1640 CA ARG A 100 -39.278 -12.631 -30.296 1.00 0.00 C ATOM 1641 C ARG A 100 -40.169 -13.869 -30.258 1.00 0.00 C ATOM 1642 O ARG A 100 -40.027 -14.722 -29.382 1.00 0.00 O ATOM 1643 CB ARG A 100 -37.900 -12.999 -30.850 1.00 0.00 C ATOM 1644 CG ARG A 100 -36.984 -11.802 -31.047 1.00 0.00 C ATOM 1645 CD ARG A 100 -35.590 -12.232 -31.477 1.00 0.00 C ATOM 1646 NE ARG A 100 -34.724 -12.505 -30.333 1.00 0.00 N ATOM 1647 CZ ARG A 100 -33.569 -13.154 -30.423 1.00 0.00 C ATOM 1648 NH1 ARG A 100 -33.143 -13.594 -31.599 1.00 0.00 N ATOM 1649 NH2 ARG A 100 -32.837 -13.363 -29.336 1.00 0.00 N ATOM 0 H ARG A 100 -38.529 -12.552 -28.340 1.00 0.00 H new ATOM 0 HA ARG A 100 -39.740 -11.892 -30.950 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -37.421 -13.704 -30.171 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -38.026 -13.511 -31.804 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -37.409 -11.137 -31.799 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -36.921 -11.234 -30.119 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -35.662 -13.125 -32.099 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -35.143 -11.451 -32.092 1.00 0.00 H new ATOM 0 HE ARG A 100 -35.023 -12.179 -29.414 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -33.703 -13.434 -32.437 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -32.256 -14.092 -31.666 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -33.161 -13.025 -28.430 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -31.950 -13.862 -29.407 1.00 0.00 H new ATOM 1663 N ASP A 101 -41.089 -13.959 -31.212 1.00 0.00 N ATOM 1664 CA ASP A 101 -42.003 -15.092 -31.289 1.00 0.00 C ATOM 1665 C ASP A 101 -41.733 -15.925 -32.538 1.00 0.00 C ATOM 1666 O ASP A 101 -41.191 -15.425 -33.524 1.00 0.00 O ATOM 1667 CB ASP A 101 -43.453 -14.605 -31.289 1.00 0.00 C ATOM 1668 CG ASP A 101 -44.421 -15.670 -30.811 1.00 0.00 C ATOM 1669 OD1 ASP A 101 -44.916 -16.445 -31.656 1.00 0.00 O ATOM 1670 OD2 ASP A 101 -44.684 -15.728 -29.591 1.00 0.00 O ATOM 0 H ASP A 101 -41.221 -13.260 -31.943 1.00 0.00 H new ATOM 0 HA ASP A 101 -41.838 -15.720 -30.413 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -43.538 -13.727 -30.649 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -43.729 -14.293 -32.296 1.00 0.00 H new TER 1675 ASP A 101