USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 785 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 HIS : no HD1:sc= -1.27 K(o=0.26,f=-0.7) USER MOD Set 1.2: A 71 SER OG : rot 173:sc= 0.558 USER MOD Set 1.3: A 74 SER OG : rot -73:sc= 0.979 USER MOD Set 2.1: A 43 THR OG1 : rot -47:sc= 1.45 USER MOD Set 2.2: A 47 THR OG1 : rot -21:sc= 1.1 USER MOD Single : A 5 ASN : amide:sc= -0.139 K(o=-0.14,f=-1.6!) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= -0.0249 USER MOD Single : A 12 TYR OH : rot -50:sc= -1.11 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ -166:sc=-0.00764 (180deg=-0.139) USER MOD Single : A 27 THR OG1 : rot 170:sc= 0.0879 USER MOD Single : A 28 GLN : amide:sc= -0.549 K(o=-0.55,f=-2.3!) USER MOD Single : A 32 LYS NZ :NH3+ 162:sc= 0.413 (180deg=0.251) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.0288 K(o=-0.029,f=-1.4) USER MOD Single : A 42 ASN : amide:sc= -0.0359 X(o=-0.036,f=-0.25) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 51 LYS NZ :NH3+ -153:sc= -0.863 (180deg=-2.91) USER MOD Single : A 53 GLN :FLIP amide:sc= -1.82 F(o=-2.7,f=-1.8) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 MET CE :methyl -134:sc= -2.25 (180deg=-4.53!) USER MOD Single : A 63 GLN : amide:sc= -0.213 K(o=-0.21,f=-1.4) USER MOD Single : A 64 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.17) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 HIS : no HD1:sc= -0.208 X(o=-0.21,f=-0.35) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= -0.194 X(o=-0.19,f=-0.02) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= -0.0618 K(o=-0.062,f=-1) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ -120:sc= -0.143 (180deg=-1.52!) USER MOD ----------------------------------------------------------------- ATOM 40 N ASN A 5 5.570 -6.955 -9.089 1.00 61.45 N ATOM 41 CA ASN A 5 6.809 -7.724 -9.114 1.00 4.14 C ATOM 42 C ASN A 5 6.756 -8.809 -10.185 1.00 32.02 C ATOM 43 O ASN A 5 7.171 -9.946 -9.955 1.00 55.41 O ATOM 44 CB ASN A 5 7.069 -8.356 -7.744 1.00 52.44 C ATOM 45 CG ASN A 5 8.502 -8.827 -7.587 1.00 53.22 C ATOM 46 OD1 ASN A 5 9.371 -8.486 -8.390 1.00 55.11 O ATOM 47 ND2 ASN A 5 8.755 -9.615 -6.549 1.00 34.11 N ATOM 0 HA ASN A 5 7.625 -7.042 -9.354 1.00 4.14 H new ATOM 0 HB2 ASN A 5 6.840 -7.631 -6.963 1.00 52.44 H new ATOM 0 HB3 ASN A 5 6.394 -9.200 -7.602 1.00 52.44 H new ATOM 0 HD21 ASN A 5 9.701 -9.963 -6.392 1.00 34.11 H new ATOM 0 HD22 ASN A 5 8.004 -9.872 -5.909 1.00 34.11 H new ATOM 54 N THR A 6 6.242 -8.450 -11.358 1.00 23.55 N ATOM 55 CA THR A 6 6.134 -9.392 -12.464 1.00 74.43 C ATOM 56 C THR A 6 7.409 -9.410 -13.299 1.00 2.32 C ATOM 57 O THR A 6 7.648 -8.510 -14.105 1.00 41.32 O ATOM 58 CB THR A 6 4.941 -9.051 -13.377 1.00 70.14 C ATOM 59 OG1 THR A 6 3.826 -8.621 -12.588 1.00 25.54 O ATOM 60 CG2 THR A 6 4.540 -10.255 -14.217 1.00 2.23 C ATOM 0 H THR A 6 5.894 -7.514 -11.566 1.00 23.55 H new ATOM 0 HA THR A 6 5.977 -10.377 -12.025 1.00 74.43 H new ATOM 0 HB THR A 6 5.244 -8.246 -14.046 1.00 70.14 H new ATOM 0 HG1 THR A 6 3.073 -8.405 -13.177 1.00 25.54 H new ATOM 0 HG21 THR A 6 3.696 -9.990 -14.853 1.00 2.23 H new ATOM 0 HG22 THR A 6 5.381 -10.561 -14.839 1.00 2.23 H new ATOM 0 HG23 THR A 6 4.255 -11.078 -13.561 1.00 2.23 H new ATOM 68 N LEU A 7 8.226 -10.439 -13.101 1.00 53.33 N ATOM 69 CA LEU A 7 9.478 -10.574 -13.837 1.00 42.20 C ATOM 70 C LEU A 7 9.265 -11.337 -15.140 1.00 55.24 C ATOM 71 O LEU A 7 8.488 -12.291 -15.192 1.00 54.33 O ATOM 72 CB LEU A 7 10.522 -11.290 -12.979 1.00 21.34 C ATOM 73 CG LEU A 7 11.036 -10.518 -11.763 1.00 30.10 C ATOM 74 CD1 LEU A 7 11.672 -11.466 -10.758 1.00 62.23 C ATOM 75 CD2 LEU A 7 12.029 -9.448 -12.192 1.00 11.32 C ATOM 0 H LEU A 7 8.044 -11.192 -12.437 1.00 53.33 H new ATOM 0 HA LEU A 7 9.838 -9.574 -14.078 1.00 42.20 H new ATOM 0 HB2 LEU A 7 10.095 -12.231 -12.633 1.00 21.34 H new ATOM 0 HB3 LEU A 7 11.373 -11.540 -13.612 1.00 21.34 H new ATOM 0 HG LEU A 7 10.189 -10.028 -11.283 1.00 30.10 H new ATOM 0 HD11 LEU A 7 12.032 -10.898 -9.900 1.00 62.23 H new ATOM 0 HD12 LEU A 7 10.932 -12.195 -10.427 1.00 62.23 H new ATOM 0 HD13 LEU A 7 12.508 -11.985 -11.226 1.00 62.23 H new ATOM 0 HD21 LEU A 7 12.384 -8.909 -11.314 1.00 11.32 H new ATOM 0 HD22 LEU A 7 12.874 -9.917 -12.696 1.00 11.32 H new ATOM 0 HD23 LEU A 7 11.541 -8.751 -12.873 1.00 11.32 H new ATOM 87 N ILE A 8 9.960 -10.912 -16.190 1.00 1.44 N ATOM 88 CA ILE A 8 9.849 -11.557 -17.492 1.00 32.12 C ATOM 89 C ILE A 8 11.160 -11.466 -18.264 1.00 63.14 C ATOM 90 O ILE A 8 12.167 -10.984 -17.745 1.00 14.22 O ATOM 91 CB ILE A 8 8.724 -10.930 -18.336 1.00 72.25 C ATOM 92 CG1 ILE A 8 9.058 -9.475 -18.671 1.00 61.12 C ATOM 93 CG2 ILE A 8 7.396 -11.018 -17.599 1.00 60.11 C ATOM 94 CD1 ILE A 8 8.037 -8.811 -19.568 1.00 35.23 C ATOM 0 H ILE A 8 10.606 -10.123 -16.164 1.00 1.44 H new ATOM 0 HA ILE A 8 9.612 -12.605 -17.306 1.00 32.12 H new ATOM 0 HB ILE A 8 8.637 -11.487 -19.269 1.00 72.25 H new ATOM 0 HG12 ILE A 8 9.139 -8.907 -17.744 1.00 61.12 H new ATOM 0 HG13 ILE A 8 10.034 -9.437 -19.155 1.00 61.12 H new ATOM 0 HG21 ILE A 8 6.611 -10.571 -18.209 1.00 60.11 H new ATOM 0 HG22 ILE A 8 7.155 -12.064 -17.407 1.00 60.11 H new ATOM 0 HG23 ILE A 8 7.469 -10.483 -16.652 1.00 60.11 H new ATOM 0 HD11 ILE A 8 8.339 -7.782 -19.763 1.00 35.23 H new ATOM 0 HD12 ILE A 8 7.972 -9.355 -20.510 1.00 35.23 H new ATOM 0 HD13 ILE A 8 7.064 -8.817 -19.078 1.00 35.23 H new ATOM 106 N SER A 9 11.141 -11.931 -19.509 1.00 71.43 N ATOM 107 CA SER A 9 12.329 -11.905 -20.354 1.00 42.40 C ATOM 108 C SER A 9 11.949 -11.977 -21.830 1.00 14.13 C ATOM 109 O SER A 9 11.682 -13.054 -22.362 1.00 34.52 O ATOM 110 CB SER A 9 13.260 -13.065 -19.998 1.00 70.53 C ATOM 111 OG SER A 9 12.521 -14.215 -19.622 1.00 41.23 O ATOM 0 H SER A 9 10.315 -12.331 -19.955 1.00 71.43 H new ATOM 0 HA SER A 9 12.849 -10.964 -20.177 1.00 42.40 H new ATOM 0 HB2 SER A 9 13.896 -13.300 -20.852 1.00 70.53 H new ATOM 0 HB3 SER A 9 13.919 -12.769 -19.182 1.00 70.53 H new ATOM 0 HG SER A 9 13.139 -14.943 -19.401 1.00 41.23 H new ATOM 117 N VAL A 10 11.926 -10.821 -22.486 1.00 32.12 N ATOM 118 CA VAL A 10 11.579 -10.752 -23.900 1.00 41.43 C ATOM 119 C VAL A 10 12.737 -10.198 -24.723 1.00 52.23 C ATOM 120 O VAL A 10 13.396 -9.240 -24.320 1.00 1.51 O ATOM 121 CB VAL A 10 10.334 -9.875 -24.131 1.00 1.44 C ATOM 122 CG1 VAL A 10 10.638 -8.420 -23.807 1.00 44.33 C ATOM 123 CG2 VAL A 10 9.839 -10.019 -25.562 1.00 14.14 C ATOM 0 H VAL A 10 12.144 -9.920 -22.061 1.00 32.12 H new ATOM 0 HA VAL A 10 11.361 -11.770 -24.222 1.00 41.43 H new ATOM 0 HB VAL A 10 9.543 -10.214 -23.462 1.00 1.44 H new ATOM 0 HG11 VAL A 10 9.747 -7.816 -23.976 1.00 44.33 H new ATOM 0 HG12 VAL A 10 10.941 -8.335 -22.763 1.00 44.33 H new ATOM 0 HG13 VAL A 10 11.444 -8.065 -24.449 1.00 44.33 H new ATOM 0 HG21 VAL A 10 8.959 -9.393 -25.707 1.00 14.14 H new ATOM 0 HG22 VAL A 10 10.624 -9.708 -26.252 1.00 14.14 H new ATOM 0 HG23 VAL A 10 9.579 -11.060 -25.754 1.00 14.14 H new ATOM 133 N ASP A 11 12.978 -10.807 -25.879 1.00 2.21 N ATOM 134 CA ASP A 11 14.056 -10.374 -26.761 1.00 11.22 C ATOM 135 C ASP A 11 13.498 -9.815 -28.066 1.00 65.44 C ATOM 136 O ASP A 11 12.309 -9.950 -28.353 1.00 54.10 O ATOM 137 CB ASP A 11 15.003 -11.538 -27.053 1.00 65.31 C ATOM 138 CG ASP A 11 14.501 -12.426 -28.174 1.00 72.34 C ATOM 139 OD1 ASP A 11 13.432 -13.049 -28.004 1.00 1.12 O ATOM 140 OD2 ASP A 11 15.177 -12.499 -29.222 1.00 73.33 O ATOM 0 H ASP A 11 12.442 -11.602 -26.227 1.00 2.21 H new ATOM 0 HA ASP A 11 14.611 -9.583 -26.256 1.00 11.22 H new ATOM 0 HB2 ASP A 11 15.985 -11.146 -27.316 1.00 65.31 H new ATOM 0 HB3 ASP A 11 15.130 -12.135 -26.150 1.00 65.31 H new ATOM 145 N TYR A 12 14.365 -9.188 -28.853 1.00 44.22 N ATOM 146 CA TYR A 12 13.959 -8.606 -30.127 1.00 1.42 C ATOM 147 C TYR A 12 15.161 -8.036 -30.874 1.00 3.14 C ATOM 148 O TYR A 12 16.267 -7.977 -30.337 1.00 62.14 O ATOM 149 CB TYR A 12 12.918 -7.508 -29.901 1.00 1.03 C ATOM 150 CG TYR A 12 13.285 -6.544 -28.795 1.00 72.11 C ATOM 151 CD1 TYR A 12 14.409 -5.734 -28.897 1.00 53.32 C ATOM 152 CD2 TYR A 12 12.506 -6.443 -27.648 1.00 65.14 C ATOM 153 CE1 TYR A 12 14.748 -4.852 -27.889 1.00 72.30 C ATOM 154 CE2 TYR A 12 12.837 -5.563 -26.636 1.00 21.42 C ATOM 155 CZ TYR A 12 13.959 -4.771 -26.761 1.00 11.44 C ATOM 156 OH TYR A 12 14.293 -3.893 -25.755 1.00 15.23 O ATOM 0 H TYR A 12 15.354 -9.070 -28.631 1.00 44.22 H new ATOM 0 HA TYR A 12 13.518 -9.397 -30.734 1.00 1.42 H new ATOM 0 HB2 TYR A 12 12.783 -6.950 -30.828 1.00 1.03 H new ATOM 0 HB3 TYR A 12 11.960 -7.971 -29.665 1.00 1.03 H new ATOM 0 HD1 TYR A 12 15.029 -5.795 -29.780 1.00 53.32 H new ATOM 0 HD2 TYR A 12 11.627 -7.063 -27.546 1.00 65.14 H new ATOM 0 HE1 TYR A 12 15.626 -4.230 -27.984 1.00 72.30 H new ATOM 0 HE2 TYR A 12 12.221 -5.496 -25.752 1.00 21.42 H new ATOM 0 HH TYR A 12 15.236 -4.011 -25.517 1.00 15.23 H new ATOM 166 N GLU A 13 14.935 -7.617 -32.115 1.00 34.13 N ATOM 167 CA GLU A 13 15.999 -7.052 -32.936 1.00 12.01 C ATOM 168 C GLU A 13 15.587 -5.697 -33.503 1.00 53.35 C ATOM 169 O GLU A 13 15.088 -5.608 -34.626 1.00 10.12 O ATOM 170 CB GLU A 13 16.355 -8.008 -34.076 1.00 44.34 C ATOM 171 CG GLU A 13 15.147 -8.515 -34.846 1.00 23.15 C ATOM 172 CD GLU A 13 14.631 -9.838 -34.314 1.00 61.33 C ATOM 173 OE1 GLU A 13 15.081 -10.258 -33.228 1.00 31.22 O ATOM 174 OE2 GLU A 13 13.777 -10.454 -34.986 1.00 14.31 O ATOM 0 H GLU A 13 14.025 -7.658 -32.574 1.00 34.13 H new ATOM 0 HA GLU A 13 16.875 -6.910 -32.304 1.00 12.01 H new ATOM 0 HB2 GLU A 13 17.029 -7.501 -34.767 1.00 44.34 H new ATOM 0 HB3 GLU A 13 16.899 -8.860 -33.668 1.00 44.34 H new ATOM 0 HG2 GLU A 13 14.351 -7.772 -34.796 1.00 23.15 H new ATOM 0 HG3 GLU A 13 15.412 -8.629 -35.897 1.00 23.15 H new ATOM 181 N ILE A 14 15.798 -4.645 -32.720 1.00 4.21 N ATOM 182 CA ILE A 14 15.450 -3.294 -33.144 1.00 32.50 C ATOM 183 C ILE A 14 16.035 -2.981 -34.517 1.00 21.13 C ATOM 184 O ILE A 14 17.138 -3.418 -34.848 1.00 15.00 O ATOM 185 CB ILE A 14 15.945 -2.242 -32.135 1.00 0.13 C ATOM 186 CG1 ILE A 14 15.334 -2.498 -30.756 1.00 34.53 C ATOM 187 CG2 ILE A 14 15.603 -0.841 -32.619 1.00 73.05 C ATOM 188 CD1 ILE A 14 13.821 -2.508 -30.758 1.00 0.44 C ATOM 0 H ILE A 14 16.208 -4.702 -31.788 1.00 4.21 H new ATOM 0 HA ILE A 14 14.362 -3.250 -33.197 1.00 32.50 H new ATOM 0 HB ILE A 14 17.029 -2.323 -32.052 1.00 0.13 H new ATOM 0 HG12 ILE A 14 15.695 -3.455 -30.379 1.00 34.53 H new ATOM 0 HG13 ILE A 14 15.683 -1.731 -30.065 1.00 34.53 H new ATOM 0 HG21 ILE A 14 15.960 -0.109 -31.895 1.00 73.05 H new ATOM 0 HG22 ILE A 14 16.081 -0.662 -33.582 1.00 73.05 H new ATOM 0 HG23 ILE A 14 14.522 -0.747 -32.728 1.00 73.05 H new ATOM 0 HD11 ILE A 14 13.457 -2.695 -29.748 1.00 0.44 H new ATOM 0 HD12 ILE A 14 13.451 -1.543 -31.104 1.00 0.44 H new ATOM 0 HD13 ILE A 14 13.463 -3.293 -31.424 1.00 0.44 H new ATOM 200 N PHE A 15 15.291 -2.220 -35.312 1.00 15.34 N ATOM 201 CA PHE A 15 15.736 -1.846 -36.649 1.00 73.21 C ATOM 202 C PHE A 15 16.269 -0.417 -36.665 1.00 43.33 C ATOM 203 O PHE A 15 16.456 0.200 -35.617 1.00 71.12 O ATOM 204 CB PHE A 15 14.586 -1.985 -37.649 1.00 64.05 C ATOM 205 CG PHE A 15 13.790 -3.246 -37.476 1.00 34.41 C ATOM 206 CD1 PHE A 15 14.423 -4.476 -37.397 1.00 30.20 C ATOM 207 CD2 PHE A 15 12.407 -3.202 -37.391 1.00 64.21 C ATOM 208 CE1 PHE A 15 13.692 -5.638 -37.238 1.00 60.31 C ATOM 209 CE2 PHE A 15 11.671 -4.361 -37.232 1.00 21.13 C ATOM 210 CZ PHE A 15 12.315 -5.581 -37.154 1.00 55.41 C ATOM 0 H PHE A 15 14.376 -1.850 -35.053 1.00 15.34 H new ATOM 0 HA PHE A 15 16.543 -2.519 -36.938 1.00 73.21 H new ATOM 0 HB2 PHE A 15 13.920 -1.128 -37.546 1.00 64.05 H new ATOM 0 HB3 PHE A 15 14.990 -1.956 -38.661 1.00 64.05 H new ATOM 0 HD1 PHE A 15 15.500 -4.527 -37.460 1.00 30.20 H new ATOM 0 HD2 PHE A 15 11.899 -2.251 -37.450 1.00 64.21 H new ATOM 0 HE1 PHE A 15 14.198 -6.590 -37.179 1.00 60.31 H new ATOM 0 HE2 PHE A 15 10.594 -4.313 -37.169 1.00 21.13 H new ATOM 0 HZ PHE A 15 11.743 -6.488 -37.028 1.00 55.41 H new ATOM 220 N GLY A 16 16.513 0.104 -37.864 1.00 45.02 N ATOM 221 CA GLY A 16 17.024 1.456 -37.996 1.00 11.24 C ATOM 222 C GLY A 16 18.443 1.491 -38.528 1.00 55.13 C ATOM 223 O GLY A 16 19.069 0.448 -38.718 1.00 11.22 O ATOM 0 H GLY A 16 16.366 -0.386 -38.746 1.00 45.02 H new ATOM 0 HA2 GLY A 16 16.375 2.023 -38.664 1.00 11.24 H new ATOM 0 HA3 GLY A 16 16.991 1.950 -37.025 1.00 11.24 H new ATOM 227 N LYS A 17 18.952 2.694 -38.773 1.00 34.14 N ATOM 228 CA LYS A 17 20.305 2.862 -39.287 1.00 44.23 C ATOM 229 C LYS A 17 21.336 2.680 -38.178 1.00 30.32 C ATOM 230 O LYS A 17 22.072 3.607 -37.842 1.00 1.53 O ATOM 231 CB LYS A 17 20.463 4.246 -39.922 1.00 64.32 C ATOM 232 CG LYS A 17 20.050 5.385 -39.007 1.00 41.53 C ATOM 233 CD LYS A 17 20.618 6.713 -39.479 1.00 44.41 C ATOM 234 CE LYS A 17 21.995 6.973 -38.886 1.00 70.33 C ATOM 235 NZ LYS A 17 22.484 8.344 -39.199 1.00 64.24 N ATOM 0 H LYS A 17 18.447 3.567 -38.623 1.00 34.14 H new ATOM 0 HA LYS A 17 20.475 2.098 -40.046 1.00 44.23 H new ATOM 0 HB2 LYS A 17 21.504 4.385 -40.215 1.00 64.32 H new ATOM 0 HB3 LYS A 17 19.867 4.289 -40.833 1.00 64.32 H new ATOM 0 HG2 LYS A 17 18.962 5.446 -38.969 1.00 41.53 H new ATOM 0 HG3 LYS A 17 20.393 5.181 -37.993 1.00 41.53 H new ATOM 0 HD2 LYS A 17 20.683 6.716 -40.567 1.00 44.41 H new ATOM 0 HD3 LYS A 17 19.941 7.520 -39.198 1.00 44.41 H new ATOM 0 HE2 LYS A 17 21.956 6.839 -37.805 1.00 70.33 H new ATOM 0 HE3 LYS A 17 22.701 6.238 -39.273 1.00 70.33 H new ATOM 0 HZ1 LYS A 17 23.425 8.482 -38.778 1.00 64.24 H new ATOM 0 HZ2 LYS A 17 22.546 8.464 -40.230 1.00 64.24 H new ATOM 0 HZ3 LYS A 17 21.823 9.046 -38.808 1.00 64.24 H new ATOM 249 N VAL A 18 21.384 1.477 -37.613 1.00 3.30 N ATOM 250 CA VAL A 18 22.327 1.172 -36.543 1.00 53.51 C ATOM 251 C VAL A 18 23.592 0.525 -37.093 1.00 63.35 C ATOM 252 O VAL A 18 24.276 -0.219 -36.391 1.00 32.31 O ATOM 253 CB VAL A 18 21.700 0.237 -35.492 1.00 74.03 C ATOM 254 CG1 VAL A 18 20.505 0.904 -34.828 1.00 51.32 C ATOM 255 CG2 VAL A 18 21.297 -1.085 -36.129 1.00 52.40 C ATOM 0 H VAL A 18 20.781 0.698 -37.878 1.00 3.30 H new ATOM 0 HA VAL A 18 22.584 2.119 -36.068 1.00 53.51 H new ATOM 0 HB VAL A 18 22.445 0.032 -34.723 1.00 74.03 H new ATOM 0 HG11 VAL A 18 20.075 0.228 -34.089 1.00 51.32 H new ATOM 0 HG12 VAL A 18 20.827 1.822 -34.336 1.00 51.32 H new ATOM 0 HG13 VAL A 18 19.755 1.141 -35.582 1.00 51.32 H new ATOM 0 HG21 VAL A 18 20.856 -1.734 -35.372 1.00 52.40 H new ATOM 0 HG22 VAL A 18 20.569 -0.901 -36.919 1.00 52.40 H new ATOM 0 HG23 VAL A 18 22.177 -1.568 -36.553 1.00 52.40 H new ATOM 265 N GLN A 19 23.898 0.814 -38.354 1.00 70.53 N ATOM 266 CA GLN A 19 25.082 0.258 -38.999 1.00 41.51 C ATOM 267 C GLN A 19 26.311 1.114 -38.709 1.00 62.41 C ATOM 268 O GLN A 19 27.211 0.698 -37.981 1.00 22.13 O ATOM 269 CB GLN A 19 24.864 0.153 -40.509 1.00 42.25 C ATOM 270 CG GLN A 19 23.851 -0.909 -40.905 1.00 40.35 C ATOM 271 CD GLN A 19 23.509 -0.867 -42.382 1.00 14.13 C ATOM 272 OE1 GLN A 19 22.976 0.125 -42.879 1.00 51.44 O ATOM 273 NE2 GLN A 19 23.814 -1.947 -43.091 1.00 75.22 N ATOM 0 H GLN A 19 23.343 1.429 -38.949 1.00 70.53 H new ATOM 0 HA GLN A 19 25.252 -0.739 -38.594 1.00 41.51 H new ATOM 0 HB2 GLN A 19 24.532 1.120 -40.888 1.00 42.25 H new ATOM 0 HB3 GLN A 19 25.817 -0.068 -40.991 1.00 42.25 H new ATOM 0 HG2 GLN A 19 24.246 -1.894 -40.655 1.00 40.35 H new ATOM 0 HG3 GLN A 19 22.941 -0.773 -40.321 1.00 40.35 H new ATOM 0 HE21 GLN A 19 24.255 -2.747 -42.637 1.00 75.22 H new ATOM 0 HE22 GLN A 19 23.607 -1.977 -44.089 1.00 75.22 H new ATOM 282 N GLY A 20 26.342 2.312 -39.285 1.00 70.31 N ATOM 283 CA GLY A 20 27.466 3.206 -39.077 1.00 15.33 C ATOM 284 C GLY A 20 27.364 3.970 -37.771 1.00 63.21 C ATOM 285 O GLY A 20 27.328 5.200 -37.764 1.00 54.33 O ATOM 0 H GLY A 20 25.609 2.679 -39.892 1.00 70.31 H new ATOM 0 HA2 GLY A 20 28.391 2.630 -39.086 1.00 15.33 H new ATOM 0 HA3 GLY A 20 27.522 3.913 -39.905 1.00 15.33 H new ATOM 289 N VAL A 21 27.317 3.239 -36.662 1.00 22.21 N ATOM 290 CA VAL A 21 27.219 3.855 -35.344 1.00 72.30 C ATOM 291 C VAL A 21 27.648 2.883 -34.250 1.00 50.41 C ATOM 292 O VAL A 21 27.083 1.798 -34.111 1.00 52.44 O ATOM 293 CB VAL A 21 25.784 4.335 -35.055 1.00 3.22 C ATOM 294 CG1 VAL A 21 24.795 3.191 -35.215 1.00 61.22 C ATOM 295 CG2 VAL A 21 25.695 4.936 -33.660 1.00 42.32 C ATOM 0 H VAL A 21 27.345 2.219 -36.650 1.00 22.21 H new ATOM 0 HA VAL A 21 27.889 4.715 -35.345 1.00 72.30 H new ATOM 0 HB VAL A 21 25.526 5.109 -35.777 1.00 3.22 H new ATOM 0 HG11 VAL A 21 23.787 3.550 -35.007 1.00 61.22 H new ATOM 0 HG12 VAL A 21 24.841 2.810 -36.235 1.00 61.22 H new ATOM 0 HG13 VAL A 21 25.047 2.392 -34.518 1.00 61.22 H new ATOM 0 HG21 VAL A 21 24.675 5.270 -33.472 1.00 42.32 H new ATOM 0 HG22 VAL A 21 25.972 4.184 -32.921 1.00 42.32 H new ATOM 0 HG23 VAL A 21 26.374 5.785 -33.586 1.00 42.32 H new ATOM 305 N PHE A 22 28.651 3.281 -33.474 1.00 61.52 N ATOM 306 CA PHE A 22 29.157 2.445 -32.392 1.00 23.14 C ATOM 307 C PHE A 22 28.781 3.028 -31.033 1.00 3.53 C ATOM 308 O PHE A 22 29.504 2.859 -30.050 1.00 73.13 O ATOM 309 CB PHE A 22 30.677 2.304 -32.496 1.00 23.23 C ATOM 310 CG PHE A 22 31.197 1.004 -31.952 1.00 4.15 C ATOM 311 CD1 PHE A 22 31.128 -0.156 -32.706 1.00 40.45 C ATOM 312 CD2 PHE A 22 31.755 0.942 -30.685 1.00 21.04 C ATOM 313 CE1 PHE A 22 31.606 -1.353 -32.209 1.00 21.32 C ATOM 314 CE2 PHE A 22 32.235 -0.253 -30.182 1.00 1.41 C ATOM 315 CZ PHE A 22 32.159 -1.402 -30.944 1.00 44.14 C ATOM 0 H PHE A 22 29.129 4.177 -33.574 1.00 61.52 H new ATOM 0 HA PHE A 22 28.700 1.459 -32.484 1.00 23.14 H new ATOM 0 HB2 PHE A 22 30.972 2.395 -33.541 1.00 23.23 H new ATOM 0 HB3 PHE A 22 31.148 3.128 -31.959 1.00 23.23 H new ATOM 0 HD1 PHE A 22 30.695 -0.124 -33.695 1.00 40.45 H new ATOM 0 HD2 PHE A 22 31.816 1.837 -30.084 1.00 21.04 H new ATOM 0 HE1 PHE A 22 31.547 -2.249 -32.809 1.00 21.32 H new ATOM 0 HE2 PHE A 22 32.669 -0.288 -29.194 1.00 1.41 H new ATOM 0 HZ PHE A 22 32.531 -2.337 -30.552 1.00 44.14 H new ATOM 325 N PHE A 23 27.646 3.717 -30.985 1.00 51.31 N ATOM 326 CA PHE A 23 27.174 4.328 -29.748 1.00 14.01 C ATOM 327 C PHE A 23 26.379 3.326 -28.915 1.00 64.23 C ATOM 328 O PHE A 23 25.173 3.480 -28.723 1.00 3.33 O ATOM 329 CB PHE A 23 26.308 5.551 -30.056 1.00 51.43 C ATOM 330 CG PHE A 23 27.092 6.827 -30.173 1.00 25.12 C ATOM 331 CD1 PHE A 23 27.738 7.362 -29.070 1.00 13.23 C ATOM 332 CD2 PHE A 23 27.184 7.491 -31.386 1.00 23.15 C ATOM 333 CE1 PHE A 23 28.461 8.536 -29.174 1.00 32.44 C ATOM 334 CE2 PHE A 23 27.906 8.664 -31.496 1.00 2.25 C ATOM 335 CZ PHE A 23 28.544 9.188 -30.388 1.00 62.10 C ATOM 0 H PHE A 23 27.036 3.866 -31.789 1.00 51.31 H new ATOM 0 HA PHE A 23 28.045 4.643 -29.173 1.00 14.01 H new ATOM 0 HB2 PHE A 23 25.768 5.379 -30.987 1.00 51.43 H new ATOM 0 HB3 PHE A 23 25.561 5.664 -29.271 1.00 51.43 H new ATOM 0 HD1 PHE A 23 27.676 6.856 -28.118 1.00 13.23 H new ATOM 0 HD2 PHE A 23 26.686 7.087 -32.255 1.00 23.15 H new ATOM 0 HE1 PHE A 23 28.960 8.942 -28.307 1.00 32.44 H new ATOM 0 HE2 PHE A 23 27.972 9.171 -32.447 1.00 2.25 H new ATOM 0 HZ PHE A 23 29.107 10.106 -30.472 1.00 62.10 H new ATOM 345 N ARG A 24 27.065 2.298 -28.425 1.00 11.31 N ATOM 346 CA ARG A 24 26.424 1.269 -27.615 1.00 2.44 C ATOM 347 C ARG A 24 26.828 1.401 -26.149 1.00 44.42 C ATOM 348 O ARG A 24 26.923 0.408 -25.428 1.00 10.01 O ATOM 349 CB ARG A 24 26.793 -0.122 -28.133 1.00 43.43 C ATOM 350 CG ARG A 24 28.260 -0.473 -27.943 1.00 73.21 C ATOM 351 CD ARG A 24 28.531 -1.931 -28.280 1.00 22.13 C ATOM 352 NE ARG A 24 29.942 -2.275 -28.126 1.00 3.30 N ATOM 353 CZ ARG A 24 30.508 -3.331 -28.699 1.00 21.21 C ATOM 354 NH1 ARG A 24 29.787 -4.143 -29.460 1.00 14.42 N ATOM 355 NH2 ARG A 24 31.798 -3.578 -28.512 1.00 4.44 N ATOM 0 H ARG A 24 28.064 2.156 -28.575 1.00 11.31 H new ATOM 0 HA ARG A 24 25.345 1.403 -27.691 1.00 2.44 H new ATOM 0 HB2 ARG A 24 26.181 -0.865 -27.622 1.00 43.43 H new ATOM 0 HB3 ARG A 24 26.548 -0.182 -29.193 1.00 43.43 H new ATOM 0 HG2 ARG A 24 28.874 0.168 -28.576 1.00 73.21 H new ATOM 0 HG3 ARG A 24 28.552 -0.276 -26.911 1.00 73.21 H new ATOM 0 HD2 ARG A 24 27.929 -2.570 -27.634 1.00 22.13 H new ATOM 0 HD3 ARG A 24 28.219 -2.130 -29.305 1.00 22.13 H new ATOM 0 HE ARG A 24 30.525 -1.671 -27.546 1.00 3.30 H new ATOM 0 HH11 ARG A 24 28.795 -3.957 -29.607 1.00 14.42 H new ATOM 0 HH12 ARG A 24 30.225 -4.953 -29.899 1.00 14.42 H new ATOM 0 HH21 ARG A 24 32.357 -2.956 -27.927 1.00 4.44 H new ATOM 0 HH22 ARG A 24 32.231 -4.390 -28.953 1.00 4.44 H new ATOM 369 N LYS A 25 27.066 2.634 -25.715 1.00 44.42 N ATOM 370 CA LYS A 25 27.460 2.898 -24.336 1.00 51.12 C ATOM 371 C LYS A 25 26.305 3.507 -23.548 1.00 34.33 C ATOM 372 O LYS A 25 26.272 3.434 -22.319 1.00 4.52 O ATOM 373 CB LYS A 25 28.667 3.838 -24.299 1.00 63.34 C ATOM 374 CG LYS A 25 29.101 4.216 -22.894 1.00 22.32 C ATOM 375 CD LYS A 25 30.422 4.967 -22.901 1.00 51.10 C ATOM 376 CE LYS A 25 31.600 4.023 -23.087 1.00 75.41 C ATOM 377 NZ LYS A 25 31.854 3.207 -21.868 1.00 23.14 N ATOM 0 H LYS A 25 26.993 3.467 -26.299 1.00 44.42 H new ATOM 0 HA LYS A 25 27.732 1.949 -23.875 1.00 51.12 H new ATOM 0 HB2 LYS A 25 29.503 3.363 -24.813 1.00 63.34 H new ATOM 0 HB3 LYS A 25 28.427 4.746 -24.853 1.00 63.34 H new ATOM 0 HG2 LYS A 25 28.333 4.834 -22.429 1.00 22.32 H new ATOM 0 HG3 LYS A 25 29.197 3.316 -22.287 1.00 22.32 H new ATOM 0 HD2 LYS A 25 30.417 5.706 -23.702 1.00 51.10 H new ATOM 0 HD3 LYS A 25 30.536 5.513 -21.964 1.00 51.10 H new ATOM 0 HE2 LYS A 25 31.406 3.363 -23.932 1.00 75.41 H new ATOM 0 HE3 LYS A 25 32.492 4.599 -23.331 1.00 75.41 H new ATOM 0 HZ1 LYS A 25 32.789 2.757 -21.940 1.00 23.14 H new ATOM 0 HZ2 LYS A 25 31.828 3.820 -21.028 1.00 23.14 H new ATOM 0 HZ3 LYS A 25 31.122 2.473 -21.783 1.00 23.14 H new ATOM 391 N HIS A 26 25.357 4.105 -24.262 1.00 53.12 N ATOM 392 CA HIS A 26 24.198 4.724 -23.629 1.00 10.44 C ATOM 393 C HIS A 26 23.127 3.683 -23.319 1.00 11.03 C ATOM 394 O HIS A 26 22.326 3.855 -22.399 1.00 73.23 O ATOM 395 CB HIS A 26 23.619 5.815 -24.530 1.00 45.24 C ATOM 396 CG HIS A 26 22.879 5.281 -25.718 1.00 21.35 C ATOM 397 ND1 HIS A 26 23.501 4.629 -26.762 1.00 1.52 N ATOM 398 CD2 HIS A 26 21.560 5.302 -26.022 1.00 3.33 C ATOM 399 CE1 HIS A 26 22.597 4.275 -27.658 1.00 3.23 C ATOM 400 NE2 HIS A 26 21.411 4.671 -27.232 1.00 43.43 N ATOM 0 H HIS A 26 25.369 4.174 -25.280 1.00 53.12 H new ATOM 0 HA HIS A 26 24.525 5.174 -22.691 1.00 10.44 H new ATOM 0 HB2 HIS A 26 22.945 6.440 -23.943 1.00 45.24 H new ATOM 0 HB3 HIS A 26 24.429 6.457 -24.876 1.00 45.24 H new ATOM 0 HD2 HIS A 26 20.772 5.735 -25.424 1.00 3.33 H new ATOM 0 HE1 HIS A 26 22.794 3.751 -28.582 1.00 3.23 H new ATOM 0 HE2 HIS A 26 20.528 4.531 -27.723 1.00 43.43 H new ATOM 408 N THR A 27 23.118 2.602 -24.093 1.00 33.04 N ATOM 409 CA THR A 27 22.144 1.534 -23.902 1.00 45.02 C ATOM 410 C THR A 27 22.319 0.867 -22.542 1.00 53.35 C ATOM 411 O THR A 27 21.345 0.629 -21.829 1.00 55.03 O ATOM 412 CB THR A 27 22.261 0.464 -25.005 1.00 3.45 C ATOM 413 OG1 THR A 27 22.934 1.008 -26.146 1.00 0.34 O ATOM 414 CG2 THR A 27 20.887 -0.043 -25.414 1.00 11.00 C ATOM 0 H THR A 27 23.774 2.443 -24.858 1.00 33.04 H new ATOM 0 HA THR A 27 21.157 1.993 -23.954 1.00 45.02 H new ATOM 0 HB THR A 27 22.837 -0.373 -24.610 1.00 3.45 H new ATOM 0 HG1 THR A 27 23.148 0.287 -26.774 1.00 0.34 H new ATOM 0 HG21 THR A 27 20.995 -0.797 -26.194 1.00 11.00 H new ATOM 0 HG22 THR A 27 20.389 -0.483 -24.550 1.00 11.00 H new ATOM 0 HG23 THR A 27 20.291 0.787 -25.792 1.00 11.00 H new ATOM 422 N GLN A 28 23.565 0.569 -22.190 1.00 1.40 N ATOM 423 CA GLN A 28 23.866 -0.070 -20.915 1.00 34.24 C ATOM 424 C GLN A 28 23.362 0.776 -19.750 1.00 23.45 C ATOM 425 O GLN A 28 23.017 0.250 -18.692 1.00 25.23 O ATOM 426 CB GLN A 28 25.371 -0.302 -20.779 1.00 24.43 C ATOM 427 CG GLN A 28 26.158 0.965 -20.484 1.00 62.51 C ATOM 428 CD GLN A 28 26.438 1.147 -19.005 1.00 54.44 C ATOM 429 OE1 GLN A 28 26.064 2.160 -18.412 1.00 21.53 O ATOM 430 NE2 GLN A 28 27.098 0.166 -18.402 1.00 13.14 N ATOM 0 H GLN A 28 24.382 0.760 -22.770 1.00 1.40 H new ATOM 0 HA GLN A 28 23.354 -1.032 -20.890 1.00 34.24 H new ATOM 0 HB2 GLN A 28 25.548 -1.024 -19.982 1.00 24.43 H new ATOM 0 HB3 GLN A 28 25.746 -0.747 -21.701 1.00 24.43 H new ATOM 0 HG2 GLN A 28 27.102 0.937 -21.028 1.00 62.51 H new ATOM 0 HG3 GLN A 28 25.603 1.827 -20.854 1.00 62.51 H new ATOM 0 HE21 GLN A 28 27.388 -0.655 -18.933 1.00 13.14 H new ATOM 0 HE22 GLN A 28 27.315 0.233 -17.408 1.00 13.14 H new ATOM 439 N ALA A 29 23.324 2.089 -19.951 1.00 75.43 N ATOM 440 CA ALA A 29 22.861 3.007 -18.918 1.00 70.12 C ATOM 441 C ALA A 29 21.344 3.154 -18.954 1.00 34.13 C ATOM 442 O ALA A 29 20.700 3.292 -17.914 1.00 23.21 O ATOM 443 CB ALA A 29 23.529 4.364 -19.081 1.00 53.32 C ATOM 0 H ALA A 29 23.608 2.541 -20.820 1.00 75.43 H new ATOM 0 HA ALA A 29 23.136 2.593 -17.948 1.00 70.12 H new ATOM 0 HB1 ALA A 29 23.174 5.040 -18.303 1.00 53.32 H new ATOM 0 HB2 ALA A 29 24.610 4.250 -18.997 1.00 53.32 H new ATOM 0 HB3 ALA A 29 23.282 4.776 -20.060 1.00 53.32 H new ATOM 449 N GLU A 30 20.779 3.124 -20.157 1.00 13.13 N ATOM 450 CA GLU A 30 19.336 3.256 -20.326 1.00 64.11 C ATOM 451 C GLU A 30 18.596 2.175 -19.543 1.00 53.52 C ATOM 452 O GLU A 30 17.576 2.442 -18.908 1.00 44.31 O ATOM 453 CB GLU A 30 18.965 3.173 -21.808 1.00 72.40 C ATOM 454 CG GLU A 30 17.905 4.178 -22.227 1.00 64.14 C ATOM 455 CD GLU A 30 17.131 3.733 -23.453 1.00 21.43 C ATOM 456 OE1 GLU A 30 16.919 2.512 -23.610 1.00 52.30 O ATOM 457 OE2 GLU A 30 16.737 4.606 -24.254 1.00 61.43 O ATOM 0 H GLU A 30 21.297 3.010 -21.028 1.00 13.13 H new ATOM 0 HA GLU A 30 19.037 4.230 -19.938 1.00 64.11 H new ATOM 0 HB2 GLU A 30 19.861 3.332 -22.408 1.00 72.40 H new ATOM 0 HB3 GLU A 30 18.608 2.167 -22.029 1.00 72.40 H new ATOM 0 HG2 GLU A 30 17.211 4.334 -21.401 1.00 64.14 H new ATOM 0 HG3 GLU A 30 18.380 5.138 -22.430 1.00 64.14 H new ATOM 464 N GLY A 31 19.117 0.953 -19.595 1.00 14.22 N ATOM 465 CA GLY A 31 18.492 -0.150 -18.888 1.00 4.45 C ATOM 466 C GLY A 31 18.637 -0.030 -17.383 1.00 63.04 C ATOM 467 O GLY A 31 17.766 -0.467 -16.631 1.00 51.22 O ATOM 0 H GLY A 31 19.960 0.707 -20.114 1.00 14.22 H new ATOM 0 HA2 GLY A 31 17.434 -0.190 -19.146 1.00 4.45 H new ATOM 0 HA3 GLY A 31 18.937 -1.088 -19.219 1.00 4.45 H new ATOM 471 N LYS A 32 19.742 0.562 -16.942 1.00 50.03 N ATOM 472 CA LYS A 32 20.000 0.738 -15.518 1.00 52.00 C ATOM 473 C LYS A 32 19.178 1.893 -14.955 1.00 34.21 C ATOM 474 O LYS A 32 18.779 1.875 -13.790 1.00 71.12 O ATOM 475 CB LYS A 32 21.489 0.993 -15.276 1.00 62.20 C ATOM 476 CG LYS A 32 22.386 -0.132 -15.764 1.00 32.14 C ATOM 477 CD LYS A 32 22.607 -1.177 -14.683 1.00 22.01 C ATOM 478 CE LYS A 32 23.511 -0.653 -13.577 1.00 53.34 C ATOM 479 NZ LYS A 32 23.170 -1.245 -12.254 1.00 72.45 N ATOM 0 H LYS A 32 20.474 0.928 -17.551 1.00 50.03 H new ATOM 0 HA LYS A 32 19.706 -0.178 -15.005 1.00 52.00 H new ATOM 0 HB2 LYS A 32 21.776 1.918 -15.775 1.00 62.20 H new ATOM 0 HB3 LYS A 32 21.655 1.142 -14.209 1.00 62.20 H new ATOM 0 HG2 LYS A 32 21.938 -0.602 -16.640 1.00 32.14 H new ATOM 0 HG3 LYS A 32 23.346 0.277 -16.078 1.00 32.14 H new ATOM 0 HD2 LYS A 32 21.647 -1.473 -14.260 1.00 22.01 H new ATOM 0 HD3 LYS A 32 23.050 -2.070 -15.124 1.00 22.01 H new ATOM 0 HE2 LYS A 32 24.549 -0.879 -13.819 1.00 53.34 H new ATOM 0 HE3 LYS A 32 23.426 0.432 -13.522 1.00 53.34 H new ATOM 0 HZ1 LYS A 32 23.968 -1.115 -11.599 1.00 72.45 H new ATOM 0 HZ2 LYS A 32 22.326 -0.774 -11.870 1.00 72.45 H new ATOM 0 HZ3 LYS A 32 22.978 -2.261 -12.367 1.00 72.45 H new ATOM 493 N LYS A 33 18.926 2.896 -15.789 1.00 72.22 N ATOM 494 CA LYS A 33 18.149 4.058 -15.376 1.00 54.44 C ATOM 495 C LYS A 33 16.818 3.633 -14.763 1.00 4.44 C ATOM 496 O LYS A 33 16.276 4.319 -13.894 1.00 64.14 O ATOM 497 CB LYS A 33 17.899 4.981 -16.571 1.00 43.43 C ATOM 498 CG LYS A 33 17.370 6.351 -16.182 1.00 20.20 C ATOM 499 CD LYS A 33 18.467 7.229 -15.604 1.00 42.24 C ATOM 500 CE LYS A 33 18.179 8.705 -15.835 1.00 31.24 C ATOM 501 NZ LYS A 33 19.361 9.556 -15.525 1.00 20.24 N ATOM 0 H LYS A 33 19.249 2.927 -16.756 1.00 72.22 H new ATOM 0 HA LYS A 33 18.722 4.597 -14.621 1.00 54.44 H new ATOM 0 HB2 LYS A 33 18.830 5.104 -17.125 1.00 43.43 H new ATOM 0 HB3 LYS A 33 17.187 4.504 -17.245 1.00 43.43 H new ATOM 0 HG2 LYS A 33 16.937 6.837 -17.057 1.00 20.20 H new ATOM 0 HG3 LYS A 33 16.569 6.239 -15.451 1.00 20.20 H new ATOM 0 HD2 LYS A 33 18.562 7.039 -14.535 1.00 42.24 H new ATOM 0 HD3 LYS A 33 19.422 6.968 -16.060 1.00 42.24 H new ATOM 0 HE2 LYS A 33 17.883 8.859 -16.873 1.00 31.24 H new ATOM 0 HE3 LYS A 33 17.337 9.012 -15.214 1.00 31.24 H new ATOM 0 HZ1 LYS A 33 19.124 10.554 -15.695 1.00 20.24 H new ATOM 0 HZ2 LYS A 33 19.629 9.429 -14.528 1.00 20.24 H new ATOM 0 HZ3 LYS A 33 20.157 9.280 -16.135 1.00 20.24 H new ATOM 515 N LEU A 34 16.298 2.499 -15.217 1.00 52.03 N ATOM 516 CA LEU A 34 15.031 1.982 -14.712 1.00 21.55 C ATOM 517 C LEU A 34 15.265 0.885 -13.678 1.00 31.43 C ATOM 518 O LEU A 34 14.746 0.946 -12.564 1.00 1.41 O ATOM 519 CB LEU A 34 14.182 1.440 -15.863 1.00 44.13 C ATOM 520 CG LEU A 34 13.246 2.444 -16.537 1.00 3.21 C ATOM 521 CD1 LEU A 34 12.512 1.793 -17.699 1.00 11.05 C ATOM 522 CD2 LEU A 34 12.257 3.011 -15.529 1.00 24.24 C ATOM 0 H LEU A 34 16.734 1.919 -15.934 1.00 52.03 H new ATOM 0 HA LEU A 34 14.498 2.803 -14.232 1.00 21.55 H new ATOM 0 HB2 LEU A 34 14.851 1.032 -16.621 1.00 44.13 H new ATOM 0 HB3 LEU A 34 13.583 0.611 -15.487 1.00 44.13 H new ATOM 0 HG LEU A 34 13.846 3.265 -16.928 1.00 3.21 H new ATOM 0 HD11 LEU A 34 11.851 2.523 -18.166 1.00 11.05 H new ATOM 0 HD12 LEU A 34 13.235 1.437 -18.433 1.00 11.05 H new ATOM 0 HD13 LEU A 34 11.923 0.952 -17.332 1.00 11.05 H new ATOM 0 HD21 LEU A 34 11.599 3.724 -16.026 1.00 24.24 H new ATOM 0 HD22 LEU A 34 11.662 2.201 -15.108 1.00 24.24 H new ATOM 0 HD23 LEU A 34 12.801 3.515 -14.730 1.00 24.24 H new ATOM 534 N GLY A 35 16.052 -0.119 -14.054 1.00 50.34 N ATOM 535 CA GLY A 35 16.343 -1.214 -13.148 1.00 33.11 C ATOM 536 C GLY A 35 16.420 -2.550 -13.859 1.00 70.43 C ATOM 537 O GLY A 35 16.980 -3.512 -13.331 1.00 42.12 O ATOM 0 H GLY A 35 16.493 -0.193 -14.971 1.00 50.34 H new ATOM 0 HA2 GLY A 35 17.288 -1.021 -12.641 1.00 33.11 H new ATOM 0 HA3 GLY A 35 15.572 -1.259 -12.378 1.00 33.11 H new ATOM 541 N LEU A 36 15.855 -2.613 -15.060 1.00 22.00 N ATOM 542 CA LEU A 36 15.861 -3.843 -15.845 1.00 11.40 C ATOM 543 C LEU A 36 17.287 -4.270 -16.177 1.00 51.24 C ATOM 544 O LEU A 36 18.244 -3.550 -15.893 1.00 42.22 O ATOM 545 CB LEU A 36 15.060 -3.652 -17.134 1.00 51.31 C ATOM 546 CG LEU A 36 13.733 -2.905 -16.995 1.00 75.42 C ATOM 547 CD1 LEU A 36 12.998 -2.871 -18.326 1.00 53.13 C ATOM 548 CD2 LEU A 36 12.867 -3.551 -15.923 1.00 22.12 C ATOM 0 H LEU A 36 15.387 -1.827 -15.511 1.00 22.00 H new ATOM 0 HA LEU A 36 15.396 -4.628 -15.249 1.00 11.40 H new ATOM 0 HB2 LEU A 36 15.683 -3.115 -17.849 1.00 51.31 H new ATOM 0 HB3 LEU A 36 14.858 -4.634 -17.562 1.00 51.31 H new ATOM 0 HG LEU A 36 13.945 -1.879 -16.694 1.00 75.42 H new ATOM 0 HD11 LEU A 36 12.056 -2.336 -18.208 1.00 53.13 H new ATOM 0 HD12 LEU A 36 13.613 -2.363 -19.069 1.00 53.13 H new ATOM 0 HD13 LEU A 36 12.797 -3.890 -18.657 1.00 53.13 H new ATOM 0 HD21 LEU A 36 11.927 -3.006 -15.838 1.00 22.12 H new ATOM 0 HD22 LEU A 36 12.663 -4.587 -16.195 1.00 22.12 H new ATOM 0 HD23 LEU A 36 13.390 -3.523 -14.967 1.00 22.12 H new ATOM 560 N VAL A 37 17.421 -5.445 -16.783 1.00 61.43 N ATOM 561 CA VAL A 37 18.730 -5.967 -17.158 1.00 72.41 C ATOM 562 C VAL A 37 18.688 -6.619 -18.536 1.00 12.22 C ATOM 563 O VAL A 37 17.617 -6.820 -19.106 1.00 74.24 O ATOM 564 CB VAL A 37 19.239 -6.996 -16.131 1.00 72.31 C ATOM 565 CG1 VAL A 37 19.268 -6.390 -14.737 1.00 13.35 C ATOM 566 CG2 VAL A 37 18.375 -8.248 -16.159 1.00 61.20 C ATOM 0 H VAL A 37 16.639 -6.054 -17.025 1.00 61.43 H new ATOM 0 HA VAL A 37 19.414 -5.119 -17.181 1.00 72.41 H new ATOM 0 HB VAL A 37 20.257 -7.278 -16.399 1.00 72.31 H new ATOM 0 HG11 VAL A 37 19.630 -7.132 -14.025 1.00 13.35 H new ATOM 0 HG12 VAL A 37 19.932 -5.526 -14.730 1.00 13.35 H new ATOM 0 HG13 VAL A 37 18.263 -6.077 -14.455 1.00 13.35 H new ATOM 0 HG21 VAL A 37 18.749 -8.964 -15.427 1.00 61.20 H new ATOM 0 HG22 VAL A 37 17.345 -7.985 -15.916 1.00 61.20 H new ATOM 0 HG23 VAL A 37 18.411 -8.693 -17.153 1.00 61.20 H new ATOM 576 N GLY A 38 19.862 -6.947 -19.065 1.00 64.14 N ATOM 577 CA GLY A 38 19.938 -7.573 -20.373 1.00 32.15 C ATOM 578 C GLY A 38 21.260 -7.311 -21.066 1.00 1.24 C ATOM 579 O GLY A 38 22.323 -7.435 -20.457 1.00 13.43 O ATOM 0 H GLY A 38 20.762 -6.791 -18.612 1.00 64.14 H new ATOM 0 HA2 GLY A 38 19.794 -8.648 -20.267 1.00 32.15 H new ATOM 0 HA3 GLY A 38 19.125 -7.203 -20.997 1.00 32.15 H new ATOM 583 N TRP A 39 21.195 -6.949 -22.342 1.00 24.31 N ATOM 584 CA TRP A 39 22.398 -6.671 -23.119 1.00 12.30 C ATOM 585 C TRP A 39 22.041 -6.112 -24.492 1.00 63.11 C ATOM 586 O TRP A 39 20.939 -6.331 -24.995 1.00 62.21 O ATOM 587 CB TRP A 39 23.236 -7.941 -23.273 1.00 51.13 C ATOM 588 CG TRP A 39 22.570 -8.994 -24.106 1.00 20.42 C ATOM 589 CD1 TRP A 39 22.473 -9.022 -25.468 1.00 34.53 C ATOM 590 CD2 TRP A 39 21.908 -10.171 -23.630 1.00 14.02 C ATOM 591 NE1 TRP A 39 21.789 -10.146 -25.867 1.00 44.21 N ATOM 592 CE2 TRP A 39 21.433 -10.867 -24.759 1.00 32.24 C ATOM 593 CE3 TRP A 39 21.671 -10.705 -22.360 1.00 60.24 C ATOM 594 CZ2 TRP A 39 20.735 -12.068 -24.653 1.00 44.34 C ATOM 595 CZ3 TRP A 39 20.978 -11.897 -22.258 1.00 5.43 C ATOM 596 CH2 TRP A 39 20.518 -12.568 -23.398 1.00 51.33 C ATOM 0 H TRP A 39 20.323 -6.841 -22.860 1.00 24.31 H new ATOM 0 HA TRP A 39 22.982 -5.923 -22.583 1.00 12.30 H new ATOM 0 HB2 TRP A 39 24.194 -7.683 -23.724 1.00 51.13 H new ATOM 0 HB3 TRP A 39 23.448 -8.350 -22.285 1.00 51.13 H new ATOM 0 HD1 TRP A 39 22.874 -8.272 -26.133 1.00 34.53 H new ATOM 0 HE1 TRP A 39 21.581 -10.401 -26.832 1.00 44.21 H new ATOM 0 HE3 TRP A 39 22.023 -10.196 -21.475 1.00 60.24 H new ATOM 0 HZ2 TRP A 39 20.378 -12.586 -25.531 1.00 44.34 H new ATOM 0 HZ3 TRP A 39 20.788 -12.318 -21.282 1.00 5.43 H new ATOM 0 HH2 TRP A 39 19.981 -13.498 -23.284 1.00 51.33 H new ATOM 607 N VAL A 40 22.980 -5.390 -25.095 1.00 4.55 N ATOM 608 CA VAL A 40 22.765 -4.801 -26.411 1.00 1.32 C ATOM 609 C VAL A 40 23.881 -5.188 -27.375 1.00 54.12 C ATOM 610 O VAL A 40 25.057 -5.180 -27.014 1.00 32.15 O ATOM 611 CB VAL A 40 22.680 -3.265 -26.332 1.00 1.25 C ATOM 612 CG1 VAL A 40 23.925 -2.694 -25.670 1.00 21.43 C ATOM 613 CG2 VAL A 40 22.483 -2.670 -27.718 1.00 22.32 C ATOM 0 H VAL A 40 23.898 -5.199 -24.693 1.00 4.55 H new ATOM 0 HA VAL A 40 21.817 -5.191 -26.781 1.00 1.32 H new ATOM 0 HB VAL A 40 21.818 -2.998 -25.721 1.00 1.25 H new ATOM 0 HG11 VAL A 40 23.847 -1.608 -25.623 1.00 21.43 H new ATOM 0 HG12 VAL A 40 24.017 -3.095 -24.661 1.00 21.43 H new ATOM 0 HG13 VAL A 40 24.805 -2.970 -26.251 1.00 21.43 H new ATOM 0 HG21 VAL A 40 22.425 -1.584 -27.643 1.00 22.32 H new ATOM 0 HG22 VAL A 40 23.324 -2.945 -28.355 1.00 22.32 H new ATOM 0 HG23 VAL A 40 21.559 -3.054 -28.151 1.00 22.32 H new ATOM 623 N GLN A 41 23.502 -5.526 -28.604 1.00 4.52 N ATOM 624 CA GLN A 41 24.472 -5.916 -29.621 1.00 33.13 C ATOM 625 C GLN A 41 23.983 -5.534 -31.014 1.00 31.11 C ATOM 626 O GLN A 41 22.858 -5.854 -31.397 1.00 4.41 O ATOM 627 CB GLN A 41 24.734 -7.422 -29.554 1.00 53.32 C ATOM 628 CG GLN A 41 25.907 -7.873 -30.408 1.00 64.32 C ATOM 629 CD GLN A 41 25.914 -9.371 -30.646 1.00 4.44 C ATOM 630 OE1 GLN A 41 25.039 -10.091 -30.166 1.00 15.12 O ATOM 631 NE2 GLN A 41 26.906 -9.848 -31.389 1.00 55.45 N ATOM 0 H GLN A 41 22.532 -5.538 -28.919 1.00 4.52 H new ATOM 0 HA GLN A 41 25.402 -5.383 -29.424 1.00 33.13 H new ATOM 0 HB2 GLN A 41 24.920 -7.704 -28.518 1.00 53.32 H new ATOM 0 HB3 GLN A 41 23.837 -7.953 -29.873 1.00 53.32 H new ATOM 0 HG2 GLN A 41 25.873 -7.357 -31.367 1.00 64.32 H new ATOM 0 HG3 GLN A 41 26.838 -7.582 -29.922 1.00 64.32 H new ATOM 0 HE21 GLN A 41 27.610 -9.214 -31.767 1.00 55.45 H new ATOM 0 HE22 GLN A 41 26.964 -10.848 -31.582 1.00 55.45 H new ATOM 640 N ASN A 42 24.836 -4.848 -31.767 1.00 41.24 N ATOM 641 CA ASN A 42 24.490 -4.421 -33.119 1.00 23.25 C ATOM 642 C ASN A 42 24.908 -5.471 -34.144 1.00 12.10 C ATOM 643 O ASN A 42 26.075 -5.549 -34.530 1.00 33.22 O ATOM 644 CB ASN A 42 25.159 -3.083 -33.440 1.00 64.42 C ATOM 645 CG ASN A 42 25.188 -2.794 -34.929 1.00 31.34 C ATOM 646 OD1 ASN A 42 24.194 -2.988 -35.629 1.00 1.41 O ATOM 647 ND2 ASN A 42 26.331 -2.329 -35.419 1.00 11.11 N ATOM 0 H ASN A 42 25.771 -4.576 -31.465 1.00 41.24 H new ATOM 0 HA ASN A 42 23.408 -4.300 -33.170 1.00 23.25 H new ATOM 0 HB2 ASN A 42 24.627 -2.282 -32.927 1.00 64.42 H new ATOM 0 HB3 ASN A 42 26.178 -3.087 -33.053 1.00 64.42 H new ATOM 0 HD21 ASN A 42 26.411 -2.117 -36.414 1.00 11.11 H new ATOM 0 HD22 ASN A 42 27.129 -2.184 -34.801 1.00 11.11 H new ATOM 654 N THR A 43 23.946 -6.277 -34.583 1.00 51.11 N ATOM 655 CA THR A 43 24.213 -7.322 -35.563 1.00 73.10 C ATOM 656 C THR A 43 24.877 -6.750 -36.810 1.00 41.00 C ATOM 657 O THR A 43 24.989 -5.533 -36.963 1.00 23.55 O ATOM 658 CB THR A 43 22.919 -8.051 -35.973 1.00 22.10 C ATOM 659 OG1 THR A 43 22.059 -7.158 -36.688 1.00 52.53 O ATOM 660 CG2 THR A 43 22.193 -8.593 -34.751 1.00 70.11 C ATOM 0 H THR A 43 22.975 -6.226 -34.275 1.00 51.11 H new ATOM 0 HA THR A 43 24.889 -8.034 -35.089 1.00 73.10 H new ATOM 0 HB THR A 43 23.188 -8.888 -36.617 1.00 22.10 H new ATOM 0 HG1 THR A 43 21.994 -6.309 -36.204 1.00 52.53 H new ATOM 0 HG21 THR A 43 21.283 -9.103 -35.065 1.00 70.11 H new ATOM 0 HG22 THR A 43 22.840 -9.295 -34.225 1.00 70.11 H new ATOM 0 HG23 THR A 43 21.936 -7.769 -34.086 1.00 70.11 H new ATOM 668 N ASP A 44 25.315 -7.634 -37.699 1.00 43.05 N ATOM 669 CA ASP A 44 25.967 -7.216 -38.935 1.00 65.42 C ATOM 670 C ASP A 44 25.019 -7.351 -40.123 1.00 22.15 C ATOM 671 O ASP A 44 25.455 -7.522 -41.261 1.00 71.31 O ATOM 672 CB ASP A 44 27.229 -8.047 -39.177 1.00 52.11 C ATOM 673 CG ASP A 44 28.048 -8.236 -37.916 1.00 22.13 C ATOM 674 OD1 ASP A 44 28.523 -7.224 -37.360 1.00 44.11 O ATOM 675 OD2 ASP A 44 28.215 -9.396 -37.485 1.00 21.44 O ATOM 0 H ASP A 44 25.231 -8.644 -37.587 1.00 43.05 H new ATOM 0 HA ASP A 44 26.245 -6.167 -38.833 1.00 65.42 H new ATOM 0 HB2 ASP A 44 26.948 -9.023 -39.574 1.00 52.11 H new ATOM 0 HB3 ASP A 44 27.842 -7.559 -39.935 1.00 52.11 H new ATOM 680 N ARG A 45 23.721 -7.274 -39.848 1.00 41.33 N ATOM 681 CA ARG A 45 22.711 -7.389 -40.893 1.00 62.44 C ATOM 682 C ARG A 45 21.910 -6.097 -41.020 1.00 72.24 C ATOM 683 O ARG A 45 21.383 -5.784 -42.087 1.00 41.41 O ATOM 684 CB ARG A 45 21.770 -8.558 -40.596 1.00 24.50 C ATOM 685 CG ARG A 45 22.373 -9.919 -40.906 1.00 31.15 C ATOM 686 CD ARG A 45 22.056 -10.358 -42.327 1.00 22.35 C ATOM 687 NE ARG A 45 20.618 -10.454 -42.562 1.00 61.12 N ATOM 688 CZ ARG A 45 20.083 -10.682 -43.756 1.00 74.41 C ATOM 689 NH1 ARG A 45 20.862 -10.838 -44.817 1.00 62.22 N ATOM 690 NH2 ARG A 45 18.765 -10.756 -43.890 1.00 75.04 N ATOM 0 H ARG A 45 23.344 -7.133 -38.911 1.00 41.33 H new ATOM 0 HA ARG A 45 23.222 -7.574 -41.838 1.00 62.44 H new ATOM 0 HB2 ARG A 45 21.486 -8.527 -39.544 1.00 24.50 H new ATOM 0 HB3 ARG A 45 20.856 -8.434 -41.177 1.00 24.50 H new ATOM 0 HG2 ARG A 45 23.454 -9.879 -40.769 1.00 31.15 H new ATOM 0 HG3 ARG A 45 21.989 -10.657 -40.202 1.00 31.15 H new ATOM 0 HD2 ARG A 45 22.492 -9.649 -43.031 1.00 22.35 H new ATOM 0 HD3 ARG A 45 22.520 -11.325 -42.520 1.00 22.35 H new ATOM 0 HE ARG A 45 19.990 -10.340 -41.766 1.00 61.12 H new ATOM 0 HH11 ARG A 45 21.876 -10.783 -44.718 1.00 62.22 H new ATOM 0 HH12 ARG A 45 20.448 -11.013 -45.733 1.00 62.22 H new ATOM 0 HH21 ARG A 45 18.162 -10.638 -43.076 1.00 75.04 H new ATOM 0 HH22 ARG A 45 18.355 -10.931 -44.807 1.00 75.04 H new ATOM 704 N GLY A 46 21.822 -5.351 -39.923 1.00 53.04 N ATOM 705 CA GLY A 46 21.083 -4.102 -39.933 1.00 75.20 C ATOM 706 C GLY A 46 20.086 -4.009 -38.795 1.00 30.54 C ATOM 707 O GLY A 46 19.002 -3.446 -38.951 1.00 43.25 O ATOM 0 H GLY A 46 22.249 -5.589 -39.028 1.00 53.04 H new ATOM 0 HA2 GLY A 46 21.783 -3.269 -39.868 1.00 75.20 H new ATOM 0 HA3 GLY A 46 20.557 -4.003 -40.882 1.00 75.20 H new ATOM 711 N THR A 47 20.451 -4.566 -37.644 1.00 1.34 N ATOM 712 CA THR A 47 19.580 -4.546 -36.475 1.00 64.00 C ATOM 713 C THR A 47 20.392 -4.534 -35.185 1.00 21.53 C ATOM 714 O THR A 47 21.622 -4.579 -35.213 1.00 0.43 O ATOM 715 CB THR A 47 18.632 -5.760 -36.461 1.00 11.33 C ATOM 716 OG1 THR A 47 19.389 -6.972 -36.367 1.00 54.31 O ATOM 717 CG2 THR A 47 17.771 -5.789 -37.715 1.00 3.33 C ATOM 0 H THR A 47 21.344 -5.036 -37.497 1.00 1.34 H new ATOM 0 HA THR A 47 18.988 -3.633 -36.537 1.00 64.00 H new ATOM 0 HB THR A 47 17.978 -5.673 -35.593 1.00 11.33 H new ATOM 0 HG1 THR A 47 20.309 -6.807 -36.663 1.00 54.31 H new ATOM 0 HG21 THR A 47 17.110 -6.655 -37.682 1.00 3.33 H new ATOM 0 HG22 THR A 47 17.174 -4.879 -37.768 1.00 3.33 H new ATOM 0 HG23 THR A 47 18.411 -5.854 -38.595 1.00 3.33 H new ATOM 725 N VAL A 48 19.696 -4.476 -34.054 1.00 1.43 N ATOM 726 CA VAL A 48 20.353 -4.460 -32.752 1.00 34.20 C ATOM 727 C VAL A 48 19.659 -5.403 -31.775 1.00 55.32 C ATOM 728 O VAL A 48 18.668 -5.037 -31.143 1.00 1.10 O ATOM 729 CB VAL A 48 20.375 -3.042 -32.152 1.00 24.04 C ATOM 730 CG1 VAL A 48 21.046 -3.051 -30.786 1.00 55.31 C ATOM 731 CG2 VAL A 48 21.078 -2.076 -33.093 1.00 64.35 C ATOM 0 H VAL A 48 18.677 -4.439 -34.013 1.00 1.43 H new ATOM 0 HA VAL A 48 21.378 -4.795 -32.910 1.00 34.20 H new ATOM 0 HB VAL A 48 19.346 -2.705 -32.024 1.00 24.04 H new ATOM 0 HG11 VAL A 48 21.053 -2.041 -30.377 1.00 55.31 H new ATOM 0 HG12 VAL A 48 20.496 -3.710 -30.115 1.00 55.31 H new ATOM 0 HG13 VAL A 48 22.071 -3.408 -30.886 1.00 55.31 H new ATOM 0 HG21 VAL A 48 21.084 -1.079 -32.653 1.00 64.35 H new ATOM 0 HG22 VAL A 48 22.104 -2.407 -33.255 1.00 64.35 H new ATOM 0 HG23 VAL A 48 20.551 -2.048 -34.047 1.00 64.35 H new ATOM 741 N GLN A 49 20.186 -6.617 -31.657 1.00 72.13 N ATOM 742 CA GLN A 49 19.616 -7.613 -30.757 1.00 40.40 C ATOM 743 C GLN A 49 19.578 -7.092 -29.324 1.00 32.00 C ATOM 744 O GLN A 49 20.590 -7.097 -28.624 1.00 54.51 O ATOM 745 CB GLN A 49 20.424 -8.910 -30.820 1.00 4.34 C ATOM 746 CG GLN A 49 20.190 -9.712 -32.089 1.00 50.14 C ATOM 747 CD GLN A 49 21.166 -10.862 -32.241 1.00 74.24 C ATOM 748 OE1 GLN A 49 22.373 -10.695 -32.063 1.00 75.44 O ATOM 749 NE2 GLN A 49 20.647 -12.039 -32.572 1.00 72.02 N ATOM 0 H GLN A 49 21.006 -6.935 -32.173 1.00 72.13 H new ATOM 0 HA GLN A 49 18.594 -7.815 -31.078 1.00 40.40 H new ATOM 0 HB2 GLN A 49 21.485 -8.672 -30.741 1.00 4.34 H new ATOM 0 HB3 GLN A 49 20.171 -9.528 -29.958 1.00 4.34 H new ATOM 0 HG2 GLN A 49 19.172 -10.102 -32.085 1.00 50.14 H new ATOM 0 HG3 GLN A 49 20.275 -9.052 -32.952 1.00 50.14 H new ATOM 0 HE21 GLN A 49 19.641 -12.132 -32.710 1.00 72.02 H new ATOM 0 HE22 GLN A 49 21.255 -12.850 -32.688 1.00 72.02 H new ATOM 758 N GLY A 50 18.403 -6.643 -28.894 1.00 34.04 N ATOM 759 CA GLY A 50 18.255 -6.125 -27.546 1.00 53.21 C ATOM 760 C GLY A 50 17.324 -6.969 -26.699 1.00 32.50 C ATOM 761 O GLY A 50 16.223 -7.315 -27.128 1.00 70.25 O ATOM 0 H GLY A 50 17.551 -6.629 -29.455 1.00 34.04 H new ATOM 0 HA2 GLY A 50 19.234 -6.079 -27.068 1.00 53.21 H new ATOM 0 HA3 GLY A 50 17.874 -5.105 -27.592 1.00 53.21 H new ATOM 765 N LYS A 51 17.766 -7.305 -25.492 1.00 11.23 N ATOM 766 CA LYS A 51 16.966 -8.115 -24.581 1.00 53.10 C ATOM 767 C LYS A 51 16.382 -7.259 -23.461 1.00 64.12 C ATOM 768 O LYS A 51 16.996 -6.283 -23.028 1.00 24.35 O ATOM 769 CB LYS A 51 17.815 -9.241 -23.987 1.00 51.02 C ATOM 770 CG LYS A 51 17.114 -10.013 -22.883 1.00 23.42 C ATOM 771 CD LYS A 51 15.903 -10.765 -23.410 1.00 1.44 C ATOM 772 CE LYS A 51 16.245 -12.208 -23.745 1.00 61.15 C ATOM 773 NZ LYS A 51 17.234 -12.300 -24.855 1.00 24.03 N ATOM 0 H LYS A 51 18.675 -7.028 -25.122 1.00 11.23 H new ATOM 0 HA LYS A 51 16.143 -8.550 -25.149 1.00 53.10 H new ATOM 0 HB2 LYS A 51 18.094 -9.933 -24.782 1.00 51.02 H new ATOM 0 HB3 LYS A 51 18.739 -8.819 -23.593 1.00 51.02 H new ATOM 0 HG2 LYS A 51 17.812 -10.717 -22.431 1.00 23.42 H new ATOM 0 HG3 LYS A 51 16.802 -9.324 -22.098 1.00 23.42 H new ATOM 0 HD2 LYS A 51 15.107 -10.742 -22.666 1.00 1.44 H new ATOM 0 HD3 LYS A 51 15.522 -10.264 -24.300 1.00 1.44 H new ATOM 0 HE2 LYS A 51 16.646 -12.701 -22.860 1.00 61.15 H new ATOM 0 HE3 LYS A 51 15.336 -12.742 -24.023 1.00 61.15 H new ATOM 0 HZ1 LYS A 51 17.111 -13.203 -25.356 1.00 24.03 H new ATOM 0 HZ2 LYS A 51 17.085 -11.513 -25.519 1.00 24.03 H new ATOM 0 HZ3 LYS A 51 18.197 -12.248 -24.467 1.00 24.03 H new ATOM 787 N LEU A 52 15.195 -7.631 -22.996 1.00 10.00 N ATOM 788 CA LEU A 52 14.529 -6.898 -21.925 1.00 22.14 C ATOM 789 C LEU A 52 13.984 -7.854 -20.868 1.00 53.33 C ATOM 790 O LEU A 52 12.860 -8.342 -20.981 1.00 53.24 O ATOM 791 CB LEU A 52 13.393 -6.045 -22.493 1.00 23.43 C ATOM 792 CG LEU A 52 13.749 -4.600 -22.843 1.00 23.22 C ATOM 793 CD1 LEU A 52 12.548 -3.885 -23.441 1.00 44.44 C ATOM 794 CD2 LEU A 52 14.253 -3.862 -21.611 1.00 42.33 C ATOM 0 H LEU A 52 14.674 -8.436 -23.344 1.00 10.00 H new ATOM 0 HA LEU A 52 15.264 -6.245 -21.454 1.00 22.14 H new ATOM 0 HB2 LEU A 52 13.014 -6.532 -23.391 1.00 23.43 H new ATOM 0 HB3 LEU A 52 12.578 -6.032 -21.769 1.00 23.43 H new ATOM 0 HG LEU A 52 14.546 -4.612 -23.586 1.00 23.22 H new ATOM 0 HD11 LEU A 52 12.820 -2.858 -23.684 1.00 44.44 H new ATOM 0 HD12 LEU A 52 12.232 -4.401 -24.348 1.00 44.44 H new ATOM 0 HD13 LEU A 52 11.730 -3.883 -22.721 1.00 44.44 H new ATOM 0 HD21 LEU A 52 14.502 -2.835 -21.878 1.00 42.33 H new ATOM 0 HD22 LEU A 52 13.477 -3.860 -20.845 1.00 42.33 H new ATOM 0 HD23 LEU A 52 15.142 -4.362 -21.226 1.00 42.33 H new ATOM 806 N GLN A 53 14.787 -8.114 -19.842 1.00 11.11 N ATOM 807 CA GLN A 53 14.383 -9.010 -18.765 1.00 3.13 C ATOM 808 C GLN A 53 14.312 -8.266 -17.435 1.00 40.34 C ATOM 809 O GLN A 53 15.254 -7.577 -17.047 1.00 3.30 O ATOM 810 CB GLN A 53 15.360 -10.182 -18.655 1.00 1.02 C ATOM 811 CG GLN A 53 16.817 -9.776 -18.806 1.00 42.22 C ATOM 812 CD GLN A 53 17.774 -10.831 -18.287 1.00 0.33 C ATOM 813 OE1 GLN A 53 17.707 -11.104 -16.989 1.00 62.45 O flip ATOM 814 NE2 GLN A 53 18.565 -11.394 -19.043 1.00 0.41 N flip ATOM 0 H GLN A 53 15.720 -7.717 -19.734 1.00 11.11 H new ATOM 0 HA GLN A 53 13.390 -9.394 -18.999 1.00 3.13 H new ATOM 0 HB2 GLN A 53 15.225 -10.667 -17.688 1.00 1.02 H new ATOM 0 HB3 GLN A 53 15.116 -10.920 -19.419 1.00 1.02 H new ATOM 0 HG2 GLN A 53 17.030 -9.584 -19.858 1.00 42.22 H new ATOM 0 HG3 GLN A 53 16.987 -8.842 -18.271 1.00 42.22 H new ATOM 0 HE21 GLN A 53 18.583 -11.153 -20.034 1.00 0.41 H new ATOM 0 HE22 GLN A 53 19.203 -12.101 -18.679 1.00 0.41 H new ATOM 823 N GLY A 54 13.187 -8.409 -16.742 1.00 32.43 N ATOM 824 CA GLY A 54 13.013 -7.744 -15.464 1.00 22.44 C ATOM 825 C GLY A 54 11.556 -7.479 -15.141 1.00 20.51 C ATOM 826 O GLY A 54 10.650 -8.060 -15.739 1.00 61.03 O ATOM 0 H GLY A 54 12.393 -8.974 -17.043 1.00 32.43 H new ATOM 0 HA2 GLY A 54 13.451 -8.357 -14.676 1.00 22.44 H new ATOM 0 HA3 GLY A 54 13.557 -6.800 -15.472 1.00 22.44 H new ATOM 830 N PRO A 55 11.314 -6.584 -14.172 1.00 73.11 N ATOM 831 CA PRO A 55 9.957 -6.224 -13.748 1.00 64.11 C ATOM 832 C PRO A 55 9.212 -5.423 -14.810 1.00 35.21 C ATOM 833 O PRO A 55 9.666 -4.359 -15.231 1.00 12.01 O ATOM 834 CB PRO A 55 10.191 -5.370 -12.500 1.00 1.52 C ATOM 835 CG PRO A 55 11.559 -4.807 -12.677 1.00 1.23 C ATOM 836 CD PRO A 55 12.345 -5.854 -13.416 1.00 41.33 C ATOM 0 HA PRO A 55 9.338 -7.103 -13.569 1.00 64.11 H new ATOM 0 HB2 PRO A 55 9.445 -4.579 -12.416 1.00 1.52 H new ATOM 0 HB3 PRO A 55 10.124 -5.969 -11.592 1.00 1.52 H new ATOM 0 HG2 PRO A 55 11.527 -3.874 -13.239 1.00 1.23 H new ATOM 0 HG3 PRO A 55 12.017 -4.583 -11.713 1.00 1.23 H new ATOM 0 HD2 PRO A 55 13.087 -5.407 -14.077 1.00 41.33 H new ATOM 0 HD3 PRO A 55 12.882 -6.511 -12.732 1.00 41.33 H new ATOM 844 N ILE A 56 8.065 -5.941 -15.238 1.00 63.02 N ATOM 845 CA ILE A 56 7.256 -5.272 -16.250 1.00 23.52 C ATOM 846 C ILE A 56 6.957 -3.832 -15.850 1.00 43.55 C ATOM 847 O ILE A 56 6.758 -2.968 -16.705 1.00 70.31 O ATOM 848 CB ILE A 56 5.927 -6.014 -16.488 1.00 45.41 C ATOM 849 CG1 ILE A 56 6.194 -7.448 -16.951 1.00 11.52 C ATOM 850 CG2 ILE A 56 5.082 -5.270 -17.511 1.00 42.41 C ATOM 851 CD1 ILE A 56 5.010 -8.371 -16.768 1.00 21.21 C ATOM 0 H ILE A 56 7.675 -6.821 -14.900 1.00 63.02 H new ATOM 0 HA ILE A 56 7.836 -5.277 -17.173 1.00 23.52 H new ATOM 0 HB ILE A 56 5.376 -6.053 -15.549 1.00 45.41 H new ATOM 0 HG12 ILE A 56 6.475 -7.435 -18.004 1.00 11.52 H new ATOM 0 HG13 ILE A 56 7.045 -7.847 -16.399 1.00 11.52 H new ATOM 0 HG21 ILE A 56 4.146 -5.806 -17.669 1.00 42.41 H new ATOM 0 HG22 ILE A 56 4.868 -4.266 -17.145 1.00 42.41 H new ATOM 0 HG23 ILE A 56 5.626 -5.204 -18.453 1.00 42.41 H new ATOM 0 HD11 ILE A 56 5.270 -9.370 -17.117 1.00 21.21 H new ATOM 0 HD12 ILE A 56 4.742 -8.414 -15.712 1.00 21.21 H new ATOM 0 HD13 ILE A 56 4.163 -7.995 -17.343 1.00 21.21 H new ATOM 863 N SER A 57 6.929 -3.578 -14.546 1.00 24.31 N ATOM 864 CA SER A 57 6.653 -2.242 -14.032 1.00 51.14 C ATOM 865 C SER A 57 7.563 -1.209 -14.689 1.00 4.52 C ATOM 866 O SER A 57 7.190 -0.046 -14.848 1.00 71.34 O ATOM 867 CB SER A 57 6.836 -2.208 -12.514 1.00 32.12 C ATOM 868 OG SER A 57 6.577 -0.914 -11.998 1.00 35.14 O ATOM 0 H SER A 57 7.094 -4.281 -13.825 1.00 24.31 H new ATOM 0 HA SER A 57 5.619 -1.994 -14.271 1.00 51.14 H new ATOM 0 HB2 SER A 57 6.166 -2.930 -12.047 1.00 32.12 H new ATOM 0 HB3 SER A 57 7.853 -2.507 -12.260 1.00 32.12 H new ATOM 0 HG SER A 57 6.699 -0.919 -11.026 1.00 35.14 H new ATOM 874 N LYS A 58 8.761 -1.641 -15.068 1.00 3.32 N ATOM 875 CA LYS A 58 9.727 -0.756 -15.708 1.00 41.14 C ATOM 876 C LYS A 58 9.773 -0.999 -17.213 1.00 61.15 C ATOM 877 O LYS A 58 9.965 -0.069 -17.997 1.00 60.21 O ATOM 878 CB LYS A 58 11.118 -0.963 -15.105 1.00 21.02 C ATOM 879 CG LYS A 58 11.441 0.000 -13.976 1.00 13.15 C ATOM 880 CD LYS A 58 10.844 -0.466 -12.658 1.00 4.21 C ATOM 881 CE LYS A 58 11.645 0.049 -11.471 1.00 75.11 C ATOM 882 NZ LYS A 58 11.157 -0.521 -10.184 1.00 40.25 N ATOM 0 H LYS A 58 9.086 -2.600 -14.943 1.00 3.32 H new ATOM 0 HA LYS A 58 9.411 0.272 -15.533 1.00 41.14 H new ATOM 0 HB2 LYS A 58 11.195 -1.985 -14.733 1.00 21.02 H new ATOM 0 HB3 LYS A 58 11.865 -0.852 -15.891 1.00 21.02 H new ATOM 0 HG2 LYS A 58 12.522 0.093 -13.874 1.00 13.15 H new ATOM 0 HG3 LYS A 58 11.057 0.991 -14.220 1.00 13.15 H new ATOM 0 HD2 LYS A 58 9.814 -0.119 -12.581 1.00 4.21 H new ATOM 0 HD3 LYS A 58 10.816 -1.555 -12.635 1.00 4.21 H new ATOM 0 HE2 LYS A 58 12.697 -0.204 -11.605 1.00 75.11 H new ATOM 0 HE3 LYS A 58 11.581 1.137 -11.434 1.00 75.11 H new ATOM 0 HZ1 LYS A 58 11.728 -0.146 -9.400 1.00 40.25 H new ATOM 0 HZ2 LYS A 58 10.161 -0.258 -10.044 1.00 40.25 H new ATOM 0 HZ3 LYS A 58 11.241 -1.557 -10.209 1.00 40.25 H new ATOM 896 N VAL A 59 9.594 -2.255 -17.611 1.00 43.23 N ATOM 897 CA VAL A 59 9.613 -2.620 -19.023 1.00 12.42 C ATOM 898 C VAL A 59 8.653 -1.750 -19.828 1.00 21.54 C ATOM 899 O VAL A 59 8.881 -1.486 -21.008 1.00 54.13 O ATOM 900 CB VAL A 59 9.240 -4.100 -19.225 1.00 35.22 C ATOM 901 CG1 VAL A 59 9.242 -4.455 -20.704 1.00 5.20 C ATOM 902 CG2 VAL A 59 10.191 -5.000 -18.451 1.00 3.43 C ATOM 0 H VAL A 59 9.434 -3.037 -16.976 1.00 43.23 H new ATOM 0 HA VAL A 59 10.631 -2.458 -19.379 1.00 12.42 H new ATOM 0 HB VAL A 59 8.233 -4.258 -18.840 1.00 35.22 H new ATOM 0 HG11 VAL A 59 8.976 -5.505 -20.827 1.00 5.20 H new ATOM 0 HG12 VAL A 59 8.516 -3.833 -21.228 1.00 5.20 H new ATOM 0 HG13 VAL A 59 10.235 -4.282 -21.118 1.00 5.20 H new ATOM 0 HG21 VAL A 59 9.912 -6.042 -18.605 1.00 3.43 H new ATOM 0 HG22 VAL A 59 11.210 -4.841 -18.803 1.00 3.43 H new ATOM 0 HG23 VAL A 59 10.133 -4.763 -17.389 1.00 3.43 H new ATOM 912 N ARG A 60 7.580 -1.309 -19.181 1.00 15.43 N ATOM 913 CA ARG A 60 6.584 -0.469 -19.837 1.00 30.35 C ATOM 914 C ARG A 60 7.230 0.783 -20.423 1.00 73.41 C ATOM 915 O ARG A 60 6.741 1.343 -21.404 1.00 31.34 O ATOM 916 CB ARG A 60 5.487 -0.074 -18.846 1.00 71.13 C ATOM 917 CG ARG A 60 4.573 -1.225 -18.458 1.00 64.21 C ATOM 918 CD ARG A 60 3.455 -1.415 -19.471 1.00 42.01 C ATOM 919 NE ARG A 60 2.326 -0.525 -19.213 1.00 63.14 N ATOM 920 CZ ARG A 60 1.257 -0.448 -19.998 1.00 44.22 C ATOM 921 NH1 ARG A 60 1.172 -1.203 -21.084 1.00 63.43 N ATOM 922 NH2 ARG A 60 0.271 0.387 -19.697 1.00 35.50 N ATOM 0 H ARG A 60 7.377 -1.519 -18.204 1.00 15.43 H new ATOM 0 HA ARG A 60 6.140 -1.043 -20.651 1.00 30.35 H new ATOM 0 HB2 ARG A 60 5.951 0.330 -17.946 1.00 71.13 H new ATOM 0 HB3 ARG A 60 4.886 0.725 -19.281 1.00 71.13 H new ATOM 0 HG2 ARG A 60 5.155 -2.143 -18.381 1.00 64.21 H new ATOM 0 HG3 ARG A 60 4.145 -1.035 -17.474 1.00 64.21 H new ATOM 0 HD2 ARG A 60 3.840 -1.231 -20.474 1.00 42.01 H new ATOM 0 HD3 ARG A 60 3.114 -2.450 -19.445 1.00 42.01 H new ATOM 0 HE ARG A 60 2.360 0.070 -18.385 1.00 63.14 H new ATOM 0 HH11 ARG A 60 1.929 -1.845 -21.319 1.00 63.43 H new ATOM 0 HH12 ARG A 60 0.350 -1.142 -21.685 1.00 63.43 H new ATOM 0 HH21 ARG A 60 0.333 0.970 -18.863 1.00 35.50 H new ATOM 0 HH22 ARG A 60 -0.550 0.446 -20.300 1.00 35.50 H new ATOM 936 N GLU A 61 8.330 1.215 -19.815 1.00 52.21 N ATOM 937 CA GLU A 61 9.041 2.402 -20.277 1.00 32.40 C ATOM 938 C GLU A 61 10.274 2.015 -21.088 1.00 41.34 C ATOM 939 O GLU A 61 10.678 2.733 -22.003 1.00 73.32 O ATOM 940 CB GLU A 61 9.451 3.273 -19.088 1.00 24.42 C ATOM 941 CG GLU A 61 8.346 3.464 -18.063 1.00 60.11 C ATOM 942 CD GLU A 61 7.185 4.276 -18.602 1.00 52.34 C ATOM 943 OE1 GLU A 61 6.381 3.720 -19.379 1.00 33.01 O ATOM 944 OE2 GLU A 61 7.080 5.469 -18.247 1.00 44.11 O ATOM 0 H GLU A 61 8.748 0.762 -19.002 1.00 52.21 H new ATOM 0 HA GLU A 61 8.369 2.971 -20.919 1.00 32.40 H new ATOM 0 HB2 GLU A 61 10.314 2.822 -18.599 1.00 24.42 H new ATOM 0 HB3 GLU A 61 9.767 4.249 -19.456 1.00 24.42 H new ATOM 0 HG2 GLU A 61 7.983 2.488 -17.739 1.00 60.11 H new ATOM 0 HG3 GLU A 61 8.754 3.960 -17.183 1.00 60.11 H new ATOM 951 N MET A 62 10.868 0.877 -20.745 1.00 60.04 N ATOM 952 CA MET A 62 12.055 0.395 -21.442 1.00 71.41 C ATOM 953 C MET A 62 11.677 -0.277 -22.759 1.00 3.42 C ATOM 954 O MET A 62 12.546 -0.712 -23.515 1.00 14.25 O ATOM 955 CB MET A 62 12.827 -0.587 -20.559 1.00 22.22 C ATOM 956 CG MET A 62 14.337 -0.472 -20.697 1.00 55.25 C ATOM 957 SD MET A 62 15.001 0.984 -19.866 1.00 61.23 S ATOM 958 CE MET A 62 15.093 2.140 -21.231 1.00 4.31 C ATOM 0 H MET A 62 10.547 0.272 -19.989 1.00 60.04 H new ATOM 0 HA MET A 62 12.691 1.253 -21.661 1.00 71.41 H new ATOM 0 HB2 MET A 62 12.552 -0.420 -19.518 1.00 22.22 H new ATOM 0 HB3 MET A 62 12.524 -1.604 -20.810 1.00 22.22 H new ATOM 0 HG2 MET A 62 14.805 -1.366 -20.285 1.00 55.25 H new ATOM 0 HG3 MET A 62 14.600 -0.434 -21.754 1.00 55.25 H new ATOM 0 HE1 MET A 62 16.059 2.644 -21.216 1.00 4.31 H new ATOM 0 HE2 MET A 62 14.979 1.602 -22.172 1.00 4.31 H new ATOM 0 HE3 MET A 62 14.297 2.879 -21.136 1.00 4.31 H new ATOM 968 N GLN A 63 10.378 -0.357 -23.026 1.00 13.33 N ATOM 969 CA GLN A 63 9.887 -0.976 -24.251 1.00 32.10 C ATOM 970 C GLN A 63 9.524 0.082 -25.288 1.00 72.40 C ATOM 971 O GLN A 63 9.468 -0.201 -26.485 1.00 52.42 O ATOM 972 CB GLN A 63 8.670 -1.853 -23.952 1.00 34.01 C ATOM 973 CG GLN A 63 7.415 -1.060 -23.624 1.00 34.40 C ATOM 974 CD GLN A 63 6.255 -1.947 -23.216 1.00 14.15 C ATOM 975 OE1 GLN A 63 6.437 -3.124 -22.905 1.00 64.54 O ATOM 976 NE2 GLN A 63 5.052 -1.384 -23.213 1.00 33.51 N ATOM 0 H GLN A 63 9.647 -0.001 -22.411 1.00 13.33 H new ATOM 0 HA GLN A 63 10.684 -1.599 -24.658 1.00 32.10 H new ATOM 0 HB2 GLN A 63 8.472 -2.491 -24.813 1.00 34.01 H new ATOM 0 HB3 GLN A 63 8.903 -2.511 -23.115 1.00 34.01 H new ATOM 0 HG2 GLN A 63 7.633 -0.359 -22.818 1.00 34.40 H new ATOM 0 HG3 GLN A 63 7.127 -0.468 -24.492 1.00 34.40 H new ATOM 0 HE21 GLN A 63 4.947 -0.405 -23.478 1.00 33.51 H new ATOM 0 HE22 GLN A 63 4.234 -1.931 -22.946 1.00 33.51 H new ATOM 985 N LYS A 64 9.277 1.301 -24.821 1.00 64.10 N ATOM 986 CA LYS A 64 8.920 2.402 -25.707 1.00 44.41 C ATOM 987 C LYS A 64 10.112 3.328 -25.931 1.00 54.50 C ATOM 988 O LYS A 64 10.233 3.955 -26.984 1.00 23.41 O ATOM 989 CB LYS A 64 7.748 3.194 -25.123 1.00 40.14 C ATOM 990 CG LYS A 64 7.477 4.502 -25.847 1.00 73.41 C ATOM 991 CD LYS A 64 8.027 5.690 -25.077 1.00 1.13 C ATOM 992 CE LYS A 64 8.636 6.726 -26.010 1.00 31.44 C ATOM 993 NZ LYS A 64 7.681 7.143 -27.073 1.00 41.34 N ATOM 0 H LYS A 64 9.318 1.551 -23.833 1.00 64.10 H new ATOM 0 HA LYS A 64 8.623 1.981 -26.668 1.00 44.41 H new ATOM 0 HB2 LYS A 64 6.850 2.577 -25.157 1.00 40.14 H new ATOM 0 HB3 LYS A 64 7.950 3.405 -24.073 1.00 40.14 H new ATOM 0 HG2 LYS A 64 7.928 4.470 -26.839 1.00 73.41 H new ATOM 0 HG3 LYS A 64 6.403 4.625 -25.989 1.00 73.41 H new ATOM 0 HD2 LYS A 64 7.228 6.149 -24.494 1.00 1.13 H new ATOM 0 HD3 LYS A 64 8.782 5.348 -24.369 1.00 1.13 H new ATOM 0 HE2 LYS A 64 8.942 7.599 -25.433 1.00 31.44 H new ATOM 0 HE3 LYS A 64 9.535 6.317 -26.470 1.00 31.44 H new ATOM 0 HZ1 LYS A 64 8.024 8.014 -27.526 1.00 41.34 H new ATOM 0 HZ2 LYS A 64 7.604 6.390 -27.786 1.00 41.34 H new ATOM 0 HZ3 LYS A 64 6.746 7.317 -26.651 1.00 41.34 H new ATOM 1007 N TRP A 65 10.987 3.409 -24.936 1.00 44.10 N ATOM 1008 CA TRP A 65 12.170 4.258 -25.026 1.00 1.00 C ATOM 1009 C TRP A 65 13.116 3.760 -26.113 1.00 41.21 C ATOM 1010 O TRP A 65 13.950 4.514 -26.617 1.00 71.22 O ATOM 1011 CB TRP A 65 12.896 4.300 -23.681 1.00 24.05 C ATOM 1012 CG TRP A 65 12.624 5.549 -22.897 1.00 64.43 C ATOM 1013 CD1 TRP A 65 11.422 6.179 -22.752 1.00 33.03 C ATOM 1014 CD2 TRP A 65 13.576 6.318 -22.154 1.00 53.53 C ATOM 1015 NE1 TRP A 65 11.568 7.295 -21.963 1.00 21.51 N ATOM 1016 CE2 TRP A 65 12.880 7.402 -21.583 1.00 33.30 C ATOM 1017 CE3 TRP A 65 14.947 6.197 -21.914 1.00 50.23 C ATOM 1018 CZ2 TRP A 65 13.511 8.356 -20.789 1.00 74.21 C ATOM 1019 CZ3 TRP A 65 15.572 7.145 -21.126 1.00 53.14 C ATOM 1020 CH2 TRP A 65 14.854 8.213 -20.571 1.00 32.43 C ATOM 0 H TRP A 65 10.900 2.898 -24.058 1.00 44.10 H new ATOM 0 HA TRP A 65 11.845 5.265 -25.287 1.00 1.00 H new ATOM 0 HB2 TRP A 65 12.598 3.435 -23.088 1.00 24.05 H new ATOM 0 HB3 TRP A 65 13.969 4.214 -23.853 1.00 24.05 H new ATOM 0 HD1 TRP A 65 10.493 5.849 -23.192 1.00 33.03 H new ATOM 0 HE1 TRP A 65 10.821 7.939 -21.703 1.00 21.51 H new ATOM 0 HE3 TRP A 65 15.509 5.377 -22.337 1.00 50.23 H new ATOM 0 HZ2 TRP A 65 12.960 9.180 -20.360 1.00 74.21 H new ATOM 0 HZ3 TRP A 65 16.632 7.061 -20.935 1.00 53.14 H new ATOM 0 HH2 TRP A 65 15.371 8.937 -19.959 1.00 32.43 H new ATOM 1031 N LEU A 66 12.982 2.488 -26.471 1.00 30.12 N ATOM 1032 CA LEU A 66 13.825 1.889 -27.500 1.00 5.44 C ATOM 1033 C LEU A 66 13.049 1.702 -28.799 1.00 61.40 C ATOM 1034 O LEU A 66 13.637 1.606 -29.876 1.00 21.34 O ATOM 1035 CB LEU A 66 14.372 0.544 -27.020 1.00 30.33 C ATOM 1036 CG LEU A 66 15.709 0.588 -26.280 1.00 23.24 C ATOM 1037 CD1 LEU A 66 15.785 -0.526 -25.247 1.00 32.11 C ATOM 1038 CD2 LEU A 66 16.866 0.486 -27.263 1.00 25.45 C ATOM 0 H LEU A 66 12.297 1.851 -26.064 1.00 30.12 H new ATOM 0 HA LEU A 66 14.658 2.565 -27.691 1.00 5.44 H new ATOM 0 HB2 LEU A 66 13.631 0.087 -26.364 1.00 30.33 H new ATOM 0 HB3 LEU A 66 14.480 -0.111 -27.885 1.00 30.33 H new ATOM 0 HG LEU A 66 15.783 1.543 -25.760 1.00 23.24 H new ATOM 0 HD11 LEU A 66 16.744 -0.479 -24.731 1.00 32.11 H new ATOM 0 HD12 LEU A 66 14.977 -0.408 -24.525 1.00 32.11 H new ATOM 0 HD13 LEU A 66 15.688 -1.491 -25.745 1.00 32.11 H new ATOM 0 HD21 LEU A 66 17.810 0.519 -26.719 1.00 25.45 H new ATOM 0 HD22 LEU A 66 16.796 -0.453 -27.811 1.00 25.45 H new ATOM 0 HD23 LEU A 66 16.822 1.319 -27.964 1.00 25.45 H new ATOM 1050 N GLU A 67 11.725 1.652 -28.690 1.00 1.24 N ATOM 1051 CA GLU A 67 10.869 1.478 -29.857 1.00 32.52 C ATOM 1052 C GLU A 67 11.066 2.618 -30.852 1.00 20.42 C ATOM 1053 O GLU A 67 11.315 2.388 -32.036 1.00 11.30 O ATOM 1054 CB GLU A 67 9.400 1.404 -29.433 1.00 63.13 C ATOM 1055 CG GLU A 67 8.432 1.342 -30.603 1.00 20.34 C ATOM 1056 CD GLU A 67 7.167 0.574 -30.272 1.00 70.32 C ATOM 1057 OE1 GLU A 67 6.947 0.276 -29.080 1.00 23.13 O ATOM 1058 OE2 GLU A 67 6.396 0.271 -31.207 1.00 64.33 O ATOM 0 H GLU A 67 11.222 1.730 -27.806 1.00 1.24 H new ATOM 0 HA GLU A 67 11.147 0.543 -30.343 1.00 32.52 H new ATOM 0 HB2 GLU A 67 9.255 0.525 -28.805 1.00 63.13 H new ATOM 0 HB3 GLU A 67 9.163 2.274 -28.821 1.00 63.13 H new ATOM 0 HG2 GLU A 67 8.169 2.355 -30.906 1.00 20.34 H new ATOM 0 HG3 GLU A 67 8.926 0.873 -31.454 1.00 20.34 H new ATOM 1065 N THR A 68 10.952 3.849 -30.363 1.00 24.44 N ATOM 1066 CA THR A 68 11.116 5.025 -31.207 1.00 60.14 C ATOM 1067 C THR A 68 12.237 5.920 -30.692 1.00 64.15 C ATOM 1068 O THR A 68 13.015 6.468 -31.474 1.00 11.43 O ATOM 1069 CB THR A 68 9.815 5.845 -31.286 1.00 52.40 C ATOM 1070 OG1 THR A 68 10.056 7.082 -31.967 1.00 73.21 O ATOM 1071 CG2 THR A 68 9.267 6.125 -29.895 1.00 13.41 C ATOM 0 H THR A 68 10.747 4.057 -29.386 1.00 24.44 H new ATOM 0 HA THR A 68 11.371 4.665 -32.204 1.00 60.14 H new ATOM 0 HB THR A 68 9.078 5.263 -31.840 1.00 52.40 H new ATOM 0 HG1 THR A 68 9.224 7.597 -32.014 1.00 73.21 H new ATOM 0 HG21 THR A 68 8.348 6.705 -29.976 1.00 13.41 H new ATOM 0 HG22 THR A 68 9.057 5.182 -29.390 1.00 13.41 H new ATOM 0 HG23 THR A 68 10.002 6.688 -29.321 1.00 13.41 H new ATOM 1079 N ARG A 69 12.316 6.063 -29.373 1.00 72.25 N ATOM 1080 CA ARG A 69 13.343 6.892 -28.755 1.00 13.24 C ATOM 1081 C ARG A 69 14.695 6.185 -28.770 1.00 12.22 C ATOM 1082 O ARG A 69 14.777 4.986 -29.033 1.00 11.22 O ATOM 1083 CB ARG A 69 12.952 7.237 -27.316 1.00 74.04 C ATOM 1084 CG ARG A 69 11.885 8.316 -27.217 1.00 65.30 C ATOM 1085 CD ARG A 69 12.503 9.701 -27.108 1.00 21.04 C ATOM 1086 NE ARG A 69 11.587 10.746 -27.557 1.00 61.22 N ATOM 1087 CZ ARG A 69 11.891 12.039 -27.559 1.00 20.12 C ATOM 1088 NH1 ARG A 69 13.081 12.444 -27.137 1.00 40.03 N ATOM 1089 NH2 ARG A 69 11.004 12.930 -27.983 1.00 71.31 N ATOM 0 H ARG A 69 11.681 5.615 -28.712 1.00 72.25 H new ATOM 0 HA ARG A 69 13.427 7.812 -29.333 1.00 13.24 H new ATOM 0 HB2 ARG A 69 12.592 6.335 -26.820 1.00 74.04 H new ATOM 0 HB3 ARG A 69 13.840 7.565 -26.776 1.00 74.04 H new ATOM 0 HG2 ARG A 69 11.239 8.272 -28.094 1.00 65.30 H new ATOM 0 HG3 ARG A 69 11.255 8.128 -26.348 1.00 65.30 H new ATOM 0 HD2 ARG A 69 12.789 9.890 -26.073 1.00 21.04 H new ATOM 0 HD3 ARG A 69 13.415 9.739 -27.703 1.00 21.04 H new ATOM 0 HE ARG A 69 10.663 10.468 -27.887 1.00 61.22 H new ATOM 0 HH11 ARG A 69 13.765 11.762 -26.810 1.00 40.03 H new ATOM 0 HH12 ARG A 69 13.312 13.437 -27.140 1.00 40.03 H new ATOM 0 HH21 ARG A 69 10.087 12.622 -28.308 1.00 71.31 H new ATOM 0 HH22 ARG A 69 11.239 13.923 -27.984 1.00 71.31 H new ATOM 1103 N GLY A 70 15.754 6.938 -28.486 1.00 72.42 N ATOM 1104 CA GLY A 70 17.088 6.366 -28.473 1.00 52.34 C ATOM 1105 C GLY A 70 18.165 7.403 -28.727 1.00 33.52 C ATOM 1106 O GLY A 70 17.894 8.603 -28.723 1.00 14.24 O ATOM 0 H GLY A 70 15.712 7.933 -28.265 1.00 72.42 H new ATOM 0 HA2 GLY A 70 17.267 5.890 -27.509 1.00 52.34 H new ATOM 0 HA3 GLY A 70 17.153 5.586 -29.231 1.00 52.34 H new ATOM 1110 N SER A 71 19.391 6.938 -28.946 1.00 54.14 N ATOM 1111 CA SER A 71 20.514 7.834 -29.197 1.00 72.32 C ATOM 1112 C SER A 71 20.275 8.666 -30.453 1.00 51.13 C ATOM 1113 O SER A 71 19.456 8.327 -31.307 1.00 72.45 O ATOM 1114 CB SER A 71 21.810 7.033 -29.341 1.00 14.21 C ATOM 1115 OG SER A 71 21.563 5.764 -29.922 1.00 4.40 O ATOM 0 H SER A 71 19.632 5.947 -28.955 1.00 54.14 H new ATOM 0 HA SER A 71 20.605 8.510 -28.347 1.00 72.32 H new ATOM 0 HB2 SER A 71 22.517 7.587 -29.958 1.00 14.21 H new ATOM 0 HB3 SER A 71 22.273 6.905 -28.362 1.00 14.21 H new ATOM 0 HG SER A 71 22.415 5.318 -30.107 1.00 4.40 H new ATOM 1121 N PRO A 72 21.007 9.784 -30.570 1.00 23.34 N ATOM 1122 CA PRO A 72 20.894 10.688 -31.717 1.00 42.44 C ATOM 1123 C PRO A 72 21.451 10.074 -32.997 1.00 75.42 C ATOM 1124 O PRO A 72 20.808 10.115 -34.046 1.00 21.52 O ATOM 1125 CB PRO A 72 21.731 11.900 -31.298 1.00 62.43 C ATOM 1126 CG PRO A 72 22.712 11.360 -30.315 1.00 14.44 C ATOM 1127 CD PRO A 72 22.003 10.250 -29.590 1.00 33.03 C ATOM 0 HA PRO A 72 19.855 10.928 -31.945 1.00 42.44 H new ATOM 0 HB2 PRO A 72 22.234 12.349 -32.154 1.00 62.43 H new ATOM 0 HB3 PRO A 72 21.109 12.676 -30.851 1.00 62.43 H new ATOM 0 HG2 PRO A 72 23.605 10.989 -30.818 1.00 14.44 H new ATOM 0 HG3 PRO A 72 23.036 12.135 -29.621 1.00 14.44 H new ATOM 0 HD2 PRO A 72 22.690 9.453 -29.305 1.00 33.03 H new ATOM 0 HD3 PRO A 72 21.530 10.606 -28.675 1.00 33.03 H new ATOM 1135 N GLU A 73 22.648 9.504 -32.903 1.00 1.22 N ATOM 1136 CA GLU A 73 23.290 8.881 -34.054 1.00 51.35 C ATOM 1137 C GLU A 73 22.438 7.739 -34.600 1.00 71.12 C ATOM 1138 O GLU A 73 21.884 7.832 -35.696 1.00 30.15 O ATOM 1139 CB GLU A 73 24.677 8.360 -33.673 1.00 42.44 C ATOM 1140 CG GLU A 73 25.521 7.947 -34.867 1.00 61.33 C ATOM 1141 CD GLU A 73 26.002 9.133 -35.681 1.00 73.51 C ATOM 1142 OE1 GLU A 73 26.956 9.807 -35.241 1.00 62.25 O ATOM 1143 OE2 GLU A 73 25.423 9.386 -36.758 1.00 74.34 O ATOM 0 H GLU A 73 23.193 9.461 -32.042 1.00 1.22 H new ATOM 0 HA GLU A 73 23.395 9.637 -34.832 1.00 51.35 H new ATOM 0 HB2 GLU A 73 25.206 9.133 -33.115 1.00 42.44 H new ATOM 0 HB3 GLU A 73 24.564 7.506 -33.005 1.00 42.44 H new ATOM 0 HG2 GLU A 73 26.382 7.377 -34.518 1.00 61.33 H new ATOM 0 HG3 GLU A 73 24.938 7.284 -35.507 1.00 61.33 H new ATOM 1150 N SER A 74 22.339 6.661 -33.828 1.00 52.42 N ATOM 1151 CA SER A 74 21.558 5.499 -34.235 1.00 65.31 C ATOM 1152 C SER A 74 20.065 5.807 -34.197 1.00 73.43 C ATOM 1153 O SER A 74 19.519 6.166 -33.153 1.00 63.22 O ATOM 1154 CB SER A 74 21.868 4.307 -33.327 1.00 63.01 C ATOM 1155 OG SER A 74 21.081 4.345 -32.149 1.00 43.13 O ATOM 0 H SER A 74 22.790 6.569 -32.918 1.00 52.42 H new ATOM 0 HA SER A 74 21.833 5.248 -35.259 1.00 65.31 H new ATOM 0 HB2 SER A 74 21.679 3.378 -33.864 1.00 63.01 H new ATOM 0 HB3 SER A 74 22.925 4.313 -33.062 1.00 63.01 H new ATOM 0 HG SER A 74 21.414 5.050 -31.556 1.00 43.13 H new ATOM 1161 N HIS A 75 19.408 5.663 -35.344 1.00 41.32 N ATOM 1162 CA HIS A 75 17.977 5.925 -35.443 1.00 54.35 C ATOM 1163 C HIS A 75 17.183 4.622 -35.422 1.00 1.40 C ATOM 1164 O HIS A 75 17.749 3.538 -35.559 1.00 63.51 O ATOM 1165 CB HIS A 75 17.667 6.704 -36.722 1.00 72.24 C ATOM 1166 CG HIS A 75 16.409 7.513 -36.641 1.00 43.30 C ATOM 1167 ND1 HIS A 75 16.128 8.364 -35.593 1.00 4.11 N ATOM 1168 CD2 HIS A 75 15.356 7.600 -37.486 1.00 73.44 C ATOM 1169 CE1 HIS A 75 14.956 8.937 -35.796 1.00 52.41 C ATOM 1170 NE2 HIS A 75 14.466 8.491 -36.939 1.00 21.23 N ATOM 0 H HIS A 75 19.844 5.366 -36.217 1.00 41.32 H new ATOM 0 HA HIS A 75 17.682 6.524 -34.581 1.00 54.35 H new ATOM 0 HB2 HIS A 75 18.502 7.368 -36.945 1.00 72.24 H new ATOM 0 HB3 HIS A 75 17.586 6.004 -37.553 1.00 72.24 H new ATOM 0 HD2 HIS A 75 15.237 7.067 -38.418 1.00 73.44 H new ATOM 0 HE1 HIS A 75 14.479 9.649 -35.139 1.00 52.41 H new ATOM 0 HE2 HIS A 75 13.572 8.764 -37.348 1.00 21.23 H new ATOM 1178 N ILE A 76 15.871 4.737 -35.248 1.00 52.44 N ATOM 1179 CA ILE A 76 15.001 3.569 -35.209 1.00 74.34 C ATOM 1180 C ILE A 76 13.757 3.780 -36.066 1.00 11.51 C ATOM 1181 O ILE A 76 12.688 4.114 -35.554 1.00 52.15 O ATOM 1182 CB ILE A 76 14.568 3.237 -33.769 1.00 72.10 C ATOM 1183 CG1 ILE A 76 15.794 2.976 -32.892 1.00 42.30 C ATOM 1184 CG2 ILE A 76 13.638 2.033 -33.759 1.00 54.15 C ATOM 1185 CD1 ILE A 76 15.537 3.184 -31.416 1.00 34.30 C ATOM 0 H ILE A 76 15.387 5.627 -35.132 1.00 52.44 H new ATOM 0 HA ILE A 76 15.577 2.734 -35.608 1.00 74.34 H new ATOM 0 HB ILE A 76 14.028 4.092 -33.362 1.00 72.10 H new ATOM 0 HG12 ILE A 76 16.134 1.953 -33.053 1.00 42.30 H new ATOM 0 HG13 ILE A 76 16.603 3.634 -33.208 1.00 42.30 H new ATOM 0 HG21 ILE A 76 13.341 1.811 -32.734 1.00 54.15 H new ATOM 0 HG22 ILE A 76 12.752 2.253 -34.354 1.00 54.15 H new ATOM 0 HG23 ILE A 76 14.154 1.171 -34.182 1.00 54.15 H new ATOM 0 HD11 ILE A 76 16.450 2.981 -30.856 1.00 34.30 H new ATOM 0 HD12 ILE A 76 15.226 4.214 -31.242 1.00 34.30 H new ATOM 0 HD13 ILE A 76 14.750 2.507 -31.085 1.00 34.30 H new ATOM 1197 N ASP A 77 13.904 3.583 -37.371 1.00 72.13 N ATOM 1198 CA ASP A 77 12.792 3.749 -38.300 1.00 14.23 C ATOM 1199 C ASP A 77 11.584 2.931 -37.853 1.00 13.52 C ATOM 1200 O ASP A 77 10.440 3.364 -37.995 1.00 50.34 O ATOM 1201 CB ASP A 77 13.211 3.334 -39.711 1.00 34.43 C ATOM 1202 CG ASP A 77 12.317 3.931 -40.780 1.00 2.53 C ATOM 1203 OD1 ASP A 77 11.273 4.516 -40.422 1.00 73.51 O ATOM 1204 OD2 ASP A 77 12.663 3.816 -41.974 1.00 10.11 O ATOM 0 H ASP A 77 14.783 3.308 -37.810 1.00 72.13 H new ATOM 0 HA ASP A 77 12.512 4.802 -38.308 1.00 14.23 H new ATOM 0 HB2 ASP A 77 14.241 3.645 -39.887 1.00 34.43 H new ATOM 0 HB3 ASP A 77 13.189 2.247 -39.788 1.00 34.43 H new ATOM 1209 N LYS A 78 11.845 1.746 -37.312 1.00 44.23 N ATOM 1210 CA LYS A 78 10.781 0.867 -36.844 1.00 20.41 C ATOM 1211 C LYS A 78 11.325 -0.177 -35.874 1.00 22.21 C ATOM 1212 O LYS A 78 12.529 -0.430 -35.830 1.00 52.41 O ATOM 1213 CB LYS A 78 10.105 0.174 -38.029 1.00 64.43 C ATOM 1214 CG LYS A 78 11.085 -0.373 -39.053 1.00 40.35 C ATOM 1215 CD LYS A 78 10.591 -1.676 -39.658 1.00 31.43 C ATOM 1216 CE LYS A 78 11.627 -2.288 -40.588 1.00 43.53 C ATOM 1217 NZ LYS A 78 11.716 -1.551 -41.880 1.00 35.51 N ATOM 0 H LYS A 78 12.786 1.372 -37.187 1.00 44.23 H new ATOM 0 HA LYS A 78 10.045 1.476 -36.320 1.00 20.41 H new ATOM 0 HB2 LYS A 78 9.487 -0.643 -37.657 1.00 64.43 H new ATOM 0 HB3 LYS A 78 9.436 0.881 -38.520 1.00 64.43 H new ATOM 0 HG2 LYS A 78 11.235 0.362 -39.844 1.00 40.35 H new ATOM 0 HG3 LYS A 78 12.054 -0.535 -38.580 1.00 40.35 H new ATOM 0 HD2 LYS A 78 10.354 -2.381 -38.861 1.00 31.43 H new ATOM 0 HD3 LYS A 78 9.668 -1.495 -40.209 1.00 31.43 H new ATOM 0 HE2 LYS A 78 12.601 -2.284 -40.099 1.00 43.53 H new ATOM 0 HE3 LYS A 78 11.372 -3.330 -40.781 1.00 43.53 H new ATOM 0 HZ1 LYS A 78 12.433 -1.999 -42.486 1.00 35.51 H new ATOM 0 HZ2 LYS A 78 10.793 -1.576 -42.358 1.00 35.51 H new ATOM 0 HZ3 LYS A 78 11.985 -0.563 -41.698 1.00 35.51 H new ATOM 1231 N ALA A 79 10.430 -0.782 -35.099 1.00 45.30 N ATOM 1232 CA ALA A 79 10.821 -1.801 -34.133 1.00 1.44 C ATOM 1233 C ALA A 79 9.657 -2.733 -33.817 1.00 74.22 C ATOM 1234 O ALA A 79 8.551 -2.555 -34.327 1.00 21.12 O ATOM 1235 CB ALA A 79 11.338 -1.149 -32.859 1.00 20.04 C ATOM 0 H ALA A 79 9.430 -0.584 -35.122 1.00 45.30 H new ATOM 0 HA ALA A 79 11.620 -2.397 -34.574 1.00 1.44 H new ATOM 0 HB1 ALA A 79 11.626 -1.921 -32.146 1.00 20.04 H new ATOM 0 HB2 ALA A 79 12.204 -0.529 -33.093 1.00 20.04 H new ATOM 0 HB3 ALA A 79 10.555 -0.528 -32.424 1.00 20.04 H new ATOM 1241 N ASN A 80 9.913 -3.728 -32.974 1.00 70.34 N ATOM 1242 CA ASN A 80 8.885 -4.690 -32.592 1.00 65.22 C ATOM 1243 C ASN A 80 9.411 -5.655 -31.534 1.00 35.43 C ATOM 1244 O ASN A 80 10.605 -5.949 -31.484 1.00 22.02 O ATOM 1245 CB ASN A 80 8.407 -5.471 -33.818 1.00 41.10 C ATOM 1246 CG ASN A 80 6.987 -5.979 -33.662 1.00 30.55 C ATOM 1247 OD1 ASN A 80 6.726 -7.176 -33.792 1.00 3.43 O ATOM 1248 ND2 ASN A 80 6.061 -5.070 -33.381 1.00 33.30 N ATOM 0 H ASN A 80 10.823 -3.889 -32.542 1.00 70.34 H new ATOM 0 HA ASN A 80 8.044 -4.139 -32.171 1.00 65.22 H new ATOM 0 HB2 ASN A 80 8.467 -4.832 -34.699 1.00 41.10 H new ATOM 0 HB3 ASN A 80 9.075 -6.315 -33.991 1.00 41.10 H new ATOM 0 HD21 ASN A 80 5.088 -5.353 -33.264 1.00 33.30 H new ATOM 0 HD22 ASN A 80 6.323 -4.089 -33.282 1.00 33.30 H new ATOM 1255 N PHE A 81 8.509 -6.146 -30.689 1.00 64.23 N ATOM 1256 CA PHE A 81 8.881 -7.078 -29.631 1.00 62.32 C ATOM 1257 C PHE A 81 8.477 -8.504 -29.995 1.00 41.15 C ATOM 1258 O PHE A 81 7.605 -8.719 -30.838 1.00 2.32 O ATOM 1259 CB PHE A 81 8.224 -6.672 -28.310 1.00 44.34 C ATOM 1260 CG PHE A 81 6.749 -6.417 -28.428 1.00 71.10 C ATOM 1261 CD1 PHE A 81 5.846 -7.467 -28.389 1.00 70.35 C ATOM 1262 CD2 PHE A 81 6.265 -5.127 -28.578 1.00 32.53 C ATOM 1263 CE1 PHE A 81 4.487 -7.236 -28.497 1.00 64.51 C ATOM 1264 CE2 PHE A 81 4.907 -4.890 -28.685 1.00 65.53 C ATOM 1265 CZ PHE A 81 4.018 -5.946 -28.646 1.00 72.32 C ATOM 0 H PHE A 81 7.516 -5.914 -30.717 1.00 64.23 H new ATOM 0 HA PHE A 81 9.964 -7.044 -29.516 1.00 62.32 H new ATOM 0 HB2 PHE A 81 8.391 -7.458 -27.574 1.00 44.34 H new ATOM 0 HB3 PHE A 81 8.711 -5.773 -27.932 1.00 44.34 H new ATOM 0 HD1 PHE A 81 6.208 -8.478 -28.273 1.00 70.35 H new ATOM 0 HD2 PHE A 81 6.956 -4.298 -28.612 1.00 32.53 H new ATOM 0 HE1 PHE A 81 3.794 -8.063 -28.465 1.00 64.51 H new ATOM 0 HE2 PHE A 81 4.542 -3.880 -28.799 1.00 65.53 H new ATOM 0 HZ PHE A 81 2.957 -5.763 -28.732 1.00 72.32 H new ATOM 1275 N LYS A 82 9.118 -9.476 -29.355 1.00 51.11 N ATOM 1276 CA LYS A 82 8.827 -10.882 -29.609 1.00 52.23 C ATOM 1277 C LYS A 82 7.961 -11.467 -28.499 1.00 34.53 C ATOM 1278 O LYS A 82 7.514 -10.751 -27.604 1.00 52.22 O ATOM 1279 CB LYS A 82 10.127 -11.679 -29.731 1.00 23.35 C ATOM 1280 CG LYS A 82 11.013 -11.227 -30.878 1.00 64.13 C ATOM 1281 CD LYS A 82 11.782 -12.391 -31.482 1.00 12.15 C ATOM 1282 CE LYS A 82 10.865 -13.318 -32.265 1.00 10.21 C ATOM 1283 NZ LYS A 82 11.627 -14.196 -33.195 1.00 25.43 N ATOM 0 H LYS A 82 9.843 -9.316 -28.656 1.00 51.11 H new ATOM 0 HA LYS A 82 8.278 -10.950 -30.548 1.00 52.23 H new ATOM 0 HB2 LYS A 82 10.684 -11.594 -28.798 1.00 23.35 H new ATOM 0 HB3 LYS A 82 9.885 -12.734 -29.864 1.00 23.35 H new ATOM 0 HG2 LYS A 82 10.401 -10.756 -31.647 1.00 64.13 H new ATOM 0 HG3 LYS A 82 11.714 -10.472 -30.522 1.00 64.13 H new ATOM 0 HD2 LYS A 82 12.564 -12.010 -32.139 1.00 12.15 H new ATOM 0 HD3 LYS A 82 12.277 -12.952 -30.689 1.00 12.15 H new ATOM 0 HE2 LYS A 82 10.293 -13.934 -31.571 1.00 10.21 H new ATOM 0 HE3 LYS A 82 10.147 -12.725 -32.832 1.00 10.21 H new ATOM 0 HZ1 LYS A 82 10.966 -14.813 -33.710 1.00 25.43 H new ATOM 0 HZ2 LYS A 82 12.153 -13.609 -33.873 1.00 25.43 H new ATOM 0 HZ3 LYS A 82 12.294 -14.780 -32.652 1.00 25.43 H new ATOM 1297 N ASN A 83 7.729 -12.775 -28.562 1.00 52.33 N ATOM 1298 CA ASN A 83 6.917 -13.456 -27.561 1.00 33.40 C ATOM 1299 C ASN A 83 7.627 -13.483 -26.211 1.00 15.43 C ATOM 1300 O ASN A 83 8.458 -14.352 -25.953 1.00 21.10 O ATOM 1301 CB ASN A 83 6.604 -14.884 -28.013 1.00 65.34 C ATOM 1302 CG ASN A 83 5.506 -14.933 -29.058 1.00 11.23 C ATOM 1303 OD1 ASN A 83 4.566 -14.138 -29.024 1.00 23.14 O ATOM 1304 ND2 ASN A 83 5.620 -15.869 -29.993 1.00 14.13 N ATOM 0 H ASN A 83 8.092 -13.383 -29.296 1.00 52.33 H new ATOM 0 HA ASN A 83 5.984 -12.904 -27.450 1.00 33.40 H new ATOM 0 HB2 ASN A 83 7.507 -15.340 -28.418 1.00 65.34 H new ATOM 0 HB3 ASN A 83 6.306 -15.478 -27.149 1.00 65.34 H new ATOM 0 HD21 ASN A 83 4.911 -15.950 -30.722 1.00 14.13 H new ATOM 0 HD22 ASN A 83 6.416 -16.506 -29.982 1.00 14.13 H new ATOM 1311 N GLU A 84 7.291 -12.524 -25.353 1.00 42.32 N ATOM 1312 CA GLU A 84 7.897 -12.437 -24.030 1.00 20.33 C ATOM 1313 C GLU A 84 7.794 -13.771 -23.296 1.00 61.51 C ATOM 1314 O GLU A 84 6.993 -14.633 -23.660 1.00 23.14 O ATOM 1315 CB GLU A 84 7.223 -11.337 -23.207 1.00 24.11 C ATOM 1316 CG GLU A 84 5.756 -11.605 -22.918 1.00 30.22 C ATOM 1317 CD GLU A 84 4.851 -11.191 -24.062 1.00 31.21 C ATOM 1318 OE1 GLU A 84 4.927 -10.019 -24.485 1.00 13.23 O ATOM 1319 OE2 GLU A 84 4.067 -12.041 -24.534 1.00 53.34 O ATOM 0 H GLU A 84 6.603 -11.797 -25.551 1.00 42.32 H new ATOM 0 HA GLU A 84 8.951 -12.192 -24.157 1.00 20.33 H new ATOM 0 HB2 GLU A 84 7.756 -11.223 -22.263 1.00 24.11 H new ATOM 0 HB3 GLU A 84 7.313 -10.390 -23.739 1.00 24.11 H new ATOM 0 HG2 GLU A 84 5.617 -12.667 -22.716 1.00 30.22 H new ATOM 0 HG3 GLU A 84 5.463 -11.068 -22.016 1.00 30.22 H new ATOM 1326 N LYS A 85 8.611 -13.935 -22.261 1.00 62.32 N ATOM 1327 CA LYS A 85 8.614 -15.163 -21.475 1.00 15.05 C ATOM 1328 C LYS A 85 8.593 -14.852 -19.981 1.00 74.33 C ATOM 1329 O LYS A 85 9.571 -14.351 -19.427 1.00 63.44 O ATOM 1330 CB LYS A 85 9.844 -16.008 -21.813 1.00 52.33 C ATOM 1331 CG LYS A 85 9.760 -17.436 -21.304 1.00 75.44 C ATOM 1332 CD LYS A 85 8.883 -18.296 -22.199 1.00 71.33 C ATOM 1333 CE LYS A 85 8.886 -19.750 -21.752 1.00 22.00 C ATOM 1334 NZ LYS A 85 9.975 -20.529 -22.404 1.00 5.51 N ATOM 0 H LYS A 85 9.280 -13.232 -21.947 1.00 62.32 H new ATOM 0 HA LYS A 85 7.715 -15.726 -21.725 1.00 15.05 H new ATOM 0 HB2 LYS A 85 9.977 -16.024 -22.895 1.00 52.33 H new ATOM 0 HB3 LYS A 85 10.729 -15.532 -21.390 1.00 52.33 H new ATOM 0 HG2 LYS A 85 10.761 -17.865 -21.253 1.00 75.44 H new ATOM 0 HG3 LYS A 85 9.360 -17.439 -20.290 1.00 75.44 H new ATOM 0 HD2 LYS A 85 7.863 -17.913 -22.187 1.00 71.33 H new ATOM 0 HD3 LYS A 85 9.236 -18.230 -23.228 1.00 71.33 H new ATOM 0 HE2 LYS A 85 9.004 -19.797 -20.669 1.00 22.00 H new ATOM 0 HE3 LYS A 85 7.924 -20.204 -21.987 1.00 22.00 H new ATOM 0 HZ1 LYS A 85 9.943 -21.514 -22.073 1.00 5.51 H new ATOM 0 HZ2 LYS A 85 9.848 -20.506 -23.436 1.00 5.51 H new ATOM 0 HZ3 LYS A 85 10.895 -20.111 -22.159 1.00 5.51 H new ATOM 1348 N VAL A 86 7.471 -15.154 -19.334 1.00 63.22 N ATOM 1349 CA VAL A 86 7.324 -14.910 -17.904 1.00 42.44 C ATOM 1350 C VAL A 86 8.225 -15.834 -17.093 1.00 71.22 C ATOM 1351 O VAL A 86 8.162 -17.056 -17.231 1.00 31.21 O ATOM 1352 CB VAL A 86 5.866 -15.103 -17.449 1.00 55.41 C ATOM 1353 CG1 VAL A 86 5.734 -14.850 -15.955 1.00 4.30 C ATOM 1354 CG2 VAL A 86 4.937 -14.190 -18.236 1.00 60.22 C ATOM 0 H VAL A 86 6.651 -15.568 -19.778 1.00 63.22 H new ATOM 0 HA VAL A 86 7.618 -13.875 -17.728 1.00 42.44 H new ATOM 0 HB VAL A 86 5.577 -16.135 -17.645 1.00 55.41 H new ATOM 0 HG11 VAL A 86 4.696 -14.991 -15.652 1.00 4.30 H new ATOM 0 HG12 VAL A 86 6.369 -15.548 -15.410 1.00 4.30 H new ATOM 0 HG13 VAL A 86 6.042 -13.829 -15.730 1.00 4.30 H new ATOM 0 HG21 VAL A 86 3.910 -14.340 -17.901 1.00 60.22 H new ATOM 0 HG22 VAL A 86 5.224 -13.151 -18.073 1.00 60.22 H new ATOM 0 HG23 VAL A 86 5.010 -14.424 -19.298 1.00 60.22 H new ATOM 1364 N ILE A 87 9.062 -15.243 -16.247 1.00 70.04 N ATOM 1365 CA ILE A 87 9.975 -16.014 -15.412 1.00 74.15 C ATOM 1366 C ILE A 87 9.796 -15.668 -13.938 1.00 62.11 C ATOM 1367 O ILE A 87 8.948 -14.850 -13.579 1.00 42.12 O ATOM 1368 CB ILE A 87 11.443 -15.772 -15.811 1.00 35.31 C ATOM 1369 CG1 ILE A 87 11.722 -14.272 -15.927 1.00 31.42 C ATOM 1370 CG2 ILE A 87 11.759 -16.478 -17.121 1.00 30.31 C ATOM 1371 CD1 ILE A 87 13.152 -13.951 -16.301 1.00 72.22 C ATOM 0 H ILE A 87 9.127 -14.233 -16.122 1.00 70.04 H new ATOM 0 HA ILE A 87 9.734 -17.066 -15.568 1.00 74.15 H new ATOM 0 HB ILE A 87 12.088 -16.183 -15.034 1.00 35.31 H new ATOM 0 HG12 ILE A 87 11.054 -13.843 -16.674 1.00 31.42 H new ATOM 0 HG13 ILE A 87 11.487 -13.792 -14.977 1.00 31.42 H new ATOM 0 HG21 ILE A 87 12.800 -16.298 -17.390 1.00 30.31 H new ATOM 0 HG22 ILE A 87 11.594 -17.549 -17.006 1.00 30.31 H new ATOM 0 HG23 ILE A 87 11.109 -16.094 -17.907 1.00 30.31 H new ATOM 0 HD11 ILE A 87 13.277 -12.870 -16.365 1.00 72.22 H new ATOM 0 HD12 ILE A 87 13.825 -14.350 -15.542 1.00 72.22 H new ATOM 0 HD13 ILE A 87 13.386 -14.401 -17.266 1.00 72.22 H new ATOM 1383 N LEU A 88 10.601 -16.295 -13.088 1.00 5.35 N ATOM 1384 CA LEU A 88 10.535 -16.052 -11.651 1.00 34.14 C ATOM 1385 C LEU A 88 11.788 -15.334 -11.161 1.00 22.55 C ATOM 1386 O LEU A 88 11.759 -14.628 -10.152 1.00 73.25 O ATOM 1387 CB LEU A 88 10.362 -17.373 -10.898 1.00 11.41 C ATOM 1388 CG LEU A 88 9.997 -17.259 -9.418 1.00 14.55 C ATOM 1389 CD1 LEU A 88 8.554 -16.804 -9.257 1.00 61.21 C ATOM 1390 CD2 LEU A 88 10.221 -18.586 -8.709 1.00 23.40 C ATOM 0 H LEU A 88 11.307 -16.975 -13.369 1.00 5.35 H new ATOM 0 HA LEU A 88 9.674 -15.413 -11.455 1.00 34.14 H new ATOM 0 HB2 LEU A 88 9.588 -17.955 -11.399 1.00 11.41 H new ATOM 0 HB3 LEU A 88 11.290 -17.939 -10.980 1.00 11.41 H new ATOM 0 HG LEU A 88 10.646 -16.512 -8.961 1.00 14.55 H new ATOM 0 HD11 LEU A 88 8.312 -16.729 -8.197 1.00 61.21 H new ATOM 0 HD12 LEU A 88 8.425 -15.830 -9.729 1.00 61.21 H new ATOM 0 HD13 LEU A 88 7.890 -17.527 -9.730 1.00 61.21 H new ATOM 0 HD21 LEU A 88 9.956 -18.485 -7.657 1.00 23.40 H new ATOM 0 HD22 LEU A 88 9.598 -19.354 -9.168 1.00 23.40 H new ATOM 0 HD23 LEU A 88 11.270 -18.871 -8.793 1.00 23.40 H new ATOM 1402 N LYS A 89 12.889 -15.518 -11.882 1.00 31.43 N ATOM 1403 CA LYS A 89 14.153 -14.886 -11.524 1.00 22.43 C ATOM 1404 C LYS A 89 14.889 -14.398 -12.768 1.00 13.15 C ATOM 1405 O LYS A 89 14.621 -14.856 -13.879 1.00 44.13 O ATOM 1406 CB LYS A 89 15.036 -15.867 -10.749 1.00 32.34 C ATOM 1407 CG LYS A 89 15.344 -17.143 -11.513 1.00 35.31 C ATOM 1408 CD LYS A 89 16.152 -18.116 -10.671 1.00 72.41 C ATOM 1409 CE LYS A 89 15.907 -19.557 -11.095 1.00 2.40 C ATOM 1410 NZ LYS A 89 16.813 -20.504 -10.389 1.00 22.14 N ATOM 0 H LYS A 89 12.931 -16.100 -12.718 1.00 31.43 H new ATOM 0 HA LYS A 89 13.934 -14.026 -10.892 1.00 22.43 H new ATOM 0 HB2 LYS A 89 15.973 -15.373 -10.491 1.00 32.34 H new ATOM 0 HB3 LYS A 89 14.542 -16.125 -9.812 1.00 32.34 H new ATOM 0 HG2 LYS A 89 14.412 -17.616 -11.824 1.00 35.31 H new ATOM 0 HG3 LYS A 89 15.896 -16.900 -12.421 1.00 35.31 H new ATOM 0 HD2 LYS A 89 17.213 -17.884 -10.763 1.00 72.41 H new ATOM 0 HD3 LYS A 89 15.889 -17.995 -9.620 1.00 72.41 H new ATOM 0 HE2 LYS A 89 14.870 -19.825 -10.890 1.00 2.40 H new ATOM 0 HE3 LYS A 89 16.053 -19.649 -12.171 1.00 2.40 H new ATOM 0 HZ1 LYS A 89 16.615 -21.475 -10.705 1.00 22.14 H new ATOM 0 HZ2 LYS A 89 17.802 -20.265 -10.605 1.00 22.14 H new ATOM 0 HZ3 LYS A 89 16.656 -20.435 -9.363 1.00 22.14 H new ATOM 1424 N LEU A 90 15.817 -13.467 -12.573 1.00 75.32 N ATOM 1425 CA LEU A 90 16.592 -12.918 -13.680 1.00 4.34 C ATOM 1426 C LEU A 90 18.028 -13.433 -13.647 1.00 12.42 C ATOM 1427 O LEU A 90 18.588 -13.670 -12.577 1.00 5.23 O ATOM 1428 CB LEU A 90 16.585 -11.389 -13.623 1.00 64.14 C ATOM 1429 CG LEU A 90 15.214 -10.729 -13.481 1.00 55.14 C ATOM 1430 CD1 LEU A 90 15.358 -9.301 -12.978 1.00 32.11 C ATOM 1431 CD2 LEU A 90 14.469 -10.756 -14.808 1.00 52.21 C ATOM 0 H LEU A 90 16.051 -13.077 -11.660 1.00 75.32 H new ATOM 0 HA LEU A 90 16.130 -13.243 -14.612 1.00 4.34 H new ATOM 0 HB2 LEU A 90 17.206 -11.074 -12.785 1.00 64.14 H new ATOM 0 HB3 LEU A 90 17.057 -11.009 -14.529 1.00 64.14 H new ATOM 0 HG LEU A 90 14.635 -11.293 -12.750 1.00 55.14 H new ATOM 0 HD11 LEU A 90 14.371 -8.847 -12.883 1.00 32.11 H new ATOM 0 HD12 LEU A 90 15.850 -9.306 -12.005 1.00 32.11 H new ATOM 0 HD13 LEU A 90 15.956 -8.725 -13.684 1.00 32.11 H new ATOM 0 HD21 LEU A 90 13.495 -10.282 -14.688 1.00 52.21 H new ATOM 0 HD22 LEU A 90 15.045 -10.216 -15.560 1.00 52.21 H new ATOM 0 HD23 LEU A 90 14.333 -11.789 -15.128 1.00 52.21 H new ATOM 1443 N ASP A 91 18.617 -13.601 -14.825 1.00 63.22 N ATOM 1444 CA ASP A 91 19.989 -14.085 -14.932 1.00 10.42 C ATOM 1445 C ASP A 91 20.966 -12.921 -15.069 1.00 21.20 C ATOM 1446 O ASP A 91 22.052 -13.072 -15.629 1.00 23.31 O ATOM 1447 CB ASP A 91 20.128 -15.028 -16.128 1.00 4.22 C ATOM 1448 CG ASP A 91 19.120 -16.160 -16.093 1.00 44.42 C ATOM 1449 OD1 ASP A 91 19.362 -17.148 -15.369 1.00 22.02 O ATOM 1450 OD2 ASP A 91 18.089 -16.057 -16.790 1.00 3.32 O ATOM 0 H ASP A 91 18.166 -13.409 -15.720 1.00 63.22 H new ATOM 0 HA ASP A 91 20.228 -14.631 -14.020 1.00 10.42 H new ATOM 0 HB2 ASP A 91 20.002 -14.461 -17.050 1.00 4.22 H new ATOM 0 HB3 ASP A 91 21.136 -15.443 -16.144 1.00 4.22 H new ATOM 1455 N TYR A 92 20.572 -11.761 -14.556 1.00 24.25 N ATOM 1456 CA TYR A 92 21.412 -10.571 -14.624 1.00 12.12 C ATOM 1457 C TYR A 92 21.067 -9.596 -13.502 1.00 52.13 C ATOM 1458 O TYR A 92 19.943 -9.583 -13.000 1.00 1.33 O ATOM 1459 CB TYR A 92 21.249 -9.883 -15.980 1.00 72.54 C ATOM 1460 CG TYR A 92 22.222 -10.374 -17.028 1.00 42.45 C ATOM 1461 CD1 TYR A 92 23.586 -10.137 -16.904 1.00 15.31 C ATOM 1462 CD2 TYR A 92 21.778 -11.075 -18.143 1.00 43.31 C ATOM 1463 CE1 TYR A 92 24.478 -10.582 -17.859 1.00 62.04 C ATOM 1464 CE2 TYR A 92 22.664 -11.525 -19.103 1.00 30.11 C ATOM 1465 CZ TYR A 92 24.013 -11.276 -18.957 1.00 13.11 C ATOM 1466 OH TYR A 92 24.899 -11.722 -19.910 1.00 71.43 O ATOM 0 H TYR A 92 19.677 -11.619 -14.089 1.00 24.25 H new ATOM 0 HA TYR A 92 22.450 -10.882 -14.504 1.00 12.12 H new ATOM 0 HB2 TYR A 92 20.232 -10.041 -16.338 1.00 72.54 H new ATOM 0 HB3 TYR A 92 21.378 -8.808 -15.851 1.00 72.54 H new ATOM 0 HD1 TYR A 92 23.954 -9.595 -16.045 1.00 15.31 H new ATOM 0 HD2 TYR A 92 20.723 -11.271 -18.261 1.00 43.31 H new ATOM 0 HE1 TYR A 92 25.535 -10.388 -17.747 1.00 62.04 H new ATOM 0 HE2 TYR A 92 22.302 -12.069 -19.963 1.00 30.11 H new ATOM 0 HH TYR A 92 24.410 -12.193 -20.617 1.00 71.43 H new ATOM 1476 N SER A 93 22.042 -8.780 -13.115 1.00 62.13 N ATOM 1477 CA SER A 93 21.844 -7.803 -12.051 1.00 45.12 C ATOM 1478 C SER A 93 21.982 -6.381 -12.587 1.00 1.01 C ATOM 1479 O SER A 93 21.430 -5.437 -12.022 1.00 53.21 O ATOM 1480 CB SER A 93 22.852 -8.035 -10.923 1.00 53.23 C ATOM 1481 OG SER A 93 22.341 -7.581 -9.682 1.00 33.11 O ATOM 0 H SER A 93 22.977 -8.776 -13.522 1.00 62.13 H new ATOM 0 HA SER A 93 20.835 -7.929 -11.659 1.00 45.12 H new ATOM 0 HB2 SER A 93 23.089 -9.097 -10.856 1.00 53.23 H new ATOM 0 HB3 SER A 93 23.782 -7.514 -11.149 1.00 53.23 H new ATOM 0 HG SER A 93 23.003 -7.742 -8.977 1.00 33.11 H new ATOM 1487 N ASP A 94 22.723 -6.237 -13.680 1.00 51.22 N ATOM 1488 CA ASP A 94 22.933 -4.931 -14.294 1.00 45.13 C ATOM 1489 C ASP A 94 23.097 -5.061 -15.805 1.00 63.24 C ATOM 1490 O ASP A 94 23.788 -5.958 -16.290 1.00 52.34 O ATOM 1491 CB ASP A 94 24.165 -4.253 -13.692 1.00 11.12 C ATOM 1492 CG ASP A 94 24.306 -4.523 -12.207 1.00 21.03 C ATOM 1493 OD1 ASP A 94 23.514 -3.959 -11.424 1.00 3.45 O ATOM 1494 OD2 ASP A 94 25.209 -5.298 -11.827 1.00 62.25 O ATOM 0 H ASP A 94 23.188 -7.008 -14.159 1.00 51.22 H new ATOM 0 HA ASP A 94 22.055 -4.317 -14.093 1.00 45.13 H new ATOM 0 HB2 ASP A 94 25.058 -4.604 -14.209 1.00 11.12 H new ATOM 0 HB3 ASP A 94 24.102 -3.178 -13.859 1.00 11.12 H new ATOM 1499 N PHE A 95 22.457 -4.161 -16.545 1.00 21.35 N ATOM 1500 CA PHE A 95 22.530 -4.177 -18.001 1.00 1.31 C ATOM 1501 C PHE A 95 23.971 -4.008 -18.475 1.00 55.31 C ATOM 1502 O PHE A 95 24.577 -2.954 -18.285 1.00 1.01 O ATOM 1503 CB PHE A 95 21.654 -3.068 -18.588 1.00 44.03 C ATOM 1504 CG PHE A 95 21.070 -3.412 -19.928 1.00 74.52 C ATOM 1505 CD1 PHE A 95 21.870 -3.450 -21.059 1.00 33.21 C ATOM 1506 CD2 PHE A 95 19.720 -3.699 -20.057 1.00 62.10 C ATOM 1507 CE1 PHE A 95 21.334 -3.766 -22.293 1.00 72.11 C ATOM 1508 CE2 PHE A 95 19.179 -4.016 -21.289 1.00 32.13 C ATOM 1509 CZ PHE A 95 19.987 -4.051 -22.408 1.00 1.40 C ATOM 0 H PHE A 95 21.882 -3.412 -16.160 1.00 21.35 H new ATOM 0 HA PHE A 95 22.163 -5.143 -18.349 1.00 1.31 H new ATOM 0 HB2 PHE A 95 20.844 -2.850 -17.893 1.00 44.03 H new ATOM 0 HB3 PHE A 95 22.247 -2.158 -18.682 1.00 44.03 H new ATOM 0 HD1 PHE A 95 22.924 -3.230 -20.975 1.00 33.21 H new ATOM 0 HD2 PHE A 95 19.083 -3.675 -19.185 1.00 62.10 H new ATOM 0 HE1 PHE A 95 21.968 -3.790 -23.167 1.00 72.11 H new ATOM 0 HE2 PHE A 95 18.125 -4.236 -21.376 1.00 32.13 H new ATOM 0 HZ PHE A 95 19.567 -4.301 -23.371 1.00 1.40 H new ATOM 1519 N GLN A 96 24.511 -5.053 -19.092 1.00 75.54 N ATOM 1520 CA GLN A 96 25.880 -5.021 -19.593 1.00 32.44 C ATOM 1521 C GLN A 96 25.901 -4.921 -21.114 1.00 43.42 C ATOM 1522 O GLN A 96 24.852 -4.887 -21.758 1.00 44.24 O ATOM 1523 CB GLN A 96 26.639 -6.270 -19.142 1.00 23.24 C ATOM 1524 CG GLN A 96 27.318 -6.115 -17.790 1.00 52.22 C ATOM 1525 CD GLN A 96 27.682 -7.446 -17.164 1.00 24.24 C ATOM 1526 OE1 GLN A 96 27.324 -7.726 -16.019 1.00 42.41 O ATOM 1527 NE2 GLN A 96 28.399 -8.277 -17.912 1.00 54.33 N ATOM 0 H GLN A 96 24.022 -5.933 -19.257 1.00 75.54 H new ATOM 0 HA GLN A 96 26.370 -4.138 -19.183 1.00 32.44 H new ATOM 0 HB2 GLN A 96 25.946 -7.110 -19.097 1.00 23.24 H new ATOM 0 HB3 GLN A 96 27.391 -6.518 -19.891 1.00 23.24 H new ATOM 0 HG2 GLN A 96 28.220 -5.514 -17.907 1.00 52.22 H new ATOM 0 HG3 GLN A 96 26.657 -5.570 -17.116 1.00 52.22 H new ATOM 0 HE21 GLN A 96 28.674 -8.005 -18.856 1.00 54.33 H new ATOM 0 HE22 GLN A 96 28.674 -9.187 -17.543 1.00 54.33 H new ATOM 1536 N ILE A 97 27.102 -4.872 -21.682 1.00 75.51 N ATOM 1537 CA ILE A 97 27.259 -4.776 -23.128 1.00 73.20 C ATOM 1538 C ILE A 97 27.941 -6.018 -23.691 1.00 24.23 C ATOM 1539 O ILE A 97 28.824 -6.596 -23.056 1.00 34.41 O ATOM 1540 CB ILE A 97 28.075 -3.532 -23.524 1.00 11.30 C ATOM 1541 CG1 ILE A 97 27.408 -2.265 -22.985 1.00 12.41 C ATOM 1542 CG2 ILE A 97 28.225 -3.456 -25.036 1.00 52.40 C ATOM 1543 CD1 ILE A 97 28.316 -1.055 -22.989 1.00 51.13 C ATOM 0 H ILE A 97 27.980 -4.897 -21.163 1.00 75.51 H new ATOM 0 HA ILE A 97 26.257 -4.693 -23.549 1.00 73.20 H new ATOM 0 HB ILE A 97 29.069 -3.612 -23.084 1.00 11.30 H new ATOM 0 HG12 ILE A 97 26.523 -2.047 -23.583 1.00 12.41 H new ATOM 0 HG13 ILE A 97 27.066 -2.449 -21.966 1.00 12.41 H new ATOM 0 HG21 ILE A 97 28.804 -2.571 -25.300 1.00 52.40 H new ATOM 0 HG22 ILE A 97 28.739 -4.347 -25.396 1.00 52.40 H new ATOM 0 HG23 ILE A 97 27.239 -3.395 -25.497 1.00 52.40 H new ATOM 0 HD11 ILE A 97 27.777 -0.194 -22.594 1.00 51.13 H new ATOM 0 HD12 ILE A 97 29.189 -1.253 -22.367 1.00 51.13 H new ATOM 0 HD13 ILE A 97 28.638 -0.845 -24.009 1.00 51.13 H new ATOM 1555 N VAL A 98 27.528 -6.423 -24.888 1.00 4.13 N ATOM 1556 CA VAL A 98 28.102 -7.595 -25.538 1.00 51.14 C ATOM 1557 C VAL A 98 29.124 -7.192 -26.595 1.00 40.41 C ATOM 1558 O VAL A 98 28.816 -6.435 -27.516 1.00 61.24 O ATOM 1559 CB VAL A 98 27.012 -8.460 -26.198 1.00 72.21 C ATOM 1560 CG1 VAL A 98 27.632 -9.662 -26.895 1.00 4.35 C ATOM 1561 CG2 VAL A 98 25.986 -8.903 -25.166 1.00 22.14 C ATOM 0 H VAL A 98 26.798 -5.957 -25.427 1.00 4.13 H new ATOM 0 HA VAL A 98 28.597 -8.177 -24.761 1.00 51.14 H new ATOM 0 HB VAL A 98 26.501 -7.858 -26.950 1.00 72.21 H new ATOM 0 HG11 VAL A 98 26.846 -10.261 -27.355 1.00 4.35 H new ATOM 0 HG12 VAL A 98 28.325 -9.319 -27.664 1.00 4.35 H new ATOM 0 HG13 VAL A 98 28.170 -10.268 -26.166 1.00 4.35 H new ATOM 0 HG21 VAL A 98 25.223 -9.513 -25.650 1.00 22.14 H new ATOM 0 HG22 VAL A 98 26.480 -9.488 -24.390 1.00 22.14 H new ATOM 0 HG23 VAL A 98 25.519 -8.026 -24.718 1.00 22.14 H new ATOM 1571 N LYS A 99 30.343 -7.702 -26.456 1.00 71.04 N ATOM 1572 CA LYS A 99 31.412 -7.398 -27.400 1.00 3.44 C ATOM 1573 C LYS A 99 31.577 -8.522 -28.417 1.00 53.13 C ATOM 1574 O LYS A 99 31.855 -8.274 -29.591 1.00 22.32 O ATOM 1575 CB LYS A 99 32.730 -7.174 -26.654 1.00 12.12 C ATOM 1576 CG LYS A 99 32.676 -6.033 -25.652 1.00 73.14 C ATOM 1577 CD LYS A 99 34.057 -5.697 -25.115 1.00 54.21 C ATOM 1578 CE LYS A 99 34.531 -6.734 -24.109 1.00 21.10 C ATOM 1579 NZ LYS A 99 35.221 -7.875 -24.772 1.00 74.22 N ATOM 0 H LYS A 99 30.615 -8.328 -25.698 1.00 71.04 H new ATOM 0 HA LYS A 99 31.143 -6.486 -27.933 1.00 3.44 H new ATOM 0 HB2 LYS A 99 33.003 -8.091 -26.133 1.00 12.12 H new ATOM 0 HB3 LYS A 99 33.518 -6.973 -27.379 1.00 12.12 H new ATOM 0 HG2 LYS A 99 32.245 -5.151 -26.126 1.00 73.14 H new ATOM 0 HG3 LYS A 99 32.019 -6.304 -24.825 1.00 73.14 H new ATOM 0 HD2 LYS A 99 34.766 -5.639 -25.941 1.00 54.21 H new ATOM 0 HD3 LYS A 99 34.036 -4.714 -24.644 1.00 54.21 H new ATOM 0 HE2 LYS A 99 35.209 -6.265 -23.396 1.00 21.10 H new ATOM 0 HE3 LYS A 99 33.678 -7.106 -23.541 1.00 21.10 H new ATOM 0 HZ1 LYS A 99 34.714 -8.758 -24.560 1.00 74.22 H new ATOM 0 HZ2 LYS A 99 35.235 -7.722 -25.801 1.00 74.22 H new ATOM 0 HZ3 LYS A 99 36.197 -7.943 -24.419 1.00 74.22 H new