USER MOD reduce.3.24.130724 H: found=0, std=0, add=689, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 689 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 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -116:sc= -0.452 (180deg=-0.599) USER MOD Single : A 2 ASN :FLIP amide:sc= 0 F(o=-0.72,f=0) USER MOD Single : A 5 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0321) USER MOD Single : A 8 TYR OH : rot -30:sc= -2.6 USER MOD Single : A 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= -0.0866 USER MOD Single : A 15 ASN : amide:sc= -0.0172 K(o=-0.017,f=-1.6!) USER MOD Single : A 16 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 GLN : amide:sc= -0.242 X(o=-0.24,f=-0.1) USER MOD Single : A 37 ASN : amide:sc= -1.36 K(o=-1.4,f=-3!) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.276 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= 0.57 K(o=0.57,f=-1.8!) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot -15:sc= -1.38 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 HIS : no HE2:sc= -1.24 K(o=-1.2,f=-3.3) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 HIS : no HD1:sc= -0.141 K(o=-0.14,f=-0.72) USER MOD Single : A 78 HIS : no HD1:sc= -1.18 K(o=-1.2,f=-3.9) USER MOD Single : A 80 ASN : amide:sc= -0.299 X(o=-0.3,f=-0.3) USER MOD Single : A 81 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : A 87 THR OG1 : rot -159:sc= 0.0436 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -18.868 -14.173 9.665 1.00 1.00 N ATOM 2 CA MET A 1 -17.590 -13.428 9.841 1.00 1.00 C ATOM 3 C MET A 1 -17.696 -12.076 9.140 1.00 1.00 C ATOM 4 O MET A 1 -16.740 -11.609 8.524 1.00 1.00 O ATOM 5 CB MET A 1 -16.438 -14.242 9.244 1.00 1.00 C ATOM 6 CG MET A 1 -16.222 -15.514 10.070 1.00 1.00 C ATOM 7 SD MET A 1 -14.862 -16.473 9.358 1.00 1.00 S ATOM 8 CE MET A 1 -15.111 -17.978 10.332 1.00 1.00 C ATOM 0 H1 MET A 1 -19.318 -14.315 10.592 1.00 1.00 H new ATOM 0 H2 MET A 1 -19.506 -13.628 9.051 1.00 1.00 H new ATOM 0 H3 MET A 1 -18.674 -15.097 9.229 1.00 1.00 H new ATOM 0 HA MET A 1 -17.398 -13.268 10.902 1.00 1.00 H new ATOM 0 HB2 MET A 1 -16.662 -14.502 8.209 1.00 1.00 H new ATOM 0 HB3 MET A 1 -15.526 -13.645 9.232 1.00 1.00 H new ATOM 0 HG2 MET A 1 -15.996 -15.255 11.104 1.00 1.00 H new ATOM 0 HG3 MET A 1 -17.134 -16.111 10.083 1.00 1.00 H new ATOM 0 HE1 MET A 1 -14.365 -18.721 10.050 1.00 1.00 H new ATOM 0 HE2 MET A 1 -15.010 -17.746 11.392 1.00 1.00 H new ATOM 0 HE3 MET A 1 -16.108 -18.374 10.141 1.00 1.00 H new ATOM 20 N ASN A 2 -18.869 -11.458 9.249 1.00 1.00 N ATOM 21 CA ASN A 2 -19.108 -10.156 8.633 1.00 1.00 C ATOM 22 C ASN A 2 -18.808 -10.187 7.141 1.00 1.00 C ATOM 23 O ASN A 2 -18.670 -9.138 6.514 1.00 1.00 O ATOM 24 CB ASN A 2 -18.236 -9.093 9.309 1.00 1.00 C ATOM 25 CG ASN A 2 -18.536 -9.055 10.803 1.00 1.00 C ATOM 26 OD1 ASN A 2 -19.756 -9.259 11.218 1.00 1.00 O flip ATOM 27 ND2 ASN A 2 -17.634 -8.836 11.612 1.00 1.00 N flip ATOM 0 H ASN A 2 -19.668 -11.837 9.757 1.00 1.00 H new ATOM 0 HA ASN A 2 -20.161 -9.909 8.766 1.00 1.00 H new ATOM 0 HB2 ASN A 2 -17.182 -9.316 9.146 1.00 1.00 H new ATOM 0 HB3 ASN A 2 -18.427 -8.116 8.865 1.00 1.00 H new ATOM 0 HD21 ASN A 2 -16.682 -8.677 11.283 1.00 1.00 H new ATOM 0 HD22 ASN A 2 -17.839 -8.814 12.611 1.00 1.00 H new ATOM 34 N GLU A 3 -18.688 -11.398 6.588 1.00 1.00 N ATOM 35 CA GLU A 3 -18.389 -11.591 5.162 1.00 1.00 C ATOM 36 C GLU A 3 -16.996 -11.049 4.810 1.00 1.00 C ATOM 37 O GLU A 3 -16.452 -11.354 3.748 1.00 1.00 O ATOM 38 CB GLU A 3 -19.456 -10.912 4.285 1.00 1.00 C ATOM 39 CG GLU A 3 -20.830 -11.505 4.610 1.00 1.00 C ATOM 40 CD GLU A 3 -21.917 -10.817 3.786 1.00 1.00 C ATOM 41 OE1 GLU A 3 -21.586 -9.923 3.022 1.00 1.00 O ATOM 42 OE2 GLU A 3 -23.069 -11.196 3.930 1.00 1.00 O ATOM 0 H GLU A 3 -18.794 -12.268 7.110 1.00 1.00 H new ATOM 0 HA GLU A 3 -18.401 -12.663 4.964 1.00 1.00 H new ATOM 0 HB2 GLU A 3 -19.460 -9.837 4.464 1.00 1.00 H new ATOM 0 HB3 GLU A 3 -19.224 -11.059 3.230 1.00 1.00 H new ATOM 0 HG2 GLU A 3 -20.830 -12.575 4.402 1.00 1.00 H new ATOM 0 HG3 GLU A 3 -21.042 -11.387 5.673 1.00 1.00 H new ATOM 49 N ALA A 4 -16.432 -10.241 5.705 1.00 1.00 N ATOM 50 CA ALA A 4 -15.114 -9.650 5.486 1.00 1.00 C ATOM 51 C ALA A 4 -14.058 -10.732 5.290 1.00 1.00 C ATOM 52 O ALA A 4 -14.131 -11.793 5.909 1.00 1.00 O ATOM 53 CB ALA A 4 -14.736 -8.785 6.695 1.00 1.00 C ATOM 0 H ALA A 4 -16.868 -9.980 6.590 1.00 1.00 H new ATOM 0 HA ALA A 4 -15.155 -9.038 4.585 1.00 1.00 H new ATOM 0 HB1 ALA A 4 -13.753 -8.343 6.533 1.00 1.00 H new ATOM 0 HB2 ALA A 4 -15.474 -7.992 6.820 1.00 1.00 H new ATOM 0 HB3 ALA A 4 -14.713 -9.404 7.592 1.00 1.00 H new ATOM 59 N LYS A 5 -13.079 -10.459 4.412 1.00 1.00 N ATOM 60 CA LYS A 5 -12.002 -11.416 4.120 1.00 1.00 C ATOM 61 C LYS A 5 -10.620 -10.800 4.384 1.00 1.00 C ATOM 62 O LYS A 5 -9.795 -11.393 5.078 1.00 1.00 O ATOM 63 CB LYS A 5 -12.077 -11.840 2.641 1.00 1.00 C ATOM 64 CG LYS A 5 -11.179 -13.085 2.384 1.00 1.00 C ATOM 65 CD LYS A 5 -10.716 -13.123 0.922 1.00 1.00 C ATOM 66 CE LYS A 5 -9.824 -14.353 0.686 1.00 1.00 C ATOM 67 NZ LYS A 5 -10.679 -15.566 0.597 1.00 1.00 N ATOM 0 H LYS A 5 -13.012 -9.584 3.893 1.00 1.00 H new ATOM 0 HA LYS A 5 -12.133 -12.278 4.774 1.00 1.00 H new ATOM 0 HB2 LYS A 5 -13.109 -12.067 2.374 1.00 1.00 H new ATOM 0 HB3 LYS A 5 -11.757 -11.016 2.004 1.00 1.00 H new ATOM 0 HG2 LYS A 5 -10.313 -13.058 3.045 1.00 1.00 H new ATOM 0 HG3 LYS A 5 -11.732 -13.994 2.620 1.00 1.00 H new ATOM 0 HD2 LYS A 5 -11.580 -13.157 0.259 1.00 1.00 H new ATOM 0 HD3 LYS A 5 -10.166 -12.213 0.682 1.00 1.00 H new ATOM 0 HE2 LYS A 5 -9.250 -14.230 -0.232 1.00 1.00 H new ATOM 0 HE3 LYS A 5 -9.106 -14.458 1.499 1.00 1.00 H new ATOM 0 HZ1 LYS A 5 -10.100 -16.378 0.304 1.00 1.00 H new ATOM 0 HZ2 LYS A 5 -11.103 -15.761 1.526 1.00 1.00 H new ATOM 0 HZ3 LYS A 5 -11.433 -15.409 -0.102 1.00 1.00 H new ATOM 81 N GLY A 6 -10.362 -9.617 3.801 1.00 1.00 N ATOM 82 CA GLY A 6 -9.065 -8.939 3.954 1.00 1.00 C ATOM 83 C GLY A 6 -9.173 -7.751 4.897 1.00 1.00 C ATOM 84 O GLY A 6 -9.726 -7.866 5.992 1.00 1.00 O ATOM 0 H GLY A 6 -11.033 -9.112 3.221 1.00 1.00 H new ATOM 0 HA2 GLY A 6 -8.326 -9.644 4.336 1.00 1.00 H new ATOM 0 HA3 GLY A 6 -8.711 -8.602 2.980 1.00 1.00 H new ATOM 88 N VAL A 7 -8.630 -6.605 4.468 1.00 1.00 N ATOM 89 CA VAL A 7 -8.657 -5.381 5.278 1.00 1.00 C ATOM 90 C VAL A 7 -9.044 -4.168 4.431 1.00 1.00 C ATOM 91 O VAL A 7 -8.310 -3.756 3.534 1.00 1.00 O ATOM 92 CB VAL A 7 -7.278 -5.153 5.898 1.00 1.00 C ATOM 93 CG1 VAL A 7 -7.332 -3.971 6.872 1.00 1.00 C ATOM 94 CG2 VAL A 7 -6.858 -6.419 6.648 1.00 1.00 C ATOM 0 H VAL A 7 -8.167 -6.500 3.565 1.00 1.00 H new ATOM 0 HA VAL A 7 -9.404 -5.503 6.062 1.00 1.00 H new ATOM 0 HB VAL A 7 -6.556 -4.929 5.113 1.00 1.00 H new ATOM 0 HG11 VAL A 7 -6.346 -3.815 7.310 1.00 1.00 H new ATOM 0 HG12 VAL A 7 -7.638 -3.072 6.337 1.00 1.00 H new ATOM 0 HG13 VAL A 7 -8.051 -4.184 7.663 1.00 1.00 H new ATOM 0 HG21 VAL A 7 -5.875 -6.268 7.095 1.00 1.00 H new ATOM 0 HG22 VAL A 7 -7.584 -6.635 7.432 1.00 1.00 H new ATOM 0 HG23 VAL A 7 -6.815 -7.257 5.952 1.00 1.00 H new ATOM 104 N TYR A 8 -10.223 -3.635 4.710 1.00 1.00 N ATOM 105 CA TYR A 8 -10.734 -2.498 3.955 1.00 1.00 C ATOM 106 C TYR A 8 -9.774 -1.320 4.062 1.00 1.00 C ATOM 107 O TYR A 8 -9.279 -1.006 5.143 1.00 1.00 O ATOM 108 CB TYR A 8 -12.111 -2.086 4.504 1.00 1.00 C ATOM 109 CG TYR A 8 -12.992 -3.319 4.660 1.00 1.00 C ATOM 110 CD1 TYR A 8 -13.259 -4.134 3.550 1.00 1.00 C ATOM 111 CD2 TYR A 8 -13.538 -3.653 5.915 1.00 1.00 C ATOM 112 CE1 TYR A 8 -14.065 -5.269 3.690 1.00 1.00 C ATOM 113 CE2 TYR A 8 -14.344 -4.789 6.047 1.00 1.00 C ATOM 114 CZ TYR A 8 -14.606 -5.594 4.935 1.00 1.00 C ATOM 115 OH TYR A 8 -15.404 -6.705 5.066 1.00 1.00 O ATOM 0 H TYR A 8 -10.842 -3.968 5.449 1.00 1.00 H new ATOM 0 HA TYR A 8 -10.829 -2.787 2.908 1.00 1.00 H new ATOM 0 HB2 TYR A 8 -11.995 -1.586 5.466 1.00 1.00 H new ATOM 0 HB3 TYR A 8 -12.584 -1.373 3.829 1.00 1.00 H new ATOM 0 HD1 TYR A 8 -12.842 -3.885 2.586 1.00 1.00 H new ATOM 0 HD2 TYR A 8 -13.334 -3.032 6.775 1.00 1.00 H new ATOM 0 HE1 TYR A 8 -14.269 -5.895 2.834 1.00 1.00 H new ATOM 0 HE2 TYR A 8 -14.764 -5.044 7.009 1.00 1.00 H new ATOM 0 HH TYR A 8 -15.877 -6.870 4.223 1.00 1.00 H new ATOM 125 N VAL A 9 -9.495 -0.682 2.920 1.00 1.00 N ATOM 126 CA VAL A 9 -8.572 0.449 2.881 1.00 1.00 C ATOM 127 C VAL A 9 -8.874 1.437 4.010 1.00 1.00 C ATOM 128 O VAL A 9 -9.971 1.440 4.571 1.00 1.00 O ATOM 129 CB VAL A 9 -8.668 1.138 1.506 1.00 1.00 C ATOM 130 CG1 VAL A 9 -10.112 1.564 1.222 1.00 1.00 C ATOM 131 CG2 VAL A 9 -7.742 2.364 1.453 1.00 1.00 C ATOM 0 H VAL A 9 -9.895 -0.931 2.016 1.00 1.00 H new ATOM 0 HA VAL A 9 -7.555 0.086 3.027 1.00 1.00 H new ATOM 0 HB VAL A 9 -8.353 0.426 0.744 1.00 1.00 H new ATOM 0 HG11 VAL A 9 -10.163 2.049 0.247 1.00 1.00 H new ATOM 0 HG12 VAL A 9 -10.758 0.686 1.225 1.00 1.00 H new ATOM 0 HG13 VAL A 9 -10.444 2.261 1.992 1.00 1.00 H new ATOM 0 HG21 VAL A 9 -7.822 2.839 0.475 1.00 1.00 H new ATOM 0 HG22 VAL A 9 -8.034 3.074 2.226 1.00 1.00 H new ATOM 0 HG23 VAL A 9 -6.712 2.049 1.620 1.00 1.00 H new ATOM 141 N MET A 10 -7.884 2.269 4.334 1.00 1.00 N ATOM 142 CA MET A 10 -8.014 3.262 5.388 1.00 1.00 C ATOM 143 C MET A 10 -8.228 4.651 4.801 1.00 1.00 C ATOM 144 O MET A 10 -9.258 5.280 5.045 1.00 1.00 O ATOM 145 CB MET A 10 -6.761 3.237 6.270 1.00 1.00 C ATOM 146 CG MET A 10 -6.902 4.280 7.373 1.00 1.00 C ATOM 147 SD MET A 10 -5.621 4.041 8.627 1.00 1.00 S ATOM 148 CE MET A 10 -5.812 5.645 9.443 1.00 1.00 C ATOM 0 H MET A 10 -6.975 2.270 3.872 1.00 1.00 H new ATOM 0 HA MET A 10 -8.886 3.020 5.996 1.00 1.00 H new ATOM 0 HB2 MET A 10 -6.628 2.246 6.705 1.00 1.00 H new ATOM 0 HB3 MET A 10 -5.875 3.443 5.669 1.00 1.00 H new ATOM 0 HG2 MET A 10 -6.824 5.281 6.949 1.00 1.00 H new ATOM 0 HG3 MET A 10 -7.888 4.204 7.831 1.00 1.00 H new ATOM 0 HE1 MET A 10 -5.104 5.720 10.268 1.00 1.00 H new ATOM 0 HE2 MET A 10 -5.619 6.443 8.726 1.00 1.00 H new ATOM 0 HE3 MET A 10 -6.828 5.739 9.827 1.00 1.00 H new ATOM 158 N SER A 11 -7.247 5.140 4.043 1.00 1.00 N ATOM 159 CA SER A 11 -7.347 6.481 3.449 1.00 1.00 C ATOM 160 C SER A 11 -6.545 6.571 2.155 1.00 1.00 C ATOM 161 O SER A 11 -5.576 5.836 1.966 1.00 1.00 O ATOM 162 CB SER A 11 -6.822 7.518 4.444 1.00 1.00 C ATOM 163 OG SER A 11 -7.611 7.474 5.625 1.00 1.00 O ATOM 0 H SER A 11 -6.385 4.640 3.826 1.00 1.00 H new ATOM 0 HA SER A 11 -8.394 6.677 3.219 1.00 1.00 H new ATOM 0 HB2 SER A 11 -5.778 7.315 4.682 1.00 1.00 H new ATOM 0 HB3 SER A 11 -6.861 8.514 4.003 1.00 1.00 H new ATOM 0 HG SER A 11 -7.277 8.136 6.266 1.00 1.00 H new ATOM 169 N VAL A 12 -6.951 7.492 1.266 1.00 1.00 N ATOM 170 CA VAL A 12 -6.272 7.709 -0.018 1.00 1.00 C ATOM 171 C VAL A 12 -5.827 9.163 -0.099 1.00 1.00 C ATOM 172 O VAL A 12 -6.633 10.061 -0.345 1.00 1.00 O ATOM 173 CB VAL A 12 -7.240 7.421 -1.164 1.00 1.00 C ATOM 174 CG1 VAL A 12 -6.501 7.503 -2.504 1.00 1.00 C ATOM 175 CG2 VAL A 12 -7.839 6.024 -0.992 1.00 1.00 C ATOM 0 H VAL A 12 -7.754 8.103 1.417 1.00 1.00 H new ATOM 0 HA VAL A 12 -5.410 7.046 -0.094 1.00 1.00 H new ATOM 0 HB VAL A 12 -8.039 8.162 -1.151 1.00 1.00 H new ATOM 0 HG11 VAL A 12 -7.197 7.297 -3.317 1.00 1.00 H new ATOM 0 HG12 VAL A 12 -6.084 8.502 -2.629 1.00 1.00 H new ATOM 0 HG13 VAL A 12 -5.696 6.769 -2.521 1.00 1.00 H new ATOM 0 HG21 VAL A 12 -8.529 5.821 -1.811 1.00 1.00 H new ATOM 0 HG22 VAL A 12 -7.040 5.282 -0.998 1.00 1.00 H new ATOM 0 HG23 VAL A 12 -8.375 5.972 -0.044 1.00 1.00 H new ATOM 185 N LEU A 13 -4.548 9.387 0.137 1.00 1.00 N ATOM 186 CA LEU A 13 -4.009 10.741 0.124 1.00 1.00 C ATOM 187 C LEU A 13 -3.881 11.255 -1.324 1.00 1.00 C ATOM 188 O LEU A 13 -3.424 10.517 -2.195 1.00 1.00 O ATOM 189 CB LEU A 13 -2.651 10.760 0.845 1.00 1.00 C ATOM 190 CG LEU A 13 -2.830 10.825 2.385 1.00 1.00 C ATOM 191 CD1 LEU A 13 -3.371 12.208 2.834 1.00 1.00 C ATOM 192 CD2 LEU A 13 -3.785 9.704 2.845 1.00 1.00 C ATOM 0 H LEU A 13 -3.864 8.657 0.339 1.00 1.00 H new ATOM 0 HA LEU A 13 -4.691 11.408 0.651 1.00 1.00 H new ATOM 0 HB2 LEU A 13 -2.084 9.868 0.580 1.00 1.00 H new ATOM 0 HB3 LEU A 13 -2.070 11.618 0.508 1.00 1.00 H new ATOM 0 HG LEU A 13 -1.854 10.684 2.849 1.00 1.00 H new ATOM 0 HD11 LEU A 13 -3.485 12.220 3.918 1.00 1.00 H new ATOM 0 HD12 LEU A 13 -2.671 12.987 2.534 1.00 1.00 H new ATOM 0 HD13 LEU A 13 -4.338 12.390 2.366 1.00 1.00 H new ATOM 0 HD21 LEU A 13 -3.909 9.752 3.927 1.00 1.00 H new ATOM 0 HD22 LEU A 13 -4.754 9.831 2.363 1.00 1.00 H new ATOM 0 HD23 LEU A 13 -3.368 8.735 2.571 1.00 1.00 H new ATOM 204 N PRO A 14 -4.291 12.488 -1.610 1.00 1.00 N ATOM 205 CA PRO A 14 -4.230 13.052 -3.000 1.00 1.00 C ATOM 206 C PRO A 14 -2.795 13.283 -3.484 1.00 1.00 C ATOM 207 O PRO A 14 -2.548 13.381 -4.686 1.00 1.00 O ATOM 208 CB PRO A 14 -5.019 14.379 -2.887 1.00 1.00 C ATOM 209 CG PRO A 14 -4.872 14.788 -1.452 1.00 1.00 C ATOM 210 CD PRO A 14 -4.844 13.481 -0.655 1.00 1.00 C ATOM 0 HA PRO A 14 -4.648 12.368 -3.739 1.00 1.00 H new ATOM 0 HB2 PRO A 14 -4.616 15.138 -3.558 1.00 1.00 H new ATOM 0 HB3 PRO A 14 -6.067 14.241 -3.154 1.00 1.00 H new ATOM 0 HG2 PRO A 14 -3.957 15.361 -1.299 1.00 1.00 H new ATOM 0 HG3 PRO A 14 -5.701 15.422 -1.138 1.00 1.00 H new ATOM 0 HD2 PRO A 14 -4.220 13.569 0.234 1.00 1.00 H new ATOM 0 HD3 PRO A 14 -5.841 13.198 -0.318 1.00 1.00 H new ATOM 218 N ASN A 15 -1.856 13.385 -2.542 1.00 1.00 N ATOM 219 CA ASN A 15 -0.442 13.627 -2.874 1.00 1.00 C ATOM 220 C ASN A 15 0.387 12.371 -2.655 1.00 1.00 C ATOM 221 O ASN A 15 1.552 12.466 -2.267 1.00 1.00 O ATOM 222 CB ASN A 15 0.108 14.753 -1.990 1.00 1.00 C ATOM 223 CG ASN A 15 -0.556 16.074 -2.355 1.00 1.00 C ATOM 224 OD1 ASN A 15 -1.054 16.232 -3.470 1.00 1.00 O ATOM 225 ND2 ASN A 15 -0.595 17.037 -1.476 1.00 1.00 N ATOM 0 H ASN A 15 -2.044 13.305 -1.543 1.00 1.00 H new ATOM 0 HA ASN A 15 -0.379 13.911 -3.924 1.00 1.00 H new ATOM 0 HB2 ASN A 15 -0.073 14.523 -0.940 1.00 1.00 H new ATOM 0 HB3 ASN A 15 1.188 14.832 -2.117 1.00 1.00 H new ATOM 0 HD21 ASN A 15 -1.039 17.925 -1.711 1.00 1.00 H new ATOM 0 HD22 ASN A 15 -0.181 16.902 -0.553 1.00 1.00 H new ATOM 232 N MET A 16 -0.210 11.193 -2.897 1.00 1.00 N ATOM 233 CA MET A 16 0.499 9.916 -2.711 1.00 1.00 C ATOM 234 C MET A 16 0.535 9.124 -4.026 1.00 1.00 C ATOM 235 O MET A 16 -0.205 9.434 -4.961 1.00 1.00 O ATOM 236 CB MET A 16 -0.203 9.092 -1.596 1.00 1.00 C ATOM 237 CG MET A 16 0.518 9.294 -0.253 1.00 1.00 C ATOM 238 SD MET A 16 0.579 11.065 0.125 1.00 1.00 S ATOM 239 CE MET A 16 2.107 11.058 1.093 1.00 1.00 C ATOM 0 H MET A 16 -1.173 11.098 -3.219 1.00 1.00 H new ATOM 0 HA MET A 16 1.527 10.118 -2.411 1.00 1.00 H new ATOM 0 HB2 MET A 16 -1.245 9.400 -1.508 1.00 1.00 H new ATOM 0 HB3 MET A 16 -0.204 8.035 -1.861 1.00 1.00 H new ATOM 0 HG2 MET A 16 -0.005 8.758 0.539 1.00 1.00 H new ATOM 0 HG3 MET A 16 1.527 8.885 -0.302 1.00 1.00 H new ATOM 0 HE1 MET A 16 2.330 12.071 1.428 1.00 1.00 H new ATOM 0 HE2 MET A 16 1.986 10.407 1.959 1.00 1.00 H new ATOM 0 HE3 MET A 16 2.927 10.692 0.476 1.00 1.00 H new ATOM 249 N PRO A 17 1.375 8.108 -4.113 1.00 1.00 N ATOM 250 CA PRO A 17 1.492 7.268 -5.345 1.00 1.00 C ATOM 251 C PRO A 17 0.240 6.411 -5.608 1.00 1.00 C ATOM 252 O PRO A 17 0.069 5.883 -6.704 1.00 1.00 O ATOM 253 CB PRO A 17 2.747 6.378 -5.098 1.00 1.00 C ATOM 254 CG PRO A 17 3.403 6.924 -3.853 1.00 1.00 C ATOM 255 CD PRO A 17 2.302 7.628 -3.061 1.00 1.00 C ATOM 0 HA PRO A 17 1.586 7.889 -6.236 1.00 1.00 H new ATOM 0 HB2 PRO A 17 2.465 5.334 -4.965 1.00 1.00 H new ATOM 0 HB3 PRO A 17 3.428 6.418 -5.948 1.00 1.00 H new ATOM 0 HG2 PRO A 17 3.852 6.122 -3.267 1.00 1.00 H new ATOM 0 HG3 PRO A 17 4.203 7.619 -4.108 1.00 1.00 H new ATOM 0 HD2 PRO A 17 1.806 6.947 -2.369 1.00 1.00 H new ATOM 0 HD3 PRO A 17 2.698 8.452 -2.468 1.00 1.00 H new ATOM 263 N ALA A 18 -0.616 6.241 -4.597 1.00 1.00 N ATOM 264 CA ALA A 18 -1.821 5.411 -4.742 1.00 1.00 C ATOM 265 C ALA A 18 -2.987 6.199 -5.350 1.00 1.00 C ATOM 266 O ALA A 18 -3.955 5.617 -5.842 1.00 1.00 O ATOM 267 CB ALA A 18 -2.220 4.888 -3.361 1.00 1.00 C ATOM 0 H ALA A 18 -0.501 6.662 -3.675 1.00 1.00 H new ATOM 0 HA ALA A 18 -1.595 4.587 -5.419 1.00 1.00 H new ATOM 0 HB1 ALA A 18 -3.113 4.270 -3.450 1.00 1.00 H new ATOM 0 HB2 ALA A 18 -1.406 4.292 -2.948 1.00 1.00 H new ATOM 0 HB3 ALA A 18 -2.426 5.729 -2.699 1.00 1.00 H new ATOM 273 N ALA A 19 -2.883 7.518 -5.305 1.00 1.00 N ATOM 274 CA ALA A 19 -3.936 8.372 -5.853 1.00 1.00 C ATOM 275 C ALA A 19 -4.019 8.192 -7.363 1.00 1.00 C ATOM 276 O ALA A 19 -2.997 8.132 -8.044 1.00 1.00 O ATOM 277 CB ALA A 19 -3.665 9.844 -5.525 1.00 1.00 C ATOM 0 H ALA A 19 -2.092 8.020 -4.901 1.00 1.00 H new ATOM 0 HA ALA A 19 -4.884 8.081 -5.400 1.00 1.00 H new ATOM 0 HB1 ALA A 19 -4.460 10.462 -5.942 1.00 1.00 H new ATOM 0 HB2 ALA A 19 -3.632 9.976 -4.443 1.00 1.00 H new ATOM 0 HB3 ALA A 19 -2.709 10.143 -5.956 1.00 1.00 H new ATOM 283 N GLY A 20 -5.243 8.114 -7.885 1.00 1.00 N ATOM 284 CA GLY A 20 -5.459 7.949 -9.327 1.00 1.00 C ATOM 285 C GLY A 20 -5.474 6.474 -9.719 1.00 1.00 C ATOM 286 O GLY A 20 -5.964 6.112 -10.790 1.00 1.00 O ATOM 0 H GLY A 20 -6.100 8.162 -7.334 1.00 1.00 H new ATOM 0 HA2 GLY A 20 -6.404 8.413 -9.611 1.00 1.00 H new ATOM 0 HA3 GLY A 20 -4.672 8.466 -9.876 1.00 1.00 H new ATOM 290 N ARG A 21 -4.925 5.626 -8.847 1.00 1.00 N ATOM 291 CA ARG A 21 -4.858 4.174 -9.090 1.00 1.00 C ATOM 292 C ARG A 21 -5.728 3.418 -8.094 1.00 1.00 C ATOM 293 O ARG A 21 -6.314 2.389 -8.428 1.00 1.00 O ATOM 294 CB ARG A 21 -3.396 3.723 -8.947 1.00 1.00 C ATOM 295 CG ARG A 21 -2.588 4.145 -10.191 1.00 1.00 C ATOM 296 CD ARG A 21 -1.076 4.023 -9.918 1.00 1.00 C ATOM 297 NE ARG A 21 -0.588 5.242 -9.273 1.00 1.00 N ATOM 298 CZ ARG A 21 0.694 5.611 -9.347 1.00 1.00 C ATOM 299 NH1 ARG A 21 1.548 4.873 -10.003 1.00 1.00 N ATOM 300 NH2 ARG A 21 1.093 6.714 -8.776 1.00 1.00 N ATOM 0 H ARG A 21 -4.516 5.917 -7.959 1.00 1.00 H new ATOM 0 HA ARG A 21 -5.226 3.959 -10.093 1.00 1.00 H new ATOM 0 HB2 ARG A 21 -2.957 4.164 -8.052 1.00 1.00 H new ATOM 0 HB3 ARG A 21 -3.351 2.641 -8.824 1.00 1.00 H new ATOM 0 HG2 ARG A 21 -2.862 3.519 -11.040 1.00 1.00 H new ATOM 0 HG3 ARG A 21 -2.833 5.172 -10.460 1.00 1.00 H new ATOM 0 HD2 ARG A 21 -0.881 3.161 -9.281 1.00 1.00 H new ATOM 0 HD3 ARG A 21 -0.541 3.856 -10.853 1.00 1.00 H new ATOM 0 HE ARG A 21 -1.244 5.825 -8.753 1.00 1.00 H new ATOM 0 HH11 ARG A 21 1.236 4.015 -10.459 1.00 1.00 H new ATOM 0 HH12 ARG A 21 2.527 5.154 -10.060 1.00 1.00 H new ATOM 0 HH21 ARG A 21 0.426 7.297 -8.271 1.00 1.00 H new ATOM 0 HH22 ARG A 21 2.072 6.993 -8.834 1.00 1.00 H new ATOM 314 N LEU A 22 -5.799 3.941 -6.872 1.00 1.00 N ATOM 315 CA LEU A 22 -6.596 3.325 -5.797 1.00 1.00 C ATOM 316 C LEU A 22 -7.603 4.328 -5.254 1.00 1.00 C ATOM 317 O LEU A 22 -7.406 5.540 -5.348 1.00 1.00 O ATOM 318 CB LEU A 22 -5.649 2.822 -4.664 1.00 1.00 C ATOM 319 CG LEU A 22 -5.572 1.277 -4.640 1.00 1.00 C ATOM 320 CD1 LEU A 22 -4.359 0.836 -3.819 1.00 1.00 C ATOM 321 CD2 LEU A 22 -6.840 0.699 -3.992 1.00 1.00 C ATOM 0 H LEU A 22 -5.314 4.794 -6.594 1.00 1.00 H new ATOM 0 HA LEU A 22 -7.145 2.472 -6.196 1.00 1.00 H new ATOM 0 HB2 LEU A 22 -4.651 3.236 -4.811 1.00 1.00 H new ATOM 0 HB3 LEU A 22 -6.006 3.185 -3.700 1.00 1.00 H new ATOM 0 HG LEU A 22 -5.483 0.914 -5.664 1.00 1.00 H new ATOM 0 HD11 LEU A 22 -4.307 -0.253 -3.803 1.00 1.00 H new ATOM 0 HD12 LEU A 22 -3.450 1.237 -4.268 1.00 1.00 H new ATOM 0 HD13 LEU A 22 -4.455 1.209 -2.799 1.00 1.00 H new ATOM 0 HD21 LEU A 22 -6.778 -0.389 -3.979 1.00 1.00 H new ATOM 0 HD22 LEU A 22 -6.928 1.070 -2.971 1.00 1.00 H new ATOM 0 HD23 LEU A 22 -7.714 1.006 -4.566 1.00 1.00 H new ATOM 333 N GLU A 23 -8.701 3.803 -4.704 1.00 1.00 N ATOM 334 CA GLU A 23 -9.771 4.644 -4.161 1.00 1.00 C ATOM 335 C GLU A 23 -10.303 4.077 -2.851 1.00 1.00 C ATOM 336 O GLU A 23 -10.230 2.874 -2.597 1.00 1.00 O ATOM 337 CB GLU A 23 -10.915 4.733 -5.180 1.00 1.00 C ATOM 338 CG GLU A 23 -10.474 5.580 -6.384 1.00 1.00 C ATOM 339 CD GLU A 23 -11.576 5.631 -7.440 1.00 1.00 C ATOM 340 OE1 GLU A 23 -12.637 5.079 -7.194 1.00 1.00 O ATOM 341 OE2 GLU A 23 -11.342 6.224 -8.480 1.00 1.00 O ATOM 0 H GLU A 23 -8.872 2.801 -4.623 1.00 1.00 H new ATOM 0 HA GLU A 23 -9.364 5.636 -3.966 1.00 1.00 H new ATOM 0 HB2 GLU A 23 -11.198 3.734 -5.511 1.00 1.00 H new ATOM 0 HB3 GLU A 23 -11.795 5.176 -4.715 1.00 1.00 H new ATOM 0 HG2 GLU A 23 -10.232 6.590 -6.055 1.00 1.00 H new ATOM 0 HG3 GLU A 23 -9.567 5.160 -6.818 1.00 1.00 H new ATOM 348 N ALA A 24 -10.844 4.965 -2.027 1.00 1.00 N ATOM 349 CA ALA A 24 -11.397 4.572 -0.748 1.00 1.00 C ATOM 350 C ALA A 24 -12.503 3.551 -0.968 1.00 1.00 C ATOM 351 O ALA A 24 -13.290 3.670 -1.908 1.00 1.00 O ATOM 352 CB ALA A 24 -11.960 5.798 -0.024 1.00 1.00 C ATOM 0 H ALA A 24 -10.909 5.963 -2.227 1.00 1.00 H new ATOM 0 HA ALA A 24 -10.611 4.130 -0.136 1.00 1.00 H new ATOM 0 HB1 ALA A 24 -12.374 5.494 0.937 1.00 1.00 H new ATOM 0 HB2 ALA A 24 -11.163 6.523 0.137 1.00 1.00 H new ATOM 0 HB3 ALA A 24 -12.745 6.250 -0.631 1.00 1.00 H new ATOM 358 N GLY A 25 -12.551 2.539 -0.105 1.00 1.00 N ATOM 359 CA GLY A 25 -13.556 1.475 -0.206 1.00 1.00 C ATOM 360 C GLY A 25 -12.926 0.202 -0.759 1.00 1.00 C ATOM 361 O GLY A 25 -13.398 -0.903 -0.488 1.00 1.00 O ATOM 0 H GLY A 25 -11.904 2.430 0.676 1.00 1.00 H new ATOM 0 HA2 GLY A 25 -13.987 1.279 0.776 1.00 1.00 H new ATOM 0 HA3 GLY A 25 -14.372 1.796 -0.854 1.00 1.00 H new ATOM 365 N ASP A 26 -11.853 0.363 -1.530 1.00 1.00 N ATOM 366 CA ASP A 26 -11.162 -0.791 -2.109 1.00 1.00 C ATOM 367 C ASP A 26 -10.494 -1.615 -1.008 1.00 1.00 C ATOM 368 O ASP A 26 -10.022 -1.060 -0.019 1.00 1.00 O ATOM 369 CB ASP A 26 -10.105 -0.317 -3.114 1.00 1.00 C ATOM 370 CG ASP A 26 -10.728 0.661 -4.111 1.00 1.00 C ATOM 371 OD1 ASP A 26 -11.860 1.064 -3.896 1.00 1.00 O ATOM 372 OD2 ASP A 26 -10.063 0.992 -5.077 1.00 1.00 O ATOM 0 H ASP A 26 -11.446 1.268 -1.767 1.00 1.00 H new ATOM 0 HA ASP A 26 -11.893 -1.415 -2.623 1.00 1.00 H new ATOM 0 HB2 ASP A 26 -9.281 0.164 -2.587 1.00 1.00 H new ATOM 0 HB3 ASP A 26 -9.687 -1.173 -3.645 1.00 1.00 H new ATOM 377 N ARG A 27 -10.458 -2.944 -1.181 1.00 1.00 N ATOM 378 CA ARG A 27 -9.840 -3.846 -0.196 1.00 1.00 C ATOM 379 C ARG A 27 -8.542 -4.423 -0.746 1.00 1.00 C ATOM 380 O ARG A 27 -8.372 -4.545 -1.960 1.00 1.00 O ATOM 381 CB ARG A 27 -10.803 -4.988 0.160 1.00 1.00 C ATOM 382 CG ARG A 27 -11.204 -5.775 -1.093 1.00 1.00 C ATOM 383 CD ARG A 27 -12.085 -6.958 -0.682 1.00 1.00 C ATOM 384 NE ARG A 27 -12.525 -7.690 -1.872 1.00 1.00 N ATOM 385 CZ ARG A 27 -11.777 -8.647 -2.423 1.00 1.00 C ATOM 386 NH1 ARG A 27 -10.620 -8.959 -1.904 1.00 1.00 N ATOM 387 NH2 ARG A 27 -12.201 -9.273 -3.488 1.00 1.00 N ATOM 0 H ARG A 27 -10.850 -3.419 -1.994 1.00 1.00 H new ATOM 0 HA ARG A 27 -9.620 -3.272 0.704 1.00 1.00 H new ATOM 0 HB2 ARG A 27 -10.330 -5.657 0.879 1.00 1.00 H new ATOM 0 HB3 ARG A 27 -11.693 -4.582 0.640 1.00 1.00 H new ATOM 0 HG2 ARG A 27 -11.742 -5.129 -1.787 1.00 1.00 H new ATOM 0 HG3 ARG A 27 -10.315 -6.131 -1.614 1.00 1.00 H new ATOM 0 HD2 ARG A 27 -11.530 -7.623 -0.020 1.00 1.00 H new ATOM 0 HD3 ARG A 27 -12.950 -6.601 -0.123 1.00 1.00 H new ATOM 0 HE ARG A 27 -13.427 -7.462 -2.290 1.00 1.00 H new ATOM 0 HH11 ARG A 27 -10.285 -8.470 -1.074 1.00 1.00 H new ATOM 0 HH12 ARG A 27 -10.051 -9.692 -2.329 1.00 1.00 H new ATOM 0 HH21 ARG A 27 -13.103 -9.030 -3.897 1.00 1.00 H new ATOM 0 HH22 ARG A 27 -11.630 -10.005 -3.910 1.00 1.00 H new ATOM 401 N ILE A 28 -7.631 -4.781 0.156 1.00 1.00 N ATOM 402 CA ILE A 28 -6.340 -5.353 -0.242 1.00 1.00 C ATOM 403 C ILE A 28 -6.402 -6.876 -0.186 1.00 1.00 C ATOM 404 O ILE A 28 -6.620 -7.463 0.873 1.00 1.00 O ATOM 405 CB ILE A 28 -5.222 -4.843 0.685 1.00 1.00 C ATOM 406 CG1 ILE A 28 -5.370 -3.323 0.895 1.00 1.00 C ATOM 407 CG2 ILE A 28 -3.852 -5.149 0.064 1.00 1.00 C ATOM 408 CD1 ILE A 28 -5.468 -2.583 -0.451 1.00 1.00 C ATOM 0 H ILE A 28 -7.759 -4.687 1.164 1.00 1.00 H new ATOM 0 HA ILE A 28 -6.122 -5.042 -1.264 1.00 1.00 H new ATOM 0 HB ILE A 28 -5.300 -5.347 1.648 1.00 1.00 H new ATOM 0 HG12 ILE A 28 -6.260 -3.120 1.490 1.00 1.00 H new ATOM 0 HG13 ILE A 28 -4.517 -2.946 1.459 1.00 1.00 H new ATOM 0 HG21 ILE A 28 -3.064 -4.786 0.724 1.00 1.00 H new ATOM 0 HG22 ILE A 28 -3.746 -6.225 -0.070 1.00 1.00 H new ATOM 0 HG23 ILE A 28 -3.772 -4.653 -0.903 1.00 1.00 H new ATOM 0 HD11 ILE A 28 -5.572 -1.513 -0.271 1.00 1.00 H new ATOM 0 HD12 ILE A 28 -4.566 -2.767 -1.034 1.00 1.00 H new ATOM 0 HD13 ILE A 28 -6.336 -2.944 -1.002 1.00 1.00 H new ATOM 420 N ALA A 29 -6.211 -7.508 -1.344 1.00 1.00 N ATOM 421 CA ALA A 29 -6.247 -8.970 -1.441 1.00 1.00 C ATOM 422 C ALA A 29 -4.856 -9.561 -1.236 1.00 1.00 C ATOM 423 O ALA A 29 -4.722 -10.753 -0.968 1.00 1.00 O ATOM 424 CB ALA A 29 -6.778 -9.378 -2.816 1.00 1.00 C ATOM 0 H ALA A 29 -6.030 -7.032 -2.228 1.00 1.00 H new ATOM 0 HA ALA A 29 -6.905 -9.353 -0.661 1.00 1.00 H new ATOM 0 HB1 ALA A 29 -6.805 -10.465 -2.888 1.00 1.00 H new ATOM 0 HB2 ALA A 29 -7.784 -8.981 -2.950 1.00 1.00 H new ATOM 0 HB3 ALA A 29 -6.124 -8.979 -3.592 1.00 1.00 H new ATOM 430 N ALA A 30 -3.828 -8.715 -1.345 1.00 1.00 N ATOM 431 CA ALA A 30 -2.445 -9.171 -1.154 1.00 1.00 C ATOM 432 C ALA A 30 -1.451 -8.079 -1.543 1.00 1.00 C ATOM 433 O ALA A 30 -1.791 -7.127 -2.244 1.00 1.00 O ATOM 434 CB ALA A 30 -2.177 -10.447 -1.993 1.00 1.00 C ATOM 0 H ALA A 30 -3.923 -7.723 -1.562 1.00 1.00 H new ATOM 0 HA ALA A 30 -2.311 -9.402 -0.097 1.00 1.00 H new ATOM 0 HB1 ALA A 30 -1.148 -10.773 -1.841 1.00 1.00 H new ATOM 0 HB2 ALA A 30 -2.858 -11.238 -1.680 1.00 1.00 H new ATOM 0 HB3 ALA A 30 -2.336 -10.228 -3.049 1.00 1.00 H new ATOM 440 N ILE A 31 -0.201 -8.250 -1.098 1.00 1.00 N ATOM 441 CA ILE A 31 0.878 -7.312 -1.422 1.00 1.00 C ATOM 442 C ILE A 31 2.135 -8.084 -1.803 1.00 1.00 C ATOM 443 O ILE A 31 2.611 -8.932 -1.055 1.00 1.00 O ATOM 444 CB ILE A 31 1.171 -6.373 -0.242 1.00 1.00 C ATOM 445 CG1 ILE A 31 -0.074 -5.521 0.031 1.00 1.00 C ATOM 446 CG2 ILE A 31 2.359 -5.453 -0.588 1.00 1.00 C ATOM 447 CD1 ILE A 31 0.135 -4.676 1.284 1.00 1.00 C ATOM 0 H ILE A 31 0.088 -9.032 -0.511 1.00 1.00 H new ATOM 0 HA ILE A 31 0.559 -6.701 -2.266 1.00 1.00 H new ATOM 0 HB ILE A 31 1.423 -6.960 0.641 1.00 1.00 H new ATOM 0 HG12 ILE A 31 -0.277 -4.875 -0.823 1.00 1.00 H new ATOM 0 HG13 ILE A 31 -0.944 -6.165 0.158 1.00 1.00 H new ATOM 0 HG21 ILE A 31 2.562 -4.789 0.253 1.00 1.00 H new ATOM 0 HG22 ILE A 31 3.241 -6.059 -0.793 1.00 1.00 H new ATOM 0 HG23 ILE A 31 2.115 -4.859 -1.469 1.00 1.00 H new ATOM 0 HD11 ILE A 31 -0.755 -4.074 1.470 1.00 1.00 H new ATOM 0 HD12 ILE A 31 0.316 -5.329 2.138 1.00 1.00 H new ATOM 0 HD13 ILE A 31 0.994 -4.020 1.141 1.00 1.00 H new ATOM 459 N ASP A 32 2.677 -7.755 -2.967 1.00 1.00 N ATOM 460 CA ASP A 32 3.894 -8.400 -3.449 1.00 1.00 C ATOM 461 C ASP A 32 3.770 -9.923 -3.386 1.00 1.00 C ATOM 462 O ASP A 32 4.773 -10.636 -3.391 1.00 1.00 O ATOM 463 CB ASP A 32 5.088 -7.940 -2.606 1.00 1.00 C ATOM 464 CG ASP A 32 6.398 -8.399 -3.243 1.00 1.00 C ATOM 465 OD1 ASP A 32 6.557 -8.198 -4.436 1.00 1.00 O ATOM 466 OD2 ASP A 32 7.222 -8.944 -2.526 1.00 1.00 O ATOM 0 H ASP A 32 2.296 -7.047 -3.595 1.00 1.00 H new ATOM 0 HA ASP A 32 4.047 -8.114 -4.489 1.00 1.00 H new ATOM 0 HB2 ASP A 32 5.081 -6.854 -2.516 1.00 1.00 H new ATOM 0 HB3 ASP A 32 5.006 -8.344 -1.597 1.00 1.00 H new ATOM 471 N GLY A 33 2.527 -10.412 -3.340 1.00 1.00 N ATOM 472 CA GLY A 33 2.255 -11.858 -3.287 1.00 1.00 C ATOM 473 C GLY A 33 1.921 -12.322 -1.871 1.00 1.00 C ATOM 474 O GLY A 33 1.596 -13.490 -1.658 1.00 1.00 O ATOM 0 H GLY A 33 1.690 -9.829 -3.338 1.00 1.00 H new ATOM 0 HA2 GLY A 33 1.425 -12.096 -3.952 1.00 1.00 H new ATOM 0 HA3 GLY A 33 3.124 -12.405 -3.653 1.00 1.00 H new ATOM 478 N GLN A 34 2.021 -11.416 -0.899 1.00 1.00 N ATOM 479 CA GLN A 34 1.736 -11.755 0.504 1.00 1.00 C ATOM 480 C GLN A 34 0.265 -11.459 0.869 1.00 1.00 C ATOM 481 O GLN A 34 -0.194 -10.336 0.664 1.00 1.00 O ATOM 482 CB GLN A 34 2.648 -10.935 1.427 1.00 1.00 C ATOM 483 CG GLN A 34 4.115 -11.145 1.029 1.00 1.00 C ATOM 484 CD GLN A 34 4.507 -12.611 1.206 1.00 1.00 C ATOM 485 OE1 GLN A 34 4.867 -13.033 2.305 1.00 1.00 O ATOM 486 NE2 GLN A 34 4.446 -13.418 0.179 1.00 1.00 N ATOM 0 H GLN A 34 2.295 -10.445 -1.051 1.00 1.00 H new ATOM 0 HA GLN A 34 1.920 -12.822 0.633 1.00 1.00 H new ATOM 0 HB2 GLN A 34 2.392 -9.878 1.361 1.00 1.00 H new ATOM 0 HB3 GLN A 34 2.496 -11.236 2.464 1.00 1.00 H new ATOM 0 HG2 GLN A 34 4.264 -10.844 -0.008 1.00 1.00 H new ATOM 0 HG3 GLN A 34 4.759 -10.513 1.640 1.00 1.00 H new ATOM 0 HE21 GLN A 34 4.147 -13.065 -0.730 1.00 1.00 H new ATOM 0 HE22 GLN A 34 4.697 -14.401 0.287 1.00 1.00 H new ATOM 495 N PRO A 35 -0.491 -12.412 1.406 1.00 1.00 N ATOM 496 CA PRO A 35 -1.921 -12.167 1.786 1.00 1.00 C ATOM 497 C PRO A 35 -2.026 -11.354 3.083 1.00 1.00 C ATOM 498 O PRO A 35 -1.302 -11.610 4.045 1.00 1.00 O ATOM 499 CB PRO A 35 -2.493 -13.588 1.943 1.00 1.00 C ATOM 500 CG PRO A 35 -1.325 -14.416 2.397 1.00 1.00 C ATOM 501 CD PRO A 35 -0.088 -13.806 1.714 1.00 1.00 C ATOM 0 HA PRO A 35 -2.466 -11.577 1.050 1.00 1.00 H new ATOM 0 HB2 PRO A 35 -3.303 -13.611 2.672 1.00 1.00 H new ATOM 0 HB3 PRO A 35 -2.900 -13.958 1.002 1.00 1.00 H new ATOM 0 HG2 PRO A 35 -1.225 -14.390 3.482 1.00 1.00 H new ATOM 0 HG3 PRO A 35 -1.453 -15.461 2.114 1.00 1.00 H new ATOM 0 HD2 PRO A 35 0.782 -13.833 2.369 1.00 1.00 H new ATOM 0 HD3 PRO A 35 0.177 -14.353 0.809 1.00 1.00 H new ATOM 509 N ILE A 36 -2.914 -10.350 3.084 1.00 1.00 N ATOM 510 CA ILE A 36 -3.093 -9.467 4.247 1.00 1.00 C ATOM 511 C ILE A 36 -4.359 -9.800 5.036 1.00 1.00 C ATOM 512 O ILE A 36 -5.481 -9.669 4.549 1.00 1.00 O ATOM 513 CB ILE A 36 -3.172 -8.015 3.776 1.00 1.00 C ATOM 514 CG1 ILE A 36 -1.972 -7.697 2.860 1.00 1.00 C ATOM 515 CG2 ILE A 36 -3.178 -7.063 4.982 1.00 1.00 C ATOM 516 CD1 ILE A 36 -0.629 -8.030 3.543 1.00 1.00 C ATOM 0 H ILE A 36 -3.519 -10.129 2.294 1.00 1.00 H new ATOM 0 HA ILE A 36 -2.237 -9.616 4.905 1.00 1.00 H new ATOM 0 HB ILE A 36 -4.097 -7.876 3.217 1.00 1.00 H new ATOM 0 HG12 ILE A 36 -2.060 -8.265 1.934 1.00 1.00 H new ATOM 0 HG13 ILE A 36 -1.991 -6.641 2.589 1.00 1.00 H new ATOM 0 HG21 ILE A 36 -3.235 -6.032 4.632 1.00 1.00 H new ATOM 0 HG22 ILE A 36 -4.040 -7.280 5.612 1.00 1.00 H new ATOM 0 HG23 ILE A 36 -2.263 -7.201 5.559 1.00 1.00 H new ATOM 0 HD11 ILE A 36 0.192 -7.792 2.867 1.00 1.00 H new ATOM 0 HD12 ILE A 36 -0.529 -7.442 4.455 1.00 1.00 H new ATOM 0 HD13 ILE A 36 -0.600 -9.091 3.790 1.00 1.00 H new ATOM 528 N ASN A 37 -4.131 -10.227 6.269 1.00 1.00 N ATOM 529 CA ASN A 37 -5.215 -10.595 7.198 1.00 1.00 C ATOM 530 C ASN A 37 -5.384 -9.542 8.294 1.00 1.00 C ATOM 531 O ASN A 37 -6.458 -9.430 8.888 1.00 1.00 O ATOM 532 CB ASN A 37 -4.921 -11.949 7.850 1.00 1.00 C ATOM 533 CG ASN A 37 -6.121 -12.388 8.689 1.00 1.00 C ATOM 534 OD1 ASN A 37 -7.167 -11.740 8.663 1.00 1.00 O ATOM 535 ND2 ASN A 37 -6.034 -13.456 9.434 1.00 1.00 N ATOM 0 H ASN A 37 -3.196 -10.332 6.663 1.00 1.00 H new ATOM 0 HA ASN A 37 -6.137 -10.656 6.620 1.00 1.00 H new ATOM 0 HB2 ASN A 37 -4.709 -12.694 7.083 1.00 1.00 H new ATOM 0 HB3 ASN A 37 -4.033 -11.876 8.478 1.00 1.00 H new ATOM 0 HD21 ASN A 37 -6.833 -13.753 9.994 1.00 1.00 H new ATOM 0 HD22 ASN A 37 -5.167 -13.993 9.456 1.00 1.00 H new ATOM 542 N THR A 38 -4.324 -8.770 8.562 1.00 1.00 N ATOM 543 CA THR A 38 -4.367 -7.722 9.600 1.00 1.00 C ATOM 544 C THR A 38 -3.745 -6.430 9.100 1.00 1.00 C ATOM 545 O THR A 38 -2.875 -6.437 8.227 1.00 1.00 O ATOM 546 CB THR A 38 -3.594 -8.172 10.841 1.00 1.00 C ATOM 547 OG1 THR A 38 -2.228 -8.361 10.503 1.00 1.00 O ATOM 548 CG2 THR A 38 -4.171 -9.476 11.373 1.00 1.00 C ATOM 0 H THR A 38 -3.429 -8.847 8.080 1.00 1.00 H new ATOM 0 HA THR A 38 -5.415 -7.551 9.846 1.00 1.00 H new ATOM 0 HB THR A 38 -3.680 -7.406 11.612 1.00 1.00 H new ATOM 0 HG1 THR A 38 -1.731 -8.648 11.298 1.00 1.00 H new ATOM 0 HG21 THR A 38 -3.613 -9.787 12.256 1.00 1.00 H new ATOM 0 HG22 THR A 38 -5.218 -9.329 11.638 1.00 1.00 H new ATOM 0 HG23 THR A 38 -4.096 -10.247 10.606 1.00 1.00 H new ATOM 556 N SER A 39 -4.179 -5.320 9.687 1.00 1.00 N ATOM 557 CA SER A 39 -3.642 -4.016 9.329 1.00 1.00 C ATOM 558 C SER A 39 -2.207 -3.908 9.826 1.00 1.00 C ATOM 559 O SER A 39 -1.365 -3.270 9.198 1.00 1.00 O ATOM 560 CB SER A 39 -4.496 -2.908 9.948 1.00 1.00 C ATOM 561 OG SER A 39 -3.995 -1.644 9.534 1.00 1.00 O ATOM 0 H SER A 39 -4.898 -5.299 10.410 1.00 1.00 H new ATOM 0 HA SER A 39 -3.659 -3.904 8.245 1.00 1.00 H new ATOM 0 HB2 SER A 39 -5.536 -3.019 9.640 1.00 1.00 H new ATOM 0 HB3 SER A 39 -4.476 -2.982 11.035 1.00 1.00 H new ATOM 0 HG SER A 39 -4.540 -0.931 9.927 1.00 1.00 H new ATOM 567 N GLU A 40 -1.938 -4.540 10.967 1.00 1.00 N ATOM 568 CA GLU A 40 -0.610 -4.519 11.553 1.00 1.00 C ATOM 569 C GLU A 40 0.391 -5.183 10.616 1.00 1.00 C ATOM 570 O GLU A 40 1.574 -4.844 10.617 1.00 1.00 O ATOM 571 CB GLU A 40 -0.629 -5.254 12.898 1.00 1.00 C ATOM 572 CG GLU A 40 0.717 -5.082 13.601 1.00 1.00 C ATOM 573 CD GLU A 40 0.692 -5.777 14.958 1.00 1.00 C ATOM 574 OE1 GLU A 40 0.258 -6.917 15.009 1.00 1.00 O ATOM 575 OE2 GLU A 40 1.107 -5.163 15.927 1.00 1.00 O ATOM 0 H GLU A 40 -2.626 -5.072 11.500 1.00 1.00 H new ATOM 0 HA GLU A 40 -0.309 -3.483 11.710 1.00 1.00 H new ATOM 0 HB2 GLU A 40 -1.430 -4.863 13.525 1.00 1.00 H new ATOM 0 HB3 GLU A 40 -0.835 -6.313 12.741 1.00 1.00 H new ATOM 0 HG2 GLU A 40 1.514 -5.499 12.985 1.00 1.00 H new ATOM 0 HG3 GLU A 40 0.936 -4.022 13.731 1.00 1.00 H new ATOM 582 N GLN A 41 -0.088 -6.127 9.810 1.00 1.00 N ATOM 583 CA GLN A 41 0.784 -6.813 8.875 1.00 1.00 C ATOM 584 C GLN A 41 1.337 -5.822 7.858 1.00 1.00 C ATOM 585 O GLN A 41 2.450 -5.993 7.362 1.00 1.00 O ATOM 586 CB GLN A 41 0.019 -7.922 8.156 1.00 1.00 C ATOM 587 CG GLN A 41 0.981 -8.746 7.298 1.00 1.00 C ATOM 588 CD GLN A 41 0.239 -9.926 6.684 1.00 1.00 C ATOM 589 OE1 GLN A 41 -0.834 -10.299 7.158 1.00 1.00 O ATOM 590 NE2 GLN A 41 0.748 -10.540 5.652 1.00 1.00 N ATOM 0 H GLN A 41 -1.062 -6.428 9.788 1.00 1.00 H new ATOM 0 HA GLN A 41 1.612 -7.257 9.428 1.00 1.00 H new ATOM 0 HB2 GLN A 41 -0.475 -8.566 8.884 1.00 1.00 H new ATOM 0 HB3 GLN A 41 -0.762 -7.490 7.530 1.00 1.00 H new ATOM 0 HG2 GLN A 41 1.407 -8.123 6.512 1.00 1.00 H new ATOM 0 HG3 GLN A 41 1.812 -9.103 7.907 1.00 1.00 H new ATOM 0 HE21 GLN A 41 1.637 -10.229 5.261 1.00 1.00 H new ATOM 0 HE22 GLN A 41 0.257 -11.331 5.236 1.00 1.00 H new ATOM 599 N ILE A 42 0.562 -4.777 7.554 1.00 1.00 N ATOM 600 CA ILE A 42 0.989 -3.758 6.603 1.00 1.00 C ATOM 601 C ILE A 42 2.091 -2.889 7.184 1.00 1.00 C ATOM 602 O ILE A 42 2.924 -2.387 6.443 1.00 1.00 O ATOM 603 CB ILE A 42 -0.206 -2.872 6.230 1.00 1.00 C ATOM 604 CG1 ILE A 42 -1.328 -3.745 5.624 1.00 1.00 C ATOM 605 CG2 ILE A 42 0.222 -1.780 5.233 1.00 1.00 C ATOM 606 CD1 ILE A 42 -0.865 -4.446 4.333 1.00 1.00 C ATOM 0 H ILE A 42 -0.363 -4.618 7.954 1.00 1.00 H new ATOM 0 HA ILE A 42 1.377 -4.262 5.718 1.00 1.00 H new ATOM 0 HB ILE A 42 -0.580 -2.383 7.129 1.00 1.00 H new ATOM 0 HG12 ILE A 42 -1.642 -4.493 6.352 1.00 1.00 H new ATOM 0 HG13 ILE A 42 -2.198 -3.124 5.410 1.00 1.00 H new ATOM 0 HG21 ILE A 42 -0.639 -1.161 4.980 1.00 1.00 H new ATOM 0 HG22 ILE A 42 0.996 -1.159 5.684 1.00 1.00 H new ATOM 0 HG23 ILE A 42 0.612 -2.246 4.328 1.00 1.00 H new ATOM 0 HD11 ILE A 42 -1.680 -5.051 3.935 1.00 1.00 H new ATOM 0 HD12 ILE A 42 -0.576 -3.697 3.596 1.00 1.00 H new ATOM 0 HD13 ILE A 42 -0.011 -5.087 4.553 1.00 1.00 H new ATOM 618 N VAL A 43 2.086 -2.716 8.502 1.00 1.00 N ATOM 619 CA VAL A 43 3.095 -1.900 9.175 1.00 1.00 C ATOM 620 C VAL A 43 4.464 -2.566 9.075 1.00 1.00 C ATOM 621 O VAL A 43 5.473 -1.908 8.835 1.00 1.00 O ATOM 622 CB VAL A 43 2.705 -1.730 10.647 1.00 1.00 C ATOM 623 CG1 VAL A 43 3.751 -0.882 11.382 1.00 1.00 C ATOM 624 CG2 VAL A 43 1.337 -1.046 10.732 1.00 1.00 C ATOM 0 H VAL A 43 1.394 -3.130 9.127 1.00 1.00 H new ATOM 0 HA VAL A 43 3.147 -0.923 8.694 1.00 1.00 H new ATOM 0 HB VAL A 43 2.657 -2.712 11.118 1.00 1.00 H new ATOM 0 HG11 VAL A 43 3.460 -0.770 12.426 1.00 1.00 H new ATOM 0 HG12 VAL A 43 4.722 -1.374 11.327 1.00 1.00 H new ATOM 0 HG13 VAL A 43 3.815 0.101 10.916 1.00 1.00 H new ATOM 0 HG21 VAL A 43 1.056 -0.923 11.778 1.00 1.00 H new ATOM 0 HG22 VAL A 43 1.389 -0.068 10.253 1.00 1.00 H new ATOM 0 HG23 VAL A 43 0.592 -1.659 10.226 1.00 1.00 H new ATOM 634 N SER A 44 4.495 -3.878 9.266 1.00 1.00 N ATOM 635 CA SER A 44 5.751 -4.607 9.180 1.00 1.00 C ATOM 636 C SER A 44 6.292 -4.542 7.754 1.00 1.00 C ATOM 637 O SER A 44 7.496 -4.411 7.535 1.00 1.00 O ATOM 638 CB SER A 44 5.543 -6.068 9.586 1.00 1.00 C ATOM 639 OG SER A 44 4.899 -6.117 10.852 1.00 1.00 O ATOM 0 H SER A 44 3.678 -4.451 9.478 1.00 1.00 H new ATOM 0 HA SER A 44 6.470 -4.149 9.860 1.00 1.00 H new ATOM 0 HB2 SER A 44 4.940 -6.583 8.838 1.00 1.00 H new ATOM 0 HB3 SER A 44 6.502 -6.584 9.633 1.00 1.00 H new ATOM 0 HG SER A 44 4.763 -7.052 11.114 1.00 1.00 H new ATOM 645 N TYR A 45 5.384 -4.666 6.790 1.00 1.00 N ATOM 646 CA TYR A 45 5.767 -4.650 5.383 1.00 1.00 C ATOM 647 C TYR A 45 6.499 -3.352 5.031 1.00 1.00 C ATOM 648 O TYR A 45 7.631 -3.382 4.553 1.00 1.00 O ATOM 649 CB TYR A 45 4.508 -4.793 4.529 1.00 1.00 C ATOM 650 CG TYR A 45 4.876 -4.877 3.064 1.00 1.00 C ATOM 651 CD1 TYR A 45 5.492 -6.035 2.574 1.00 1.00 C ATOM 652 CD2 TYR A 45 4.587 -3.817 2.190 1.00 1.00 C ATOM 653 CE1 TYR A 45 5.818 -6.136 1.218 1.00 1.00 C ATOM 654 CE2 TYR A 45 4.915 -3.919 0.837 1.00 1.00 C ATOM 655 CZ TYR A 45 5.530 -5.081 0.351 1.00 1.00 C ATOM 656 OH TYR A 45 5.848 -5.186 -0.987 1.00 1.00 O ATOM 0 H TYR A 45 4.384 -4.778 6.956 1.00 1.00 H new ATOM 0 HA TYR A 45 6.446 -5.480 5.186 1.00 1.00 H new ATOM 0 HB2 TYR A 45 3.959 -5.687 4.825 1.00 1.00 H new ATOM 0 HB3 TYR A 45 3.847 -3.942 4.697 1.00 1.00 H new ATOM 0 HD1 TYR A 45 5.716 -6.852 3.245 1.00 1.00 H new ATOM 0 HD2 TYR A 45 4.111 -2.923 2.564 1.00 1.00 H new ATOM 0 HE1 TYR A 45 6.293 -7.030 0.842 1.00 1.00 H new ATOM 0 HE2 TYR A 45 4.695 -3.103 0.165 1.00 1.00 H new ATOM 0 HH TYR A 45 6.470 -5.932 -1.118 1.00 1.00 H new ATOM 666 N VAL A 46 5.846 -2.215 5.260 1.00 1.00 N ATOM 667 CA VAL A 46 6.454 -0.930 4.950 1.00 1.00 C ATOM 668 C VAL A 46 7.808 -0.802 5.654 1.00 1.00 C ATOM 669 O VAL A 46 8.770 -0.287 5.083 1.00 1.00 O ATOM 670 CB VAL A 46 5.527 0.224 5.379 1.00 1.00 C ATOM 671 CG1 VAL A 46 4.305 0.298 4.461 1.00 1.00 C ATOM 672 CG2 VAL A 46 5.072 0.021 6.820 1.00 1.00 C ATOM 0 H VAL A 46 4.907 -2.160 5.655 1.00 1.00 H new ATOM 0 HA VAL A 46 6.607 -0.872 3.872 1.00 1.00 H new ATOM 0 HB VAL A 46 6.083 1.159 5.304 1.00 1.00 H new ATOM 0 HG11 VAL A 46 3.661 1.118 4.778 1.00 1.00 H new ATOM 0 HG12 VAL A 46 4.631 0.468 3.435 1.00 1.00 H new ATOM 0 HG13 VAL A 46 3.752 -0.640 4.515 1.00 1.00 H new ATOM 0 HG21 VAL A 46 4.417 0.842 7.114 1.00 1.00 H new ATOM 0 HG22 VAL A 46 4.531 -0.922 6.901 1.00 1.00 H new ATOM 0 HG23 VAL A 46 5.942 -0.002 7.476 1.00 1.00 H new ATOM 682 N ARG A 47 7.870 -1.274 6.891 1.00 1.00 N ATOM 683 CA ARG A 47 9.104 -1.212 7.669 1.00 1.00 C ATOM 684 C ARG A 47 10.188 -2.094 7.027 1.00 1.00 C ATOM 685 O ARG A 47 11.357 -1.715 6.965 1.00 1.00 O ATOM 686 CB ARG A 47 8.812 -1.660 9.126 1.00 1.00 C ATOM 687 CG ARG A 47 9.671 -0.881 10.139 1.00 1.00 C ATOM 688 CD ARG A 47 11.165 -1.095 9.863 1.00 1.00 C ATOM 689 NE ARG A 47 11.939 -0.676 11.025 1.00 1.00 N ATOM 690 CZ ARG A 47 11.969 -1.414 12.133 1.00 1.00 C ATOM 691 NH1 ARG A 47 11.343 -2.561 12.169 1.00 1.00 N ATOM 692 NH2 ARG A 47 12.628 -0.998 13.178 1.00 1.00 N ATOM 0 H ARG A 47 7.084 -1.703 7.378 1.00 1.00 H new ATOM 0 HA ARG A 47 9.476 -0.188 7.682 1.00 1.00 H new ATOM 0 HB2 ARG A 47 7.756 -1.508 9.350 1.00 1.00 H new ATOM 0 HB3 ARG A 47 9.008 -2.728 9.226 1.00 1.00 H new ATOM 0 HG2 ARG A 47 9.434 0.182 10.082 1.00 1.00 H new ATOM 0 HG3 ARG A 47 9.433 -1.207 11.151 1.00 1.00 H new ATOM 0 HD2 ARG A 47 11.358 -2.145 9.643 1.00 1.00 H new ATOM 0 HD3 ARG A 47 11.469 -0.525 8.985 1.00 1.00 H new ATOM 0 HE ARG A 47 12.466 0.197 10.989 1.00 1.00 H new ATOM 0 HH11 ARG A 47 10.833 -2.889 11.349 1.00 1.00 H new ATOM 0 HH12 ARG A 47 11.365 -3.128 13.017 1.00 1.00 H new ATOM 0 HH21 ARG A 47 13.122 -0.106 13.148 1.00 1.00 H new ATOM 0 HH22 ARG A 47 12.650 -1.565 14.026 1.00 1.00 H new ATOM 706 N GLU A 48 9.794 -3.276 6.555 1.00 1.00 N ATOM 707 CA GLU A 48 10.746 -4.197 5.934 1.00 1.00 C ATOM 708 C GLU A 48 11.511 -3.498 4.813 1.00 1.00 C ATOM 709 O GLU A 48 12.734 -3.605 4.720 1.00 1.00 O ATOM 710 CB GLU A 48 9.997 -5.414 5.361 1.00 1.00 C ATOM 711 CG GLU A 48 10.992 -6.495 4.901 1.00 1.00 C ATOM 712 CD GLU A 48 11.666 -7.151 6.106 1.00 1.00 C ATOM 713 OE1 GLU A 48 11.244 -6.880 7.219 1.00 1.00 O ATOM 714 OE2 GLU A 48 12.590 -7.918 5.896 1.00 1.00 O ATOM 0 H GLU A 48 8.833 -3.616 6.590 1.00 1.00 H new ATOM 0 HA GLU A 48 11.454 -4.528 6.694 1.00 1.00 H new ATOM 0 HB2 GLU A 48 9.328 -5.826 6.117 1.00 1.00 H new ATOM 0 HB3 GLU A 48 9.375 -5.103 4.521 1.00 1.00 H new ATOM 0 HG2 GLU A 48 10.471 -7.250 4.313 1.00 1.00 H new ATOM 0 HG3 GLU A 48 11.747 -6.050 4.252 1.00 1.00 H new ATOM 721 N LYS A 49 10.779 -2.790 3.956 1.00 1.00 N ATOM 722 CA LYS A 49 11.384 -2.083 2.826 1.00 1.00 C ATOM 723 C LYS A 49 11.957 -0.747 3.296 1.00 1.00 C ATOM 724 O LYS A 49 11.998 -0.470 4.495 1.00 1.00 O ATOM 725 CB LYS A 49 10.335 -1.859 1.715 1.00 1.00 C ATOM 726 CG LYS A 49 9.507 -3.140 1.474 1.00 1.00 C ATOM 727 CD LYS A 49 10.369 -4.218 0.815 1.00 1.00 C ATOM 728 CE LYS A 49 9.527 -5.465 0.552 1.00 1.00 C ATOM 729 NZ LYS A 49 10.375 -6.486 -0.124 1.00 1.00 N ATOM 0 H LYS A 49 9.766 -2.690 4.021 1.00 1.00 H new ATOM 0 HA LYS A 49 12.194 -2.689 2.419 1.00 1.00 H new ATOM 0 HB2 LYS A 49 9.672 -1.040 1.994 1.00 1.00 H new ATOM 0 HB3 LYS A 49 10.834 -1.564 0.792 1.00 1.00 H new ATOM 0 HG2 LYS A 49 9.113 -3.509 2.421 1.00 1.00 H new ATOM 0 HG3 LYS A 49 8.650 -2.913 0.840 1.00 1.00 H new ATOM 0 HD2 LYS A 49 10.783 -3.844 -0.121 1.00 1.00 H new ATOM 0 HD3 LYS A 49 11.212 -4.467 1.459 1.00 1.00 H new ATOM 0 HE2 LYS A 49 9.136 -5.860 1.489 1.00 1.00 H new ATOM 0 HE3 LYS A 49 8.668 -5.215 -0.071 1.00 1.00 H new ATOM 0 HZ1 LYS A 49 9.810 -7.340 -0.308 1.00 1.00 H new ATOM 0 HZ2 LYS A 49 10.727 -6.104 -1.025 1.00 1.00 H new ATOM 0 HZ3 LYS A 49 11.180 -6.729 0.488 1.00 1.00 H new ATOM 743 N GLN A 50 12.422 0.068 2.341 1.00 1.00 N ATOM 744 CA GLN A 50 13.026 1.374 2.647 1.00 1.00 C ATOM 745 C GLN A 50 12.423 2.466 1.777 1.00 1.00 C ATOM 746 O GLN A 50 11.673 2.189 0.842 1.00 1.00 O ATOM 747 CB GLN A 50 14.546 1.289 2.428 1.00 1.00 C ATOM 748 CG GLN A 50 15.231 2.625 2.785 1.00 1.00 C ATOM 749 CD GLN A 50 16.734 2.429 2.964 1.00 1.00 C ATOM 750 OE1 GLN A 50 17.386 1.812 2.123 1.00 1.00 O ATOM 751 NE2 GLN A 50 17.323 2.922 4.021 1.00 1.00 N ATOM 0 H GLN A 50 12.392 -0.154 1.346 1.00 1.00 H new ATOM 0 HA GLN A 50 12.822 1.628 3.687 1.00 1.00 H new ATOM 0 HB2 GLN A 50 14.961 0.488 3.040 1.00 1.00 H new ATOM 0 HB3 GLN A 50 14.754 1.036 1.388 1.00 1.00 H new ATOM 0 HG2 GLN A 50 15.046 3.356 1.998 1.00 1.00 H new ATOM 0 HG3 GLN A 50 14.800 3.027 3.702 1.00 1.00 H new ATOM 0 HE21 GLN A 50 16.779 3.433 4.716 1.00 1.00 H new ATOM 0 HE22 GLN A 50 18.327 2.796 4.151 1.00 1.00 H new ATOM 760 N ALA A 51 12.762 3.711 2.084 1.00 1.00 N ATOM 761 CA ALA A 51 12.269 4.846 1.327 1.00 1.00 C ATOM 762 C ALA A 51 12.807 4.788 -0.099 1.00 1.00 C ATOM 763 O ALA A 51 13.986 4.499 -0.308 1.00 1.00 O ATOM 764 CB ALA A 51 12.753 6.136 2.011 1.00 1.00 C ATOM 0 H ALA A 51 13.380 3.958 2.857 1.00 1.00 H new ATOM 0 HA ALA A 51 11.180 4.826 1.293 1.00 1.00 H new ATOM 0 HB1 ALA A 51 12.391 7.001 1.455 1.00 1.00 H new ATOM 0 HB2 ALA A 51 12.369 6.174 3.030 1.00 1.00 H new ATOM 0 HB3 ALA A 51 13.843 6.149 2.033 1.00 1.00 H new ATOM 770 N GLY A 52 11.945 5.053 -1.081 1.00 1.00 N ATOM 771 CA GLY A 52 12.353 5.022 -2.482 1.00 1.00 C ATOM 772 C GLY A 52 12.172 3.622 -3.057 1.00 1.00 C ATOM 773 O GLY A 52 12.444 3.389 -4.236 1.00 1.00 O ATOM 0 H GLY A 52 10.964 5.290 -0.931 1.00 1.00 H new ATOM 0 HA2 GLY A 52 11.763 5.737 -3.055 1.00 1.00 H new ATOM 0 HA3 GLY A 52 13.396 5.326 -2.571 1.00 1.00 H new ATOM 777 N ASP A 53 11.708 2.690 -2.220 1.00 1.00 N ATOM 778 CA ASP A 53 11.494 1.314 -2.666 1.00 1.00 C ATOM 779 C ASP A 53 10.287 1.230 -3.602 1.00 1.00 C ATOM 780 O ASP A 53 9.640 2.237 -3.888 1.00 1.00 O ATOM 781 CB ASP A 53 11.294 0.399 -1.450 1.00 1.00 C ATOM 782 CG ASP A 53 11.212 -1.059 -1.890 1.00 1.00 C ATOM 783 OD1 ASP A 53 12.208 -1.564 -2.383 1.00 1.00 O ATOM 784 OD2 ASP A 53 10.157 -1.648 -1.735 1.00 1.00 O ATOM 0 H ASP A 53 11.476 2.861 -1.242 1.00 1.00 H new ATOM 0 HA ASP A 53 12.374 0.984 -3.218 1.00 1.00 H new ATOM 0 HB2 ASP A 53 12.119 0.528 -0.750 1.00 1.00 H new ATOM 0 HB3 ASP A 53 10.382 0.678 -0.923 1.00 1.00 H new ATOM 789 N ARG A 54 9.997 0.019 -4.085 1.00 1.00 N ATOM 790 CA ARG A 54 8.871 -0.213 -5.003 1.00 1.00 C ATOM 791 C ARG A 54 8.155 -1.489 -4.619 1.00 1.00 C ATOM 792 O ARG A 54 8.776 -2.550 -4.543 1.00 1.00 O ATOM 793 CB ARG A 54 9.382 -0.373 -6.435 1.00 1.00 C ATOM 794 CG ARG A 54 10.125 0.889 -6.855 1.00 1.00 C ATOM 795 CD ARG A 54 10.644 0.728 -8.286 1.00 1.00 C ATOM 796 NE ARG A 54 11.671 -0.303 -8.333 1.00 1.00 N ATOM 797 CZ ARG A 54 12.246 -0.656 -9.480 1.00 1.00 C ATOM 798 NH1 ARG A 54 11.893 -0.073 -10.596 1.00 1.00 N ATOM 799 NH2 ARG A 54 13.160 -1.588 -9.492 1.00 1.00 N ATOM 0 H ARG A 54 10.527 -0.822 -3.856 1.00 1.00 H new ATOM 0 HA ARG A 54 8.195 0.640 -4.940 1.00 1.00 H new ATOM 0 HB2 ARG A 54 10.044 -1.236 -6.502 1.00 1.00 H new ATOM 0 HB3 ARG A 54 8.548 -0.558 -7.111 1.00 1.00 H new ATOM 0 HG2 ARG A 54 9.461 1.751 -6.793 1.00 1.00 H new ATOM 0 HG3 ARG A 54 10.956 1.077 -6.175 1.00 1.00 H new ATOM 0 HD2 ARG A 54 9.822 0.464 -8.952 1.00 1.00 H new ATOM 0 HD3 ARG A 54 11.051 1.674 -8.642 1.00 1.00 H new ATOM 0 HE ARG A 54 11.956 -0.764 -7.469 1.00 1.00 H new ATOM 0 HH11 ARG A 54 11.176 0.653 -10.588 1.00 1.00 H new ATOM 0 HH12 ARG A 54 12.334 -0.344 -11.475 1.00 1.00 H new ATOM 0 HH21 ARG A 54 13.433 -2.046 -8.622 1.00 1.00 H new ATOM 0 HH22 ARG A 54 13.601 -1.859 -10.371 1.00 1.00 H new ATOM 813 N VAL A 55 6.851 -1.385 -4.362 1.00 1.00 N ATOM 814 CA VAL A 55 6.054 -2.548 -3.964 1.00 1.00 C ATOM 815 C VAL A 55 4.745 -2.649 -4.756 1.00 1.00 C ATOM 816 O VAL A 55 3.980 -1.693 -4.878 1.00 1.00 O ATOM 817 CB VAL A 55 5.764 -2.486 -2.457 1.00 1.00 C ATOM 818 CG1 VAL A 55 7.062 -2.707 -1.679 1.00 1.00 C ATOM 819 CG2 VAL A 55 5.195 -1.113 -2.096 1.00 1.00 C ATOM 0 H VAL A 55 6.325 -0.513 -4.421 1.00 1.00 H new ATOM 0 HA VAL A 55 6.635 -3.443 -4.189 1.00 1.00 H new ATOM 0 HB VAL A 55 5.041 -3.260 -2.200 1.00 1.00 H new ATOM 0 HG11 VAL A 55 6.857 -2.663 -0.609 1.00 1.00 H new ATOM 0 HG12 VAL A 55 7.475 -3.684 -1.930 1.00 1.00 H new ATOM 0 HG13 VAL A 55 7.781 -1.931 -1.943 1.00 1.00 H new ATOM 0 HG21 VAL A 55 4.991 -1.074 -1.026 1.00 1.00 H new ATOM 0 HG22 VAL A 55 5.918 -0.340 -2.356 1.00 1.00 H new ATOM 0 HG23 VAL A 55 4.270 -0.946 -2.648 1.00 1.00 H new ATOM 829 N ARG A 56 4.517 -3.850 -5.268 1.00 1.00 N ATOM 830 CA ARG A 56 3.314 -4.167 -6.044 1.00 1.00 C ATOM 831 C ARG A 56 2.197 -4.565 -5.090 1.00 1.00 C ATOM 832 O ARG A 56 2.320 -5.526 -4.327 1.00 1.00 O ATOM 833 CB ARG A 56 3.597 -5.308 -7.030 1.00 1.00 C ATOM 834 CG ARG A 56 4.674 -4.897 -8.066 1.00 1.00 C ATOM 835 CD ARG A 56 4.080 -3.990 -9.164 1.00 1.00 C ATOM 836 NE ARG A 56 5.077 -3.749 -10.206 1.00 1.00 N ATOM 837 CZ ARG A 56 5.359 -4.671 -11.125 1.00 1.00 C ATOM 838 NH1 ARG A 56 4.767 -5.833 -11.089 1.00 1.00 N ATOM 839 NH2 ARG A 56 6.235 -4.412 -12.060 1.00 1.00 N ATOM 0 H ARG A 56 5.158 -4.636 -5.160 1.00 1.00 H new ATOM 0 HA ARG A 56 3.012 -3.289 -6.615 1.00 1.00 H new ATOM 0 HB2 ARG A 56 3.931 -6.190 -6.484 1.00 1.00 H new ATOM 0 HB3 ARG A 56 2.677 -5.583 -7.547 1.00 1.00 H new ATOM 0 HG2 ARG A 56 5.487 -4.375 -7.561 1.00 1.00 H new ATOM 0 HG3 ARG A 56 5.103 -5.790 -8.521 1.00 1.00 H new ATOM 0 HD2 ARG A 56 3.196 -4.459 -9.596 1.00 1.00 H new ATOM 0 HD3 ARG A 56 3.758 -3.043 -8.731 1.00 1.00 H new ATOM 0 HE ARG A 56 5.567 -2.855 -10.230 1.00 1.00 H new ATOM 0 HH11 ARG A 56 4.087 -6.036 -10.356 1.00 1.00 H new ATOM 0 HH12 ARG A 56 4.984 -6.538 -11.793 1.00 1.00 H new ATOM 0 HH21 ARG A 56 6.701 -3.505 -12.085 1.00 1.00 H new ATOM 0 HH22 ARG A 56 6.452 -5.117 -12.765 1.00 1.00 H new ATOM 853 N VAL A 57 1.116 -3.788 -5.122 1.00 1.00 N ATOM 854 CA VAL A 57 -0.043 -4.007 -4.242 1.00 1.00 C ATOM 855 C VAL A 57 -1.226 -4.538 -5.039 1.00 1.00 C ATOM 856 O VAL A 57 -1.541 -4.028 -6.101 1.00 1.00 O ATOM 857 CB VAL A 57 -0.426 -2.678 -3.564 1.00 1.00 C ATOM 858 CG1 VAL A 57 -1.761 -2.825 -2.797 1.00 1.00 C ATOM 859 CG2 VAL A 57 0.694 -2.269 -2.595 1.00 1.00 C ATOM 0 H VAL A 57 1.013 -2.993 -5.752 1.00 1.00 H new ATOM 0 HA VAL A 57 0.222 -4.744 -3.484 1.00 1.00 H new ATOM 0 HB VAL A 57 -0.553 -1.910 -4.327 1.00 1.00 H new ATOM 0 HG11 VAL A 57 -2.016 -1.876 -2.325 1.00 1.00 H new ATOM 0 HG12 VAL A 57 -2.551 -3.107 -3.493 1.00 1.00 H new ATOM 0 HG13 VAL A 57 -1.658 -3.595 -2.032 1.00 1.00 H new ATOM 0 HG21 VAL A 57 0.431 -1.329 -2.111 1.00 1.00 H new ATOM 0 HG22 VAL A 57 0.822 -3.043 -1.839 1.00 1.00 H new ATOM 0 HG23 VAL A 57 1.625 -2.144 -3.147 1.00 1.00 H new ATOM 869 N THR A 58 -1.886 -5.570 -4.504 1.00 1.00 N ATOM 870 CA THR A 58 -3.052 -6.177 -5.156 1.00 1.00 C ATOM 871 C THR A 58 -4.323 -5.739 -4.434 1.00 1.00 C ATOM 872 O THR A 58 -4.395 -5.800 -3.208 1.00 1.00 O ATOM 873 CB THR A 58 -2.929 -7.706 -5.090 1.00 1.00 C ATOM 874 OG1 THR A 58 -1.662 -8.097 -5.600 1.00 1.00 O ATOM 875 CG2 THR A 58 -4.036 -8.353 -5.925 1.00 1.00 C ATOM 0 H THR A 58 -1.631 -6.005 -3.617 1.00 1.00 H new ATOM 0 HA THR A 58 -3.097 -5.857 -6.197 1.00 1.00 H new ATOM 0 HB THR A 58 -3.025 -8.031 -4.054 1.00 1.00 H new ATOM 0 HG1 THR A 58 -1.579 -9.073 -5.558 1.00 1.00 H new ATOM 0 HG21 THR A 58 -3.943 -9.438 -5.874 1.00 1.00 H new ATOM 0 HG22 THR A 58 -5.009 -8.053 -5.535 1.00 1.00 H new ATOM 0 HG23 THR A 58 -3.946 -8.029 -6.962 1.00 1.00 H new ATOM 883 N PHE A 59 -5.332 -5.308 -5.195 1.00 1.00 N ATOM 884 CA PHE A 59 -6.607 -4.877 -4.602 1.00 1.00 C ATOM 885 C PHE A 59 -7.749 -5.169 -5.577 1.00 1.00 C ATOM 886 O PHE A 59 -7.525 -5.226 -6.785 1.00 1.00 O ATOM 887 CB PHE A 59 -6.570 -3.372 -4.283 1.00 1.00 C ATOM 888 CG PHE A 59 -6.620 -2.555 -5.569 1.00 1.00 C ATOM 889 CD1 PHE A 59 -5.438 -2.229 -6.247 1.00 1.00 C ATOM 890 CD2 PHE A 59 -7.857 -2.128 -6.078 1.00 1.00 C ATOM 891 CE1 PHE A 59 -5.495 -1.473 -7.428 1.00 1.00 C ATOM 892 CE2 PHE A 59 -7.910 -1.377 -7.254 1.00 1.00 C ATOM 893 CZ PHE A 59 -6.729 -1.047 -7.928 1.00 1.00 C ATOM 0 H PHE A 59 -5.296 -5.247 -6.213 1.00 1.00 H new ATOM 0 HA PHE A 59 -6.768 -5.427 -3.675 1.00 1.00 H new ATOM 0 HB2 PHE A 59 -7.413 -3.108 -3.644 1.00 1.00 H new ATOM 0 HB3 PHE A 59 -5.663 -3.134 -3.728 1.00 1.00 H new ATOM 0 HD1 PHE A 59 -4.485 -2.559 -5.861 1.00 1.00 H new ATOM 0 HD2 PHE A 59 -8.770 -2.381 -5.559 1.00 1.00 H new ATOM 0 HE1 PHE A 59 -4.585 -1.220 -7.951 1.00 1.00 H new ATOM 0 HE2 PHE A 59 -8.863 -1.051 -7.644 1.00 1.00 H new ATOM 0 HZ PHE A 59 -6.771 -0.463 -8.835 1.00 1.00 H new ATOM 903 N ILE A 60 -8.968 -5.367 -5.057 1.00 1.00 N ATOM 904 CA ILE A 60 -10.141 -5.670 -5.890 1.00 1.00 C ATOM 905 C ILE A 60 -11.082 -4.474 -5.934 1.00 1.00 C ATOM 906 O ILE A 60 -11.344 -3.830 -4.917 1.00 1.00 O ATOM 907 CB ILE A 60 -10.874 -6.923 -5.304 1.00 1.00 C ATOM 908 CG1 ILE A 60 -10.290 -8.205 -5.927 1.00 1.00 C ATOM 909 CG2 ILE A 60 -12.395 -6.883 -5.587 1.00 1.00 C ATOM 910 CD1 ILE A 60 -8.761 -8.250 -5.747 1.00 1.00 C ATOM 0 H ILE A 60 -9.168 -5.322 -4.058 1.00 1.00 H new ATOM 0 HA ILE A 60 -9.819 -5.884 -6.909 1.00 1.00 H new ATOM 0 HB ILE A 60 -10.722 -6.916 -4.225 1.00 1.00 H new ATOM 0 HG12 ILE A 60 -10.742 -9.080 -5.461 1.00 1.00 H new ATOM 0 HG13 ILE A 60 -10.538 -8.245 -6.988 1.00 1.00 H new ATOM 0 HG21 ILE A 60 -12.867 -7.770 -5.164 1.00 1.00 H new ATOM 0 HG22 ILE A 60 -12.826 -5.991 -5.133 1.00 1.00 H new ATOM 0 HG23 ILE A 60 -12.564 -6.860 -6.664 1.00 1.00 H new ATOM 0 HD11 ILE A 60 -8.369 -9.163 -6.194 1.00 1.00 H new ATOM 0 HD12 ILE A 60 -8.312 -7.385 -6.235 1.00 1.00 H new ATOM 0 HD13 ILE A 60 -8.519 -8.233 -4.684 1.00 1.00 H new ATOM 922 N ARG A 61 -11.610 -4.210 -7.125 1.00 1.00 N ATOM 923 CA ARG A 61 -12.556 -3.129 -7.337 1.00 1.00 C ATOM 924 C ARG A 61 -13.635 -3.582 -8.327 1.00 1.00 C ATOM 925 O ARG A 61 -13.342 -3.966 -9.457 1.00 1.00 O ATOM 926 CB ARG A 61 -11.807 -1.885 -7.840 1.00 1.00 C ATOM 927 CG ARG A 61 -12.804 -0.780 -8.206 1.00 1.00 C ATOM 928 CD ARG A 61 -12.056 0.507 -8.542 1.00 1.00 C ATOM 929 NE ARG A 61 -13.019 1.581 -8.767 1.00 1.00 N ATOM 930 CZ ARG A 61 -13.628 2.187 -7.749 1.00 1.00 C ATOM 931 NH1 ARG A 61 -13.338 1.848 -6.522 1.00 1.00 N ATOM 932 NH2 ARG A 61 -14.512 3.118 -7.977 1.00 1.00 N ATOM 0 H ARG A 61 -11.392 -4.741 -7.968 1.00 1.00 H new ATOM 0 HA ARG A 61 -13.049 -2.868 -6.400 1.00 1.00 H new ATOM 0 HB2 ARG A 61 -11.123 -1.527 -7.071 1.00 1.00 H new ATOM 0 HB3 ARG A 61 -11.202 -2.142 -8.710 1.00 1.00 H new ATOM 0 HG2 ARG A 61 -13.409 -1.092 -9.058 1.00 1.00 H new ATOM 0 HG3 ARG A 61 -13.488 -0.606 -7.376 1.00 1.00 H new ATOM 0 HD2 ARG A 61 -11.382 0.772 -7.728 1.00 1.00 H new ATOM 0 HD3 ARG A 61 -11.441 0.362 -9.430 1.00 1.00 H new ATOM 0 HE ARG A 61 -13.229 1.873 -9.721 1.00 1.00 H new ATOM 0 HH11 ARG A 61 -12.646 1.120 -6.344 1.00 1.00 H new ATOM 0 HH12 ARG A 61 -13.803 2.311 -5.741 1.00 1.00 H new ATOM 0 HH21 ARG A 61 -14.738 3.383 -8.936 1.00 1.00 H new ATOM 0 HH22 ARG A 61 -14.978 3.581 -7.197 1.00 1.00 H new ATOM 946 N ASP A 62 -14.883 -3.529 -7.872 1.00 1.00 N ATOM 947 CA ASP A 62 -16.023 -3.923 -8.698 1.00 1.00 C ATOM 948 C ASP A 62 -15.836 -5.338 -9.245 1.00 1.00 C ATOM 949 O ASP A 62 -16.170 -5.599 -10.397 1.00 1.00 O ATOM 950 CB ASP A 62 -16.192 -2.945 -9.873 1.00 1.00 C ATOM 951 CG ASP A 62 -16.648 -1.578 -9.373 1.00 1.00 C ATOM 952 OD1 ASP A 62 -17.082 -1.498 -8.236 1.00 1.00 O ATOM 953 OD2 ASP A 62 -16.561 -0.630 -10.137 1.00 1.00 O ATOM 0 H ASP A 62 -15.133 -3.216 -6.934 1.00 1.00 H new ATOM 0 HA ASP A 62 -16.915 -3.900 -8.071 1.00 1.00 H new ATOM 0 HB2 ASP A 62 -15.248 -2.846 -10.409 1.00 1.00 H new ATOM 0 HB3 ASP A 62 -16.920 -3.341 -10.581 1.00 1.00 H new ATOM 958 N ARG A 63 -15.300 -6.239 -8.418 1.00 1.00 N ATOM 959 CA ARG A 63 -15.068 -7.625 -8.815 1.00 1.00 C ATOM 960 C ARG A 63 -13.960 -7.734 -9.860 1.00 1.00 C ATOM 961 O ARG A 63 -13.733 -8.809 -10.416 1.00 1.00 O ATOM 962 CB ARG A 63 -16.356 -8.274 -9.339 1.00 1.00 C ATOM 963 CG ARG A 63 -17.532 -8.026 -8.371 1.00 1.00 C ATOM 964 CD ARG A 63 -17.291 -8.734 -7.028 1.00 1.00 C ATOM 965 NE ARG A 63 -16.870 -10.113 -7.251 1.00 1.00 N ATOM 966 CZ ARG A 63 -17.738 -11.048 -7.626 1.00 1.00 C ATOM 967 NH1 ARG A 63 -19.000 -10.743 -7.767 1.00 1.00 N ATOM 968 NH2 ARG A 63 -17.332 -12.268 -7.853 1.00 1.00 N ATOM 0 H ARG A 63 -15.017 -6.028 -7.461 1.00 1.00 H new ATOM 0 HA ARG A 63 -14.746 -8.163 -7.923 1.00 1.00 H new ATOM 0 HB2 ARG A 63 -16.598 -7.870 -10.322 1.00 1.00 H new ATOM 0 HB3 ARG A 63 -16.203 -9.346 -9.464 1.00 1.00 H new ATOM 0 HG2 ARG A 63 -17.654 -6.955 -8.206 1.00 1.00 H new ATOM 0 HG3 ARG A 63 -18.459 -8.388 -8.817 1.00 1.00 H new ATOM 0 HD2 ARG A 63 -16.528 -8.201 -6.460 1.00 1.00 H new ATOM 0 HD3 ARG A 63 -18.203 -8.717 -6.431 1.00 1.00 H new ATOM 0 HE ARG A 63 -15.891 -10.365 -7.117 1.00 1.00 H new ATOM 0 HH11 ARG A 63 -19.317 -9.790 -7.590 1.00 1.00 H new ATOM 0 HH12 ARG A 63 -19.668 -11.458 -8.055 1.00 1.00 H new ATOM 0 HH21 ARG A 63 -16.346 -12.506 -7.743 1.00 1.00 H new ATOM 0 HH22 ARG A 63 -18.000 -12.983 -8.140 1.00 1.00 H new ATOM 982 N LYS A 64 -13.256 -6.621 -10.110 1.00 1.00 N ATOM 983 CA LYS A 64 -12.147 -6.598 -11.074 1.00 1.00 C ATOM 984 C LYS A 64 -10.814 -6.466 -10.339 1.00 1.00 C ATOM 985 O LYS A 64 -10.562 -5.473 -9.660 1.00 1.00 O ATOM 986 CB LYS A 64 -12.303 -5.416 -12.040 1.00 1.00 C ATOM 987 CG LYS A 64 -13.692 -5.448 -12.697 1.00 1.00 C ATOM 988 CD LYS A 64 -13.748 -4.469 -13.881 1.00 1.00 C ATOM 989 CE LYS A 64 -13.607 -3.018 -13.397 1.00 1.00 C ATOM 990 NZ LYS A 64 -13.971 -2.092 -14.507 1.00 1.00 N ATOM 0 H LYS A 64 -13.435 -5.724 -9.658 1.00 1.00 H new ATOM 0 HA LYS A 64 -12.165 -7.531 -11.637 1.00 1.00 H new ATOM 0 HB2 LYS A 64 -12.168 -4.477 -11.503 1.00 1.00 H new ATOM 0 HB3 LYS A 64 -11.529 -5.458 -12.806 1.00 1.00 H new ATOM 0 HG2 LYS A 64 -13.915 -6.458 -13.041 1.00 1.00 H new ATOM 0 HG3 LYS A 64 -14.454 -5.185 -11.963 1.00 1.00 H new ATOM 0 HD2 LYS A 64 -12.951 -4.700 -14.588 1.00 1.00 H new ATOM 0 HD3 LYS A 64 -14.691 -4.589 -14.414 1.00 1.00 H new ATOM 0 HE2 LYS A 64 -14.253 -2.845 -12.537 1.00 1.00 H new ATOM 0 HE3 LYS A 64 -12.584 -2.829 -13.071 1.00 1.00 H new ATOM 0 HZ1 LYS A 64 -13.877 -1.108 -14.183 1.00 1.00 H new ATOM 0 HZ2 LYS A 64 -13.337 -2.253 -15.315 1.00 1.00 H new ATOM 0 HZ3 LYS A 64 -14.954 -2.268 -14.798 1.00 1.00 H new ATOM 1004 N GLN A 65 -9.975 -7.486 -10.471 1.00 1.00 N ATOM 1005 CA GLN A 65 -8.672 -7.502 -9.821 1.00 1.00 C ATOM 1006 C GLN A 65 -7.703 -6.553 -10.521 1.00 1.00 C ATOM 1007 O GLN A 65 -7.524 -6.622 -11.737 1.00 1.00 O ATOM 1008 CB GLN A 65 -8.093 -8.921 -9.871 1.00 1.00 C ATOM 1009 CG GLN A 65 -8.989 -9.872 -9.076 1.00 1.00 C ATOM 1010 CD GLN A 65 -8.483 -11.304 -9.205 1.00 1.00 C ATOM 1011 OE1 GLN A 65 -7.639 -11.736 -8.420 1.00 1.00 O ATOM 1012 NE2 GLN A 65 -8.950 -12.067 -10.154 1.00 1.00 N ATOM 0 H GLN A 65 -10.176 -8.318 -11.026 1.00 1.00 H new ATOM 0 HA GLN A 65 -8.802 -7.180 -8.788 1.00 1.00 H new ATOM 0 HB2 GLN A 65 -8.017 -9.257 -10.905 1.00 1.00 H new ATOM 0 HB3 GLN A 65 -7.084 -8.927 -9.459 1.00 1.00 H new ATOM 0 HG2 GLN A 65 -9.004 -9.577 -8.027 1.00 1.00 H new ATOM 0 HG3 GLN A 65 -10.014 -9.807 -9.440 1.00 1.00 H new ATOM 0 HE21 GLN A 65 -9.649 -11.705 -10.802 1.00 1.00 H new ATOM 0 HE22 GLN A 65 -8.616 -13.026 -10.248 1.00 1.00 H new ATOM 1021 N HIS A 66 -7.065 -5.675 -9.742 1.00 1.00 N ATOM 1022 CA HIS A 66 -6.089 -4.718 -10.289 1.00 1.00 C ATOM 1023 C HIS A 66 -4.937 -4.486 -9.310 1.00 1.00 C ATOM 1024 O HIS A 66 -5.139 -4.372 -8.101 1.00 1.00 O ATOM 1025 CB HIS A 66 -6.763 -3.374 -10.571 1.00 1.00 C ATOM 1026 CG HIS A 66 -7.843 -3.543 -11.594 1.00 1.00 C ATOM 1027 ND1 HIS A 66 -7.581 -3.706 -12.945 1.00 1.00 N ATOM 1028 CD2 HIS A 66 -9.202 -3.557 -11.471 1.00 1.00 C ATOM 1029 CE1 HIS A 66 -8.766 -3.810 -13.576 1.00 1.00 C ATOM 1030 NE2 HIS A 66 -9.788 -3.727 -12.721 1.00 1.00 N ATOM 0 H HIS A 66 -7.203 -5.604 -8.734 1.00 1.00 H new ATOM 0 HA HIS A 66 -5.698 -5.143 -11.213 1.00 1.00 H new ATOM 0 HB2 HIS A 66 -7.184 -2.969 -9.650 1.00 1.00 H new ATOM 0 HB3 HIS A 66 -6.024 -2.656 -10.926 1.00 1.00 H new ATOM 0 HD1 HIS A 66 -6.660 -3.741 -13.381 1.00 1.00 H new ATOM 0 HD2 HIS A 66 -9.742 -3.452 -10.542 1.00 1.00 H new ATOM 0 HE1 HIS A 66 -8.876 -3.944 -14.642 1.00 1.00 H new ATOM 1039 N GLU A 67 -3.729 -4.414 -9.865 1.00 1.00 N ATOM 1040 CA GLU A 67 -2.506 -4.190 -9.094 1.00 1.00 C ATOM 1041 C GLU A 67 -2.177 -2.700 -9.031 1.00 1.00 C ATOM 1042 O GLU A 67 -2.319 -1.976 -10.018 1.00 1.00 O ATOM 1043 CB GLU A 67 -1.334 -4.942 -9.741 1.00 1.00 C ATOM 1044 CG GLU A 67 -1.550 -6.453 -9.614 1.00 1.00 C ATOM 1045 CD GLU A 67 -0.425 -7.209 -10.324 1.00 1.00 C ATOM 1046 OE1 GLU A 67 0.453 -6.561 -10.870 1.00 1.00 O ATOM 1047 OE2 GLU A 67 -0.461 -8.429 -10.311 1.00 1.00 O ATOM 0 H GLU A 67 -3.569 -4.510 -10.868 1.00 1.00 H new ATOM 0 HA GLU A 67 -2.665 -4.561 -8.082 1.00 1.00 H new ATOM 0 HB2 GLU A 67 -1.249 -4.665 -10.792 1.00 1.00 H new ATOM 0 HB3 GLU A 67 -0.398 -4.658 -9.260 1.00 1.00 H new ATOM 0 HG2 GLU A 67 -1.581 -6.736 -8.562 1.00 1.00 H new ATOM 0 HG3 GLU A 67 -2.512 -6.728 -10.046 1.00 1.00 H new ATOM 1054 N ALA A 68 -1.752 -2.254 -7.846 1.00 1.00 N ATOM 1055 CA ALA A 68 -1.406 -0.846 -7.596 1.00 1.00 C ATOM 1056 C ALA A 68 0.103 -0.686 -7.369 1.00 1.00 C ATOM 1057 O ALA A 68 0.664 -1.207 -6.404 1.00 1.00 O ATOM 1058 CB ALA A 68 -2.185 -0.338 -6.354 1.00 1.00 C ATOM 0 H ALA A 68 -1.637 -2.856 -7.031 1.00 1.00 H new ATOM 0 HA ALA A 68 -1.682 -0.256 -8.470 1.00 1.00 H new ATOM 0 HB1 ALA A 68 -1.930 0.705 -6.166 1.00 1.00 H new ATOM 0 HB2 ALA A 68 -3.256 -0.423 -6.537 1.00 1.00 H new ATOM 0 HB3 ALA A 68 -1.916 -0.939 -5.485 1.00 1.00 H new ATOM 1064 N GLU A 69 0.732 0.061 -8.267 1.00 1.00 N ATOM 1065 CA GLU A 69 2.169 0.330 -8.179 1.00 1.00 C ATOM 1066 C GLU A 69 2.417 1.404 -7.111 1.00 1.00 C ATOM 1067 O GLU A 69 2.168 2.590 -7.330 1.00 1.00 O ATOM 1068 CB GLU A 69 2.718 0.789 -9.550 1.00 1.00 C ATOM 1069 CG GLU A 69 1.691 1.696 -10.240 1.00 1.00 C ATOM 1070 CD GLU A 69 2.317 2.391 -11.447 1.00 1.00 C ATOM 1071 OE1 GLU A 69 3.490 2.723 -11.377 1.00 1.00 O ATOM 1072 OE2 GLU A 69 1.611 2.591 -12.423 1.00 1.00 O ATOM 0 H GLU A 69 0.272 0.494 -9.068 1.00 1.00 H new ATOM 0 HA GLU A 69 2.691 -0.584 -7.897 1.00 1.00 H new ATOM 0 HB2 GLU A 69 3.658 1.324 -9.416 1.00 1.00 H new ATOM 0 HB3 GLU A 69 2.931 -0.078 -10.176 1.00 1.00 H new ATOM 0 HG2 GLU A 69 0.832 1.106 -10.558 1.00 1.00 H new ATOM 0 HG3 GLU A 69 1.323 2.441 -9.535 1.00 1.00 H new ATOM 1079 N LEU A 70 2.893 0.960 -5.947 1.00 1.00 N ATOM 1080 CA LEU A 70 3.168 1.856 -4.806 1.00 1.00 C ATOM 1081 C LEU A 70 4.662 1.919 -4.518 1.00 1.00 C ATOM 1082 O LEU A 70 5.391 0.940 -4.682 1.00 1.00 O ATOM 1083 CB LEU A 70 2.386 1.363 -3.545 1.00 1.00 C ATOM 1084 CG LEU A 70 1.207 2.317 -3.194 1.00 1.00 C ATOM 1085 CD1 LEU A 70 0.198 1.595 -2.288 1.00 1.00 C ATOM 1086 CD2 LEU A 70 1.747 3.563 -2.461 1.00 1.00 C ATOM 0 H LEU A 70 3.100 -0.022 -5.762 1.00 1.00 H new ATOM 0 HA LEU A 70 2.832 2.861 -5.060 1.00 1.00 H new ATOM 0 HB2 LEU A 70 2.002 0.359 -3.724 1.00 1.00 H new ATOM 0 HB3 LEU A 70 3.067 1.297 -2.696 1.00 1.00 H new ATOM 0 HG LEU A 70 0.712 2.620 -4.117 1.00 1.00 H new ATOM 0 HD11 LEU A 70 -0.623 2.270 -2.048 1.00 1.00 H new ATOM 0 HD12 LEU A 70 -0.192 0.718 -2.805 1.00 1.00 H new ATOM 0 HD13 LEU A 70 0.693 1.284 -1.368 1.00 1.00 H new ATOM 0 HD21 LEU A 70 0.919 4.229 -2.217 1.00 1.00 H new ATOM 0 HD22 LEU A 70 2.249 3.256 -1.543 1.00 1.00 H new ATOM 0 HD23 LEU A 70 2.455 4.085 -3.104 1.00 1.00 H new ATOM 1098 N VAL A 71 5.093 3.098 -4.077 1.00 1.00 N ATOM 1099 CA VAL A 71 6.490 3.355 -3.735 1.00 1.00 C ATOM 1100 C VAL A 71 6.583 3.978 -2.345 1.00 1.00 C ATOM 1101 O VAL A 71 5.817 4.878 -1.996 1.00 1.00 O ATOM 1102 CB VAL A 71 7.124 4.285 -4.776 1.00 1.00 C ATOM 1103 CG1 VAL A 71 7.022 3.641 -6.164 1.00 1.00 C ATOM 1104 CG2 VAL A 71 6.403 5.637 -4.795 1.00 1.00 C ATOM 0 H VAL A 71 4.482 3.904 -3.946 1.00 1.00 H new ATOM 0 HA VAL A 71 7.033 2.410 -3.732 1.00 1.00 H new ATOM 0 HB VAL A 71 8.170 4.444 -4.514 1.00 1.00 H new ATOM 0 HG11 VAL A 71 7.472 4.301 -6.905 1.00 1.00 H new ATOM 0 HG12 VAL A 71 7.547 2.686 -6.162 1.00 1.00 H new ATOM 0 HG13 VAL A 71 5.974 3.478 -6.413 1.00 1.00 H new ATOM 0 HG21 VAL A 71 6.865 6.285 -5.539 1.00 1.00 H new ATOM 0 HG22 VAL A 71 5.353 5.486 -5.047 1.00 1.00 H new ATOM 0 HG23 VAL A 71 6.477 6.103 -3.812 1.00 1.00 H new ATOM 1114 N LEU A 72 7.510 3.472 -1.550 1.00 1.00 N ATOM 1115 CA LEU A 72 7.691 3.957 -0.192 1.00 1.00 C ATOM 1116 C LEU A 72 8.190 5.394 -0.203 1.00 1.00 C ATOM 1117 O LEU A 72 9.203 5.700 -0.835 1.00 1.00 O ATOM 1118 CB LEU A 72 8.710 3.054 0.527 1.00 1.00 C ATOM 1119 CG LEU A 72 8.047 1.736 0.981 1.00 1.00 C ATOM 1120 CD1 LEU A 72 6.996 1.989 2.106 1.00 1.00 C ATOM 1121 CD2 LEU A 72 7.378 1.039 -0.226 1.00 1.00 C ATOM 0 H LEU A 72 8.149 2.725 -1.821 1.00 1.00 H new ATOM 0 HA LEU A 72 6.736 3.930 0.332 1.00 1.00 H new ATOM 0 HB2 LEU A 72 9.544 2.836 -0.140 1.00 1.00 H new ATOM 0 HB3 LEU A 72 9.120 3.577 1.391 1.00 1.00 H new ATOM 0 HG LEU A 72 8.824 1.088 1.387 1.00 1.00 H new ATOM 0 HD11 LEU A 72 6.547 1.042 2.404 1.00 1.00 H new ATOM 0 HD12 LEU A 72 7.486 2.445 2.966 1.00 1.00 H new ATOM 0 HD13 LEU A 72 6.219 2.658 1.735 1.00 1.00 H new ATOM 0 HD21 LEU A 72 6.912 0.110 0.103 1.00 1.00 H new ATOM 0 HD22 LEU A 72 6.618 1.695 -0.650 1.00 1.00 H new ATOM 0 HD23 LEU A 72 8.131 0.820 -0.983 1.00 1.00 H new ATOM 1133 N LYS A 73 7.468 6.279 0.499 1.00 1.00 N ATOM 1134 CA LYS A 73 7.833 7.698 0.575 1.00 1.00 C ATOM 1135 C LYS A 73 7.741 8.203 2.038 1.00 1.00 C ATOM 1136 O LYS A 73 6.657 8.179 2.623 1.00 1.00 O ATOM 1137 CB LYS A 73 6.876 8.508 -0.299 1.00 1.00 C ATOM 1138 CG LYS A 73 7.349 9.965 -0.366 1.00 1.00 C ATOM 1139 CD LYS A 73 6.497 10.729 -1.379 1.00 1.00 C ATOM 1140 CE LYS A 73 6.864 12.215 -1.341 1.00 1.00 C ATOM 1141 NZ LYS A 73 6.184 12.918 -2.463 1.00 1.00 N ATOM 0 H LYS A 73 6.627 6.035 1.022 1.00 1.00 H new ATOM 0 HA LYS A 73 8.858 7.820 0.224 1.00 1.00 H new ATOM 0 HB2 LYS A 73 6.834 8.082 -1.302 1.00 1.00 H new ATOM 0 HB3 LYS A 73 5.867 8.461 0.109 1.00 1.00 H new ATOM 0 HG2 LYS A 73 7.270 10.430 0.617 1.00 1.00 H new ATOM 0 HG3 LYS A 73 8.399 10.005 -0.654 1.00 1.00 H new ATOM 0 HD2 LYS A 73 6.659 10.330 -2.380 1.00 1.00 H new ATOM 0 HD3 LYS A 73 5.439 10.599 -1.151 1.00 1.00 H new ATOM 0 HE2 LYS A 73 6.564 12.651 -0.388 1.00 1.00 H new ATOM 0 HE3 LYS A 73 7.944 12.337 -1.422 1.00 1.00 H new ATOM 0 HZ1 LYS A 73 6.431 13.928 -2.440 1.00 1.00 H new ATOM 0 HZ2 LYS A 73 6.491 12.507 -3.367 1.00 1.00 H new ATOM 0 HZ3 LYS A 73 5.154 12.811 -2.366 1.00 1.00 H new ATOM 1155 N PRO A 74 8.832 8.646 2.652 1.00 1.00 N ATOM 1156 CA PRO A 74 8.812 9.131 4.071 1.00 1.00 C ATOM 1157 C PRO A 74 8.201 10.529 4.200 1.00 1.00 C ATOM 1158 O PRO A 74 7.633 11.055 3.243 1.00 1.00 O ATOM 1159 CB PRO A 74 10.302 9.103 4.470 1.00 1.00 C ATOM 1160 CG PRO A 74 11.041 9.365 3.193 1.00 1.00 C ATOM 1161 CD PRO A 74 10.194 8.728 2.082 1.00 1.00 C ATOM 0 HA PRO A 74 8.188 8.516 4.720 1.00 1.00 H new ATOM 0 HB2 PRO A 74 10.526 9.862 5.220 1.00 1.00 H new ATOM 0 HB3 PRO A 74 10.580 8.140 4.898 1.00 1.00 H new ATOM 0 HG2 PRO A 74 11.165 10.435 3.025 1.00 1.00 H new ATOM 0 HG3 PRO A 74 12.040 8.929 3.222 1.00 1.00 H new ATOM 0 HD2 PRO A 74 10.209 9.334 1.176 1.00 1.00 H new ATOM 0 HD3 PRO A 74 10.571 7.741 1.812 1.00 1.00 H new ATOM 1169 N PHE A 75 8.321 11.112 5.404 1.00 1.00 N ATOM 1170 CA PHE A 75 7.774 12.456 5.683 1.00 1.00 C ATOM 1171 C PHE A 75 8.866 13.398 6.233 1.00 1.00 C ATOM 1172 O PHE A 75 9.758 12.956 6.959 1.00 1.00 O ATOM 1173 CB PHE A 75 6.628 12.334 6.705 1.00 1.00 C ATOM 1174 CG PHE A 75 5.387 11.799 6.014 1.00 1.00 C ATOM 1175 CD1 PHE A 75 5.277 10.430 5.747 1.00 1.00 C ATOM 1176 CD2 PHE A 75 4.362 12.674 5.620 1.00 1.00 C ATOM 1177 CE1 PHE A 75 4.145 9.935 5.089 1.00 1.00 C ATOM 1178 CE2 PHE A 75 3.231 12.178 4.967 1.00 1.00 C ATOM 1179 CZ PHE A 75 3.122 10.809 4.701 1.00 1.00 C ATOM 0 H PHE A 75 8.790 10.678 6.199 1.00 1.00 H new ATOM 0 HA PHE A 75 7.400 12.880 4.751 1.00 1.00 H new ATOM 0 HB2 PHE A 75 6.920 11.668 7.517 1.00 1.00 H new ATOM 0 HB3 PHE A 75 6.418 13.307 7.150 1.00 1.00 H new ATOM 0 HD1 PHE A 75 6.065 9.756 6.048 1.00 1.00 H new ATOM 0 HD2 PHE A 75 4.448 13.731 5.822 1.00 1.00 H new ATOM 0 HE1 PHE A 75 4.061 8.879 4.880 1.00 1.00 H new ATOM 0 HE2 PHE A 75 2.441 12.851 4.668 1.00 1.00 H new ATOM 0 HZ PHE A 75 2.248 10.426 4.196 1.00 1.00 H new ATOM 1189 N PRO A 76 8.818 14.683 5.911 1.00 1.00 N ATOM 1190 CA PRO A 76 9.837 15.664 6.408 1.00 1.00 C ATOM 1191 C PRO A 76 9.717 15.899 7.919 1.00 1.00 C ATOM 1192 O PRO A 76 10.717 16.111 8.605 1.00 1.00 O ATOM 1193 CB PRO A 76 9.534 16.949 5.603 1.00 1.00 C ATOM 1194 CG PRO A 76 8.080 16.841 5.238 1.00 1.00 C ATOM 1195 CD PRO A 76 7.804 15.341 5.057 1.00 1.00 C ATOM 0 HA PRO A 76 10.858 15.311 6.266 1.00 1.00 H new ATOM 0 HB2 PRO A 76 9.727 17.842 6.197 1.00 1.00 H new ATOM 0 HB3 PRO A 76 10.161 17.016 4.714 1.00 1.00 H new ATOM 0 HG2 PRO A 76 7.448 17.263 6.020 1.00 1.00 H new ATOM 0 HG3 PRO A 76 7.865 17.391 4.322 1.00 1.00 H new ATOM 0 HD2 PRO A 76 6.792 15.081 5.367 1.00 1.00 H new ATOM 0 HD3 PRO A 76 7.905 15.040 4.014 1.00 1.00 H new ATOM 1203 N HIS A 77 8.485 15.856 8.428 1.00 1.00 N ATOM 1204 CA HIS A 77 8.239 16.062 9.858 1.00 1.00 C ATOM 1205 C HIS A 77 8.499 14.775 10.634 1.00 1.00 C ATOM 1206 O HIS A 77 8.878 14.810 11.804 1.00 1.00 O ATOM 1207 CB HIS A 77 6.793 16.511 10.080 1.00 1.00 C ATOM 1208 CG HIS A 77 6.535 17.768 9.294 1.00 1.00 C ATOM 1209 ND1 HIS A 77 5.913 17.751 8.056 1.00 1.00 N ATOM 1210 CD2 HIS A 77 6.816 19.088 9.554 1.00 1.00 C ATOM 1211 CE1 HIS A 77 5.838 19.022 7.621 1.00 1.00 C ATOM 1212 NE2 HIS A 77 6.375 19.877 8.495 1.00 1.00 N ATOM 0 H HIS A 77 7.645 15.681 7.876 1.00 1.00 H new ATOM 0 HA HIS A 77 8.918 16.835 10.218 1.00 1.00 H new ATOM 0 HB2 HIS A 77 6.105 15.726 9.768 1.00 1.00 H new ATOM 0 HB3 HIS A 77 6.614 16.689 11.140 1.00 1.00 H new ATOM 0 HD2 HIS A 77 7.304 19.457 10.444 1.00 1.00 H new ATOM 0 HE1 HIS A 77 5.397 19.315 6.680 1.00 1.00 H new ATOM 0 HE2 HIS A 77 6.447 20.891 8.406 1.00 1.00 H new ATOM 1221 N HIS A 78 8.282 13.636 9.971 1.00 1.00 N ATOM 1222 CA HIS A 78 8.481 12.320 10.589 1.00 1.00 C ATOM 1223 C HIS A 78 9.180 11.374 9.609 1.00 1.00 C ATOM 1224 O HIS A 78 8.609 10.356 9.212 1.00 1.00 O ATOM 1225 CB HIS A 78 7.123 11.739 10.981 1.00 1.00 C ATOM 1226 CG HIS A 78 6.417 12.713 11.885 1.00 1.00 C ATOM 1227 ND1 HIS A 78 5.721 13.808 11.395 1.00 1.00 N ATOM 1228 CD2 HIS A 78 6.301 12.778 13.252 1.00 1.00 C ATOM 1229 CE1 HIS A 78 5.224 14.479 12.450 1.00 1.00 C ATOM 1230 NE2 HIS A 78 5.548 13.895 13.605 1.00 1.00 N ATOM 0 H HIS A 78 7.967 13.598 9.002 1.00 1.00 H new ATOM 0 HA HIS A 78 9.106 12.432 11.475 1.00 1.00 H new ATOM 0 HB2 HIS A 78 6.524 11.549 10.091 1.00 1.00 H new ATOM 0 HB3 HIS A 78 7.254 10.783 11.487 1.00 1.00 H new ATOM 0 HD2 HIS A 78 6.729 12.071 13.947 1.00 1.00 H new ATOM 0 HE1 HIS A 78 4.635 15.381 12.371 1.00 1.00 H new ATOM 0 HE2 HIS A 78 5.298 14.201 14.545 1.00 1.00 H new ATOM 1239 N PRO A 79 10.393 11.688 9.198 1.00 1.00 N ATOM 1240 CA PRO A 79 11.148 10.831 8.230 1.00 1.00 C ATOM 1241 C PRO A 79 11.442 9.444 8.803 1.00 1.00 C ATOM 1242 O PRO A 79 11.610 8.473 8.065 1.00 1.00 O ATOM 1243 CB PRO A 79 12.442 11.637 7.942 1.00 1.00 C ATOM 1244 CG PRO A 79 12.599 12.552 9.125 1.00 1.00 C ATOM 1245 CD PRO A 79 11.174 12.877 9.599 1.00 1.00 C ATOM 0 HA PRO A 79 10.580 10.630 7.321 1.00 1.00 H new ATOM 0 HB2 PRO A 79 13.303 10.977 7.836 1.00 1.00 H new ATOM 0 HB3 PRO A 79 12.357 12.202 7.014 1.00 1.00 H new ATOM 0 HG2 PRO A 79 13.174 12.071 9.917 1.00 1.00 H new ATOM 0 HG3 PRO A 79 13.135 13.460 8.848 1.00 1.00 H new ATOM 0 HD2 PRO A 79 11.137 13.036 10.677 1.00 1.00 H new ATOM 0 HD3 PRO A 79 10.793 13.784 9.130 1.00 1.00 H new ATOM 1253 N ASN A 80 11.520 9.373 10.121 1.00 1.00 N ATOM 1254 CA ASN A 80 11.812 8.121 10.794 1.00 1.00 C ATOM 1255 C ASN A 80 10.799 7.056 10.402 1.00 1.00 C ATOM 1256 O ASN A 80 11.008 5.872 10.670 1.00 1.00 O ATOM 1257 CB ASN A 80 11.782 8.324 12.311 1.00 1.00 C ATOM 1258 CG ASN A 80 12.105 7.013 13.024 1.00 1.00 C ATOM 1259 OD1 ASN A 80 11.222 6.402 13.629 1.00 1.00 O ATOM 1260 ND2 ASN A 80 13.321 6.544 12.988 1.00 1.00 N ATOM 0 H ASN A 80 11.385 10.168 10.745 1.00 1.00 H new ATOM 0 HA ASN A 80 12.806 7.790 10.492 1.00 1.00 H new ATOM 0 HB2 ASN A 80 12.503 9.090 12.597 1.00 1.00 H new ATOM 0 HB3 ASN A 80 10.799 8.681 12.618 1.00 1.00 H new ATOM 0 HD21 ASN A 80 13.544 5.669 13.462 1.00 1.00 H new ATOM 0 HD22 ASN A 80 14.049 7.052 12.486 1.00 1.00 H new ATOM 1267 N GLN A 81 9.697 7.478 9.770 1.00 1.00 N ATOM 1268 CA GLN A 81 8.638 6.564 9.344 1.00 1.00 C ATOM 1269 C GLN A 81 8.560 6.538 7.830 1.00 1.00 C ATOM 1270 O GLN A 81 9.210 7.339 7.156 1.00 1.00 O ATOM 1271 CB GLN A 81 7.302 7.041 9.915 1.00 1.00 C ATOM 1272 CG GLN A 81 7.298 6.831 11.432 1.00 1.00 C ATOM 1273 CD GLN A 81 5.972 7.291 12.029 1.00 1.00 C ATOM 1274 OE1 GLN A 81 5.052 7.651 11.295 1.00 1.00 O ATOM 1275 NE2 GLN A 81 5.820 7.302 13.326 1.00 1.00 N ATOM 0 H GLN A 81 9.518 8.456 9.542 1.00 1.00 H new ATOM 0 HA GLN A 81 8.857 5.560 9.708 1.00 1.00 H new ATOM 0 HB2 GLN A 81 7.149 8.095 9.681 1.00 1.00 H new ATOM 0 HB3 GLN A 81 6.480 6.490 9.458 1.00 1.00 H new ATOM 0 HG2 GLN A 81 7.461 5.778 11.660 1.00 1.00 H new ATOM 0 HG3 GLN A 81 8.120 7.386 11.885 1.00 1.00 H new ATOM 0 HE21 GLN A 81 6.584 7.003 13.932 1.00 1.00 H new ATOM 0 HE22 GLN A 81 4.937 7.610 13.733 1.00 1.00 H new ATOM 1284 N ILE A 82 7.763 5.602 7.301 1.00 1.00 N ATOM 1285 CA ILE A 82 7.599 5.443 5.846 1.00 1.00 C ATOM 1286 C ILE A 82 6.139 5.689 5.448 1.00 1.00 C ATOM 1287 O ILE A 82 5.311 6.041 6.285 1.00 1.00 O ATOM 1288 CB ILE A 82 8.070 4.019 5.392 1.00 1.00 C ATOM 1289 CG1 ILE A 82 8.802 3.285 6.545 1.00 1.00 C ATOM 1290 CG2 ILE A 82 9.026 4.145 4.195 1.00 1.00 C ATOM 1291 CD1 ILE A 82 10.077 4.035 6.999 1.00 1.00 C ATOM 0 H ILE A 82 7.220 4.941 7.857 1.00 1.00 H new ATOM 0 HA ILE A 82 8.222 6.181 5.340 1.00 1.00 H new ATOM 0 HB ILE A 82 7.188 3.444 5.109 1.00 1.00 H new ATOM 0 HG12 ILE A 82 8.125 3.177 7.392 1.00 1.00 H new ATOM 0 HG13 ILE A 82 9.070 2.279 6.221 1.00 1.00 H new ATOM 0 HG21 ILE A 82 9.351 3.152 3.883 1.00 1.00 H new ATOM 0 HG22 ILE A 82 8.511 4.635 3.368 1.00 1.00 H new ATOM 0 HG23 ILE A 82 9.895 4.737 4.484 1.00 1.00 H new ATOM 0 HD11 ILE A 82 10.555 3.483 7.808 1.00 1.00 H new ATOM 0 HD12 ILE A 82 10.767 4.120 6.160 1.00 1.00 H new ATOM 0 HD13 ILE A 82 9.808 5.031 7.349 1.00 1.00 H new ATOM 1303 N GLY A 83 5.851 5.521 4.156 1.00 1.00 N ATOM 1304 CA GLY A 83 4.506 5.746 3.624 1.00 1.00 C ATOM 1305 C GLY A 83 3.434 5.062 4.467 1.00 1.00 C ATOM 1306 O GLY A 83 3.023 3.934 4.190 1.00 1.00 O ATOM 0 H GLY A 83 6.534 5.229 3.457 1.00 1.00 H new ATOM 0 HA2 GLY A 83 4.307 6.817 3.584 1.00 1.00 H new ATOM 0 HA3 GLY A 83 4.454 5.374 2.601 1.00 1.00 H new ATOM 1310 N LEU A 84 2.982 5.769 5.502 1.00 1.00 N ATOM 1311 CA LEU A 84 1.942 5.269 6.414 1.00 1.00 C ATOM 1312 C LEU A 84 0.568 5.816 6.036 1.00 1.00 C ATOM 1313 O LEU A 84 -0.439 5.479 6.659 1.00 1.00 O ATOM 1314 CB LEU A 84 2.294 5.658 7.876 1.00 1.00 C ATOM 1315 CG LEU A 84 2.102 7.186 8.184 1.00 1.00 C ATOM 1316 CD1 LEU A 84 2.768 8.063 7.109 1.00 1.00 C ATOM 1317 CD2 LEU A 84 0.601 7.587 8.340 1.00 1.00 C ATOM 0 H LEU A 84 3.322 6.702 5.735 1.00 1.00 H new ATOM 0 HA LEU A 84 1.904 4.183 6.330 1.00 1.00 H new ATOM 0 HB2 LEU A 84 1.672 5.078 8.557 1.00 1.00 H new ATOM 0 HB3 LEU A 84 3.329 5.383 8.077 1.00 1.00 H new ATOM 0 HG LEU A 84 2.592 7.362 9.142 1.00 1.00 H new ATOM 0 HD11 LEU A 84 2.616 9.115 7.352 1.00 1.00 H new ATOM 0 HD12 LEU A 84 3.836 7.849 7.075 1.00 1.00 H new ATOM 0 HD13 LEU A 84 2.324 7.848 6.137 1.00 1.00 H new ATOM 0 HD21 LEU A 84 0.530 8.654 8.552 1.00 1.00 H new ATOM 0 HD22 LEU A 84 0.067 7.364 7.416 1.00 1.00 H new ATOM 0 HD23 LEU A 84 0.157 7.024 9.161 1.00 1.00 H new ATOM 1329 N GLY A 85 0.534 6.678 5.026 1.00 1.00 N ATOM 1330 CA GLY A 85 -0.716 7.295 4.596 1.00 1.00 C ATOM 1331 C GLY A 85 -1.707 6.268 4.079 1.00 1.00 C ATOM 1332 O GLY A 85 -2.918 6.434 4.226 1.00 1.00 O ATOM 0 H GLY A 85 1.354 6.965 4.491 1.00 1.00 H new ATOM 0 HA2 GLY A 85 -1.159 7.838 5.431 1.00 1.00 H new ATOM 0 HA3 GLY A 85 -0.510 8.026 3.814 1.00 1.00 H new ATOM 1336 N VAL A 86 -1.185 5.212 3.461 1.00 1.00 N ATOM 1337 CA VAL A 86 -2.016 4.148 2.893 1.00 1.00 C ATOM 1338 C VAL A 86 -1.901 2.886 3.732 1.00 1.00 C ATOM 1339 O VAL A 86 -0.838 2.584 4.276 1.00 1.00 O ATOM 1340 CB VAL A 86 -1.560 3.861 1.463 1.00 1.00 C ATOM 1341 CG1 VAL A 86 -2.509 2.855 0.808 1.00 1.00 C ATOM 1342 CG2 VAL A 86 -1.565 5.168 0.667 1.00 1.00 C ATOM 0 H VAL A 86 -0.183 5.068 3.339 1.00 1.00 H new ATOM 0 HA VAL A 86 -3.057 4.471 2.889 1.00 1.00 H new ATOM 0 HB VAL A 86 -0.554 3.441 1.477 1.00 1.00 H new ATOM 0 HG11 VAL A 86 -2.179 2.654 -0.211 1.00 1.00 H new ATOM 0 HG12 VAL A 86 -2.507 1.927 1.380 1.00 1.00 H new ATOM 0 HG13 VAL A 86 -3.518 3.266 0.788 1.00 1.00 H new ATOM 0 HG21 VAL A 86 -1.241 4.973 -0.355 1.00 1.00 H new ATOM 0 HG22 VAL A 86 -2.573 5.583 0.655 1.00 1.00 H new ATOM 0 HG23 VAL A 86 -0.885 5.881 1.133 1.00 1.00 H new ATOM 1352 N THR A 87 -3.013 2.152 3.836 1.00 1.00 N ATOM 1353 CA THR A 87 -3.066 0.909 4.616 1.00 1.00 C ATOM 1354 C THR A 87 -3.479 -0.260 3.727 1.00 1.00 C ATOM 1355 O THR A 87 -2.935 -1.337 3.909 1.00 1.00 O ATOM 1356 CB THR A 87 -4.077 1.062 5.754 1.00 1.00 C ATOM 1357 OG1 THR A 87 -3.748 2.215 6.520 1.00 1.00 O ATOM 1358 CG2 THR A 87 -4.044 -0.176 6.654 1.00 1.00 C ATOM 0 H THR A 87 -3.895 2.398 3.387 1.00 1.00 H new ATOM 0 HA THR A 87 -2.076 0.710 5.025 1.00 1.00 H new ATOM 0 HB THR A 87 -5.078 1.170 5.335 1.00 1.00 H new ATOM 0 HG1 THR A 87 -4.154 2.144 7.409 1.00 1.00 H new ATOM 0 HG21 THR A 87 -4.767 -0.058 7.461 1.00 1.00 H new ATOM 0 HG22 THR A 87 -4.296 -1.059 6.067 1.00 1.00 H new ATOM 0 HG23 THR A 87 -3.046 -0.293 7.075 1.00 1.00 H new TER 1366 THR A 87