USER MOD reduce.3.24.130724 H: found=0, std=0, add=768, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 767 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 26 THR OG1 : rot 150:sc= -3.18! USER MOD Set 1.2: A 29 GLN : amide:sc= -1.67! C(o=-4.8!,f=-8.6!) USER MOD Single : A 1 MET CE :methyl -125:sc= -0.0555 (180deg=-0.452) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 55:sc= -0.449! USER MOD Single : A 12 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.27) USER MOD Single : A 14 THR OG1 : rot 25:sc= -5.61! USER MOD Single : A 15 ASN : amide:sc= -0.887 X(o=-0.89,f=-0.45) USER MOD Single : A 17 TYR OH : rot 180:sc= -0.16 USER MOD Single : A 19 THR OG1 : rot 180:sc= -1.88! USER MOD Single : A 20 ASN : amide:sc= -0.824 K(o=-0.82,f=-0.1) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0904) USER MOD Single : A 37 TYR OH : rot 30:sc= -1.05 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 LYS NZ :NH3+ 175:sc= -7.85! (180deg=-8.12!) USER MOD Single : A 44 ASN : amide:sc= -0.707 K(o=-0.71,f=-3) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.493 USER MOD Single : A 62 TYR OH : rot 113:sc= -4.16! USER MOD Single : A 63 ASN : amide:sc= -21.1! C(o=-21!,f=-28!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.091) USER MOD Single : A 73 SER OG : rot -44:sc= 0.41 USER MOD Single : A 76 ASN : amide:sc= -7.26! C(o=-7.3!,f=-4.2!) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 95 HIS : no HD1:sc= -1.05 K(o=-1.1,f=-0.47) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -20.692 1.850 12.792 1.00 0.00 N ATOM 2 CA MET A 1 -20.515 2.867 11.717 1.00 0.00 C ATOM 3 C MET A 1 -19.044 2.913 11.297 1.00 0.00 C ATOM 4 O MET A 1 -18.391 3.932 11.397 1.00 0.00 O ATOM 5 CB MET A 1 -20.940 4.242 12.236 1.00 0.00 C ATOM 6 CG MET A 1 -21.183 5.182 11.054 1.00 0.00 C ATOM 7 SD MET A 1 -22.498 6.352 11.472 1.00 0.00 S ATOM 8 CE MET A 1 -23.885 5.203 11.293 1.00 0.00 C ATOM 0 H1 MET A 1 -21.691 1.818 13.078 1.00 0.00 H new ATOM 0 H2 MET A 1 -20.403 0.916 12.437 1.00 0.00 H new ATOM 0 H3 MET A 1 -20.105 2.106 13.612 1.00 0.00 H new ATOM 0 HA MET A 1 -21.131 2.598 10.859 1.00 0.00 H new ATOM 0 HB2 MET A 1 -21.846 4.152 12.835 1.00 0.00 H new ATOM 0 HB3 MET A 1 -20.167 4.651 12.887 1.00 0.00 H new ATOM 0 HG2 MET A 1 -20.267 5.720 10.810 1.00 0.00 H new ATOM 0 HG3 MET A 1 -21.460 4.608 10.170 1.00 0.00 H new ATOM 0 HE1 MET A 1 -24.609 5.614 10.590 1.00 0.00 H new ATOM 0 HE2 MET A 1 -23.519 4.246 10.920 1.00 0.00 H new ATOM 0 HE3 MET A 1 -24.363 5.056 12.262 1.00 0.00 H new ATOM 20 N SER A 2 -18.516 1.816 10.825 1.00 0.00 N ATOM 21 CA SER A 2 -17.089 1.800 10.399 1.00 0.00 C ATOM 22 C SER A 2 -17.012 1.513 8.899 1.00 0.00 C ATOM 23 O SER A 2 -17.620 0.586 8.402 1.00 0.00 O ATOM 24 CB SER A 2 -16.337 0.712 11.166 1.00 0.00 C ATOM 25 OG SER A 2 -14.996 0.651 10.699 1.00 0.00 O ATOM 0 H SER A 2 -19.012 0.931 10.716 1.00 0.00 H new ATOM 0 HA SER A 2 -16.636 2.769 10.610 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.353 0.927 12.234 1.00 0.00 H new ATOM 0 HB3 SER A 2 -16.827 -0.252 11.027 1.00 0.00 H new ATOM 0 HG SER A 2 -14.510 -0.044 11.190 1.00 0.00 H new ATOM 31 N TYR A 3 -16.270 2.302 8.171 1.00 0.00 N ATOM 32 CA TYR A 3 -16.156 2.073 6.704 1.00 0.00 C ATOM 33 C TYR A 3 -14.803 2.587 6.209 1.00 0.00 C ATOM 34 O TYR A 3 -14.047 3.185 6.949 1.00 0.00 O ATOM 35 CB TYR A 3 -17.278 2.822 5.985 1.00 0.00 C ATOM 36 CG TYR A 3 -17.131 4.303 6.239 1.00 0.00 C ATOM 37 CD1 TYR A 3 -17.354 4.819 7.521 1.00 0.00 C ATOM 38 CD2 TYR A 3 -16.765 5.159 5.193 1.00 0.00 C ATOM 39 CE1 TYR A 3 -17.213 6.192 7.757 1.00 0.00 C ATOM 40 CE2 TYR A 3 -16.624 6.531 5.429 1.00 0.00 C ATOM 41 CZ TYR A 3 -16.847 7.048 6.711 1.00 0.00 C ATOM 42 OH TYR A 3 -16.706 8.401 6.942 1.00 0.00 O ATOM 0 H TYR A 3 -15.738 3.095 8.529 1.00 0.00 H new ATOM 0 HA TYR A 3 -16.237 1.006 6.496 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -17.239 2.619 4.915 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -18.248 2.475 6.340 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -17.635 4.158 8.328 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -16.592 4.760 4.204 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -17.387 6.591 8.746 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -16.343 7.191 4.622 1.00 0.00 H new ATOM 0 HH TYR A 3 -16.447 8.850 6.110 1.00 0.00 H new ATOM 52 N ALA A 4 -14.496 2.365 4.961 1.00 0.00 N ATOM 53 CA ALA A 4 -13.194 2.845 4.416 1.00 0.00 C ATOM 54 C ALA A 4 -13.415 4.161 3.671 1.00 0.00 C ATOM 55 O ALA A 4 -14.489 4.428 3.169 1.00 0.00 O ATOM 56 CB ALA A 4 -12.625 1.801 3.451 1.00 0.00 C ATOM 0 H ALA A 4 -15.090 1.872 4.294 1.00 0.00 H new ATOM 0 HA ALA A 4 -12.491 3.000 5.234 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -11.673 2.153 3.053 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -12.471 0.861 3.981 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -13.325 1.644 2.630 1.00 0.00 H new ATOM 62 N ARG A 5 -12.410 4.989 3.597 1.00 0.00 N ATOM 63 CA ARG A 5 -12.574 6.287 2.888 1.00 0.00 C ATOM 64 C ARG A 5 -12.310 6.104 1.388 1.00 0.00 C ATOM 65 O ARG A 5 -12.849 6.833 0.580 1.00 0.00 O ATOM 66 CB ARG A 5 -11.593 7.317 3.457 1.00 0.00 C ATOM 67 CG ARG A 5 -11.820 8.666 2.771 1.00 0.00 C ATOM 68 CD ARG A 5 -11.682 9.791 3.797 1.00 0.00 C ATOM 69 NE ARG A 5 -12.759 10.798 3.580 1.00 0.00 N ATOM 70 CZ ARG A 5 -13.020 11.683 4.503 1.00 0.00 C ATOM 71 NH1 ARG A 5 -13.111 11.313 5.751 1.00 0.00 N ATOM 72 NH2 ARG A 5 -13.184 12.936 4.179 1.00 0.00 N ATOM 0 H ARG A 5 -11.486 4.823 3.995 1.00 0.00 H new ATOM 0 HA ARG A 5 -13.595 6.640 3.032 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -11.735 7.415 4.533 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -10.567 6.984 3.300 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -11.097 8.803 1.967 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -12.811 8.693 2.317 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -11.746 9.386 4.807 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -10.704 10.263 3.705 1.00 0.00 H new ATOM 0 HE ARG A 5 -13.292 10.796 2.710 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -12.978 10.334 6.004 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -13.315 12.003 6.474 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -13.108 13.225 3.204 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -13.388 13.627 4.901 1.00 0.00 H new ATOM 86 N PRO A 6 -11.487 5.141 1.058 1.00 0.00 N ATOM 87 CA PRO A 6 -11.207 4.943 -0.383 1.00 0.00 C ATOM 88 C PRO A 6 -11.975 3.741 -0.944 1.00 0.00 C ATOM 89 O PRO A 6 -12.602 2.991 -0.221 1.00 0.00 O ATOM 90 CB PRO A 6 -9.704 4.695 -0.452 1.00 0.00 C ATOM 91 CG PRO A 6 -9.282 4.190 0.939 1.00 0.00 C ATOM 92 CD PRO A 6 -10.383 4.632 1.916 1.00 0.00 C ATOM 0 HA PRO A 6 -11.519 5.802 -0.976 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -9.467 3.959 -1.221 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -9.171 5.610 -0.711 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -9.174 3.105 0.942 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -8.317 4.607 1.227 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -10.717 3.799 2.535 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -10.021 5.406 2.592 1.00 0.00 H new ATOM 100 N GLY A 7 -11.923 3.560 -2.238 1.00 0.00 N ATOM 101 CA GLY A 7 -12.636 2.417 -2.877 1.00 0.00 C ATOM 102 C GLY A 7 -12.177 2.291 -4.334 1.00 0.00 C ATOM 103 O GLY A 7 -11.183 2.866 -4.729 1.00 0.00 O ATOM 0 H GLY A 7 -11.412 4.161 -2.884 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -12.428 1.494 -2.336 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -13.714 2.575 -2.835 1.00 0.00 H new ATOM 107 N GLY A 8 -12.891 1.548 -5.139 1.00 0.00 N ATOM 108 CA GLY A 8 -12.486 1.396 -6.569 1.00 0.00 C ATOM 109 C GLY A 8 -13.145 0.147 -7.169 1.00 0.00 C ATOM 110 O GLY A 8 -14.211 -0.261 -6.751 1.00 0.00 O ATOM 0 H GLY A 8 -13.734 1.041 -4.870 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -12.780 2.280 -7.135 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -11.401 1.316 -6.642 1.00 0.00 H new ATOM 114 N GLU A 9 -12.527 -0.461 -8.152 1.00 0.00 N ATOM 115 CA GLU A 9 -13.137 -1.677 -8.772 1.00 0.00 C ATOM 116 C GLU A 9 -12.117 -2.383 -9.681 1.00 0.00 C ATOM 117 O GLU A 9 -11.389 -1.752 -10.422 1.00 0.00 O ATOM 118 CB GLU A 9 -14.351 -1.260 -9.608 1.00 0.00 C ATOM 119 CG GLU A 9 -15.638 -1.600 -8.853 1.00 0.00 C ATOM 120 CD GLU A 9 -16.137 -2.979 -9.288 1.00 0.00 C ATOM 121 OE1 GLU A 9 -15.499 -3.956 -8.933 1.00 0.00 O ATOM 122 OE2 GLU A 9 -17.147 -3.032 -9.969 1.00 0.00 O ATOM 0 H GLU A 9 -11.634 -0.170 -8.549 1.00 0.00 H new ATOM 0 HA GLU A 9 -13.442 -2.363 -7.982 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -14.312 -0.191 -9.816 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -14.336 -1.773 -10.570 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -15.455 -1.590 -7.779 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -16.399 -0.846 -9.053 1.00 0.00 H new ATOM 129 N SER A 10 -12.072 -3.692 -9.634 1.00 0.00 N ATOM 130 CA SER A 10 -11.113 -4.451 -10.497 1.00 0.00 C ATOM 131 C SER A 10 -9.732 -3.801 -10.439 1.00 0.00 C ATOM 132 O SER A 10 -9.496 -2.894 -9.666 1.00 0.00 O ATOM 133 CB SER A 10 -11.610 -4.450 -11.942 1.00 0.00 C ATOM 134 OG SER A 10 -12.467 -3.334 -12.143 1.00 0.00 O ATOM 0 H SER A 10 -12.660 -4.270 -9.033 1.00 0.00 H new ATOM 0 HA SER A 10 -11.045 -5.476 -10.133 1.00 0.00 H new ATOM 0 HB2 SER A 10 -10.765 -4.403 -12.629 1.00 0.00 H new ATOM 0 HB3 SER A 10 -12.144 -5.376 -12.156 1.00 0.00 H new ATOM 0 HG SER A 10 -12.001 -2.512 -11.882 1.00 0.00 H new ATOM 140 N ILE A 11 -8.811 -4.254 -11.252 1.00 0.00 N ATOM 141 CA ILE A 11 -7.454 -3.645 -11.229 1.00 0.00 C ATOM 142 C ILE A 11 -7.506 -2.304 -11.956 1.00 0.00 C ATOM 143 O ILE A 11 -7.185 -2.200 -13.123 1.00 0.00 O ATOM 144 CB ILE A 11 -6.416 -4.581 -11.880 1.00 0.00 C ATOM 145 CG1 ILE A 11 -6.785 -6.061 -11.580 1.00 0.00 C ATOM 146 CG2 ILE A 11 -5.021 -4.250 -11.315 1.00 0.00 C ATOM 147 CD1 ILE A 11 -5.705 -6.749 -10.718 1.00 0.00 C ATOM 0 H ILE A 11 -8.941 -5.011 -11.923 1.00 0.00 H new ATOM 0 HA ILE A 11 -7.145 -3.489 -10.195 1.00 0.00 H new ATOM 0 HB ILE A 11 -6.410 -4.438 -12.961 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.744 -6.101 -11.064 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -6.905 -6.604 -12.517 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -4.279 -4.907 -11.769 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -4.774 -3.213 -11.541 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -5.022 -4.396 -10.235 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.995 -7.782 -10.527 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -4.752 -6.731 -11.247 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -5.604 -6.220 -9.770 1.00 0.00 H new ATOM 159 N LYS A 12 -7.932 -1.273 -11.268 1.00 0.00 N ATOM 160 CA LYS A 12 -8.031 0.063 -11.913 1.00 0.00 C ATOM 161 C LYS A 12 -7.573 1.167 -10.954 1.00 0.00 C ATOM 162 O LYS A 12 -6.508 1.730 -11.116 1.00 0.00 O ATOM 163 CB LYS A 12 -9.480 0.313 -12.330 1.00 0.00 C ATOM 164 CG LYS A 12 -10.060 -0.966 -12.938 1.00 0.00 C ATOM 165 CD LYS A 12 -9.349 -1.270 -14.260 1.00 0.00 C ATOM 166 CE LYS A 12 -10.256 -0.876 -15.428 1.00 0.00 C ATOM 167 NZ LYS A 12 -10.150 0.591 -15.664 1.00 0.00 N ATOM 0 H LYS A 12 -8.214 -1.304 -10.288 1.00 0.00 H new ATOM 0 HA LYS A 12 -7.382 0.079 -12.789 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -10.071 0.619 -11.467 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -9.527 1.127 -13.054 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -9.936 -1.799 -12.246 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -11.130 -0.848 -13.107 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -8.409 -0.721 -14.314 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -9.103 -2.330 -14.318 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -9.968 -1.422 -16.327 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -11.289 -1.146 -15.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -10.568 0.825 -16.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -10.659 1.101 -14.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -9.149 0.872 -15.656 1.00 0.00 H new ATOM 181 N ASP A 13 -8.364 1.506 -9.968 1.00 0.00 N ATOM 182 CA ASP A 13 -7.937 2.600 -9.043 1.00 0.00 C ATOM 183 C ASP A 13 -8.407 2.350 -7.603 1.00 0.00 C ATOM 184 O ASP A 13 -9.417 2.863 -7.162 1.00 0.00 O ATOM 185 CB ASP A 13 -8.511 3.930 -9.539 1.00 0.00 C ATOM 186 CG ASP A 13 -7.997 5.073 -8.660 1.00 0.00 C ATOM 187 OD1 ASP A 13 -7.921 4.881 -7.459 1.00 0.00 O ATOM 188 OD2 ASP A 13 -7.690 6.120 -9.206 1.00 0.00 O ATOM 0 H ASP A 13 -9.270 1.083 -9.765 1.00 0.00 H new ATOM 0 HA ASP A 13 -6.847 2.629 -9.038 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -8.222 4.098 -10.576 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -9.600 3.900 -9.513 1.00 0.00 H new ATOM 193 N THR A 14 -7.646 1.590 -6.872 1.00 0.00 N ATOM 194 CA THR A 14 -7.968 1.297 -5.443 1.00 0.00 C ATOM 195 C THR A 14 -6.674 0.783 -4.800 1.00 0.00 C ATOM 196 O THR A 14 -6.667 -0.118 -3.991 1.00 0.00 O ATOM 197 CB THR A 14 -9.105 0.256 -5.338 1.00 0.00 C ATOM 198 OG1 THR A 14 -8.771 -0.740 -4.386 1.00 0.00 O ATOM 199 CG2 THR A 14 -9.367 -0.404 -6.696 1.00 0.00 C ATOM 0 H THR A 14 -6.792 1.147 -7.210 1.00 0.00 H new ATOM 0 HA THR A 14 -8.323 2.189 -4.928 1.00 0.00 H new ATOM 0 HB THR A 14 -10.009 0.775 -5.019 1.00 0.00 H new ATOM 0 HG1 THR A 14 -8.128 -0.375 -3.743 1.00 0.00 H new ATOM 0 HG21 THR A 14 -10.171 -1.133 -6.597 1.00 0.00 H new ATOM 0 HG22 THR A 14 -9.654 0.357 -7.421 1.00 0.00 H new ATOM 0 HG23 THR A 14 -8.462 -0.907 -7.037 1.00 0.00 H new ATOM 207 N ASN A 15 -5.564 1.361 -5.182 1.00 0.00 N ATOM 208 CA ASN A 15 -4.251 0.906 -4.644 1.00 0.00 C ATOM 209 C ASN A 15 -4.067 1.393 -3.209 1.00 0.00 C ATOM 210 O ASN A 15 -4.969 1.933 -2.600 1.00 0.00 O ATOM 211 CB ASN A 15 -3.131 1.477 -5.514 1.00 0.00 C ATOM 212 CG ASN A 15 -3.413 2.952 -5.797 1.00 0.00 C ATOM 213 OD1 ASN A 15 -3.786 3.313 -6.894 1.00 0.00 O ATOM 214 ND2 ASN A 15 -3.248 3.827 -4.843 1.00 0.00 N ATOM 0 H ASN A 15 -5.513 2.133 -5.847 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.220 -0.184 -4.655 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -2.171 1.369 -5.009 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -3.063 0.922 -6.450 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -3.433 4.815 -5.019 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -2.935 3.523 -3.921 1.00 0.00 H new ATOM 221 N LEU A 16 -2.909 1.167 -2.660 1.00 0.00 N ATOM 222 CA LEU A 16 -2.653 1.569 -1.250 1.00 0.00 C ATOM 223 C LEU A 16 -1.706 2.765 -1.193 1.00 0.00 C ATOM 224 O LEU A 16 -0.592 2.716 -1.676 1.00 0.00 O ATOM 225 CB LEU A 16 -1.990 0.385 -0.529 1.00 0.00 C ATOM 226 CG LEU A 16 -2.622 0.087 0.845 1.00 0.00 C ATOM 227 CD1 LEU A 16 -4.093 0.505 0.885 1.00 0.00 C ATOM 228 CD2 LEU A 16 -2.551 -1.414 1.097 1.00 0.00 C ATOM 0 H LEU A 16 -2.123 0.718 -3.130 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.596 1.845 -0.778 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -2.063 -0.503 -1.157 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.929 0.595 -0.397 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.075 0.648 1.603 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.508 0.281 1.868 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -4.173 1.575 0.693 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.648 -0.043 0.123 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -2.995 -1.642 2.066 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -3.098 -1.941 0.315 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.509 -1.735 1.090 1.00 0.00 H new ATOM 240 N TYR A 17 -2.128 3.826 -0.566 1.00 0.00 N ATOM 241 CA TYR A 17 -1.239 5.009 -0.430 1.00 0.00 C ATOM 242 C TYR A 17 -0.459 4.844 0.872 1.00 0.00 C ATOM 243 O TYR A 17 -0.939 5.175 1.937 1.00 0.00 O ATOM 244 CB TYR A 17 -2.086 6.280 -0.372 1.00 0.00 C ATOM 245 CG TYR A 17 -1.200 7.470 -0.096 1.00 0.00 C ATOM 246 CD1 TYR A 17 0.045 7.575 -0.725 1.00 0.00 C ATOM 247 CD2 TYR A 17 -1.626 8.468 0.788 1.00 0.00 C ATOM 248 CE1 TYR A 17 0.866 8.680 -0.471 1.00 0.00 C ATOM 249 CE2 TYR A 17 -0.806 9.574 1.042 1.00 0.00 C ATOM 250 CZ TYR A 17 0.440 9.680 0.413 1.00 0.00 C ATOM 251 OH TYR A 17 1.248 10.771 0.663 1.00 0.00 O ATOM 0 H TYR A 17 -3.051 3.924 -0.142 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.558 5.086 -1.278 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -2.615 6.419 -1.315 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -2.842 6.189 0.408 1.00 0.00 H new ATOM 0 HD1 TYR A 17 0.373 6.804 -1.406 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -2.587 8.385 1.274 1.00 0.00 H new ATOM 0 HE1 TYR A 17 1.827 8.762 -0.956 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -1.135 10.345 1.723 1.00 0.00 H new ATOM 0 HH TYR A 17 0.802 11.370 1.298 1.00 0.00 H new ATOM 261 N VAL A 18 0.728 4.301 0.806 1.00 0.00 N ATOM 262 CA VAL A 18 1.501 4.086 2.060 1.00 0.00 C ATOM 263 C VAL A 18 2.398 5.290 2.348 1.00 0.00 C ATOM 264 O VAL A 18 3.125 5.763 1.500 1.00 0.00 O ATOM 265 CB VAL A 18 2.341 2.813 1.931 1.00 0.00 C ATOM 266 CG1 VAL A 18 1.421 1.638 1.593 1.00 0.00 C ATOM 267 CG2 VAL A 18 3.378 2.980 0.820 1.00 0.00 C ATOM 0 H VAL A 18 1.190 4.001 -0.052 1.00 0.00 H new ATOM 0 HA VAL A 18 0.806 3.973 2.892 1.00 0.00 H new ATOM 0 HB VAL A 18 2.856 2.624 2.873 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.013 0.728 1.500 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.685 1.512 2.387 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.909 1.836 0.651 1.00 0.00 H new ATOM 0 HG21 VAL A 18 3.971 2.069 0.736 1.00 0.00 H new ATOM 0 HG22 VAL A 18 2.871 3.171 -0.126 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.033 3.819 1.057 1.00 0.00 H new ATOM 277 N THR A 19 2.346 5.793 3.550 1.00 0.00 N ATOM 278 CA THR A 19 3.194 6.966 3.901 1.00 0.00 C ATOM 279 C THR A 19 4.006 6.652 5.161 1.00 0.00 C ATOM 280 O THR A 19 3.968 5.553 5.676 1.00 0.00 O ATOM 281 CB THR A 19 2.304 8.185 4.157 1.00 0.00 C ATOM 282 OG1 THR A 19 1.672 8.051 5.422 1.00 0.00 O ATOM 283 CG2 THR A 19 1.242 8.284 3.060 1.00 0.00 C ATOM 0 H THR A 19 1.754 5.443 4.303 1.00 0.00 H new ATOM 0 HA THR A 19 3.873 7.181 3.076 1.00 0.00 H new ATOM 0 HB THR A 19 2.914 9.088 4.150 1.00 0.00 H new ATOM 0 HG1 THR A 19 1.103 8.832 5.588 1.00 0.00 H new ATOM 0 HG21 THR A 19 0.609 9.152 3.244 1.00 0.00 H new ATOM 0 HG22 THR A 19 1.729 8.388 2.090 1.00 0.00 H new ATOM 0 HG23 THR A 19 0.630 7.382 3.063 1.00 0.00 H new ATOM 291 N ASN A 20 4.742 7.607 5.660 1.00 0.00 N ATOM 292 CA ASN A 20 5.555 7.358 6.884 1.00 0.00 C ATOM 293 C ASN A 20 6.463 6.149 6.660 1.00 0.00 C ATOM 294 O ASN A 20 6.266 5.100 7.239 1.00 0.00 O ATOM 295 CB ASN A 20 4.621 7.070 8.062 1.00 0.00 C ATOM 296 CG ASN A 20 5.151 7.767 9.317 1.00 0.00 C ATOM 297 OD1 ASN A 20 4.393 8.112 10.202 1.00 0.00 O ATOM 298 ND2 ASN A 20 6.432 7.989 9.432 1.00 0.00 N ATOM 0 H ASN A 20 4.816 8.548 5.274 1.00 0.00 H new ATOM 0 HA ASN A 20 6.163 8.237 7.099 1.00 0.00 H new ATOM 0 HB2 ASN A 20 3.614 7.421 7.836 1.00 0.00 H new ATOM 0 HB3 ASN A 20 4.553 5.995 8.231 1.00 0.00 H new ATOM 0 HD21 ASN A 20 6.797 8.452 10.265 1.00 0.00 H new ATOM 0 HD22 ASN A 20 7.068 7.700 8.689 1.00 0.00 H new ATOM 305 N LEU A 21 7.457 6.282 5.825 1.00 0.00 N ATOM 306 CA LEU A 21 8.369 5.130 5.575 1.00 0.00 C ATOM 307 C LEU A 21 9.430 5.522 4.542 1.00 0.00 C ATOM 308 O LEU A 21 9.192 6.357 3.693 1.00 0.00 O ATOM 309 CB LEU A 21 7.555 3.948 5.041 1.00 0.00 C ATOM 310 CG LEU A 21 7.022 4.284 3.647 1.00 0.00 C ATOM 311 CD1 LEU A 21 8.032 3.830 2.592 1.00 0.00 C ATOM 312 CD2 LEU A 21 5.692 3.562 3.425 1.00 0.00 C ATOM 0 H LEU A 21 7.676 7.133 5.308 1.00 0.00 H new ATOM 0 HA LEU A 21 8.860 4.850 6.507 1.00 0.00 H new ATOM 0 HB2 LEU A 21 8.177 3.054 4.998 1.00 0.00 H new ATOM 0 HB3 LEU A 21 6.727 3.728 5.715 1.00 0.00 H new ATOM 0 HG LEU A 21 6.870 5.360 3.564 1.00 0.00 H new ATOM 0 HD11 LEU A 21 7.653 4.069 1.598 1.00 0.00 H new ATOM 0 HD12 LEU A 21 8.980 4.343 2.752 1.00 0.00 H new ATOM 0 HD13 LEU A 21 8.184 2.754 2.673 1.00 0.00 H new ATOM 0 HD21 LEU A 21 5.310 3.800 2.432 1.00 0.00 H new ATOM 0 HD22 LEU A 21 5.844 2.486 3.507 1.00 0.00 H new ATOM 0 HD23 LEU A 21 4.973 3.885 4.177 1.00 0.00 H new ATOM 324 N PRO A 22 10.571 4.894 4.650 1.00 0.00 N ATOM 325 CA PRO A 22 11.654 5.201 3.690 1.00 0.00 C ATOM 326 C PRO A 22 11.876 4.012 2.752 1.00 0.00 C ATOM 327 O PRO A 22 11.100 3.077 2.727 1.00 0.00 O ATOM 328 CB PRO A 22 12.886 5.435 4.564 1.00 0.00 C ATOM 329 CG PRO A 22 12.615 4.705 5.893 1.00 0.00 C ATOM 330 CD PRO A 22 11.092 4.520 5.986 1.00 0.00 C ATOM 0 HA PRO A 22 11.427 6.062 3.061 1.00 0.00 H new ATOM 0 HB2 PRO A 22 13.784 5.047 4.083 1.00 0.00 H new ATOM 0 HB3 PRO A 22 13.048 6.500 4.731 1.00 0.00 H new ATOM 0 HG2 PRO A 22 13.125 3.742 5.918 1.00 0.00 H new ATOM 0 HG3 PRO A 22 12.988 5.285 6.737 1.00 0.00 H new ATOM 0 HD2 PRO A 22 10.835 3.490 6.234 1.00 0.00 H new ATOM 0 HD3 PRO A 22 10.666 5.152 6.765 1.00 0.00 H new ATOM 338 N ARG A 23 12.927 4.041 1.983 1.00 0.00 N ATOM 339 CA ARG A 23 13.196 2.912 1.049 1.00 0.00 C ATOM 340 C ARG A 23 14.004 1.831 1.772 1.00 0.00 C ATOM 341 O ARG A 23 14.923 1.258 1.221 1.00 0.00 O ATOM 342 CB ARG A 23 13.991 3.423 -0.154 1.00 0.00 C ATOM 343 CG ARG A 23 13.084 4.286 -1.034 1.00 0.00 C ATOM 344 CD ARG A 23 13.915 5.382 -1.704 1.00 0.00 C ATOM 345 NE ARG A 23 13.516 5.505 -3.134 1.00 0.00 N ATOM 346 CZ ARG A 23 14.377 5.926 -4.018 1.00 0.00 C ATOM 347 NH1 ARG A 23 14.662 7.198 -4.099 1.00 0.00 N ATOM 348 NH2 ARG A 23 14.956 5.077 -4.822 1.00 0.00 N ATOM 0 H ARG A 23 13.612 4.797 1.960 1.00 0.00 H new ATOM 0 HA ARG A 23 12.250 2.491 0.708 1.00 0.00 H new ATOM 0 HB2 ARG A 23 14.849 4.005 0.184 1.00 0.00 H new ATOM 0 HB3 ARG A 23 14.382 2.583 -0.729 1.00 0.00 H new ATOM 0 HG2 ARG A 23 12.599 3.669 -1.790 1.00 0.00 H new ATOM 0 HG3 ARG A 23 12.293 4.732 -0.432 1.00 0.00 H new ATOM 0 HD2 ARG A 23 13.765 6.332 -1.191 1.00 0.00 H new ATOM 0 HD3 ARG A 23 14.976 5.144 -1.631 1.00 0.00 H new ATOM 0 HE ARG A 23 12.569 5.260 -3.422 1.00 0.00 H new ATOM 0 HH11 ARG A 23 14.211 7.863 -3.470 1.00 0.00 H new ATOM 0 HH12 ARG A 23 15.336 7.527 -4.791 1.00 0.00 H new ATOM 0 HH21 ARG A 23 14.735 4.083 -4.759 1.00 0.00 H new ATOM 0 HH22 ARG A 23 15.629 5.407 -5.513 1.00 0.00 H new ATOM 362 N THR A 24 13.667 1.544 3.000 1.00 0.00 N ATOM 363 CA THR A 24 14.413 0.495 3.753 1.00 0.00 C ATOM 364 C THR A 24 13.897 -0.884 3.339 1.00 0.00 C ATOM 365 O THR A 24 14.617 -1.861 3.364 1.00 0.00 O ATOM 366 CB THR A 24 14.191 0.694 5.254 1.00 0.00 C ATOM 367 OG1 THR A 24 14.709 -0.424 5.962 1.00 0.00 O ATOM 368 CG2 THR A 24 12.695 0.827 5.535 1.00 0.00 C ATOM 0 H THR A 24 12.908 1.990 3.514 1.00 0.00 H new ATOM 0 HA THR A 24 15.478 0.569 3.531 1.00 0.00 H new ATOM 0 HB THR A 24 14.703 1.599 5.580 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.568 -0.296 6.923 1.00 0.00 H new ATOM 0 HG21 THR A 24 12.537 0.969 6.604 1.00 0.00 H new ATOM 0 HG22 THR A 24 12.298 1.685 4.993 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.182 -0.078 5.209 1.00 0.00 H new ATOM 376 N ILE A 25 12.651 -0.967 2.957 1.00 0.00 N ATOM 377 CA ILE A 25 12.084 -2.278 2.537 1.00 0.00 C ATOM 378 C ILE A 25 11.871 -2.275 1.024 1.00 0.00 C ATOM 379 O ILE A 25 11.846 -1.237 0.394 1.00 0.00 O ATOM 380 CB ILE A 25 10.742 -2.503 3.238 1.00 0.00 C ATOM 381 CG1 ILE A 25 9.767 -1.391 2.844 1.00 0.00 C ATOM 382 CG2 ILE A 25 10.947 -2.486 4.753 1.00 0.00 C ATOM 383 CD1 ILE A 25 8.346 -1.793 3.242 1.00 0.00 C ATOM 0 H ILE A 25 12.001 -0.182 2.918 1.00 0.00 H new ATOM 0 HA ILE A 25 12.774 -3.077 2.809 1.00 0.00 H new ATOM 0 HB ILE A 25 10.334 -3.468 2.937 1.00 0.00 H new ATOM 0 HG12 ILE A 25 10.044 -0.459 3.336 1.00 0.00 H new ATOM 0 HG13 ILE A 25 9.818 -1.212 1.770 1.00 0.00 H new ATOM 0 HG21 ILE A 25 9.991 -2.646 5.251 1.00 0.00 H new ATOM 0 HG22 ILE A 25 11.641 -3.278 5.035 1.00 0.00 H new ATOM 0 HG23 ILE A 25 11.356 -1.521 5.054 1.00 0.00 H new ATOM 0 HD11 ILE A 25 7.652 -1.001 2.961 1.00 0.00 H new ATOM 0 HD12 ILE A 25 8.071 -2.715 2.729 1.00 0.00 H new ATOM 0 HD13 ILE A 25 8.301 -1.950 4.320 1.00 0.00 H new ATOM 395 N THR A 26 11.718 -3.427 0.433 1.00 0.00 N ATOM 396 CA THR A 26 11.508 -3.478 -1.039 1.00 0.00 C ATOM 397 C THR A 26 10.021 -3.671 -1.343 1.00 0.00 C ATOM 398 O THR A 26 9.340 -4.470 -0.721 1.00 0.00 O ATOM 399 CB THR A 26 12.303 -4.645 -1.635 1.00 0.00 C ATOM 400 OG1 THR A 26 11.493 -5.812 -1.642 1.00 0.00 O ATOM 401 CG2 THR A 26 13.557 -4.898 -0.799 1.00 0.00 C ATOM 0 H THR A 26 11.729 -4.332 0.904 1.00 0.00 H new ATOM 0 HA THR A 26 11.850 -2.542 -1.480 1.00 0.00 H new ATOM 0 HB THR A 26 12.597 -4.398 -2.655 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.751 -6.385 -2.394 1.00 0.00 H new ATOM 0 HG21 THR A 26 14.118 -5.729 -1.227 1.00 0.00 H new ATOM 0 HG22 THR A 26 14.179 -4.003 -0.796 1.00 0.00 H new ATOM 0 HG23 THR A 26 13.269 -5.143 0.223 1.00 0.00 H new ATOM 409 N ASP A 27 9.508 -2.951 -2.301 1.00 0.00 N ATOM 410 CA ASP A 27 8.073 -3.108 -2.646 1.00 0.00 C ATOM 411 C ASP A 27 7.847 -4.544 -3.118 1.00 0.00 C ATOM 412 O ASP A 27 6.937 -5.217 -2.684 1.00 0.00 O ATOM 413 CB ASP A 27 7.695 -2.125 -3.761 1.00 0.00 C ATOM 414 CG ASP A 27 8.378 -2.536 -5.067 1.00 0.00 C ATOM 415 OD1 ASP A 27 9.497 -2.103 -5.289 1.00 0.00 O ATOM 416 OD2 ASP A 27 7.769 -3.275 -5.823 1.00 0.00 O ATOM 0 H ASP A 27 10.019 -2.265 -2.856 1.00 0.00 H new ATOM 0 HA ASP A 27 7.452 -2.899 -1.775 1.00 0.00 H new ATOM 0 HB2 ASP A 27 6.613 -2.110 -3.894 1.00 0.00 H new ATOM 0 HB3 ASP A 27 7.996 -1.114 -3.485 1.00 0.00 H new ATOM 421 N ASP A 28 8.684 -5.025 -3.994 1.00 0.00 N ATOM 422 CA ASP A 28 8.526 -6.419 -4.483 1.00 0.00 C ATOM 423 C ASP A 28 8.488 -7.375 -3.288 1.00 0.00 C ATOM 424 O ASP A 28 8.017 -8.490 -3.389 1.00 0.00 O ATOM 425 CB ASP A 28 9.706 -6.775 -5.388 1.00 0.00 C ATOM 426 CG ASP A 28 9.344 -7.984 -6.251 1.00 0.00 C ATOM 427 OD1 ASP A 28 8.170 -8.149 -6.540 1.00 0.00 O ATOM 428 OD2 ASP A 28 10.245 -8.724 -6.608 1.00 0.00 O ATOM 0 H ASP A 28 9.470 -4.511 -4.392 1.00 0.00 H new ATOM 0 HA ASP A 28 7.597 -6.507 -5.047 1.00 0.00 H new ATOM 0 HB2 ASP A 28 9.960 -5.926 -6.022 1.00 0.00 H new ATOM 0 HB3 ASP A 28 10.586 -6.997 -4.785 1.00 0.00 H new ATOM 433 N GLN A 29 8.976 -6.947 -2.155 1.00 0.00 N ATOM 434 CA GLN A 29 8.962 -7.836 -0.961 1.00 0.00 C ATOM 435 C GLN A 29 7.556 -7.874 -0.369 1.00 0.00 C ATOM 436 O GLN A 29 6.990 -8.931 -0.176 1.00 0.00 O ATOM 437 CB GLN A 29 9.948 -7.322 0.091 1.00 0.00 C ATOM 438 CG GLN A 29 11.244 -8.128 0.014 1.00 0.00 C ATOM 439 CD GLN A 29 12.221 -7.629 1.078 1.00 0.00 C ATOM 440 OE1 GLN A 29 12.183 -6.476 1.462 1.00 0.00 O ATOM 441 NE2 GLN A 29 13.100 -8.454 1.576 1.00 0.00 N ATOM 0 H GLN A 29 9.382 -6.023 -2.006 1.00 0.00 H new ATOM 0 HA GLN A 29 9.258 -8.841 -1.263 1.00 0.00 H new ATOM 0 HB2 GLN A 29 10.155 -6.265 -0.075 1.00 0.00 H new ATOM 0 HB3 GLN A 29 9.512 -7.409 1.086 1.00 0.00 H new ATOM 0 HG2 GLN A 29 11.035 -9.187 0.165 1.00 0.00 H new ATOM 0 HG3 GLN A 29 11.688 -8.029 -0.977 1.00 0.00 H new ATOM 0 HE21 GLN A 29 13.132 -9.421 1.254 1.00 0.00 H new ATOM 0 HE22 GLN A 29 13.756 -8.132 2.288 1.00 0.00 H new ATOM 450 N LEU A 30 6.981 -6.735 -0.087 1.00 0.00 N ATOM 451 CA LEU A 30 5.600 -6.738 0.483 1.00 0.00 C ATOM 452 C LEU A 30 4.749 -7.729 -0.306 1.00 0.00 C ATOM 453 O LEU A 30 3.897 -8.383 0.242 1.00 0.00 O ATOM 454 CB LEU A 30 4.991 -5.333 0.402 1.00 0.00 C ATOM 455 CG LEU A 30 5.170 -4.613 1.747 1.00 0.00 C ATOM 456 CD1 LEU A 30 6.609 -4.793 2.238 1.00 0.00 C ATOM 457 CD2 LEU A 30 4.879 -3.121 1.566 1.00 0.00 C ATOM 0 H LEU A 30 7.399 -5.815 -0.224 1.00 0.00 H new ATOM 0 HA LEU A 30 5.634 -7.034 1.531 1.00 0.00 H new ATOM 0 HB2 LEU A 30 5.472 -4.763 -0.393 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.932 -5.399 0.152 1.00 0.00 H new ATOM 0 HG LEU A 30 4.481 -5.035 2.479 1.00 0.00 H new ATOM 0 HD11 LEU A 30 6.734 -4.282 3.192 1.00 0.00 H new ATOM 0 HD12 LEU A 30 6.820 -5.855 2.365 1.00 0.00 H new ATOM 0 HD13 LEU A 30 7.298 -4.371 1.507 1.00 0.00 H new ATOM 0 HD21 LEU A 30 5.005 -2.607 2.519 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.569 -2.702 0.834 1.00 0.00 H new ATOM 0 HD23 LEU A 30 3.855 -2.990 1.216 1.00 0.00 H new ATOM 469 N ASP A 31 4.990 -7.864 -1.583 1.00 0.00 N ATOM 470 CA ASP A 31 4.195 -8.831 -2.394 1.00 0.00 C ATOM 471 C ASP A 31 4.192 -10.190 -1.695 1.00 0.00 C ATOM 472 O ASP A 31 3.166 -10.683 -1.275 1.00 0.00 O ATOM 473 CB ASP A 31 4.827 -8.975 -3.778 1.00 0.00 C ATOM 474 CG ASP A 31 4.093 -10.064 -4.565 1.00 0.00 C ATOM 475 OD1 ASP A 31 4.215 -11.220 -4.193 1.00 0.00 O ATOM 476 OD2 ASP A 31 3.422 -9.725 -5.524 1.00 0.00 O ATOM 0 H ASP A 31 5.702 -7.347 -2.099 1.00 0.00 H new ATOM 0 HA ASP A 31 3.172 -8.468 -2.497 1.00 0.00 H new ATOM 0 HB2 ASP A 31 4.775 -8.027 -4.313 1.00 0.00 H new ATOM 0 HB3 ASP A 31 5.883 -9.230 -3.683 1.00 0.00 H new ATOM 481 N THR A 32 5.337 -10.798 -1.564 1.00 0.00 N ATOM 482 CA THR A 32 5.401 -12.118 -0.884 1.00 0.00 C ATOM 483 C THR A 32 4.987 -11.943 0.578 1.00 0.00 C ATOM 484 O THR A 32 4.710 -12.898 1.276 1.00 0.00 O ATOM 485 CB THR A 32 6.833 -12.656 -0.958 1.00 0.00 C ATOM 486 OG1 THR A 32 7.096 -13.114 -2.276 1.00 0.00 O ATOM 487 CG2 THR A 32 7.002 -13.812 0.029 1.00 0.00 C ATOM 0 H THR A 32 6.230 -10.437 -1.899 1.00 0.00 H new ATOM 0 HA THR A 32 4.728 -12.823 -1.371 1.00 0.00 H new ATOM 0 HB THR A 32 7.532 -11.860 -0.701 1.00 0.00 H new ATOM 0 HG1 THR A 32 8.013 -13.457 -2.326 1.00 0.00 H new ATOM 0 HG21 THR A 32 8.022 -14.192 -0.027 1.00 0.00 H new ATOM 0 HG22 THR A 32 6.801 -13.459 1.041 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.303 -14.610 -0.222 1.00 0.00 H new ATOM 495 N ILE A 33 4.952 -10.725 1.046 1.00 0.00 N ATOM 496 CA ILE A 33 4.565 -10.478 2.462 1.00 0.00 C ATOM 497 C ILE A 33 3.035 -10.534 2.609 1.00 0.00 C ATOM 498 O ILE A 33 2.523 -10.780 3.682 1.00 0.00 O ATOM 499 CB ILE A 33 5.124 -9.109 2.912 1.00 0.00 C ATOM 500 CG1 ILE A 33 5.799 -9.271 4.277 1.00 0.00 C ATOM 501 CG2 ILE A 33 4.015 -8.048 3.020 1.00 0.00 C ATOM 502 CD1 ILE A 33 7.308 -9.442 4.085 1.00 0.00 C ATOM 0 H ILE A 33 5.176 -9.889 0.506 1.00 0.00 H new ATOM 0 HA ILE A 33 4.988 -11.253 3.102 1.00 0.00 H new ATOM 0 HB ILE A 33 5.841 -8.772 2.163 1.00 0.00 H new ATOM 0 HG12 ILE A 33 5.598 -8.399 4.900 1.00 0.00 H new ATOM 0 HG13 ILE A 33 5.388 -10.136 4.797 1.00 0.00 H new ATOM 0 HG21 ILE A 33 4.448 -7.100 3.339 1.00 0.00 H new ATOM 0 HG22 ILE A 33 3.538 -7.920 2.048 1.00 0.00 H new ATOM 0 HG23 ILE A 33 3.272 -8.371 3.749 1.00 0.00 H new ATOM 0 HD11 ILE A 33 7.788 -9.557 5.057 1.00 0.00 H new ATOM 0 HD12 ILE A 33 7.500 -10.327 3.479 1.00 0.00 H new ATOM 0 HD13 ILE A 33 7.713 -8.563 3.583 1.00 0.00 H new ATOM 514 N PHE A 34 2.297 -10.312 1.548 1.00 0.00 N ATOM 515 CA PHE A 34 0.809 -10.363 1.672 1.00 0.00 C ATOM 516 C PHE A 34 0.166 -10.812 0.353 1.00 0.00 C ATOM 517 O PHE A 34 -0.905 -10.364 -0.007 1.00 0.00 O ATOM 518 CB PHE A 34 0.276 -8.978 2.078 1.00 0.00 C ATOM 519 CG PHE A 34 0.079 -8.098 0.863 1.00 0.00 C ATOM 520 CD1 PHE A 34 1.091 -7.976 -0.089 1.00 0.00 C ATOM 521 CD2 PHE A 34 -1.117 -7.395 0.701 1.00 0.00 C ATOM 522 CE1 PHE A 34 0.908 -7.149 -1.204 1.00 0.00 C ATOM 523 CE2 PHE A 34 -1.304 -6.575 -0.415 1.00 0.00 C ATOM 524 CZ PHE A 34 -0.291 -6.449 -1.366 1.00 0.00 C ATOM 0 H PHE A 34 2.654 -10.101 0.616 1.00 0.00 H new ATOM 0 HA PHE A 34 0.548 -11.090 2.441 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -0.670 -9.089 2.609 1.00 0.00 H new ATOM 0 HB3 PHE A 34 0.974 -8.503 2.767 1.00 0.00 H new ATOM 0 HD1 PHE A 34 2.016 -8.520 0.034 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -1.899 -7.485 1.440 1.00 0.00 H new ATOM 0 HE1 PHE A 34 1.693 -7.052 -1.939 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -2.233 -6.039 -0.541 1.00 0.00 H new ATOM 0 HZ PHE A 34 -0.433 -5.812 -2.226 1.00 0.00 H new ATOM 534 N GLY A 35 0.799 -11.696 -0.365 1.00 0.00 N ATOM 535 CA GLY A 35 0.208 -12.169 -1.650 1.00 0.00 C ATOM 536 C GLY A 35 -0.709 -13.365 -1.382 1.00 0.00 C ATOM 537 O GLY A 35 -0.519 -14.436 -1.924 1.00 0.00 O ATOM 0 H GLY A 35 1.698 -12.111 -0.120 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -0.356 -11.364 -2.121 1.00 0.00 H new ATOM 0 HA3 GLY A 35 0.999 -12.453 -2.344 1.00 0.00 H new ATOM 541 N LYS A 36 -1.699 -13.196 -0.545 1.00 0.00 N ATOM 542 CA LYS A 36 -2.618 -14.331 -0.244 1.00 0.00 C ATOM 543 C LYS A 36 -4.083 -13.881 -0.346 1.00 0.00 C ATOM 544 O LYS A 36 -4.987 -14.690 -0.293 1.00 0.00 O ATOM 545 CB LYS A 36 -2.342 -14.843 1.172 1.00 0.00 C ATOM 546 CG LYS A 36 -1.021 -15.614 1.190 1.00 0.00 C ATOM 547 CD LYS A 36 -1.308 -17.118 1.226 1.00 0.00 C ATOM 548 CE LYS A 36 -0.020 -17.879 1.550 1.00 0.00 C ATOM 549 NZ LYS A 36 0.263 -17.783 3.010 1.00 0.00 N ATOM 0 H LYS A 36 -1.910 -12.324 -0.059 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.444 -15.126 -0.969 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -2.296 -14.007 1.870 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -3.156 -15.489 1.501 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -0.431 -15.367 0.307 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -0.431 -15.325 2.059 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -2.069 -17.335 1.975 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -1.704 -17.446 0.265 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.119 -18.924 1.256 1.00 0.00 H new ATOM 0 HE3 LYS A 36 0.812 -17.465 0.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 1.000 -18.470 3.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 0.590 -16.823 3.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -0.604 -17.989 3.546 1.00 0.00 H new ATOM 563 N TYR A 37 -4.333 -12.605 -0.488 1.00 0.00 N ATOM 564 CA TYR A 37 -5.752 -12.135 -0.586 1.00 0.00 C ATOM 565 C TYR A 37 -5.997 -11.531 -1.969 1.00 0.00 C ATOM 566 O TYR A 37 -6.560 -10.462 -2.095 1.00 0.00 O ATOM 567 CB TYR A 37 -6.054 -11.069 0.482 1.00 0.00 C ATOM 568 CG TYR A 37 -4.886 -10.921 1.426 1.00 0.00 C ATOM 569 CD1 TYR A 37 -4.384 -12.039 2.101 1.00 0.00 C ATOM 570 CD2 TYR A 37 -4.303 -9.665 1.620 1.00 0.00 C ATOM 571 CE1 TYR A 37 -3.298 -11.898 2.970 1.00 0.00 C ATOM 572 CE2 TYR A 37 -3.214 -9.526 2.484 1.00 0.00 C ATOM 573 CZ TYR A 37 -2.713 -10.643 3.158 1.00 0.00 C ATOM 574 OH TYR A 37 -1.635 -10.509 3.997 1.00 0.00 O ATOM 0 H TYR A 37 -3.625 -11.872 -0.540 1.00 0.00 H new ATOM 0 HA TYR A 37 -6.406 -12.992 -0.425 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -6.264 -10.114 0.001 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -6.947 -11.348 1.040 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -4.835 -13.009 1.951 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -4.695 -8.802 1.102 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -2.911 -12.759 3.496 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -2.760 -8.557 2.631 1.00 0.00 H new ATOM 0 HH TYR A 37 -1.118 -11.342 4.001 1.00 0.00 H new ATOM 584 N GLY A 38 -5.585 -12.202 -3.009 1.00 0.00 N ATOM 585 CA GLY A 38 -5.803 -11.654 -4.378 1.00 0.00 C ATOM 586 C GLY A 38 -4.462 -11.524 -5.098 1.00 0.00 C ATOM 587 O GLY A 38 -3.412 -11.704 -4.514 1.00 0.00 O ATOM 0 H GLY A 38 -5.108 -13.103 -2.971 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -6.468 -12.309 -4.941 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.291 -10.681 -4.318 1.00 0.00 H new ATOM 591 N SER A 39 -4.490 -11.212 -6.363 1.00 0.00 N ATOM 592 CA SER A 39 -3.218 -11.069 -7.121 1.00 0.00 C ATOM 593 C SER A 39 -2.752 -9.612 -7.068 1.00 0.00 C ATOM 594 O SER A 39 -3.170 -8.797 -7.864 1.00 0.00 O ATOM 595 CB SER A 39 -3.442 -11.479 -8.577 1.00 0.00 C ATOM 596 OG SER A 39 -3.294 -12.888 -8.696 1.00 0.00 O ATOM 0 H SER A 39 -5.339 -11.050 -6.904 1.00 0.00 H new ATOM 0 HA SER A 39 -2.457 -11.710 -6.676 1.00 0.00 H new ATOM 0 HB2 SER A 39 -4.438 -11.177 -8.903 1.00 0.00 H new ATOM 0 HB3 SER A 39 -2.727 -10.971 -9.224 1.00 0.00 H new ATOM 0 HG SER A 39 -3.439 -13.155 -9.628 1.00 0.00 H new ATOM 602 N ILE A 40 -1.903 -9.290 -6.119 1.00 0.00 N ATOM 603 CA ILE A 40 -1.392 -7.880 -5.971 1.00 0.00 C ATOM 604 C ILE A 40 -1.363 -7.173 -7.348 1.00 0.00 C ATOM 605 O ILE A 40 -1.150 -7.794 -8.372 1.00 0.00 O ATOM 606 CB ILE A 40 0.010 -7.875 -5.331 1.00 0.00 C ATOM 607 CG1 ILE A 40 0.368 -9.240 -4.713 1.00 0.00 C ATOM 608 CG2 ILE A 40 0.028 -6.829 -4.235 1.00 0.00 C ATOM 609 CD1 ILE A 40 -0.399 -9.450 -3.395 1.00 0.00 C ATOM 0 H ILE A 40 -1.536 -9.948 -5.432 1.00 0.00 H new ATOM 0 HA ILE A 40 -2.069 -7.334 -5.314 1.00 0.00 H new ATOM 0 HB ILE A 40 0.741 -7.657 -6.110 1.00 0.00 H new ATOM 0 HG12 ILE A 40 0.125 -10.039 -5.414 1.00 0.00 H new ATOM 0 HG13 ILE A 40 1.441 -9.293 -4.529 1.00 0.00 H new ATOM 0 HG21 ILE A 40 1.013 -6.808 -3.768 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.191 -5.851 -4.662 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -0.724 -7.074 -3.485 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -0.135 -10.419 -2.971 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -0.135 -8.661 -2.691 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -1.471 -9.419 -3.589 1.00 0.00 H new ATOM 621 N VAL A 41 -1.666 -5.891 -7.378 1.00 0.00 N ATOM 622 CA VAL A 41 -1.766 -5.141 -8.692 1.00 0.00 C ATOM 623 C VAL A 41 -0.588 -4.174 -9.025 1.00 0.00 C ATOM 624 O VAL A 41 -0.807 -3.038 -9.395 1.00 0.00 O ATOM 625 CB VAL A 41 -3.075 -4.341 -8.660 1.00 0.00 C ATOM 626 CG1 VAL A 41 -4.125 -5.127 -7.873 1.00 0.00 C ATOM 627 CG2 VAL A 41 -2.884 -2.981 -7.975 1.00 0.00 C ATOM 0 H VAL A 41 -1.850 -5.325 -6.550 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.729 -5.895 -9.478 1.00 0.00 H new ATOM 0 HB VAL A 41 -3.394 -4.178 -9.689 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.058 -4.563 -7.847 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.296 -6.089 -8.355 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -3.771 -5.289 -6.855 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.830 -2.440 -7.969 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -2.548 -3.134 -6.950 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -2.138 -2.401 -8.519 1.00 0.00 H new ATOM 637 N GLN A 42 0.634 -4.622 -8.948 1.00 0.00 N ATOM 638 CA GLN A 42 1.821 -3.747 -9.316 1.00 0.00 C ATOM 639 C GLN A 42 2.308 -2.870 -8.139 1.00 0.00 C ATOM 640 O GLN A 42 1.810 -1.785 -7.914 1.00 0.00 O ATOM 641 CB GLN A 42 1.446 -2.837 -10.491 1.00 0.00 C ATOM 642 CG GLN A 42 2.683 -2.579 -11.355 1.00 0.00 C ATOM 643 CD GLN A 42 2.513 -3.261 -12.714 1.00 0.00 C ATOM 644 OE1 GLN A 42 2.311 -4.456 -12.785 1.00 0.00 O ATOM 645 NE2 GLN A 42 2.588 -2.546 -13.804 1.00 0.00 N ATOM 0 H GLN A 42 0.880 -5.564 -8.645 1.00 0.00 H new ATOM 0 HA GLN A 42 2.636 -4.418 -9.587 1.00 0.00 H new ATOM 0 HB2 GLN A 42 0.663 -3.303 -11.089 1.00 0.00 H new ATOM 0 HB3 GLN A 42 1.046 -1.893 -10.120 1.00 0.00 H new ATOM 0 HG2 GLN A 42 2.827 -1.507 -11.491 1.00 0.00 H new ATOM 0 HG3 GLN A 42 3.574 -2.959 -10.855 1.00 0.00 H new ATOM 0 HE21 GLN A 42 2.758 -1.542 -13.745 1.00 0.00 H new ATOM 0 HE22 GLN A 42 2.477 -2.992 -14.715 1.00 0.00 H new ATOM 654 N LYS A 43 3.304 -3.323 -7.412 1.00 0.00 N ATOM 655 CA LYS A 43 3.853 -2.516 -6.265 1.00 0.00 C ATOM 656 C LYS A 43 4.825 -1.458 -6.798 1.00 0.00 C ATOM 657 O LYS A 43 5.848 -1.776 -7.370 1.00 0.00 O ATOM 658 CB LYS A 43 4.610 -3.452 -5.317 1.00 0.00 C ATOM 659 CG LYS A 43 3.883 -3.514 -3.969 1.00 0.00 C ATOM 660 CD LYS A 43 4.500 -4.613 -3.101 1.00 0.00 C ATOM 661 CE LYS A 43 3.387 -5.381 -2.384 1.00 0.00 C ATOM 662 NZ LYS A 43 2.491 -4.426 -1.677 1.00 0.00 N ATOM 0 H LYS A 43 3.764 -4.221 -7.562 1.00 0.00 H new ATOM 0 HA LYS A 43 3.034 -2.027 -5.739 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.678 -4.449 -5.751 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.630 -3.096 -5.176 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.955 -2.552 -3.461 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.823 -3.713 -4.125 1.00 0.00 H new ATOM 0 HD2 LYS A 43 5.086 -5.293 -3.719 1.00 0.00 H new ATOM 0 HD3 LYS A 43 5.183 -4.176 -2.372 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.815 -5.966 -3.104 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.818 -6.085 -1.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 1.690 -4.944 -1.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 3.021 -3.947 -0.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 2.135 -3.720 -2.352 1.00 0.00 H new ATOM 676 N ASN A 44 4.522 -0.201 -6.609 1.00 0.00 N ATOM 677 CA ASN A 44 5.440 0.870 -7.098 1.00 0.00 C ATOM 678 C ASN A 44 5.861 1.743 -5.913 1.00 0.00 C ATOM 679 O ASN A 44 5.152 1.848 -4.935 1.00 0.00 O ATOM 680 CB ASN A 44 4.721 1.731 -8.140 1.00 0.00 C ATOM 681 CG ASN A 44 5.733 2.645 -8.837 1.00 0.00 C ATOM 682 OD1 ASN A 44 6.210 3.597 -8.254 1.00 0.00 O ATOM 683 ND2 ASN A 44 6.081 2.393 -10.070 1.00 0.00 N ATOM 0 H ASN A 44 3.680 0.130 -6.138 1.00 0.00 H new ATOM 0 HA ASN A 44 6.320 0.418 -7.556 1.00 0.00 H new ATOM 0 HB2 ASN A 44 4.225 1.095 -8.873 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.946 2.329 -7.661 1.00 0.00 H new ATOM 0 HD21 ASN A 44 6.754 2.996 -10.543 1.00 0.00 H new ATOM 0 HD22 ASN A 44 5.680 1.593 -10.560 1.00 0.00 H new ATOM 690 N ILE A 45 7.006 2.366 -5.985 1.00 0.00 N ATOM 691 CA ILE A 45 7.460 3.222 -4.848 1.00 0.00 C ATOM 692 C ILE A 45 7.902 4.591 -5.373 1.00 0.00 C ATOM 693 O ILE A 45 8.217 4.747 -6.535 1.00 0.00 O ATOM 694 CB ILE A 45 8.638 2.546 -4.143 1.00 0.00 C ATOM 695 CG1 ILE A 45 9.651 2.073 -5.189 1.00 0.00 C ATOM 696 CG2 ILE A 45 8.137 1.344 -3.342 1.00 0.00 C ATOM 697 CD1 ILE A 45 10.984 1.764 -4.506 1.00 0.00 C ATOM 0 H ILE A 45 7.646 2.321 -6.778 1.00 0.00 H new ATOM 0 HA ILE A 45 6.637 3.354 -4.146 1.00 0.00 H new ATOM 0 HB ILE A 45 9.113 3.258 -3.468 1.00 0.00 H new ATOM 0 HG12 ILE A 45 9.276 1.185 -5.698 1.00 0.00 H new ATOM 0 HG13 ILE A 45 9.790 2.841 -5.950 1.00 0.00 H new ATOM 0 HG21 ILE A 45 8.978 0.865 -2.841 1.00 0.00 H new ATOM 0 HG22 ILE A 45 7.414 1.678 -2.598 1.00 0.00 H new ATOM 0 HG23 ILE A 45 7.661 0.631 -4.015 1.00 0.00 H new ATOM 0 HD11 ILE A 45 11.705 1.427 -5.251 1.00 0.00 H new ATOM 0 HD12 ILE A 45 11.360 2.663 -4.018 1.00 0.00 H new ATOM 0 HD13 ILE A 45 10.839 0.981 -3.762 1.00 0.00 H new ATOM 709 N LEU A 46 7.929 5.587 -4.524 1.00 0.00 N ATOM 710 CA LEU A 46 8.353 6.940 -4.983 1.00 0.00 C ATOM 711 C LEU A 46 8.839 7.766 -3.788 1.00 0.00 C ATOM 712 O LEU A 46 8.183 7.852 -2.767 1.00 0.00 O ATOM 713 CB LEU A 46 7.171 7.651 -5.648 1.00 0.00 C ATOM 714 CG LEU A 46 5.860 7.172 -5.021 1.00 0.00 C ATOM 715 CD1 LEU A 46 4.940 8.370 -4.785 1.00 0.00 C ATOM 716 CD2 LEU A 46 5.176 6.184 -5.969 1.00 0.00 C ATOM 0 H LEU A 46 7.677 5.520 -3.538 1.00 0.00 H new ATOM 0 HA LEU A 46 9.166 6.835 -5.702 1.00 0.00 H new ATOM 0 HB2 LEU A 46 7.269 8.730 -5.528 1.00 0.00 H new ATOM 0 HB3 LEU A 46 7.168 7.448 -6.719 1.00 0.00 H new ATOM 0 HG LEU A 46 6.069 6.682 -4.070 1.00 0.00 H new ATOM 0 HD11 LEU A 46 4.006 8.029 -4.338 1.00 0.00 H new ATOM 0 HD12 LEU A 46 5.427 9.076 -4.113 1.00 0.00 H new ATOM 0 HD13 LEU A 46 4.730 8.860 -5.736 1.00 0.00 H new ATOM 0 HD21 LEU A 46 4.242 5.841 -5.525 1.00 0.00 H new ATOM 0 HD22 LEU A 46 4.967 6.676 -6.919 1.00 0.00 H new ATOM 0 HD23 LEU A 46 5.832 5.330 -6.139 1.00 0.00 H new ATOM 728 N ARG A 47 9.988 8.377 -3.910 1.00 0.00 N ATOM 729 CA ARG A 47 10.526 9.201 -2.790 1.00 0.00 C ATOM 730 C ARG A 47 10.228 10.681 -3.055 1.00 0.00 C ATOM 731 O ARG A 47 10.173 11.487 -2.147 1.00 0.00 O ATOM 732 CB ARG A 47 12.041 8.997 -2.689 1.00 0.00 C ATOM 733 CG ARG A 47 12.507 9.307 -1.265 1.00 0.00 C ATOM 734 CD ARG A 47 13.450 10.511 -1.286 1.00 0.00 C ATOM 735 NE ARG A 47 14.124 10.637 0.036 1.00 0.00 N ATOM 736 CZ ARG A 47 14.126 11.784 0.662 1.00 0.00 C ATOM 737 NH1 ARG A 47 14.874 12.762 0.229 1.00 0.00 N ATOM 738 NH2 ARG A 47 13.378 11.951 1.719 1.00 0.00 N ATOM 0 H ARG A 47 10.579 8.340 -4.741 1.00 0.00 H new ATOM 0 HA ARG A 47 10.054 8.897 -1.856 1.00 0.00 H new ATOM 0 HB2 ARG A 47 12.298 7.971 -2.951 1.00 0.00 H new ATOM 0 HB3 ARG A 47 12.554 9.646 -3.399 1.00 0.00 H new ATOM 0 HG2 ARG A 47 11.648 9.516 -0.628 1.00 0.00 H new ATOM 0 HG3 ARG A 47 13.015 8.441 -0.841 1.00 0.00 H new ATOM 0 HD2 ARG A 47 14.193 10.391 -2.075 1.00 0.00 H new ATOM 0 HD3 ARG A 47 12.892 11.420 -1.510 1.00 0.00 H new ATOM 0 HE ARG A 47 14.584 9.828 0.453 1.00 0.00 H new ATOM 0 HH11 ARG A 47 15.457 12.631 -0.598 1.00 0.00 H new ATOM 0 HH12 ARG A 47 14.876 13.657 0.717 1.00 0.00 H new ATOM 0 HH21 ARG A 47 12.793 11.186 2.056 1.00 0.00 H new ATOM 0 HH22 ARG A 47 13.379 12.846 2.208 1.00 0.00 H new ATOM 752 N ASP A 48 10.033 11.042 -4.295 1.00 0.00 N ATOM 753 CA ASP A 48 9.736 12.467 -4.622 1.00 0.00 C ATOM 754 C ASP A 48 8.926 12.524 -5.920 1.00 0.00 C ATOM 755 O ASP A 48 8.793 11.541 -6.621 1.00 0.00 O ATOM 756 CB ASP A 48 11.046 13.238 -4.801 1.00 0.00 C ATOM 757 CG ASP A 48 10.776 14.740 -4.693 1.00 0.00 C ATOM 758 OD1 ASP A 48 9.822 15.104 -4.024 1.00 0.00 O ATOM 759 OD2 ASP A 48 11.527 15.501 -5.280 1.00 0.00 O ATOM 0 H ASP A 48 10.067 10.411 -5.096 1.00 0.00 H new ATOM 0 HA ASP A 48 9.164 12.918 -3.811 1.00 0.00 H new ATOM 0 HB2 ASP A 48 11.766 12.932 -4.042 1.00 0.00 H new ATOM 0 HB3 ASP A 48 11.487 13.006 -5.771 1.00 0.00 H new ATOM 764 N LYS A 49 8.377 13.664 -6.247 1.00 0.00 N ATOM 765 CA LYS A 49 7.577 13.767 -7.500 1.00 0.00 C ATOM 766 C LYS A 49 7.138 15.217 -7.719 1.00 0.00 C ATOM 767 O LYS A 49 6.067 15.479 -8.230 1.00 0.00 O ATOM 768 CB LYS A 49 6.341 12.872 -7.385 1.00 0.00 C ATOM 769 CG LYS A 49 5.545 13.263 -6.139 1.00 0.00 C ATOM 770 CD LYS A 49 4.185 12.563 -6.163 1.00 0.00 C ATOM 771 CE LYS A 49 3.128 13.484 -5.550 1.00 0.00 C ATOM 772 NZ LYS A 49 1.779 13.084 -6.041 1.00 0.00 N ATOM 0 H LYS A 49 8.448 14.524 -5.703 1.00 0.00 H new ATOM 0 HA LYS A 49 8.187 13.446 -8.345 1.00 0.00 H new ATOM 0 HB2 LYS A 49 5.719 12.975 -8.274 1.00 0.00 H new ATOM 0 HB3 LYS A 49 6.640 11.826 -7.325 1.00 0.00 H new ATOM 0 HG2 LYS A 49 6.095 12.983 -5.240 1.00 0.00 H new ATOM 0 HG3 LYS A 49 5.409 14.344 -6.105 1.00 0.00 H new ATOM 0 HD2 LYS A 49 3.912 12.310 -7.187 1.00 0.00 H new ATOM 0 HD3 LYS A 49 4.235 11.628 -5.606 1.00 0.00 H new ATOM 0 HE2 LYS A 49 3.164 13.424 -4.462 1.00 0.00 H new ATOM 0 HE3 LYS A 49 3.333 14.520 -5.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 1.059 13.709 -5.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.749 13.163 -7.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 1.586 12.101 -5.763 1.00 0.00 H new ATOM 786 N LEU A 50 7.955 16.160 -7.339 1.00 0.00 N ATOM 787 CA LEU A 50 7.580 17.591 -7.530 1.00 0.00 C ATOM 788 C LEU A 50 8.839 18.460 -7.485 1.00 0.00 C ATOM 789 O LEU A 50 9.291 18.967 -8.491 1.00 0.00 O ATOM 790 CB LEU A 50 6.624 18.021 -6.415 1.00 0.00 C ATOM 791 CG LEU A 50 6.123 19.438 -6.692 1.00 0.00 C ATOM 792 CD1 LEU A 50 5.635 19.536 -8.139 1.00 0.00 C ATOM 793 CD2 LEU A 50 4.968 19.760 -5.741 1.00 0.00 C ATOM 0 H LEU A 50 8.865 16.003 -6.905 1.00 0.00 H new ATOM 0 HA LEU A 50 7.090 17.712 -8.496 1.00 0.00 H new ATOM 0 HB2 LEU A 50 5.782 17.331 -6.357 1.00 0.00 H new ATOM 0 HB3 LEU A 50 7.132 17.985 -5.452 1.00 0.00 H new ATOM 0 HG LEU A 50 6.935 20.149 -6.536 1.00 0.00 H new ATOM 0 HD11 LEU A 50 5.278 20.547 -8.335 1.00 0.00 H new ATOM 0 HD12 LEU A 50 6.457 19.304 -8.817 1.00 0.00 H new ATOM 0 HD13 LEU A 50 4.822 18.827 -8.298 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.608 20.770 -5.935 1.00 0.00 H new ATOM 0 HD22 LEU A 50 4.157 19.049 -5.899 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.315 19.691 -4.710 1.00 0.00 H new ATOM 805 N THR A 51 9.408 18.634 -6.323 1.00 0.00 N ATOM 806 CA THR A 51 10.638 19.467 -6.212 1.00 0.00 C ATOM 807 C THR A 51 11.655 18.753 -5.322 1.00 0.00 C ATOM 808 O THR A 51 12.750 18.436 -5.744 1.00 0.00 O ATOM 809 CB THR A 51 10.283 20.823 -5.595 1.00 0.00 C ATOM 810 OG1 THR A 51 8.871 20.945 -5.500 1.00 0.00 O ATOM 811 CG2 THR A 51 10.837 21.946 -6.473 1.00 0.00 C ATOM 0 H THR A 51 9.074 18.235 -5.446 1.00 0.00 H new ATOM 0 HA THR A 51 11.065 19.620 -7.203 1.00 0.00 H new ATOM 0 HB THR A 51 10.721 20.894 -4.599 1.00 0.00 H new ATOM 0 HG1 THR A 51 8.643 21.812 -5.104 1.00 0.00 H new ATOM 0 HG21 THR A 51 10.584 22.911 -6.033 1.00 0.00 H new ATOM 0 HG22 THR A 51 11.921 21.852 -6.543 1.00 0.00 H new ATOM 0 HG23 THR A 51 10.402 21.877 -7.470 1.00 0.00 H new ATOM 819 N GLY A 52 11.302 18.494 -4.093 1.00 0.00 N ATOM 820 CA GLY A 52 12.247 17.798 -3.176 1.00 0.00 C ATOM 821 C GLY A 52 11.721 17.879 -1.743 1.00 0.00 C ATOM 822 O GLY A 52 12.069 18.769 -0.992 1.00 0.00 O ATOM 0 H GLY A 52 10.399 18.735 -3.684 1.00 0.00 H new ATOM 0 HA2 GLY A 52 12.359 16.756 -3.475 1.00 0.00 H new ATOM 0 HA3 GLY A 52 13.234 18.256 -3.239 1.00 0.00 H new ATOM 826 N ARG A 53 10.881 16.958 -1.359 1.00 0.00 N ATOM 827 CA ARG A 53 10.331 16.983 0.026 1.00 0.00 C ATOM 828 C ARG A 53 10.857 15.776 0.805 1.00 0.00 C ATOM 829 O ARG A 53 11.559 14.945 0.265 1.00 0.00 O ATOM 830 CB ARG A 53 8.803 16.926 -0.032 1.00 0.00 C ATOM 831 CG ARG A 53 8.231 18.335 0.127 1.00 0.00 C ATOM 832 CD ARG A 53 6.710 18.255 0.255 1.00 0.00 C ATOM 833 NE ARG A 53 6.231 19.323 1.177 1.00 0.00 N ATOM 834 CZ ARG A 53 6.571 19.299 2.438 1.00 0.00 C ATOM 835 NH1 ARG A 53 6.284 18.259 3.172 1.00 0.00 N ATOM 836 NH2 ARG A 53 7.198 20.315 2.963 1.00 0.00 N ATOM 0 H ARG A 53 10.552 16.190 -1.944 1.00 0.00 H new ATOM 0 HA ARG A 53 10.642 17.901 0.525 1.00 0.00 H new ATOM 0 HB2 ARG A 53 8.481 16.497 -0.981 1.00 0.00 H new ATOM 0 HB3 ARG A 53 8.423 16.277 0.757 1.00 0.00 H new ATOM 0 HG2 ARG A 53 8.656 18.814 1.009 1.00 0.00 H new ATOM 0 HG3 ARG A 53 8.503 18.949 -0.732 1.00 0.00 H new ATOM 0 HD2 ARG A 53 6.246 18.370 -0.724 1.00 0.00 H new ATOM 0 HD3 ARG A 53 6.417 17.275 0.633 1.00 0.00 H new ATOM 0 HE ARG A 53 5.637 20.073 0.823 1.00 0.00 H new ATOM 0 HH11 ARG A 53 5.794 17.464 2.761 1.00 0.00 H new ATOM 0 HH12 ARG A 53 6.550 18.241 4.157 1.00 0.00 H new ATOM 0 HH21 ARG A 53 7.423 21.128 2.389 1.00 0.00 H new ATOM 0 HH22 ARG A 53 7.464 20.297 3.948 1.00 0.00 H new ATOM 850 N PRO A 54 10.490 15.722 2.056 1.00 0.00 N ATOM 851 CA PRO A 54 10.943 14.592 2.893 1.00 0.00 C ATOM 852 C PRO A 54 9.771 13.650 3.178 1.00 0.00 C ATOM 853 O PRO A 54 9.758 12.939 4.163 1.00 0.00 O ATOM 854 CB PRO A 54 11.438 15.245 4.183 1.00 0.00 C ATOM 855 CG PRO A 54 10.737 16.613 4.268 1.00 0.00 C ATOM 856 CD PRO A 54 10.276 16.960 2.843 1.00 0.00 C ATOM 0 HA PRO A 54 11.718 13.995 2.413 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.196 14.629 5.049 1.00 0.00 H new ATOM 0 HB3 PRO A 54 12.522 15.363 4.169 1.00 0.00 H new ATOM 0 HG2 PRO A 54 9.888 16.572 4.950 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.417 17.374 4.651 1.00 0.00 H new ATOM 0 HD2 PRO A 54 9.228 17.260 2.830 1.00 0.00 H new ATOM 0 HD3 PRO A 54 10.850 17.791 2.434 1.00 0.00 H new ATOM 864 N ARG A 55 8.786 13.643 2.323 1.00 0.00 N ATOM 865 CA ARG A 55 7.614 12.752 2.545 1.00 0.00 C ATOM 866 C ARG A 55 8.031 11.297 2.328 1.00 0.00 C ATOM 867 O ARG A 55 7.840 10.454 3.182 1.00 0.00 O ATOM 868 CB ARG A 55 6.501 13.113 1.560 1.00 0.00 C ATOM 869 CG ARG A 55 5.141 12.862 2.214 1.00 0.00 C ATOM 870 CD ARG A 55 4.268 14.111 2.072 1.00 0.00 C ATOM 871 NE ARG A 55 3.500 14.325 3.328 1.00 0.00 N ATOM 872 CZ ARG A 55 4.038 14.978 4.322 1.00 0.00 C ATOM 873 NH1 ARG A 55 4.848 14.366 5.142 1.00 0.00 N ATOM 874 NH2 ARG A 55 3.767 16.242 4.494 1.00 0.00 N ATOM 0 H ARG A 55 8.742 14.216 1.480 1.00 0.00 H new ATOM 0 HA ARG A 55 7.252 12.880 3.565 1.00 0.00 H new ATOM 0 HB2 ARG A 55 6.587 14.159 1.265 1.00 0.00 H new ATOM 0 HB3 ARG A 55 6.596 12.517 0.653 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.652 12.008 1.745 1.00 0.00 H new ATOM 0 HG3 ARG A 55 5.272 12.615 3.267 1.00 0.00 H new ATOM 0 HD2 ARG A 55 4.890 14.981 1.861 1.00 0.00 H new ATOM 0 HD3 ARG A 55 3.585 13.996 1.230 1.00 0.00 H new ATOM 0 HE ARG A 55 2.551 13.961 3.413 1.00 0.00 H new ATOM 0 HH11 ARG A 55 5.061 13.378 5.006 1.00 0.00 H new ATOM 0 HH12 ARG A 55 5.269 14.876 5.919 1.00 0.00 H new ATOM 0 HH21 ARG A 55 3.135 16.720 3.852 1.00 0.00 H new ATOM 0 HH22 ARG A 55 4.187 16.753 5.271 1.00 0.00 H new ATOM 888 N GLY A 56 8.592 10.991 1.192 1.00 0.00 N ATOM 889 CA GLY A 56 9.008 9.586 0.928 1.00 0.00 C ATOM 890 C GLY A 56 7.807 8.669 1.146 1.00 0.00 C ATOM 891 O GLY A 56 7.527 8.247 2.251 1.00 0.00 O ATOM 0 H GLY A 56 8.780 11.651 0.437 1.00 0.00 H new ATOM 0 HA2 GLY A 56 9.378 9.487 -0.092 1.00 0.00 H new ATOM 0 HA3 GLY A 56 9.825 9.303 1.592 1.00 0.00 H new ATOM 895 N VAL A 57 7.082 8.367 0.105 1.00 0.00 N ATOM 896 CA VAL A 57 5.891 7.489 0.268 1.00 0.00 C ATOM 897 C VAL A 57 5.947 6.338 -0.735 1.00 0.00 C ATOM 898 O VAL A 57 6.550 6.438 -1.787 1.00 0.00 O ATOM 899 CB VAL A 57 4.624 8.309 0.028 1.00 0.00 C ATOM 900 CG1 VAL A 57 4.282 9.105 1.289 1.00 0.00 C ATOM 901 CG2 VAL A 57 4.856 9.276 -1.136 1.00 0.00 C ATOM 0 H VAL A 57 7.262 8.688 -0.846 1.00 0.00 H new ATOM 0 HA VAL A 57 5.883 7.081 1.279 1.00 0.00 H new ATOM 0 HB VAL A 57 3.799 7.639 -0.213 1.00 0.00 H new ATOM 0 HG11 VAL A 57 3.378 9.689 1.116 1.00 0.00 H new ATOM 0 HG12 VAL A 57 4.117 8.418 2.119 1.00 0.00 H new ATOM 0 HG13 VAL A 57 5.107 9.775 1.531 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.953 9.861 -1.308 1.00 0.00 H new ATOM 0 HG22 VAL A 57 5.682 9.945 -0.894 1.00 0.00 H new ATOM 0 HG23 VAL A 57 5.099 8.711 -2.036 1.00 0.00 H new ATOM 911 N ALA A 58 5.313 5.242 -0.419 1.00 0.00 N ATOM 912 CA ALA A 58 5.318 4.083 -1.350 1.00 0.00 C ATOM 913 C ALA A 58 3.900 3.848 -1.875 1.00 0.00 C ATOM 914 O ALA A 58 2.956 4.511 -1.484 1.00 0.00 O ATOM 915 CB ALA A 58 5.806 2.834 -0.613 1.00 0.00 C ATOM 0 H ALA A 58 4.791 5.101 0.446 1.00 0.00 H new ATOM 0 HA ALA A 58 5.986 4.291 -2.186 1.00 0.00 H new ATOM 0 HB1 ALA A 58 5.809 1.986 -1.297 1.00 0.00 H new ATOM 0 HB2 ALA A 58 6.816 3.003 -0.240 1.00 0.00 H new ATOM 0 HB3 ALA A 58 5.141 2.623 0.224 1.00 0.00 H new ATOM 921 N PHE A 59 3.743 2.905 -2.758 1.00 0.00 N ATOM 922 CA PHE A 59 2.393 2.620 -3.313 1.00 0.00 C ATOM 923 C PHE A 59 2.195 1.108 -3.422 1.00 0.00 C ATOM 924 O PHE A 59 2.730 0.467 -4.305 1.00 0.00 O ATOM 925 CB PHE A 59 2.272 3.241 -4.708 1.00 0.00 C ATOM 926 CG PHE A 59 1.656 4.617 -4.607 1.00 0.00 C ATOM 927 CD1 PHE A 59 2.439 5.709 -4.212 1.00 0.00 C ATOM 928 CD2 PHE A 59 0.302 4.802 -4.914 1.00 0.00 C ATOM 929 CE1 PHE A 59 1.868 6.985 -4.123 1.00 0.00 C ATOM 930 CE2 PHE A 59 -0.269 6.078 -4.824 1.00 0.00 C ATOM 931 CZ PHE A 59 0.514 7.169 -4.429 1.00 0.00 C ATOM 0 H PHE A 59 4.494 2.317 -3.121 1.00 0.00 H new ATOM 0 HA PHE A 59 1.636 3.044 -2.654 1.00 0.00 H new ATOM 0 HB2 PHE A 59 3.256 3.307 -5.173 1.00 0.00 H new ATOM 0 HB3 PHE A 59 1.659 2.605 -5.347 1.00 0.00 H new ATOM 0 HD1 PHE A 59 3.483 5.567 -3.976 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -0.302 3.961 -5.220 1.00 0.00 H new ATOM 0 HE1 PHE A 59 2.472 7.827 -3.818 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -1.313 6.220 -5.059 1.00 0.00 H new ATOM 0 HZ PHE A 59 0.074 8.153 -4.360 1.00 0.00 H new ATOM 941 N VAL A 60 1.418 0.531 -2.547 1.00 0.00 N ATOM 942 CA VAL A 60 1.182 -0.938 -2.627 1.00 0.00 C ATOM 943 C VAL A 60 0.151 -1.187 -3.714 1.00 0.00 C ATOM 944 O VAL A 60 -0.616 -0.320 -4.083 1.00 0.00 O ATOM 945 CB VAL A 60 0.664 -1.466 -1.263 1.00 0.00 C ATOM 946 CG1 VAL A 60 -0.459 -2.505 -1.448 1.00 0.00 C ATOM 947 CG2 VAL A 60 1.807 -2.121 -0.489 1.00 0.00 C ATOM 0 H VAL A 60 0.939 1.010 -1.784 1.00 0.00 H new ATOM 0 HA VAL A 60 2.109 -1.461 -2.863 1.00 0.00 H new ATOM 0 HB VAL A 60 0.269 -0.613 -0.712 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.797 -2.853 -0.472 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.294 -2.048 -1.980 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -0.081 -3.350 -2.023 1.00 0.00 H new ATOM 0 HG21 VAL A 60 1.435 -2.489 0.467 1.00 0.00 H new ATOM 0 HG22 VAL A 60 2.208 -2.954 -1.067 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.595 -1.388 -0.314 1.00 0.00 H new ATOM 957 N ARG A 61 0.147 -2.367 -4.232 1.00 0.00 N ATOM 958 CA ARG A 61 -0.803 -2.709 -5.304 1.00 0.00 C ATOM 959 C ARG A 61 -1.932 -3.561 -4.743 1.00 0.00 C ATOM 960 O ARG A 61 -1.773 -4.730 -4.477 1.00 0.00 O ATOM 961 CB ARG A 61 -0.061 -3.499 -6.368 1.00 0.00 C ATOM 962 CG ARG A 61 1.138 -4.227 -5.754 1.00 0.00 C ATOM 963 CD ARG A 61 1.496 -5.441 -6.594 1.00 0.00 C ATOM 964 NE ARG A 61 2.400 -6.337 -5.823 1.00 0.00 N ATOM 965 CZ ARG A 61 3.257 -7.091 -6.453 1.00 0.00 C ATOM 966 NH1 ARG A 61 2.840 -7.961 -7.332 1.00 0.00 N ATOM 967 NH2 ARG A 61 4.532 -6.971 -6.211 1.00 0.00 N ATOM 0 H ARG A 61 0.773 -3.123 -3.954 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.224 -1.798 -5.730 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -0.735 -4.220 -6.830 1.00 0.00 H new ATOM 0 HB3 ARG A 61 0.278 -2.828 -7.158 1.00 0.00 H new ATOM 0 HG2 ARG A 61 1.992 -3.552 -5.694 1.00 0.00 H new ATOM 0 HG3 ARG A 61 0.903 -4.536 -4.735 1.00 0.00 H new ATOM 0 HD2 ARG A 61 0.591 -5.978 -6.878 1.00 0.00 H new ATOM 0 HD3 ARG A 61 1.982 -5.126 -7.517 1.00 0.00 H new ATOM 0 HE ARG A 61 2.349 -6.361 -4.805 1.00 0.00 H new ATOM 0 HH11 ARG A 61 1.843 -8.051 -7.527 1.00 0.00 H new ATOM 0 HH12 ARG A 61 3.511 -8.550 -7.824 1.00 0.00 H new ATOM 0 HH21 ARG A 61 4.859 -6.287 -5.529 1.00 0.00 H new ATOM 0 HH22 ARG A 61 5.202 -7.561 -6.704 1.00 0.00 H new ATOM 981 N TYR A 62 -3.073 -2.982 -4.569 1.00 0.00 N ATOM 982 CA TYR A 62 -4.220 -3.748 -4.033 1.00 0.00 C ATOM 983 C TYR A 62 -5.486 -2.985 -4.378 1.00 0.00 C ATOM 984 O TYR A 62 -6.021 -2.264 -3.563 1.00 0.00 O ATOM 985 CB TYR A 62 -4.079 -3.868 -2.516 1.00 0.00 C ATOM 986 CG TYR A 62 -4.202 -5.311 -2.099 1.00 0.00 C ATOM 987 CD1 TYR A 62 -3.677 -6.331 -2.903 1.00 0.00 C ATOM 988 CD2 TYR A 62 -4.841 -5.631 -0.899 1.00 0.00 C ATOM 989 CE1 TYR A 62 -3.791 -7.664 -2.506 1.00 0.00 C ATOM 990 CE2 TYR A 62 -4.954 -6.965 -0.501 1.00 0.00 C ATOM 991 CZ TYR A 62 -4.430 -7.984 -1.305 1.00 0.00 C ATOM 992 OH TYR A 62 -4.544 -9.304 -0.917 1.00 0.00 O ATOM 0 H TYR A 62 -3.265 -2.002 -4.776 1.00 0.00 H new ATOM 0 HA TYR A 62 -4.255 -4.750 -4.462 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -3.115 -3.471 -2.200 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -4.847 -3.272 -2.023 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.183 -6.085 -3.832 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -5.248 -4.846 -0.278 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.385 -8.449 -3.127 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -5.446 -7.211 0.428 1.00 0.00 H new ATOM 0 HH TYR A 62 -4.004 -9.457 -0.114 1.00 0.00 H new ATOM 1002 N ASN A 63 -5.967 -3.122 -5.581 1.00 0.00 N ATOM 1003 CA ASN A 63 -7.182 -2.373 -5.950 1.00 0.00 C ATOM 1004 C ASN A 63 -8.391 -3.069 -5.338 1.00 0.00 C ATOM 1005 O ASN A 63 -8.501 -3.123 -4.132 1.00 0.00 O ATOM 1006 CB ASN A 63 -7.304 -2.238 -7.473 1.00 0.00 C ATOM 1007 CG ASN A 63 -6.648 -3.423 -8.164 1.00 0.00 C ATOM 1008 OD1 ASN A 63 -5.648 -3.257 -8.833 1.00 0.00 O ATOM 1009 ND2 ASN A 63 -7.174 -4.618 -8.047 1.00 0.00 N ATOM 0 H ASN A 63 -5.572 -3.714 -6.312 1.00 0.00 H new ATOM 0 HA ASN A 63 -7.125 -1.358 -5.556 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -8.355 -2.180 -7.756 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -6.833 -1.311 -7.801 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -6.743 -5.413 -8.519 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -8.014 -4.753 -7.484 1.00 0.00 H new ATOM 1016 N LYS A 64 -9.288 -3.596 -6.140 1.00 0.00 N ATOM 1017 CA LYS A 64 -10.502 -4.284 -5.593 1.00 0.00 C ATOM 1018 C LYS A 64 -10.851 -3.696 -4.227 1.00 0.00 C ATOM 1019 O LYS A 64 -10.348 -4.143 -3.224 1.00 0.00 O ATOM 1020 CB LYS A 64 -10.220 -5.780 -5.438 1.00 0.00 C ATOM 1021 CG LYS A 64 -11.123 -6.571 -6.384 1.00 0.00 C ATOM 1022 CD LYS A 64 -12.324 -7.108 -5.603 1.00 0.00 C ATOM 1023 CE LYS A 64 -12.608 -8.548 -6.030 1.00 0.00 C ATOM 1024 NZ LYS A 64 -14.077 -8.794 -5.996 1.00 0.00 N ATOM 0 H LYS A 64 -9.230 -3.578 -7.158 1.00 0.00 H new ATOM 0 HA LYS A 64 -11.336 -4.138 -6.280 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -9.173 -5.988 -5.659 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -10.396 -6.089 -4.408 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -11.461 -5.933 -7.201 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -10.567 -7.395 -6.832 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -12.122 -7.068 -4.533 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -13.199 -6.484 -5.786 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -12.222 -8.724 -7.034 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -12.096 -9.244 -5.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -14.272 -9.773 -6.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -14.432 -8.642 -5.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -14.554 -8.139 -6.648 1.00 0.00 H new ATOM 1038 N ARG A 65 -11.667 -2.673 -4.192 1.00 0.00 N ATOM 1039 CA ARG A 65 -12.017 -2.014 -2.885 1.00 0.00 C ATOM 1040 C ARG A 65 -11.919 -3.019 -1.733 1.00 0.00 C ATOM 1041 O ARG A 65 -11.397 -2.715 -0.679 1.00 0.00 O ATOM 1042 CB ARG A 65 -13.446 -1.451 -2.926 1.00 0.00 C ATOM 1043 CG ARG A 65 -13.885 -1.187 -4.370 1.00 0.00 C ATOM 1044 CD ARG A 65 -14.404 -2.484 -4.997 1.00 0.00 C ATOM 1045 NE ARG A 65 -15.442 -3.082 -4.111 1.00 0.00 N ATOM 1046 CZ ARG A 65 -16.646 -2.581 -4.083 1.00 0.00 C ATOM 1047 NH1 ARG A 65 -17.449 -2.755 -5.098 1.00 0.00 N ATOM 1048 NH2 ARG A 65 -17.050 -1.906 -3.041 1.00 0.00 N ATOM 0 H ARG A 65 -12.110 -2.260 -5.013 1.00 0.00 H new ATOM 0 HA ARG A 65 -11.309 -1.201 -2.725 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -14.133 -2.155 -2.455 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -13.494 -0.526 -2.352 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -14.664 -0.425 -4.390 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -13.047 -0.801 -4.950 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -14.824 -2.282 -5.982 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -13.583 -3.186 -5.139 1.00 0.00 H new ATOM 0 HE ARG A 65 -15.211 -3.884 -3.525 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -17.135 -3.283 -5.912 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -18.391 -2.363 -5.076 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -16.424 -1.770 -2.247 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -17.992 -1.515 -3.021 1.00 0.00 H new ATOM 1062 N GLU A 66 -12.386 -4.223 -1.927 1.00 0.00 N ATOM 1063 CA GLU A 66 -12.277 -5.233 -0.842 1.00 0.00 C ATOM 1064 C GLU A 66 -10.796 -5.559 -0.643 1.00 0.00 C ATOM 1065 O GLU A 66 -10.255 -5.418 0.435 1.00 0.00 O ATOM 1066 CB GLU A 66 -13.036 -6.502 -1.236 1.00 0.00 C ATOM 1067 CG GLU A 66 -14.357 -6.563 -0.467 1.00 0.00 C ATOM 1068 CD GLU A 66 -14.071 -6.730 1.026 1.00 0.00 C ATOM 1069 OE1 GLU A 66 -13.019 -7.253 1.353 1.00 0.00 O ATOM 1070 OE2 GLU A 66 -14.910 -6.331 1.817 1.00 0.00 O ATOM 0 H GLU A 66 -12.835 -4.547 -2.784 1.00 0.00 H new ATOM 0 HA GLU A 66 -12.706 -4.842 0.081 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -13.227 -6.507 -2.309 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -12.433 -7.383 -1.016 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -14.932 -5.653 -0.638 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -14.962 -7.395 -0.828 1.00 0.00 H new ATOM 1077 N GLU A 67 -10.131 -5.980 -1.688 1.00 0.00 N ATOM 1078 CA GLU A 67 -8.681 -6.300 -1.577 1.00 0.00 C ATOM 1079 C GLU A 67 -7.964 -5.171 -0.832 1.00 0.00 C ATOM 1080 O GLU A 67 -7.220 -5.414 0.096 1.00 0.00 O ATOM 1081 CB GLU A 67 -8.078 -6.445 -2.978 1.00 0.00 C ATOM 1082 CG GLU A 67 -7.054 -7.583 -2.981 1.00 0.00 C ATOM 1083 CD GLU A 67 -7.366 -8.543 -4.132 1.00 0.00 C ATOM 1084 OE1 GLU A 67 -6.959 -8.252 -5.245 1.00 0.00 O ATOM 1085 OE2 GLU A 67 -8.008 -9.549 -3.882 1.00 0.00 O ATOM 0 H GLU A 67 -10.533 -6.116 -2.615 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.559 -7.235 -1.030 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -8.865 -6.648 -3.704 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.601 -5.512 -3.278 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.047 -7.181 -3.091 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -7.083 -8.116 -2.030 1.00 0.00 H new ATOM 1092 N ALA A 68 -8.175 -3.934 -1.212 1.00 0.00 N ATOM 1093 CA ALA A 68 -7.488 -2.830 -0.489 1.00 0.00 C ATOM 1094 C ALA A 68 -7.778 -2.992 1.003 1.00 0.00 C ATOM 1095 O ALA A 68 -6.892 -2.917 1.829 1.00 0.00 O ATOM 1096 CB ALA A 68 -8.006 -1.475 -0.985 1.00 0.00 C ATOM 0 H ALA A 68 -8.784 -3.648 -1.979 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.414 -2.869 -0.670 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.497 -0.673 -0.450 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -7.811 -1.380 -2.053 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -9.079 -1.408 -0.805 1.00 0.00 H new ATOM 1102 N GLN A 69 -9.012 -3.245 1.348 1.00 0.00 N ATOM 1103 CA GLN A 69 -9.364 -3.444 2.780 1.00 0.00 C ATOM 1104 C GLN A 69 -8.373 -4.438 3.398 1.00 0.00 C ATOM 1105 O GLN A 69 -7.889 -4.254 4.500 1.00 0.00 O ATOM 1106 CB GLN A 69 -10.786 -4.008 2.875 1.00 0.00 C ATOM 1107 CG GLN A 69 -11.650 -3.086 3.738 1.00 0.00 C ATOM 1108 CD GLN A 69 -12.535 -2.221 2.837 1.00 0.00 C ATOM 1109 OE1 GLN A 69 -12.112 -1.182 2.369 1.00 0.00 O ATOM 1110 NE2 GLN A 69 -13.753 -2.608 2.573 1.00 0.00 N ATOM 0 H GLN A 69 -9.793 -3.322 0.696 1.00 0.00 H new ATOM 0 HA GLN A 69 -9.316 -2.495 3.315 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -11.218 -4.100 1.879 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -10.763 -5.009 3.306 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -12.269 -3.677 4.413 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -11.016 -2.453 4.359 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -14.108 -3.480 2.966 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -14.350 -2.039 1.974 1.00 0.00 H new ATOM 1119 N GLU A 70 -8.068 -5.487 2.683 1.00 0.00 N ATOM 1120 CA GLU A 70 -7.108 -6.505 3.198 1.00 0.00 C ATOM 1121 C GLU A 70 -5.753 -5.855 3.458 1.00 0.00 C ATOM 1122 O GLU A 70 -5.322 -5.719 4.585 1.00 0.00 O ATOM 1123 CB GLU A 70 -6.917 -7.595 2.149 1.00 0.00 C ATOM 1124 CG GLU A 70 -7.848 -8.770 2.447 1.00 0.00 C ATOM 1125 CD GLU A 70 -9.296 -8.279 2.479 1.00 0.00 C ATOM 1126 OE1 GLU A 70 -9.849 -8.055 1.415 1.00 0.00 O ATOM 1127 OE2 GLU A 70 -9.829 -8.135 3.568 1.00 0.00 O ATOM 0 H GLU A 70 -8.446 -5.684 1.756 1.00 0.00 H new ATOM 0 HA GLU A 70 -7.504 -6.927 4.122 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -7.125 -7.197 1.156 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -5.880 -7.932 2.146 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -7.731 -9.542 1.686 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -7.585 -9.222 3.403 1.00 0.00 H new ATOM 1134 N ALA A 71 -5.074 -5.459 2.415 1.00 0.00 N ATOM 1135 CA ALA A 71 -3.739 -4.824 2.584 1.00 0.00 C ATOM 1136 C ALA A 71 -3.793 -3.775 3.694 1.00 0.00 C ATOM 1137 O ALA A 71 -2.783 -3.395 4.251 1.00 0.00 O ATOM 1138 CB ALA A 71 -3.320 -4.163 1.278 1.00 0.00 C ATOM 0 H ALA A 71 -5.390 -5.549 1.449 1.00 0.00 H new ATOM 0 HA ALA A 71 -3.013 -5.590 2.855 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -2.342 -3.698 1.403 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -3.267 -4.915 0.490 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -4.051 -3.402 1.004 1.00 0.00 H new ATOM 1144 N ILE A 72 -4.954 -3.298 4.032 1.00 0.00 N ATOM 1145 CA ILE A 72 -5.034 -2.292 5.116 1.00 0.00 C ATOM 1146 C ILE A 72 -4.745 -2.995 6.443 1.00 0.00 C ATOM 1147 O ILE A 72 -3.741 -2.753 7.076 1.00 0.00 O ATOM 1148 CB ILE A 72 -6.433 -1.679 5.136 1.00 0.00 C ATOM 1149 CG1 ILE A 72 -6.774 -1.193 3.708 1.00 0.00 C ATOM 1150 CG2 ILE A 72 -6.469 -0.529 6.151 1.00 0.00 C ATOM 1151 CD1 ILE A 72 -7.003 0.327 3.662 1.00 0.00 C ATOM 0 H ILE A 72 -5.844 -3.560 3.607 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.307 -1.496 4.955 1.00 0.00 H new ATOM 0 HB ILE A 72 -7.178 -2.414 5.441 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -5.963 -1.459 3.030 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -7.668 -1.706 3.353 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -7.466 -0.089 6.168 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -6.224 -0.911 7.142 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -5.742 0.231 5.865 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -7.240 0.629 2.642 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -7.831 0.590 4.320 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -6.100 0.841 3.992 1.00 0.00 H new ATOM 1163 N SER A 73 -5.608 -3.883 6.860 1.00 0.00 N ATOM 1164 CA SER A 73 -5.372 -4.611 8.144 1.00 0.00 C ATOM 1165 C SER A 73 -4.345 -5.734 7.941 1.00 0.00 C ATOM 1166 O SER A 73 -4.154 -6.568 8.805 1.00 0.00 O ATOM 1167 CB SER A 73 -6.688 -5.220 8.630 1.00 0.00 C ATOM 1168 OG SER A 73 -6.538 -5.641 9.980 1.00 0.00 O ATOM 0 H SER A 73 -6.465 -4.136 6.369 1.00 0.00 H new ATOM 0 HA SER A 73 -4.989 -3.907 8.882 1.00 0.00 H new ATOM 0 HB2 SER A 73 -7.492 -4.488 8.552 1.00 0.00 H new ATOM 0 HB3 SER A 73 -6.965 -6.066 8.001 1.00 0.00 H new ATOM 0 HG SER A 73 -5.683 -6.109 10.084 1.00 0.00 H new ATOM 1174 N ALA A 74 -3.685 -5.774 6.813 1.00 0.00 N ATOM 1175 CA ALA A 74 -2.684 -6.855 6.576 1.00 0.00 C ATOM 1176 C ALA A 74 -1.305 -6.242 6.321 1.00 0.00 C ATOM 1177 O ALA A 74 -0.345 -6.541 7.004 1.00 0.00 O ATOM 1178 CB ALA A 74 -3.107 -7.679 5.360 1.00 0.00 C ATOM 0 H ALA A 74 -3.795 -5.108 6.049 1.00 0.00 H new ATOM 0 HA ALA A 74 -2.633 -7.497 7.456 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -2.377 -8.470 5.185 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -4.086 -8.123 5.544 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -3.160 -7.033 4.483 1.00 0.00 H new ATOM 1184 N LEU A 75 -1.199 -5.388 5.340 1.00 0.00 N ATOM 1185 CA LEU A 75 0.119 -4.761 5.036 1.00 0.00 C ATOM 1186 C LEU A 75 0.401 -3.652 6.059 1.00 0.00 C ATOM 1187 O LEU A 75 1.535 -3.428 6.435 1.00 0.00 O ATOM 1188 CB LEU A 75 0.101 -4.159 3.625 1.00 0.00 C ATOM 1189 CG LEU A 75 0.225 -5.269 2.573 1.00 0.00 C ATOM 1190 CD1 LEU A 75 -0.031 -4.686 1.182 1.00 0.00 C ATOM 1191 CD2 LEU A 75 1.634 -5.867 2.604 1.00 0.00 C ATOM 0 H LEU A 75 -1.968 -5.097 4.736 1.00 0.00 H new ATOM 0 HA LEU A 75 0.898 -5.521 5.090 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.824 -3.604 3.471 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.921 -3.450 3.514 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.507 -6.046 2.794 1.00 0.00 H new ATOM 0 HD11 LEU A 75 0.057 -5.475 0.435 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -1.034 -4.261 1.144 1.00 0.00 H new ATOM 0 HD13 LEU A 75 0.701 -3.906 0.974 1.00 0.00 H new ATOM 0 HD21 LEU A 75 1.712 -6.654 1.854 1.00 0.00 H new ATOM 0 HD22 LEU A 75 2.365 -5.087 2.389 1.00 0.00 H new ATOM 0 HD23 LEU A 75 1.830 -6.286 3.591 1.00 0.00 H new ATOM 1203 N ASN A 76 -0.611 -2.965 6.535 1.00 0.00 N ATOM 1204 CA ASN A 76 -0.354 -1.901 7.549 1.00 0.00 C ATOM 1205 C ASN A 76 0.497 -2.504 8.673 1.00 0.00 C ATOM 1206 O ASN A 76 0.222 -3.587 9.154 1.00 0.00 O ATOM 1207 CB ASN A 76 -1.679 -1.388 8.122 1.00 0.00 C ATOM 1208 CG ASN A 76 -2.257 -2.399 9.120 1.00 0.00 C ATOM 1209 OD1 ASN A 76 -2.744 -2.023 10.167 1.00 0.00 O ATOM 1210 ND2 ASN A 76 -2.230 -3.676 8.839 1.00 0.00 N ATOM 0 H ASN A 76 -1.587 -3.094 6.269 1.00 0.00 H new ATOM 0 HA ASN A 76 0.169 -1.064 7.085 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -1.522 -0.429 8.616 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -2.390 -1.218 7.314 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -2.617 -4.352 9.498 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -1.822 -3.996 7.961 1.00 0.00 H new ATOM 1217 N ASN A 77 1.531 -1.829 9.086 1.00 0.00 N ATOM 1218 CA ASN A 77 2.398 -2.386 10.167 1.00 0.00 C ATOM 1219 C ASN A 77 3.153 -3.610 9.643 1.00 0.00 C ATOM 1220 O ASN A 77 3.087 -4.678 10.217 1.00 0.00 O ATOM 1221 CB ASN A 77 1.548 -2.801 11.371 1.00 0.00 C ATOM 1222 CG ASN A 77 2.000 -2.020 12.605 1.00 0.00 C ATOM 1223 OD1 ASN A 77 1.343 -1.088 13.024 1.00 0.00 O ATOM 1224 ND2 ASN A 77 3.104 -2.365 13.209 1.00 0.00 N ATOM 0 H ASN A 77 1.815 -0.918 8.725 1.00 0.00 H new ATOM 0 HA ASN A 77 3.106 -1.617 10.475 1.00 0.00 H new ATOM 0 HB2 ASN A 77 0.494 -2.607 11.170 1.00 0.00 H new ATOM 0 HB3 ASN A 77 1.647 -3.872 11.548 1.00 0.00 H new ATOM 0 HD21 ASN A 77 3.416 -1.852 14.034 1.00 0.00 H new ATOM 0 HD22 ASN A 77 3.655 -3.148 12.857 1.00 0.00 H new ATOM 1231 N VAL A 78 3.887 -3.468 8.567 1.00 0.00 N ATOM 1232 CA VAL A 78 4.653 -4.637 8.038 1.00 0.00 C ATOM 1233 C VAL A 78 5.999 -4.709 8.762 1.00 0.00 C ATOM 1234 O VAL A 78 7.034 -4.918 8.159 1.00 0.00 O ATOM 1235 CB VAL A 78 4.897 -4.482 6.532 1.00 0.00 C ATOM 1236 CG1 VAL A 78 5.774 -3.255 6.287 1.00 0.00 C ATOM 1237 CG2 VAL A 78 5.614 -5.726 6.007 1.00 0.00 C ATOM 0 H VAL A 78 3.988 -2.602 8.037 1.00 0.00 H new ATOM 0 HA VAL A 78 4.079 -5.548 8.207 1.00 0.00 H new ATOM 0 HB VAL A 78 3.944 -4.362 6.016 1.00 0.00 H new ATOM 0 HG11 VAL A 78 5.950 -3.141 5.217 1.00 0.00 H new ATOM 0 HG12 VAL A 78 5.271 -2.366 6.669 1.00 0.00 H new ATOM 0 HG13 VAL A 78 6.727 -3.381 6.800 1.00 0.00 H new ATOM 0 HG21 VAL A 78 5.790 -5.620 4.936 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.568 -5.840 6.522 1.00 0.00 H new ATOM 0 HG23 VAL A 78 4.996 -6.606 6.188 1.00 0.00 H new ATOM 1247 N ILE A 79 5.986 -4.538 10.053 1.00 0.00 N ATOM 1248 CA ILE A 79 7.251 -4.595 10.835 1.00 0.00 C ATOM 1249 C ILE A 79 7.024 -5.504 12.050 1.00 0.00 C ATOM 1250 O ILE A 79 5.922 -5.962 12.281 1.00 0.00 O ATOM 1251 CB ILE A 79 7.664 -3.164 11.283 1.00 0.00 C ATOM 1252 CG1 ILE A 79 7.378 -2.947 12.775 1.00 0.00 C ATOM 1253 CG2 ILE A 79 6.886 -2.111 10.489 1.00 0.00 C ATOM 1254 CD1 ILE A 79 7.651 -1.487 13.140 1.00 0.00 C ATOM 0 H ILE A 79 5.147 -4.360 10.604 1.00 0.00 H new ATOM 0 HA ILE A 79 8.058 -4.998 10.224 1.00 0.00 H new ATOM 0 HB ILE A 79 8.733 -3.063 11.098 1.00 0.00 H new ATOM 0 HG12 ILE A 79 6.342 -3.201 12.998 1.00 0.00 H new ATOM 0 HG13 ILE A 79 8.004 -3.606 13.376 1.00 0.00 H new ATOM 0 HG21 ILE A 79 7.186 -1.115 10.814 1.00 0.00 H new ATOM 0 HG22 ILE A 79 7.099 -2.226 9.426 1.00 0.00 H new ATOM 0 HG23 ILE A 79 5.818 -2.242 10.661 1.00 0.00 H new ATOM 0 HD11 ILE A 79 7.448 -1.333 14.200 1.00 0.00 H new ATOM 0 HD12 ILE A 79 8.694 -1.249 12.932 1.00 0.00 H new ATOM 0 HD13 ILE A 79 7.006 -0.837 12.549 1.00 0.00 H new ATOM 1266 N PRO A 80 8.070 -5.717 12.798 1.00 0.00 N ATOM 1267 CA PRO A 80 7.914 -6.566 13.998 1.00 0.00 C ATOM 1268 C PRO A 80 7.479 -5.692 15.178 1.00 0.00 C ATOM 1269 O PRO A 80 8.000 -5.802 16.269 1.00 0.00 O ATOM 1270 CB PRO A 80 9.304 -7.154 14.235 1.00 0.00 C ATOM 1271 CG PRO A 80 10.299 -6.202 13.545 1.00 0.00 C ATOM 1272 CD PRO A 80 9.489 -5.393 12.517 1.00 0.00 C ATOM 0 HA PRO A 80 7.163 -7.347 13.881 1.00 0.00 H new ATOM 0 HB2 PRO A 80 9.516 -7.232 15.301 1.00 0.00 H new ATOM 0 HB3 PRO A 80 9.377 -8.160 13.821 1.00 0.00 H new ATOM 0 HG2 PRO A 80 10.772 -5.542 14.272 1.00 0.00 H new ATOM 0 HG3 PRO A 80 11.096 -6.762 13.057 1.00 0.00 H new ATOM 0 HD2 PRO A 80 9.677 -4.324 12.621 1.00 0.00 H new ATOM 0 HD3 PRO A 80 9.761 -5.667 11.498 1.00 0.00 H new ATOM 1280 N GLU A 81 6.536 -4.812 14.951 1.00 0.00 N ATOM 1281 CA GLU A 81 6.063 -3.908 16.037 1.00 0.00 C ATOM 1282 C GLU A 81 7.264 -3.425 16.850 1.00 0.00 C ATOM 1283 O GLU A 81 7.248 -3.425 18.066 1.00 0.00 O ATOM 1284 CB GLU A 81 5.090 -4.651 16.954 1.00 0.00 C ATOM 1285 CG GLU A 81 5.735 -5.942 17.462 1.00 0.00 C ATOM 1286 CD GLU A 81 4.836 -6.576 18.525 1.00 0.00 C ATOM 1287 OE1 GLU A 81 4.194 -5.833 19.250 1.00 0.00 O ATOM 1288 OE2 GLU A 81 4.804 -7.794 18.596 1.00 0.00 O ATOM 0 H GLU A 81 6.072 -4.682 14.052 1.00 0.00 H new ATOM 0 HA GLU A 81 5.550 -3.054 15.594 1.00 0.00 H new ATOM 0 HB2 GLU A 81 4.814 -4.016 17.796 1.00 0.00 H new ATOM 0 HB3 GLU A 81 4.172 -4.881 16.414 1.00 0.00 H new ATOM 0 HG2 GLU A 81 5.884 -6.636 16.635 1.00 0.00 H new ATOM 0 HG3 GLU A 81 6.718 -5.729 17.881 1.00 0.00 H new ATOM 1295 N GLY A 82 8.307 -3.017 16.185 1.00 0.00 N ATOM 1296 CA GLY A 82 9.522 -2.538 16.908 1.00 0.00 C ATOM 1297 C GLY A 82 10.117 -1.341 16.164 1.00 0.00 C ATOM 1298 O GLY A 82 11.098 -1.459 15.457 1.00 0.00 O ATOM 0 H GLY A 82 8.373 -2.994 15.167 1.00 0.00 H new ATOM 0 HA2 GLY A 82 9.263 -2.254 17.928 1.00 0.00 H new ATOM 0 HA3 GLY A 82 10.257 -3.340 16.977 1.00 0.00 H new ATOM 1302 N GLY A 83 9.525 -0.191 16.317 1.00 0.00 N ATOM 1303 CA GLY A 83 10.041 1.022 15.620 1.00 0.00 C ATOM 1304 C GLY A 83 8.855 1.880 15.185 1.00 0.00 C ATOM 1305 O GLY A 83 8.896 3.094 15.232 1.00 0.00 O ATOM 0 H GLY A 83 8.701 -0.037 16.898 1.00 0.00 H new ATOM 0 HA2 GLY A 83 10.694 1.589 16.283 1.00 0.00 H new ATOM 0 HA3 GLY A 83 10.637 0.735 14.754 1.00 0.00 H new ATOM 1309 N SER A 84 7.789 1.250 14.777 1.00 0.00 N ATOM 1310 CA SER A 84 6.579 2.006 14.352 1.00 0.00 C ATOM 1311 C SER A 84 6.859 2.782 13.063 1.00 0.00 C ATOM 1312 O SER A 84 6.491 3.932 12.928 1.00 0.00 O ATOM 1313 CB SER A 84 6.174 2.980 15.458 1.00 0.00 C ATOM 1314 OG SER A 84 4.860 2.666 15.900 1.00 0.00 O ATOM 0 H SER A 84 7.704 0.235 14.719 1.00 0.00 H new ATOM 0 HA SER A 84 5.769 1.300 14.167 1.00 0.00 H new ATOM 0 HB2 SER A 84 6.875 2.916 16.290 1.00 0.00 H new ATOM 0 HB3 SER A 84 6.211 4.005 15.088 1.00 0.00 H new ATOM 0 HG SER A 84 4.597 3.287 16.611 1.00 0.00 H new ATOM 1320 N GLN A 85 7.480 2.154 12.104 1.00 0.00 N ATOM 1321 CA GLN A 85 7.752 2.846 10.818 1.00 0.00 C ATOM 1322 C GLN A 85 7.243 1.975 9.662 1.00 0.00 C ATOM 1323 O GLN A 85 7.961 1.725 8.714 1.00 0.00 O ATOM 1324 CB GLN A 85 9.258 3.072 10.668 1.00 0.00 C ATOM 1325 CG GLN A 85 9.772 3.892 11.854 1.00 0.00 C ATOM 1326 CD GLN A 85 10.099 5.315 11.393 1.00 0.00 C ATOM 1327 OE1 GLN A 85 9.272 5.979 10.801 1.00 0.00 O ATOM 1328 NE2 GLN A 85 11.278 5.813 11.644 1.00 0.00 N ATOM 0 H GLN A 85 7.810 1.190 12.157 1.00 0.00 H new ATOM 0 HA GLN A 85 7.242 3.809 10.803 1.00 0.00 H new ATOM 0 HB2 GLN A 85 9.777 2.115 10.622 1.00 0.00 H new ATOM 0 HB3 GLN A 85 9.467 3.593 9.734 1.00 0.00 H new ATOM 0 HG2 GLN A 85 9.021 3.918 12.643 1.00 0.00 H new ATOM 0 HG3 GLN A 85 10.661 3.422 12.276 1.00 0.00 H new ATOM 0 HE21 GLN A 85 11.972 5.255 12.141 1.00 0.00 H new ATOM 0 HE22 GLN A 85 11.506 6.761 11.343 1.00 0.00 H new ATOM 1337 N PRO A 86 6.013 1.531 9.783 1.00 0.00 N ATOM 1338 CA PRO A 86 5.460 0.674 8.705 1.00 0.00 C ATOM 1339 C PRO A 86 4.801 1.511 7.611 1.00 0.00 C ATOM 1340 O PRO A 86 5.019 2.700 7.497 1.00 0.00 O ATOM 1341 CB PRO A 86 4.400 -0.173 9.393 1.00 0.00 C ATOM 1342 CG PRO A 86 3.973 0.604 10.648 1.00 0.00 C ATOM 1343 CD PRO A 86 5.129 1.555 10.981 1.00 0.00 C ATOM 0 HA PRO A 86 6.242 0.085 8.226 1.00 0.00 H new ATOM 0 HB2 PRO A 86 3.549 -0.343 8.733 1.00 0.00 H new ATOM 0 HB3 PRO A 86 4.797 -1.152 9.659 1.00 0.00 H new ATOM 0 HG2 PRO A 86 3.053 1.159 10.467 1.00 0.00 H new ATOM 0 HG3 PRO A 86 3.777 -0.075 11.478 1.00 0.00 H new ATOM 0 HD2 PRO A 86 4.765 2.563 11.181 1.00 0.00 H new ATOM 0 HD3 PRO A 86 5.664 1.227 11.872 1.00 0.00 H new ATOM 1351 N LEU A 87 3.984 0.881 6.810 1.00 0.00 N ATOM 1352 CA LEU A 87 3.285 1.609 5.715 1.00 0.00 C ATOM 1353 C LEU A 87 1.999 2.236 6.243 1.00 0.00 C ATOM 1354 O LEU A 87 1.131 1.551 6.748 1.00 0.00 O ATOM 1355 CB LEU A 87 2.875 0.627 4.616 1.00 0.00 C ATOM 1356 CG LEU A 87 4.098 0.000 3.966 1.00 0.00 C ATOM 1357 CD1 LEU A 87 4.376 -1.342 4.632 1.00 0.00 C ATOM 1358 CD2 LEU A 87 3.814 -0.223 2.480 1.00 0.00 C ATOM 0 H LEU A 87 3.770 -0.115 6.869 1.00 0.00 H new ATOM 0 HA LEU A 87 3.964 2.370 5.331 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.242 -0.154 5.038 1.00 0.00 H new ATOM 0 HB3 LEU A 87 2.283 1.145 3.862 1.00 0.00 H new ATOM 0 HG LEU A 87 4.961 0.656 4.080 1.00 0.00 H new ATOM 0 HD11 LEU A 87 5.252 -1.801 4.173 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.561 -1.189 5.695 1.00 0.00 H new ATOM 0 HD13 LEU A 87 3.514 -1.997 4.504 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.687 -0.673 2.006 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.958 -0.888 2.369 1.00 0.00 H new ATOM 0 HD23 LEU A 87 3.595 0.733 2.004 1.00 0.00 H new ATOM 1370 N SER A 88 1.831 3.512 6.076 1.00 0.00 N ATOM 1371 CA SER A 88 0.556 4.131 6.512 1.00 0.00 C ATOM 1372 C SER A 88 -0.454 3.812 5.410 1.00 0.00 C ATOM 1373 O SER A 88 -0.477 4.459 4.381 1.00 0.00 O ATOM 1374 CB SER A 88 0.726 5.646 6.654 1.00 0.00 C ATOM 1375 OG SER A 88 1.103 5.954 7.990 1.00 0.00 O ATOM 0 H SER A 88 2.512 4.148 5.661 1.00 0.00 H new ATOM 0 HA SER A 88 0.231 3.750 7.480 1.00 0.00 H new ATOM 0 HB2 SER A 88 1.484 6.005 5.958 1.00 0.00 H new ATOM 0 HB3 SER A 88 -0.205 6.153 6.401 1.00 0.00 H new ATOM 0 HG SER A 88 1.214 6.923 8.083 1.00 0.00 H new ATOM 1381 N VAL A 89 -1.238 2.776 5.586 1.00 0.00 N ATOM 1382 CA VAL A 89 -2.187 2.363 4.507 1.00 0.00 C ATOM 1383 C VAL A 89 -3.402 3.290 4.426 1.00 0.00 C ATOM 1384 O VAL A 89 -3.912 3.783 5.413 1.00 0.00 O ATOM 1385 CB VAL A 89 -2.659 0.932 4.780 1.00 0.00 C ATOM 1386 CG1 VAL A 89 -3.367 0.873 6.134 1.00 0.00 C ATOM 1387 CG2 VAL A 89 -3.631 0.497 3.682 1.00 0.00 C ATOM 0 H VAL A 89 -1.261 2.201 6.428 1.00 0.00 H new ATOM 0 HA VAL A 89 -1.661 2.422 3.554 1.00 0.00 H new ATOM 0 HB VAL A 89 -1.797 0.265 4.792 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -3.702 -0.147 6.325 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -2.677 1.182 6.919 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -4.228 1.542 6.124 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -3.967 -0.522 3.876 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -4.491 1.167 3.671 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -3.129 0.535 2.715 1.00 0.00 H new ATOM 1397 N ARG A 90 -3.851 3.515 3.219 1.00 0.00 N ATOM 1398 CA ARG A 90 -5.024 4.395 2.960 1.00 0.00 C ATOM 1399 C ARG A 90 -5.179 4.511 1.437 1.00 0.00 C ATOM 1400 O ARG A 90 -5.162 3.518 0.738 1.00 0.00 O ATOM 1401 CB ARG A 90 -4.776 5.774 3.578 1.00 0.00 C ATOM 1402 CG ARG A 90 -6.105 6.522 3.705 1.00 0.00 C ATOM 1403 CD ARG A 90 -5.888 8.009 3.420 1.00 0.00 C ATOM 1404 NE ARG A 90 -6.612 8.818 4.439 1.00 0.00 N ATOM 1405 CZ ARG A 90 -6.593 10.119 4.368 1.00 0.00 C ATOM 1406 NH1 ARG A 90 -5.487 10.768 4.611 1.00 0.00 N ATOM 1407 NH2 ARG A 90 -7.678 10.772 4.052 1.00 0.00 N ATOM 0 H ARG A 90 -3.438 3.111 2.378 1.00 0.00 H new ATOM 0 HA ARG A 90 -5.931 3.983 3.403 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -4.311 5.667 4.558 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -4.084 6.343 2.958 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -6.833 6.110 3.006 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -6.514 6.390 4.707 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.824 8.243 3.442 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -6.248 8.256 2.421 1.00 0.00 H new ATOM 0 HE ARG A 90 -7.122 8.355 5.191 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -4.639 10.257 4.856 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -5.471 11.786 4.556 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -8.541 10.264 3.860 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -7.662 11.790 3.997 1.00 0.00 H new ATOM 1421 N LEU A 91 -5.314 5.694 0.901 1.00 0.00 N ATOM 1422 CA LEU A 91 -5.450 5.807 -0.580 1.00 0.00 C ATOM 1423 C LEU A 91 -4.848 7.126 -1.064 1.00 0.00 C ATOM 1424 O LEU A 91 -4.807 8.105 -0.347 1.00 0.00 O ATOM 1425 CB LEU A 91 -6.926 5.746 -0.963 1.00 0.00 C ATOM 1426 CG LEU A 91 -7.067 5.769 -2.487 1.00 0.00 C ATOM 1427 CD1 LEU A 91 -6.858 4.361 -3.047 1.00 0.00 C ATOM 1428 CD2 LEU A 91 -8.469 6.259 -2.860 1.00 0.00 C ATOM 0 H LEU A 91 -5.336 6.575 1.415 1.00 0.00 H new ATOM 0 HA LEU A 91 -4.917 4.981 -1.050 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -7.379 4.840 -0.560 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -7.460 6.590 -0.526 1.00 0.00 H new ATOM 0 HG LEU A 91 -6.318 6.440 -2.908 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -6.959 4.382 -4.132 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -5.861 4.008 -2.782 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -7.605 3.687 -2.626 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -8.572 6.276 -3.945 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -9.214 5.586 -2.436 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -8.620 7.264 -2.465 1.00 0.00 H new ATOM 1440 N ALA A 92 -4.378 7.153 -2.282 1.00 0.00 N ATOM 1441 CA ALA A 92 -3.774 8.401 -2.824 1.00 0.00 C ATOM 1442 C ALA A 92 -4.451 8.765 -4.148 1.00 0.00 C ATOM 1443 O ALA A 92 -5.441 8.178 -4.534 1.00 0.00 O ATOM 1444 CB ALA A 92 -2.280 8.178 -3.061 1.00 0.00 C ATOM 0 H ALA A 92 -4.387 6.362 -2.926 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.914 9.213 -2.111 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -1.834 9.090 -3.458 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -1.797 7.918 -2.119 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -2.142 7.366 -3.775 1.00 0.00 H new ATOM 1450 N GLU A 93 -3.921 9.732 -4.847 1.00 0.00 N ATOM 1451 CA GLU A 93 -4.530 10.137 -6.147 1.00 0.00 C ATOM 1452 C GLU A 93 -3.806 9.430 -7.294 1.00 0.00 C ATOM 1453 O GLU A 93 -2.956 8.587 -7.079 1.00 0.00 O ATOM 1454 CB GLU A 93 -4.405 11.653 -6.318 1.00 0.00 C ATOM 1455 CG GLU A 93 -4.518 12.331 -4.951 1.00 0.00 C ATOM 1456 CD GLU A 93 -5.316 13.628 -5.088 1.00 0.00 C ATOM 1457 OE1 GLU A 93 -4.982 14.417 -5.959 1.00 0.00 O ATOM 1458 OE2 GLU A 93 -6.246 13.813 -4.322 1.00 0.00 O ATOM 0 H GLU A 93 -3.092 10.260 -4.574 1.00 0.00 H new ATOM 0 HA GLU A 93 -5.583 9.856 -6.158 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -3.449 11.900 -6.781 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.186 12.020 -6.984 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -5.008 11.664 -4.242 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.525 12.543 -4.555 1.00 0.00 H new ATOM 1465 N GLU A 94 -4.136 9.763 -8.512 1.00 0.00 N ATOM 1466 CA GLU A 94 -3.468 9.108 -9.674 1.00 0.00 C ATOM 1467 C GLU A 94 -3.846 7.625 -9.712 1.00 0.00 C ATOM 1468 O GLU A 94 -4.101 7.013 -8.693 1.00 0.00 O ATOM 1469 CB GLU A 94 -1.950 9.245 -9.533 1.00 0.00 C ATOM 1470 CG GLU A 94 -1.398 10.056 -10.707 1.00 0.00 C ATOM 1471 CD GLU A 94 -1.011 11.455 -10.223 1.00 0.00 C ATOM 1472 OE1 GLU A 94 0.050 11.585 -9.634 1.00 0.00 O ATOM 1473 OE2 GLU A 94 -1.780 12.375 -10.452 1.00 0.00 O ATOM 0 H GLU A 94 -4.840 10.461 -8.753 1.00 0.00 H new ATOM 0 HA GLU A 94 -3.792 9.588 -10.597 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -1.705 9.736 -8.591 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.486 8.259 -9.509 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -0.530 9.554 -11.133 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -2.145 10.127 -11.497 1.00 0.00 H new ATOM 1480 N HIS A 95 -3.886 7.043 -10.879 1.00 0.00 N ATOM 1481 CA HIS A 95 -4.248 5.600 -10.980 1.00 0.00 C ATOM 1482 C HIS A 95 -3.070 4.743 -10.510 1.00 0.00 C ATOM 1483 O HIS A 95 -2.090 5.245 -9.997 1.00 0.00 O ATOM 1484 CB HIS A 95 -4.582 5.258 -12.434 1.00 0.00 C ATOM 1485 CG HIS A 95 -3.513 5.808 -13.340 1.00 0.00 C ATOM 1486 ND1 HIS A 95 -3.801 6.669 -14.387 1.00 0.00 N ATOM 1487 CD2 HIS A 95 -2.153 5.627 -13.366 1.00 0.00 C ATOM 1488 CE1 HIS A 95 -2.639 6.973 -14.993 1.00 0.00 C ATOM 1489 NE2 HIS A 95 -1.603 6.364 -14.411 1.00 0.00 N ATOM 0 H HIS A 95 -3.684 7.503 -11.767 1.00 0.00 H new ATOM 0 HA HIS A 95 -5.116 5.399 -10.352 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -4.656 4.177 -12.556 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -5.552 5.676 -12.703 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -1.594 5.007 -12.680 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -2.554 7.630 -15.846 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -0.620 6.426 -14.675 1.00 0.00 H new ATOM 1497 N GLY A 96 -3.157 3.450 -10.678 1.00 0.00 N ATOM 1498 CA GLY A 96 -2.041 2.567 -10.237 1.00 0.00 C ATOM 1499 C GLY A 96 -1.696 1.576 -11.349 1.00 0.00 C ATOM 1500 O GLY A 96 -0.593 1.557 -11.856 1.00 0.00 O ATOM 0 H GLY A 96 -3.951 2.969 -11.101 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -1.166 3.168 -9.988 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -2.326 2.029 -9.333 1.00 0.00 H new ATOM 1504 N LYS A 97 -2.631 0.749 -11.730 1.00 0.00 N ATOM 1505 CA LYS A 97 -2.354 -0.241 -12.807 1.00 0.00 C ATOM 1506 C LYS A 97 -3.574 -0.350 -13.725 1.00 0.00 C ATOM 1507 O LYS A 97 -3.433 -0.062 -14.903 1.00 0.00 O ATOM 1508 CB LYS A 97 -2.062 -1.606 -12.179 1.00 0.00 C ATOM 1509 CG LYS A 97 -1.059 -2.368 -13.048 1.00 0.00 C ATOM 1510 CD LYS A 97 -1.619 -2.519 -14.463 1.00 0.00 C ATOM 1511 CE LYS A 97 -1.272 -3.906 -15.005 1.00 0.00 C ATOM 1512 NZ LYS A 97 -2.277 -4.303 -16.033 1.00 0.00 N ATOM 1513 OXT LYS A 97 -4.629 -0.719 -13.235 1.00 0.00 O ATOM 0 H LYS A 97 -3.574 0.717 -11.342 1.00 0.00 H new ATOM 0 HA LYS A 97 -1.491 0.084 -13.388 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -1.662 -1.477 -11.173 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.985 -2.179 -12.084 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -0.109 -1.835 -13.077 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -0.861 -3.350 -12.617 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -2.700 -2.381 -14.454 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -1.204 -1.749 -15.113 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -0.273 -3.898 -15.441 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -1.260 -4.633 -14.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -2.042 -5.246 -16.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -3.223 -4.326 -15.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -2.267 -3.614 -16.812 1.00 0.00 H new TER 1527 LYS A 97