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 71 SER OG : rot -85:sc= 1.01 USER MOD Set 1.2: A 74 SER OG : rot 180:sc= -0.109 USER MOD Set 2.1: A 41 GLN : amide:sc= 0 X(o=-0.1,f=-0.1) USER MOD Set 2.2: A 49 GLN : amide:sc= -0.104 K(o=-0.1,f=-3.8!) USER MOD Set 3.1: A 43 THR OG1 : rot -160:sc= 1.51 USER MOD Set 3.2: A 47 THR OG1 : rot 180:sc= 0.368 USER MOD Single : A 5 ASN : amide:sc= -0.256 K(o=-0.26,f=0.41) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 130:sc= -0.521 USER MOD Single : A 17 LYS NZ :NH3+ -149:sc= 0.0463 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= -0.0549 K(o=-0.055,f=-1.1!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= -0.0855 X(o=-0.086,f=-0.18) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.555 K(o=-0.55,f=-2.3!) USER MOD Single : A 32 LYS NZ :NH3+ -158:sc= -0.0595 (180deg=-0.471) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -0.985 K(o=-0.98,f=-4.5!) USER MOD Single : A 51 LYS NZ :NH3+ 154:sc= -0.604 (180deg=-1.16!) USER MOD Single : A 53 GLN : amide:sc= -0.175 K(o=-0.18,f=-2.1) 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 150:sc= -4.84! (180deg=-9.08!) USER MOD Single : A 63 GLN : amide:sc= -1.16 K(o=-1.2,f=-2.3) USER MOD Single : A 64 LYS NZ :NH3+ 165:sc= -0.0159 (180deg=-0.25) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 HIS : no HD1:sc= -0.0671 X(o=-0.067,f=0) USER MOD Single : A 78 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.412) USER MOD Single : A 80 ASN : amide:sc= -0.406 X(o=-0.41,f=-0.37) USER MOD Single : A 82 LYS NZ :NH3+ 129:sc= -0.139 (180deg=-1.21) USER MOD Single : A 83 ASN : amide:sc= -0.0839 K(o=-0.084,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 53:sc= 2.06 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.085) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 40 N ASN A 5 4.668 -7.111 -9.657 1.00 52.53 N ATOM 41 CA ASN A 5 5.613 -8.193 -9.407 1.00 15.00 C ATOM 42 C ASN A 5 5.643 -9.170 -10.578 1.00 61.04 C ATOM 43 O ASN A 5 5.876 -10.366 -10.399 1.00 1.13 O ATOM 44 CB ASN A 5 5.243 -8.933 -8.120 1.00 74.52 C ATOM 45 CG ASN A 5 3.864 -9.561 -8.190 1.00 53.13 C ATOM 46 OD1 ASN A 5 3.650 -10.537 -8.909 1.00 75.02 O ATOM 47 ND2 ASN A 5 2.920 -9.001 -7.442 1.00 24.13 N ATOM 0 HA ASN A 5 6.606 -7.757 -9.295 1.00 15.00 H new ATOM 0 HB2 ASN A 5 5.983 -9.709 -7.925 1.00 74.52 H new ATOM 0 HB3 ASN A 5 5.281 -8.238 -7.281 1.00 74.52 H new ATOM 0 HD21 ASN A 5 1.973 -9.379 -7.449 1.00 24.13 H new ATOM 0 HD22 ASN A 5 3.142 -8.193 -6.861 1.00 24.13 H new ATOM 54 N THR A 6 5.407 -8.653 -11.780 1.00 13.40 N ATOM 55 CA THR A 6 5.406 -9.478 -12.981 1.00 65.11 C ATOM 56 C THR A 6 6.733 -9.367 -13.725 1.00 34.34 C ATOM 57 O THR A 6 6.978 -8.392 -14.436 1.00 75.34 O ATOM 58 CB THR A 6 4.262 -9.083 -13.934 1.00 22.43 C ATOM 59 OG1 THR A 6 3.148 -8.589 -13.183 1.00 33.44 O ATOM 60 CG2 THR A 6 3.825 -10.272 -14.776 1.00 64.24 C ATOM 0 H THR A 6 5.214 -7.665 -11.947 1.00 13.40 H new ATOM 0 HA THR A 6 5.259 -10.508 -12.656 1.00 65.11 H new ATOM 0 HB THR A 6 4.627 -8.301 -14.600 1.00 22.43 H new ATOM 0 HG1 THR A 6 2.426 -8.338 -13.796 1.00 33.44 H new ATOM 0 HG21 THR A 6 3.016 -9.969 -15.441 1.00 64.24 H new ATOM 0 HG22 THR A 6 4.668 -10.628 -15.368 1.00 64.24 H new ATOM 0 HG23 THR A 6 3.477 -11.072 -14.123 1.00 64.24 H new ATOM 68 N LEU A 7 7.585 -10.372 -13.556 1.00 44.23 N ATOM 69 CA LEU A 7 8.888 -10.388 -14.213 1.00 1.41 C ATOM 70 C LEU A 7 8.833 -11.184 -15.513 1.00 21.14 C ATOM 71 O LEU A 7 8.330 -12.307 -15.543 1.00 33.54 O ATOM 72 CB LEU A 7 9.944 -10.984 -13.280 1.00 50.34 C ATOM 73 CG LEU A 7 10.099 -10.303 -11.920 1.00 33.53 C ATOM 74 CD1 LEU A 7 10.626 -11.288 -10.888 1.00 31.15 C ATOM 75 CD2 LEU A 7 11.020 -9.097 -12.028 1.00 61.22 C ATOM 0 H LEU A 7 7.398 -11.186 -12.970 1.00 44.23 H new ATOM 0 HA LEU A 7 9.161 -9.360 -14.450 1.00 1.41 H new ATOM 0 HB2 LEU A 7 9.702 -12.033 -13.113 1.00 50.34 H new ATOM 0 HB3 LEU A 7 10.907 -10.957 -13.790 1.00 50.34 H new ATOM 0 HG LEU A 7 9.118 -9.957 -11.595 1.00 33.53 H new ATOM 0 HD11 LEU A 7 10.730 -10.786 -9.926 1.00 31.15 H new ATOM 0 HD12 LEU A 7 9.929 -12.120 -10.790 1.00 31.15 H new ATOM 0 HD13 LEU A 7 11.598 -11.665 -11.208 1.00 31.15 H new ATOM 0 HD21 LEU A 7 11.118 -8.625 -11.050 1.00 61.22 H new ATOM 0 HD22 LEU A 7 12.002 -9.419 -12.376 1.00 61.22 H new ATOM 0 HD23 LEU A 7 10.601 -8.381 -12.736 1.00 61.22 H new ATOM 87 N ILE A 8 9.356 -10.596 -16.583 1.00 54.04 N ATOM 88 CA ILE A 8 9.369 -11.252 -17.885 1.00 32.33 C ATOM 89 C ILE A 8 10.713 -11.067 -18.580 1.00 63.41 C ATOM 90 O ILE A 8 11.594 -10.371 -18.076 1.00 11.41 O ATOM 91 CB ILE A 8 8.252 -10.713 -18.799 1.00 24.25 C ATOM 92 CG1 ILE A 8 8.399 -9.201 -18.981 1.00 75.11 C ATOM 93 CG2 ILE A 8 6.886 -11.053 -18.222 1.00 60.14 C ATOM 94 CD1 ILE A 8 7.669 -8.665 -20.193 1.00 34.42 C ATOM 0 H ILE A 8 9.776 -9.667 -16.574 1.00 54.04 H new ATOM 0 HA ILE A 8 9.199 -12.313 -17.705 1.00 32.33 H new ATOM 0 HB ILE A 8 8.340 -11.188 -19.776 1.00 24.25 H new ATOM 0 HG12 ILE A 8 8.025 -8.698 -18.089 1.00 75.11 H new ATOM 0 HG13 ILE A 8 9.457 -8.954 -19.066 1.00 75.11 H new ATOM 0 HG21 ILE A 8 6.107 -10.666 -18.879 1.00 60.14 H new ATOM 0 HG22 ILE A 8 6.785 -12.135 -18.139 1.00 60.14 H new ATOM 0 HG23 ILE A 8 6.786 -10.602 -17.235 1.00 60.14 H new ATOM 0 HD11 ILE A 8 7.817 -7.587 -20.260 1.00 34.42 H new ATOM 0 HD12 ILE A 8 8.059 -9.141 -21.093 1.00 34.42 H new ATOM 0 HD13 ILE A 8 6.604 -8.880 -20.101 1.00 34.42 H new ATOM 106 N SER A 9 10.864 -11.695 -19.742 1.00 55.12 N ATOM 107 CA SER A 9 12.102 -11.601 -20.507 1.00 34.31 C ATOM 108 C SER A 9 11.829 -11.744 -22.001 1.00 42.33 C ATOM 109 O SER A 9 11.422 -12.806 -22.472 1.00 23.35 O ATOM 110 CB SER A 9 13.089 -12.678 -20.052 1.00 43.52 C ATOM 111 OG SER A 9 12.506 -13.967 -20.121 1.00 33.02 O ATOM 0 H SER A 9 10.144 -12.274 -20.174 1.00 55.12 H new ATOM 0 HA SER A 9 12.538 -10.618 -20.328 1.00 34.31 H new ATOM 0 HB2 SER A 9 13.981 -12.645 -20.677 1.00 43.52 H new ATOM 0 HB3 SER A 9 13.408 -12.474 -19.030 1.00 43.52 H new ATOM 0 HG SER A 9 13.158 -14.637 -19.827 1.00 33.02 H new ATOM 117 N VAL A 10 12.057 -10.665 -22.743 1.00 54.44 N ATOM 118 CA VAL A 10 11.837 -10.668 -24.185 1.00 3.12 C ATOM 119 C VAL A 10 13.103 -10.269 -24.934 1.00 44.53 C ATOM 120 O VAL A 10 13.769 -9.297 -24.575 1.00 62.14 O ATOM 121 CB VAL A 10 10.696 -9.712 -24.581 1.00 63.11 C ATOM 122 CG1 VAL A 10 11.063 -8.275 -24.245 1.00 53.40 C ATOM 123 CG2 VAL A 10 10.371 -9.856 -26.060 1.00 73.21 C ATOM 0 H VAL A 10 12.394 -9.778 -22.370 1.00 54.44 H new ATOM 0 HA VAL A 10 11.560 -11.685 -24.461 1.00 3.12 H new ATOM 0 HB VAL A 10 9.807 -9.978 -24.009 1.00 63.11 H new ATOM 0 HG11 VAL A 10 10.245 -7.614 -24.532 1.00 53.40 H new ATOM 0 HG12 VAL A 10 11.243 -8.186 -23.174 1.00 53.40 H new ATOM 0 HG13 VAL A 10 11.965 -7.993 -24.789 1.00 53.40 H new ATOM 0 HG21 VAL A 10 9.563 -9.174 -26.323 1.00 73.21 H new ATOM 0 HG22 VAL A 10 11.255 -9.617 -26.652 1.00 73.21 H new ATOM 0 HG23 VAL A 10 10.062 -10.881 -26.267 1.00 73.21 H new ATOM 133 N ASP A 11 13.430 -11.024 -25.977 1.00 51.11 N ATOM 134 CA ASP A 11 14.616 -10.748 -26.779 1.00 61.24 C ATOM 135 C ASP A 11 14.237 -10.466 -28.230 1.00 65.51 C ATOM 136 O ASP A 11 13.302 -11.062 -28.765 1.00 14.42 O ATOM 137 CB ASP A 11 15.588 -11.927 -26.713 1.00 3.03 C ATOM 138 CG ASP A 11 15.120 -13.111 -27.536 1.00 44.32 C ATOM 139 OD1 ASP A 11 13.907 -13.403 -27.517 1.00 73.24 O ATOM 140 OD2 ASP A 11 15.968 -13.745 -28.199 1.00 30.21 O ATOM 0 H ASP A 11 12.890 -11.832 -26.287 1.00 51.11 H new ATOM 0 HA ASP A 11 15.103 -9.862 -26.370 1.00 61.24 H new ATOM 0 HB2 ASP A 11 16.568 -11.607 -27.068 1.00 3.03 H new ATOM 0 HB3 ASP A 11 15.710 -12.236 -25.675 1.00 3.03 H new ATOM 145 N TYR A 12 14.970 -9.555 -28.861 1.00 32.32 N ATOM 146 CA TYR A 12 14.709 -9.192 -30.249 1.00 13.14 C ATOM 147 C TYR A 12 15.870 -8.391 -30.830 1.00 12.03 C ATOM 148 O TYR A 12 16.786 -7.996 -30.110 1.00 43.31 O ATOM 149 CB TYR A 12 13.415 -8.383 -30.351 1.00 54.30 C ATOM 150 CG TYR A 12 13.295 -7.297 -29.305 1.00 71.23 C ATOM 151 CD1 TYR A 12 14.200 -6.244 -29.263 1.00 11.41 C ATOM 152 CD2 TYR A 12 12.278 -7.325 -28.359 1.00 72.43 C ATOM 153 CE1 TYR A 12 14.095 -5.250 -28.309 1.00 10.10 C ATOM 154 CE2 TYR A 12 12.164 -6.335 -27.403 1.00 23.32 C ATOM 155 CZ TYR A 12 13.075 -5.300 -27.382 1.00 3.25 C ATOM 156 OH TYR A 12 12.966 -4.312 -26.429 1.00 64.43 O ATOM 0 H TYR A 12 15.749 -9.055 -28.433 1.00 32.32 H new ATOM 0 HA TYR A 12 14.602 -10.111 -30.825 1.00 13.14 H new ATOM 0 HB2 TYR A 12 13.357 -7.930 -31.341 1.00 54.30 H new ATOM 0 HB3 TYR A 12 12.565 -9.060 -30.259 1.00 54.30 H new ATOM 0 HD1 TYR A 12 14.999 -6.202 -29.988 1.00 11.41 H new ATOM 0 HD2 TYR A 12 11.564 -8.135 -28.371 1.00 72.43 H new ATOM 0 HE1 TYR A 12 14.808 -4.439 -28.289 1.00 10.10 H new ATOM 0 HE2 TYR A 12 11.366 -6.371 -26.676 1.00 23.32 H new ATOM 0 HH TYR A 12 12.047 -3.972 -26.414 1.00 64.43 H new ATOM 166 N GLU A 13 15.822 -8.156 -32.137 1.00 41.33 N ATOM 167 CA GLU A 13 16.870 -7.402 -32.816 1.00 31.11 C ATOM 168 C GLU A 13 16.298 -6.153 -33.480 1.00 44.31 C ATOM 169 O GLU A 13 15.919 -6.178 -34.651 1.00 73.32 O ATOM 170 CB GLU A 13 17.563 -8.278 -33.862 1.00 54.31 C ATOM 171 CG GLU A 13 16.597 -9.012 -34.777 1.00 51.44 C ATOM 172 CD GLU A 13 16.298 -10.420 -34.301 1.00 42.05 C ATOM 173 OE1 GLU A 13 17.206 -11.275 -34.374 1.00 12.02 O ATOM 174 OE2 GLU A 13 15.158 -10.667 -33.857 1.00 72.43 O ATOM 0 H GLU A 13 15.070 -8.476 -32.747 1.00 41.33 H new ATOM 0 HA GLU A 13 17.602 -7.093 -32.070 1.00 31.11 H new ATOM 0 HB2 GLU A 13 18.221 -7.655 -34.467 1.00 54.31 H new ATOM 0 HB3 GLU A 13 18.193 -9.007 -33.353 1.00 54.31 H new ATOM 0 HG2 GLU A 13 15.666 -8.449 -34.842 1.00 51.44 H new ATOM 0 HG3 GLU A 13 17.016 -9.054 -35.783 1.00 51.44 H new ATOM 181 N ILE A 14 16.240 -5.062 -32.724 1.00 2.13 N ATOM 182 CA ILE A 14 15.716 -3.803 -33.239 1.00 31.15 C ATOM 183 C ILE A 14 16.392 -3.421 -34.551 1.00 23.42 C ATOM 184 O ILE A 14 17.585 -3.662 -34.740 1.00 31.10 O ATOM 185 CB ILE A 14 15.904 -2.659 -32.225 1.00 51.53 C ATOM 186 CG1 ILE A 14 15.185 -2.985 -30.915 1.00 22.34 C ATOM 187 CG2 ILE A 14 15.391 -1.349 -32.805 1.00 11.34 C ATOM 188 CD1 ILE A 14 13.711 -3.276 -31.090 1.00 22.20 C ATOM 0 H ILE A 14 16.549 -5.024 -31.753 1.00 2.13 H new ATOM 0 HA ILE A 14 14.650 -3.952 -33.413 1.00 31.15 H new ATOM 0 HB ILE A 14 16.968 -2.550 -32.015 1.00 51.53 H new ATOM 0 HG12 ILE A 14 15.665 -3.847 -30.452 1.00 22.34 H new ATOM 0 HG13 ILE A 14 15.302 -2.147 -30.227 1.00 22.34 H new ATOM 0 HG21 ILE A 14 15.530 -0.550 -32.077 1.00 11.34 H new ATOM 0 HG22 ILE A 14 15.944 -1.112 -33.714 1.00 11.34 H new ATOM 0 HG23 ILE A 14 14.331 -1.445 -33.040 1.00 11.34 H new ATOM 0 HD11 ILE A 14 13.266 -3.499 -30.120 1.00 22.20 H new ATOM 0 HD12 ILE A 14 13.218 -2.407 -31.524 1.00 22.20 H new ATOM 0 HD13 ILE A 14 13.585 -4.133 -31.752 1.00 22.20 H new ATOM 200 N PHE A 15 15.623 -2.823 -35.454 1.00 62.25 N ATOM 201 CA PHE A 15 16.148 -2.407 -36.750 1.00 1.33 C ATOM 202 C PHE A 15 16.649 -0.967 -36.696 1.00 4.42 C ATOM 203 O PHE A 15 16.759 -0.376 -35.622 1.00 41.44 O ATOM 204 CB PHE A 15 15.071 -2.544 -37.828 1.00 42.30 C ATOM 205 CG PHE A 15 14.278 -3.815 -37.725 1.00 63.22 C ATOM 206 CD1 PHE A 15 14.901 -5.012 -37.411 1.00 61.30 C ATOM 207 CD2 PHE A 15 12.910 -3.813 -37.943 1.00 71.34 C ATOM 208 CE1 PHE A 15 14.174 -6.184 -37.315 1.00 63.12 C ATOM 209 CE2 PHE A 15 12.178 -4.982 -37.849 1.00 11.24 C ATOM 210 CZ PHE A 15 12.811 -6.169 -37.535 1.00 40.23 C ATOM 0 H PHE A 15 14.634 -2.615 -35.313 1.00 62.25 H new ATOM 0 HA PHE A 15 16.987 -3.056 -37.000 1.00 1.33 H new ATOM 0 HB2 PHE A 15 14.391 -1.695 -37.761 1.00 42.30 H new ATOM 0 HB3 PHE A 15 15.543 -2.498 -38.810 1.00 42.30 H new ATOM 0 HD1 PHE A 15 15.967 -5.030 -37.239 1.00 61.30 H new ATOM 0 HD2 PHE A 15 12.410 -2.888 -38.189 1.00 71.34 H new ATOM 0 HE1 PHE A 15 14.672 -7.110 -37.068 1.00 63.12 H new ATOM 0 HE2 PHE A 15 11.112 -4.967 -38.021 1.00 11.24 H new ATOM 0 HZ PHE A 15 12.241 -7.083 -37.462 1.00 40.23 H new ATOM 220 N GLY A 16 16.953 -0.408 -37.863 1.00 43.35 N ATOM 221 CA GLY A 16 17.440 0.958 -37.928 1.00 22.20 C ATOM 222 C GLY A 16 18.886 1.037 -38.375 1.00 4.22 C ATOM 223 O GLY A 16 19.484 0.029 -38.752 1.00 2.10 O ATOM 0 H GLY A 16 16.871 -0.877 -38.765 1.00 43.35 H new ATOM 0 HA2 GLY A 16 16.818 1.530 -38.617 1.00 22.20 H new ATOM 0 HA3 GLY A 16 17.340 1.423 -36.947 1.00 22.20 H new ATOM 227 N LYS A 17 19.451 2.239 -38.335 1.00 3.25 N ATOM 228 CA LYS A 17 20.837 2.448 -38.739 1.00 34.03 C ATOM 229 C LYS A 17 21.777 2.318 -37.545 1.00 22.31 C ATOM 230 O LYS A 17 22.672 3.141 -37.354 1.00 65.04 O ATOM 231 CB LYS A 17 21.000 3.827 -39.382 1.00 15.14 C ATOM 232 CG LYS A 17 20.707 4.978 -38.435 1.00 11.13 C ATOM 233 CD LYS A 17 21.508 6.217 -38.799 1.00 14.11 C ATOM 234 CE LYS A 17 22.860 6.232 -38.102 1.00 74.32 C ATOM 235 NZ LYS A 17 23.406 7.612 -37.980 1.00 34.34 N ATOM 0 H LYS A 17 18.970 3.084 -38.027 1.00 3.25 H new ATOM 0 HA LYS A 17 21.096 1.681 -39.469 1.00 34.03 H new ATOM 0 HB2 LYS A 17 22.019 3.926 -39.756 1.00 15.14 H new ATOM 0 HB3 LYS A 17 20.336 3.898 -40.243 1.00 15.14 H new ATOM 0 HG2 LYS A 17 19.642 5.211 -38.462 1.00 11.13 H new ATOM 0 HG3 LYS A 17 20.942 4.679 -37.414 1.00 11.13 H new ATOM 0 HD2 LYS A 17 21.654 6.253 -39.879 1.00 14.11 H new ATOM 0 HD3 LYS A 17 20.946 7.109 -38.523 1.00 14.11 H new ATOM 0 HE2 LYS A 17 22.762 5.791 -37.110 1.00 74.32 H new ATOM 0 HE3 LYS A 17 23.562 5.611 -38.659 1.00 74.32 H new ATOM 0 HZ1 LYS A 17 24.445 7.578 -38.011 1.00 34.34 H new ATOM 0 HZ2 LYS A 17 23.055 8.195 -38.767 1.00 34.34 H new ATOM 0 HZ3 LYS A 17 23.100 8.028 -37.077 1.00 34.34 H new ATOM 249 N VAL A 18 21.569 1.277 -36.744 1.00 41.40 N ATOM 250 CA VAL A 18 22.400 1.038 -35.570 1.00 62.12 C ATOM 251 C VAL A 18 23.683 0.305 -35.946 1.00 21.15 C ATOM 252 O VAL A 18 23.987 -0.754 -35.397 1.00 71.12 O ATOM 253 CB VAL A 18 21.646 0.218 -34.506 1.00 40.23 C ATOM 254 CG1 VAL A 18 20.510 1.035 -33.909 1.00 61.32 C ATOM 255 CG2 VAL A 18 21.124 -1.079 -35.105 1.00 52.12 C ATOM 0 H VAL A 18 20.832 0.586 -36.887 1.00 41.40 H new ATOM 0 HA VAL A 18 22.651 2.014 -35.155 1.00 62.12 H new ATOM 0 HB VAL A 18 22.341 -0.033 -33.705 1.00 40.23 H new ATOM 0 HG11 VAL A 18 19.989 0.440 -33.159 1.00 61.32 H new ATOM 0 HG12 VAL A 18 20.914 1.933 -33.442 1.00 61.32 H new ATOM 0 HG13 VAL A 18 19.812 1.318 -34.697 1.00 61.32 H new ATOM 0 HG21 VAL A 18 20.594 -1.646 -34.340 1.00 52.12 H new ATOM 0 HG22 VAL A 18 20.443 -0.853 -35.926 1.00 52.12 H new ATOM 0 HG23 VAL A 18 21.960 -1.669 -35.480 1.00 52.12 H new ATOM 265 N GLN A 19 24.432 0.876 -36.883 1.00 40.41 N ATOM 266 CA GLN A 19 25.683 0.276 -37.332 1.00 10.52 C ATOM 267 C GLN A 19 26.876 0.916 -36.630 1.00 2.42 C ATOM 268 O GLN A 19 27.478 0.319 -35.738 1.00 41.43 O ATOM 269 CB GLN A 19 25.829 0.423 -38.847 1.00 52.44 C ATOM 270 CG GLN A 19 24.962 -0.543 -39.639 1.00 11.35 C ATOM 271 CD GLN A 19 25.393 -0.662 -41.087 1.00 24.21 C ATOM 272 OE1 GLN A 19 26.581 -0.578 -41.402 1.00 12.01 O ATOM 273 NE2 GLN A 19 24.429 -0.860 -41.978 1.00 12.21 N ATOM 0 H GLN A 19 24.195 1.753 -37.346 1.00 40.41 H new ATOM 0 HA GLN A 19 25.660 -0.784 -37.078 1.00 10.52 H new ATOM 0 HB2 GLN A 19 25.573 1.444 -39.131 1.00 52.44 H new ATOM 0 HB3 GLN A 19 26.873 0.268 -39.120 1.00 52.44 H new ATOM 0 HG2 GLN A 19 25.000 -1.527 -39.171 1.00 11.35 H new ATOM 0 HG3 GLN A 19 23.925 -0.211 -39.599 1.00 11.35 H new ATOM 0 HE21 GLN A 19 23.458 -0.923 -41.673 1.00 12.21 H new ATOM 0 HE22 GLN A 19 24.660 -0.949 -42.968 1.00 12.21 H new ATOM 282 N GLY A 20 27.213 2.136 -37.039 1.00 23.10 N ATOM 283 CA GLY A 20 28.334 2.836 -36.439 1.00 13.31 C ATOM 284 C GLY A 20 27.905 3.764 -35.320 1.00 0.25 C ATOM 285 O GLY A 20 27.958 4.986 -35.461 1.00 60.04 O ATOM 0 H GLY A 20 26.730 2.652 -37.775 1.00 23.10 H new ATOM 0 HA2 GLY A 20 29.047 2.109 -36.051 1.00 13.31 H new ATOM 0 HA3 GLY A 20 28.852 3.412 -37.206 1.00 13.31 H new ATOM 289 N VAL A 21 27.477 3.184 -34.203 1.00 20.21 N ATOM 290 CA VAL A 21 27.037 3.967 -33.055 1.00 34.24 C ATOM 291 C VAL A 21 27.315 3.232 -31.748 1.00 65.45 C ATOM 292 O VAL A 21 27.339 2.001 -31.709 1.00 13.32 O ATOM 293 CB VAL A 21 25.533 4.289 -33.139 1.00 12.15 C ATOM 294 CG1 VAL A 21 24.706 3.019 -33.011 1.00 63.54 C ATOM 295 CG2 VAL A 21 25.144 5.297 -32.068 1.00 11.32 C ATOM 0 H VAL A 21 27.426 2.174 -34.069 1.00 20.21 H new ATOM 0 HA VAL A 21 27.603 4.898 -33.072 1.00 34.24 H new ATOM 0 HB VAL A 21 25.328 4.731 -34.114 1.00 12.15 H new ATOM 0 HG11 VAL A 21 23.646 3.267 -33.073 1.00 63.54 H new ATOM 0 HG12 VAL A 21 24.966 2.333 -33.817 1.00 63.54 H new ATOM 0 HG13 VAL A 21 24.912 2.546 -32.051 1.00 63.54 H new ATOM 0 HG21 VAL A 21 24.078 5.513 -32.142 1.00 11.32 H new ATOM 0 HG22 VAL A 21 25.363 4.884 -31.083 1.00 11.32 H new ATOM 0 HG23 VAL A 21 25.711 6.217 -32.211 1.00 11.32 H new ATOM 305 N PHE A 22 27.526 3.994 -30.680 1.00 64.44 N ATOM 306 CA PHE A 22 27.804 3.415 -29.371 1.00 65.31 C ATOM 307 C PHE A 22 26.552 3.416 -28.499 1.00 63.40 C ATOM 308 O PHE A 22 26.630 3.579 -27.281 1.00 44.12 O ATOM 309 CB PHE A 22 28.925 4.190 -28.675 1.00 21.41 C ATOM 310 CG PHE A 22 28.695 5.673 -28.638 1.00 52.42 C ATOM 311 CD1 PHE A 22 27.976 6.251 -27.604 1.00 70.20 C ATOM 312 CD2 PHE A 22 29.197 6.491 -29.638 1.00 72.42 C ATOM 313 CE1 PHE A 22 27.762 7.616 -27.567 1.00 65.00 C ATOM 314 CE2 PHE A 22 28.987 7.856 -29.606 1.00 51.23 C ATOM 315 CZ PHE A 22 28.268 8.420 -28.570 1.00 72.51 C ATOM 0 H PHE A 22 27.510 5.014 -30.695 1.00 64.44 H new ATOM 0 HA PHE A 22 28.122 2.383 -29.518 1.00 65.31 H new ATOM 0 HB2 PHE A 22 29.031 3.821 -27.655 1.00 21.41 H new ATOM 0 HB3 PHE A 22 29.866 3.989 -29.186 1.00 21.41 H new ATOM 0 HD1 PHE A 22 27.578 5.627 -26.817 1.00 70.20 H new ATOM 0 HD2 PHE A 22 29.759 6.056 -30.452 1.00 72.42 H new ATOM 0 HE1 PHE A 22 27.200 8.053 -26.755 1.00 65.00 H new ATOM 0 HE2 PHE A 22 29.385 8.482 -30.391 1.00 51.23 H new ATOM 0 HZ PHE A 22 28.102 9.487 -28.544 1.00 72.51 H new ATOM 325 N PHE A 23 25.398 3.232 -29.131 1.00 40.55 N ATOM 326 CA PHE A 23 24.128 3.214 -28.415 1.00 22.43 C ATOM 327 C PHE A 23 24.149 2.173 -27.299 1.00 73.53 C ATOM 328 O PHE A 23 23.433 2.298 -26.306 1.00 34.43 O ATOM 329 CB PHE A 23 22.978 2.921 -29.380 1.00 73.40 C ATOM 330 CG PHE A 23 21.660 2.704 -28.693 1.00 74.44 C ATOM 331 CD1 PHE A 23 21.157 3.650 -27.815 1.00 40.10 C ATOM 332 CD2 PHE A 23 20.923 1.554 -28.927 1.00 31.43 C ATOM 333 CE1 PHE A 23 19.945 3.452 -27.181 1.00 52.43 C ATOM 334 CE2 PHE A 23 19.710 1.351 -28.296 1.00 73.42 C ATOM 335 CZ PHE A 23 19.220 2.302 -27.423 1.00 73.11 C ATOM 0 H PHE A 23 25.316 3.093 -30.138 1.00 40.55 H new ATOM 0 HA PHE A 23 23.976 4.197 -27.969 1.00 22.43 H new ATOM 0 HB2 PHE A 23 22.881 3.751 -30.080 1.00 73.40 H new ATOM 0 HB3 PHE A 23 23.223 2.036 -29.967 1.00 73.40 H new ATOM 0 HD1 PHE A 23 21.718 4.553 -27.624 1.00 40.10 H new ATOM 0 HD2 PHE A 23 21.301 0.808 -29.610 1.00 31.43 H new ATOM 0 HE1 PHE A 23 19.565 4.196 -26.497 1.00 52.43 H new ATOM 0 HE2 PHE A 23 19.146 0.450 -28.486 1.00 73.42 H new ATOM 0 HZ PHE A 23 18.272 2.147 -26.930 1.00 73.11 H new ATOM 345 N ARG A 24 24.974 1.145 -27.472 1.00 50.20 N ATOM 346 CA ARG A 24 25.087 0.081 -26.482 1.00 1.23 C ATOM 347 C ARG A 24 25.446 0.649 -25.112 1.00 11.42 C ATOM 348 O ARG A 24 25.144 0.049 -24.080 1.00 44.10 O ATOM 349 CB ARG A 24 26.142 -0.938 -26.915 1.00 63.03 C ATOM 350 CG ARG A 24 25.977 -1.413 -28.349 1.00 73.45 C ATOM 351 CD ARG A 24 26.918 -2.565 -28.667 1.00 3.40 C ATOM 352 NE ARG A 24 28.317 -2.145 -28.664 1.00 10.53 N ATOM 353 CZ ARG A 24 28.871 -1.427 -29.635 1.00 10.25 C ATOM 354 NH1 ARG A 24 28.148 -1.051 -30.681 1.00 3.14 N ATOM 355 NH2 ARG A 24 30.150 -1.083 -29.560 1.00 24.12 N ATOM 0 H ARG A 24 25.574 1.027 -28.289 1.00 50.20 H new ATOM 0 HA ARG A 24 24.120 -0.416 -26.408 1.00 1.23 H new ATOM 0 HB2 ARG A 24 27.131 -0.495 -26.799 1.00 63.03 H new ATOM 0 HB3 ARG A 24 26.098 -1.799 -26.248 1.00 63.03 H new ATOM 0 HG2 ARG A 24 24.946 -1.728 -28.513 1.00 73.45 H new ATOM 0 HG3 ARG A 24 26.170 -0.586 -29.032 1.00 73.45 H new ATOM 0 HD2 ARG A 24 26.777 -3.361 -27.936 1.00 3.40 H new ATOM 0 HD3 ARG A 24 26.666 -2.980 -29.643 1.00 3.40 H new ATOM 0 HE ARG A 24 28.901 -2.418 -27.873 1.00 10.53 H new ATOM 0 HH11 ARG A 24 27.164 -1.313 -30.742 1.00 3.14 H new ATOM 0 HH12 ARG A 24 28.576 -0.500 -31.425 1.00 3.14 H new ATOM 0 HH21 ARG A 24 30.709 -1.370 -28.756 1.00 24.12 H new ATOM 0 HH22 ARG A 24 30.574 -0.532 -30.306 1.00 24.12 H new ATOM 369 N LYS A 25 26.092 1.810 -25.109 1.00 43.34 N ATOM 370 CA LYS A 25 26.492 2.461 -23.868 1.00 4.24 C ATOM 371 C LYS A 25 25.332 3.250 -23.268 1.00 63.14 C ATOM 372 O LYS A 25 25.284 3.481 -22.060 1.00 22.13 O ATOM 373 CB LYS A 25 27.682 3.392 -24.116 1.00 15.03 C ATOM 374 CG LYS A 25 28.523 3.647 -22.877 1.00 65.54 C ATOM 375 CD LYS A 25 29.494 2.506 -22.619 1.00 11.21 C ATOM 376 CE LYS A 25 30.583 2.450 -23.679 1.00 71.23 C ATOM 377 NZ LYS A 25 31.676 1.512 -23.302 1.00 63.11 N ATOM 0 H LYS A 25 26.350 2.320 -25.954 1.00 43.34 H new ATOM 0 HA LYS A 25 26.786 1.686 -23.160 1.00 4.24 H new ATOM 0 HB2 LYS A 25 28.315 2.961 -24.892 1.00 15.03 H new ATOM 0 HB3 LYS A 25 27.314 4.344 -24.498 1.00 15.03 H new ATOM 0 HG2 LYS A 25 29.077 4.578 -22.997 1.00 65.54 H new ATOM 0 HG3 LYS A 25 27.871 3.774 -22.013 1.00 65.54 H new ATOM 0 HD2 LYS A 25 29.948 2.629 -21.636 1.00 11.21 H new ATOM 0 HD3 LYS A 25 28.951 1.561 -22.604 1.00 11.21 H new ATOM 0 HE2 LYS A 25 30.149 2.139 -24.629 1.00 71.23 H new ATOM 0 HE3 LYS A 25 30.996 3.448 -23.828 1.00 71.23 H new ATOM 0 HZ1 LYS A 25 32.398 1.502 -24.050 1.00 63.11 H new ATOM 0 HZ2 LYS A 25 32.107 1.823 -22.408 1.00 63.11 H new ATOM 0 HZ3 LYS A 25 31.287 0.555 -23.184 1.00 63.11 H new ATOM 391 N HIS A 26 24.398 3.660 -24.121 1.00 23.31 N ATOM 392 CA HIS A 26 23.237 4.421 -23.675 1.00 31.25 C ATOM 393 C HIS A 26 22.099 3.488 -23.269 1.00 43.41 C ATOM 394 O HIS A 26 21.343 3.780 -22.342 1.00 23.14 O ATOM 395 CB HIS A 26 22.766 5.368 -24.779 1.00 5.13 C ATOM 396 CG HIS A 26 23.575 6.625 -24.874 1.00 43.03 C ATOM 397 ND1 HIS A 26 24.951 6.644 -24.778 1.00 13.01 N ATOM 398 CD2 HIS A 26 23.195 7.911 -25.061 1.00 31.44 C ATOM 399 CE1 HIS A 26 25.381 7.887 -24.899 1.00 2.11 C ATOM 400 NE2 HIS A 26 24.335 8.675 -25.072 1.00 5.21 N ATOM 0 H HIS A 26 24.423 3.478 -25.124 1.00 23.31 H new ATOM 0 HA HIS A 26 23.531 5.008 -22.805 1.00 31.25 H new ATOM 0 HB2 HIS A 26 22.806 4.847 -25.735 1.00 5.13 H new ATOM 0 HB3 HIS A 26 21.723 5.629 -24.602 1.00 5.13 H new ATOM 0 HD2 HIS A 26 22.183 8.269 -25.179 1.00 31.44 H new ATOM 0 HE1 HIS A 26 26.412 8.205 -24.863 1.00 2.11 H new ATOM 0 HE2 HIS A 26 24.369 9.687 -25.194 1.00 5.21 H new ATOM 408 N THR A 27 21.982 2.365 -23.971 1.00 4.22 N ATOM 409 CA THR A 27 20.936 1.391 -23.686 1.00 5.24 C ATOM 410 C THR A 27 21.192 0.682 -22.360 1.00 53.54 C ATOM 411 O THR A 27 20.255 0.284 -21.669 1.00 75.15 O ATOM 412 CB THR A 27 20.829 0.339 -24.805 1.00 75.32 C ATOM 413 OG1 THR A 27 19.663 -0.470 -24.607 1.00 3.31 O ATOM 414 CG2 THR A 27 22.066 -0.546 -24.838 1.00 11.43 C ATOM 0 H THR A 27 22.599 2.108 -24.741 1.00 4.22 H new ATOM 0 HA THR A 27 19.998 1.943 -23.625 1.00 5.24 H new ATOM 0 HB THR A 27 20.751 0.862 -25.758 1.00 75.32 H new ATOM 0 HG1 THR A 27 19.601 -1.136 -25.324 1.00 3.31 H new ATOM 0 HG21 THR A 27 21.966 -1.281 -25.637 1.00 11.43 H new ATOM 0 HG22 THR A 27 22.948 0.068 -25.018 1.00 11.43 H new ATOM 0 HG23 THR A 27 22.171 -1.060 -23.883 1.00 11.43 H new ATOM 422 N GLN A 28 22.465 0.530 -22.012 1.00 22.31 N ATOM 423 CA GLN A 28 22.842 -0.132 -20.768 1.00 43.53 C ATOM 424 C GLN A 28 22.604 0.783 -19.571 1.00 51.14 C ATOM 425 O GLN A 28 22.317 0.317 -18.469 1.00 44.11 O ATOM 426 CB GLN A 28 24.311 -0.555 -20.817 1.00 23.44 C ATOM 427 CG GLN A 28 25.284 0.602 -20.661 1.00 41.32 C ATOM 428 CD GLN A 28 25.758 0.779 -19.232 1.00 15.00 C ATOM 429 OE1 GLN A 28 25.768 -0.170 -18.447 1.00 71.05 O ATOM 430 NE2 GLN A 28 26.153 1.998 -18.886 1.00 1.35 N ATOM 0 H GLN A 28 23.252 0.856 -22.573 1.00 22.31 H new ATOM 0 HA GLN A 28 22.219 -1.019 -20.654 1.00 43.53 H new ATOM 0 HB2 GLN A 28 24.497 -1.284 -20.028 1.00 23.44 H new ATOM 0 HB3 GLN A 28 24.505 -1.056 -21.766 1.00 23.44 H new ATOM 0 HG2 GLN A 28 26.146 0.436 -21.307 1.00 41.32 H new ATOM 0 HG3 GLN A 28 24.805 1.522 -20.997 1.00 41.32 H new ATOM 0 HE21 GLN A 28 26.128 2.755 -19.569 1.00 1.35 H new ATOM 0 HE22 GLN A 28 26.482 2.178 -17.937 1.00 1.35 H new ATOM 439 N ALA A 29 22.725 2.087 -19.796 1.00 55.44 N ATOM 440 CA ALA A 29 22.520 3.067 -18.737 1.00 4.41 C ATOM 441 C ALA A 29 21.051 3.143 -18.335 1.00 5.32 C ATOM 442 O ALA A 29 20.710 2.975 -17.165 1.00 31.32 O ATOM 443 CB ALA A 29 23.020 4.435 -19.179 1.00 72.25 C ATOM 0 H ALA A 29 22.964 2.489 -20.702 1.00 55.44 H new ATOM 0 HA ALA A 29 23.092 2.748 -17.866 1.00 4.41 H new ATOM 0 HB1 ALA A 29 22.860 5.157 -18.378 1.00 72.25 H new ATOM 0 HB2 ALA A 29 24.084 4.377 -19.408 1.00 72.25 H new ATOM 0 HB3 ALA A 29 22.474 4.752 -20.067 1.00 72.25 H new ATOM 449 N GLU A 30 20.187 3.399 -19.312 1.00 64.23 N ATOM 450 CA GLU A 30 18.755 3.498 -19.058 1.00 40.41 C ATOM 451 C GLU A 30 18.243 2.255 -18.338 1.00 34.35 C ATOM 452 O GLU A 30 17.427 2.347 -17.421 1.00 24.23 O ATOM 453 CB GLU A 30 17.994 3.690 -20.371 1.00 54.44 C ATOM 454 CG GLU A 30 16.746 4.546 -20.232 1.00 34.20 C ATOM 455 CD GLU A 30 15.601 4.053 -21.096 1.00 42.22 C ATOM 456 OE1 GLU A 30 15.855 3.685 -22.262 1.00 50.44 O ATOM 457 OE2 GLU A 30 14.452 4.036 -20.607 1.00 65.30 O ATOM 0 H GLU A 30 20.454 3.542 -20.286 1.00 64.23 H new ATOM 0 HA GLU A 30 18.585 4.363 -18.418 1.00 40.41 H new ATOM 0 HB2 GLU A 30 18.659 4.148 -21.103 1.00 54.44 H new ATOM 0 HB3 GLU A 30 17.712 2.713 -20.764 1.00 54.44 H new ATOM 0 HG2 GLU A 30 16.431 4.556 -19.189 1.00 34.20 H new ATOM 0 HG3 GLU A 30 16.984 5.575 -20.503 1.00 34.20 H new ATOM 464 N GLY A 31 18.727 1.091 -18.760 1.00 61.14 N ATOM 465 CA GLY A 31 18.307 -0.155 -18.146 1.00 11.11 C ATOM 466 C GLY A 31 18.572 -0.183 -16.654 1.00 35.34 C ATOM 467 O GLY A 31 17.845 -0.830 -15.899 1.00 24.34 O ATOM 0 H GLY A 31 19.403 0.989 -19.517 1.00 61.14 H new ATOM 0 HA2 GLY A 31 17.242 -0.305 -18.326 1.00 11.11 H new ATOM 0 HA3 GLY A 31 18.830 -0.985 -18.621 1.00 11.11 H new ATOM 471 N LYS A 32 19.616 0.519 -16.226 1.00 35.50 N ATOM 472 CA LYS A 32 19.976 0.572 -14.814 1.00 71.31 C ATOM 473 C LYS A 32 19.022 1.478 -14.043 1.00 12.11 C ATOM 474 O LYS A 32 18.656 1.186 -12.904 1.00 1.50 O ATOM 475 CB LYS A 32 21.413 1.071 -14.652 1.00 25.10 C ATOM 476 CG LYS A 32 22.447 0.175 -15.313 1.00 34.11 C ATOM 477 CD LYS A 32 22.850 -0.975 -14.405 1.00 74.22 C ATOM 478 CE LYS A 32 23.850 -0.529 -13.350 1.00 43.55 C ATOM 479 NZ LYS A 32 25.140 -0.097 -13.957 1.00 61.20 N ATOM 0 H LYS A 32 20.228 1.059 -16.837 1.00 35.50 H new ATOM 0 HA LYS A 32 19.900 -0.436 -14.407 1.00 71.31 H new ATOM 0 HB2 LYS A 32 21.490 2.073 -15.074 1.00 25.10 H new ATOM 0 HB3 LYS A 32 21.642 1.154 -13.590 1.00 25.10 H new ATOM 0 HG2 LYS A 32 22.044 -0.220 -16.246 1.00 34.11 H new ATOM 0 HG3 LYS A 32 23.328 0.763 -15.570 1.00 34.11 H new ATOM 0 HD2 LYS A 32 21.964 -1.383 -13.918 1.00 74.22 H new ATOM 0 HD3 LYS A 32 23.284 -1.777 -15.003 1.00 74.22 H new ATOM 0 HE2 LYS A 32 23.427 0.293 -12.773 1.00 43.55 H new ATOM 0 HE3 LYS A 32 24.032 -1.347 -12.653 1.00 43.55 H new ATOM 0 HZ1 LYS A 32 25.896 -0.159 -13.246 1.00 61.20 H new ATOM 0 HZ2 LYS A 32 25.370 -0.715 -14.761 1.00 61.20 H new ATOM 0 HZ3 LYS A 32 25.056 0.885 -14.289 1.00 61.20 H new ATOM 493 N LYS A 33 18.621 2.578 -14.671 1.00 14.21 N ATOM 494 CA LYS A 33 17.707 3.527 -14.046 1.00 34.55 C ATOM 495 C LYS A 33 16.340 2.891 -13.812 1.00 14.43 C ATOM 496 O LYS A 33 15.601 3.296 -12.913 1.00 0.31 O ATOM 497 CB LYS A 33 17.558 4.775 -14.918 1.00 62.34 C ATOM 498 CG LYS A 33 17.072 5.995 -14.157 1.00 13.44 C ATOM 499 CD LYS A 33 18.213 6.697 -13.440 1.00 43.34 C ATOM 500 CE LYS A 33 18.906 7.702 -14.348 1.00 4.23 C ATOM 501 NZ LYS A 33 20.170 8.212 -13.748 1.00 25.44 N ATOM 0 H LYS A 33 18.915 2.835 -15.613 1.00 14.21 H new ATOM 0 HA LYS A 33 18.125 3.814 -13.081 1.00 34.55 H new ATOM 0 HB2 LYS A 33 18.520 5.003 -15.378 1.00 62.34 H new ATOM 0 HB3 LYS A 33 16.860 4.561 -15.728 1.00 62.34 H new ATOM 0 HG2 LYS A 33 16.594 6.689 -14.848 1.00 13.44 H new ATOM 0 HG3 LYS A 33 16.315 5.695 -13.432 1.00 13.44 H new ATOM 0 HD2 LYS A 33 17.830 7.207 -12.556 1.00 43.34 H new ATOM 0 HD3 LYS A 33 18.936 5.958 -13.094 1.00 43.34 H new ATOM 0 HE2 LYS A 33 19.123 7.235 -15.309 1.00 4.23 H new ATOM 0 HE3 LYS A 33 18.234 8.538 -14.544 1.00 4.23 H new ATOM 0 HZ1 LYS A 33 20.612 8.894 -14.397 1.00 25.44 H new ATOM 0 HZ2 LYS A 33 19.961 8.681 -12.843 1.00 25.44 H new ATOM 0 HZ3 LYS A 33 20.821 7.418 -13.584 1.00 25.44 H new ATOM 515 N LEU A 34 16.009 1.894 -14.624 1.00 61.14 N ATOM 516 CA LEU A 34 14.731 1.201 -14.505 1.00 12.20 C ATOM 517 C LEU A 34 14.873 -0.063 -13.663 1.00 41.22 C ATOM 518 O LEU A 34 14.214 -0.214 -12.635 1.00 40.14 O ATOM 519 CB LEU A 34 14.189 0.846 -15.891 1.00 1.41 C ATOM 520 CG LEU A 34 13.465 1.968 -16.636 1.00 44.50 C ATOM 521 CD1 LEU A 34 13.024 1.497 -18.013 1.00 22.11 C ATOM 522 CD2 LEU A 34 12.271 2.460 -15.831 1.00 24.13 C ATOM 0 H LEU A 34 16.608 1.547 -15.373 1.00 61.14 H new ATOM 0 HA LEU A 34 14.029 1.870 -14.008 1.00 12.20 H new ATOM 0 HB2 LEU A 34 15.020 0.505 -16.508 1.00 1.41 H new ATOM 0 HB3 LEU A 34 13.504 0.005 -15.787 1.00 1.41 H new ATOM 0 HG LEU A 34 14.159 2.799 -16.764 1.00 44.50 H new ATOM 0 HD11 LEU A 34 12.511 2.309 -18.528 1.00 22.11 H new ATOM 0 HD12 LEU A 34 13.897 1.195 -18.591 1.00 22.11 H new ATOM 0 HD13 LEU A 34 12.347 0.649 -17.908 1.00 22.11 H new ATOM 0 HD21 LEU A 34 11.768 3.258 -16.377 1.00 24.13 H new ATOM 0 HD22 LEU A 34 11.576 1.636 -15.671 1.00 24.13 H new ATOM 0 HD23 LEU A 34 12.613 2.839 -14.868 1.00 24.13 H new ATOM 534 N GLY A 35 15.740 -0.968 -14.106 1.00 24.31 N ATOM 535 CA GLY A 35 15.955 -2.207 -13.380 1.00 42.44 C ATOM 536 C GLY A 35 15.906 -3.423 -14.283 1.00 64.40 C ATOM 537 O GLY A 35 15.411 -4.480 -13.888 1.00 11.43 O ATOM 0 H GLY A 35 16.297 -0.866 -14.954 1.00 24.31 H new ATOM 0 HA2 GLY A 35 16.923 -2.168 -12.880 1.00 42.44 H new ATOM 0 HA3 GLY A 35 15.198 -2.305 -12.602 1.00 42.44 H new ATOM 541 N LEU A 36 16.420 -3.277 -15.499 1.00 53.44 N ATOM 542 CA LEU A 36 16.431 -4.372 -16.462 1.00 64.44 C ATOM 543 C LEU A 36 17.851 -4.883 -16.689 1.00 53.34 C ATOM 544 O LEU A 36 18.825 -4.196 -16.383 1.00 3.31 O ATOM 545 CB LEU A 36 15.822 -3.917 -17.790 1.00 23.42 C ATOM 546 CG LEU A 36 14.497 -3.161 -17.696 1.00 11.33 C ATOM 547 CD1 LEU A 36 13.992 -2.794 -19.083 1.00 31.33 C ATOM 548 CD2 LEU A 36 13.461 -3.990 -16.951 1.00 0.12 C ATOM 0 H LEU A 36 16.835 -2.410 -15.842 1.00 53.44 H new ATOM 0 HA LEU A 36 15.832 -5.187 -16.055 1.00 64.44 H new ATOM 0 HB2 LEU A 36 16.545 -3.280 -18.299 1.00 23.42 H new ATOM 0 HB3 LEU A 36 15.673 -4.795 -18.418 1.00 23.42 H new ATOM 0 HG LEU A 36 14.665 -2.240 -17.138 1.00 11.33 H new ATOM 0 HD11 LEU A 36 13.048 -2.256 -18.996 1.00 31.33 H new ATOM 0 HD12 LEU A 36 14.726 -2.160 -19.581 1.00 31.33 H new ATOM 0 HD13 LEU A 36 13.840 -3.702 -19.667 1.00 31.33 H new ATOM 0 HD21 LEU A 36 12.524 -3.436 -16.894 1.00 0.12 H new ATOM 0 HD22 LEU A 36 13.296 -4.928 -17.481 1.00 0.12 H new ATOM 0 HD23 LEU A 36 13.820 -4.201 -15.944 1.00 0.12 H new ATOM 560 N VAL A 37 17.960 -6.092 -17.231 1.00 11.13 N ATOM 561 CA VAL A 37 19.260 -6.693 -17.502 1.00 70.34 C ATOM 562 C VAL A 37 19.327 -7.239 -18.924 1.00 53.04 C ATOM 563 O VAL A 37 18.354 -7.167 -19.674 1.00 42.15 O ATOM 564 CB VAL A 37 19.570 -7.832 -16.512 1.00 54.24 C ATOM 565 CG1 VAL A 37 19.655 -7.296 -15.092 1.00 2.45 C ATOM 566 CG2 VAL A 37 18.519 -8.927 -16.615 1.00 61.22 C ATOM 0 H VAL A 37 17.164 -6.674 -17.491 1.00 11.13 H new ATOM 0 HA VAL A 37 20.004 -5.905 -17.382 1.00 70.34 H new ATOM 0 HB VAL A 37 20.537 -8.262 -16.771 1.00 54.24 H new ATOM 0 HG11 VAL A 37 19.875 -8.115 -14.407 1.00 2.45 H new ATOM 0 HG12 VAL A 37 20.447 -6.550 -15.032 1.00 2.45 H new ATOM 0 HG13 VAL A 37 18.704 -6.839 -14.818 1.00 2.45 H new ATOM 0 HG21 VAL A 37 18.753 -9.724 -15.909 1.00 61.22 H new ATOM 0 HG22 VAL A 37 17.538 -8.513 -16.382 1.00 61.22 H new ATOM 0 HG23 VAL A 37 18.512 -9.330 -17.628 1.00 61.22 H new ATOM 576 N GLY A 38 20.482 -7.786 -19.289 1.00 64.21 N ATOM 577 CA GLY A 38 20.655 -8.337 -20.621 1.00 11.04 C ATOM 578 C GLY A 38 21.892 -7.802 -21.313 1.00 44.14 C ATOM 579 O GLY A 38 22.680 -7.070 -20.714 1.00 14.50 O ATOM 0 H GLY A 38 21.302 -7.858 -18.686 1.00 64.21 H new ATOM 0 HA2 GLY A 38 20.720 -9.423 -20.556 1.00 11.04 H new ATOM 0 HA3 GLY A 38 19.777 -8.106 -21.223 1.00 11.04 H new ATOM 583 N TRP A 39 22.066 -8.169 -22.578 1.00 33.22 N ATOM 584 CA TRP A 39 23.218 -7.722 -23.352 1.00 70.23 C ATOM 585 C TRP A 39 22.785 -7.191 -24.714 1.00 44.33 C ATOM 586 O TRP A 39 21.774 -7.623 -25.268 1.00 24.31 O ATOM 587 CB TRP A 39 24.214 -8.869 -23.532 1.00 31.25 C ATOM 588 CG TRP A 39 23.747 -9.916 -24.497 1.00 52.02 C ATOM 589 CD1 TRP A 39 23.931 -9.923 -25.850 1.00 71.24 C ATOM 590 CD2 TRP A 39 23.017 -11.107 -24.183 1.00 54.22 C ATOM 591 NE1 TRP A 39 23.359 -11.047 -26.397 1.00 0.04 N ATOM 592 CE2 TRP A 39 22.793 -11.790 -25.395 1.00 15.33 C ATOM 593 CE3 TRP A 39 22.532 -11.664 -22.997 1.00 2.23 C ATOM 594 CZ2 TRP A 39 22.104 -12.999 -25.451 1.00 45.20 C ATOM 595 CZ3 TRP A 39 21.849 -12.864 -23.054 1.00 42.33 C ATOM 596 CH2 TRP A 39 21.641 -13.521 -24.274 1.00 61.11 C ATOM 0 H TRP A 39 21.424 -8.775 -23.089 1.00 33.22 H new ATOM 0 HA TRP A 39 23.701 -6.913 -22.804 1.00 70.23 H new ATOM 0 HB2 TRP A 39 25.165 -8.464 -23.879 1.00 31.25 H new ATOM 0 HB3 TRP A 39 24.400 -9.334 -22.564 1.00 31.25 H new ATOM 0 HD1 TRP A 39 24.450 -9.158 -26.408 1.00 71.24 H new ATOM 0 HE1 TRP A 39 23.356 -11.289 -27.388 1.00 0.04 H new ATOM 0 HE3 TRP A 39 22.688 -11.165 -22.052 1.00 2.23 H new ATOM 0 HZ2 TRP A 39 21.941 -13.507 -26.390 1.00 45.20 H new ATOM 0 HZ3 TRP A 39 21.469 -13.303 -22.143 1.00 42.33 H new ATOM 0 HH2 TRP A 39 21.104 -14.458 -24.286 1.00 61.11 H new ATOM 607 N VAL A 40 23.557 -6.250 -25.250 1.00 60.32 N ATOM 608 CA VAL A 40 23.254 -5.661 -26.549 1.00 13.32 C ATOM 609 C VAL A 40 24.470 -5.698 -27.467 1.00 3.12 C ATOM 610 O VAL A 40 25.561 -5.275 -27.085 1.00 11.14 O ATOM 611 CB VAL A 40 22.776 -4.203 -26.406 1.00 25.32 C ATOM 612 CG1 VAL A 40 21.354 -4.157 -25.870 1.00 34.30 C ATOM 613 CG2 VAL A 40 23.720 -3.420 -25.505 1.00 73.22 C ATOM 0 H VAL A 40 24.397 -5.880 -24.805 1.00 60.32 H new ATOM 0 HA VAL A 40 22.454 -6.257 -26.988 1.00 13.32 H new ATOM 0 HB VAL A 40 22.782 -3.738 -27.392 1.00 25.32 H new ATOM 0 HG11 VAL A 40 21.034 -3.119 -25.776 1.00 34.30 H new ATOM 0 HG12 VAL A 40 20.689 -4.681 -26.557 1.00 34.30 H new ATOM 0 HG13 VAL A 40 21.318 -4.638 -24.892 1.00 34.30 H new ATOM 0 HG21 VAL A 40 23.368 -2.392 -25.415 1.00 73.22 H new ATOM 0 HG22 VAL A 40 23.748 -3.882 -24.518 1.00 73.22 H new ATOM 0 HG23 VAL A 40 24.721 -3.424 -25.936 1.00 73.22 H new ATOM 623 N GLN A 41 24.275 -6.206 -28.679 1.00 74.31 N ATOM 624 CA GLN A 41 25.357 -6.299 -29.652 1.00 53.40 C ATOM 625 C GLN A 41 24.956 -5.653 -30.975 1.00 23.24 C ATOM 626 O GLN A 41 23.884 -5.062 -31.088 1.00 14.21 O ATOM 627 CB GLN A 41 25.742 -7.761 -29.881 1.00 31.23 C ATOM 628 CG GLN A 41 24.733 -8.532 -30.717 1.00 24.31 C ATOM 629 CD GLN A 41 25.162 -9.964 -30.975 1.00 12.53 C ATOM 630 OE1 GLN A 41 24.540 -10.907 -30.486 1.00 20.40 O ATOM 631 NE2 GLN A 41 26.229 -10.132 -31.746 1.00 63.41 N ATOM 0 H GLN A 41 23.378 -6.560 -29.011 1.00 74.31 H new ATOM 0 HA GLN A 41 26.218 -5.763 -29.252 1.00 53.40 H new ATOM 0 HB2 GLN A 41 26.714 -7.799 -30.373 1.00 31.23 H new ATOM 0 HB3 GLN A 41 25.854 -8.254 -28.915 1.00 31.23 H new ATOM 0 HG2 GLN A 41 23.769 -8.531 -30.208 1.00 24.31 H new ATOM 0 HG3 GLN A 41 24.591 -8.022 -31.670 1.00 24.31 H new ATOM 0 HE21 GLN A 41 26.714 -9.321 -32.130 1.00 63.41 H new ATOM 0 HE22 GLN A 41 26.564 -11.072 -31.955 1.00 63.41 H new ATOM 640 N ASN A 42 25.826 -5.771 -31.972 1.00 64.03 N ATOM 641 CA ASN A 42 25.564 -5.198 -33.287 1.00 54.14 C ATOM 642 C ASN A 42 25.763 -6.239 -34.384 1.00 62.34 C ATOM 643 O ASN A 42 26.831 -6.843 -34.497 1.00 33.14 O ATOM 644 CB ASN A 42 26.479 -3.997 -33.536 1.00 30.43 C ATOM 645 CG ASN A 42 26.238 -3.357 -34.889 1.00 42.11 C ATOM 646 OD1 ASN A 42 25.298 -3.714 -35.599 1.00 15.24 O ATOM 647 ND2 ASN A 42 27.090 -2.406 -35.253 1.00 42.42 N ATOM 0 H ASN A 42 26.719 -6.258 -31.895 1.00 64.03 H new ATOM 0 HA ASN A 42 24.526 -4.866 -33.310 1.00 54.14 H new ATOM 0 HB2 ASN A 42 26.321 -3.255 -32.753 1.00 30.43 H new ATOM 0 HB3 ASN A 42 27.519 -4.316 -33.468 1.00 30.43 H new ATOM 0 HD21 ASN A 42 26.979 -1.939 -36.153 1.00 42.42 H new ATOM 0 HD22 ASN A 42 27.855 -2.142 -34.632 1.00 42.42 H new ATOM 654 N THR A 43 24.728 -6.445 -35.193 1.00 43.12 N ATOM 655 CA THR A 43 24.789 -7.413 -36.281 1.00 11.11 C ATOM 656 C THR A 43 25.650 -6.898 -37.428 1.00 41.53 C ATOM 657 O THR A 43 26.141 -5.769 -37.390 1.00 62.21 O ATOM 658 CB THR A 43 23.383 -7.744 -36.818 1.00 4.35 C ATOM 659 OG1 THR A 43 22.817 -6.591 -37.451 1.00 62.22 O ATOM 660 CG2 THR A 43 22.471 -8.210 -35.693 1.00 70.33 C ATOM 0 H THR A 43 23.837 -5.954 -35.115 1.00 43.12 H new ATOM 0 HA THR A 43 25.237 -8.319 -35.873 1.00 11.11 H new ATOM 0 HB THR A 43 23.476 -8.549 -37.547 1.00 4.35 H new ATOM 0 HG1 THR A 43 21.844 -6.693 -37.507 1.00 62.22 H new ATOM 0 HG21 THR A 43 21.484 -8.438 -36.096 1.00 70.33 H new ATOM 0 HG22 THR A 43 22.890 -9.104 -35.232 1.00 70.33 H new ATOM 0 HG23 THR A 43 22.385 -7.422 -34.945 1.00 70.33 H new ATOM 668 N ASP A 44 25.829 -7.730 -38.448 1.00 30.22 N ATOM 669 CA ASP A 44 26.630 -7.358 -39.608 1.00 1.51 C ATOM 670 C ASP A 44 25.745 -6.825 -40.731 1.00 24.31 C ATOM 671 O ASP A 44 26.103 -6.904 -41.906 1.00 41.53 O ATOM 672 CB ASP A 44 27.438 -8.558 -40.104 1.00 12.04 C ATOM 673 CG ASP A 44 28.649 -8.839 -39.236 1.00 41.32 C ATOM 674 OD1 ASP A 44 29.627 -8.065 -39.313 1.00 54.02 O ATOM 675 OD2 ASP A 44 28.619 -9.832 -38.480 1.00 3.32 O ATOM 0 H ASP A 44 25.430 -8.667 -38.495 1.00 30.22 H new ATOM 0 HA ASP A 44 27.317 -6.568 -39.305 1.00 1.51 H new ATOM 0 HB2 ASP A 44 26.798 -9.440 -40.126 1.00 12.04 H new ATOM 0 HB3 ASP A 44 27.763 -8.375 -41.128 1.00 12.04 H new ATOM 680 N ARG A 45 24.589 -6.285 -40.361 1.00 32.32 N ATOM 681 CA ARG A 45 23.652 -5.742 -41.337 1.00 31.40 C ATOM 682 C ARG A 45 23.178 -4.353 -40.921 1.00 41.34 C ATOM 683 O ARG A 45 23.043 -3.457 -41.754 1.00 1.03 O ATOM 684 CB ARG A 45 22.451 -6.676 -41.497 1.00 14.04 C ATOM 685 CG ARG A 45 21.533 -6.297 -42.648 1.00 1.45 C ATOM 686 CD ARG A 45 20.659 -7.466 -43.072 1.00 32.33 C ATOM 687 NE ARG A 45 19.423 -7.022 -43.712 1.00 25.32 N ATOM 688 CZ ARG A 45 18.636 -7.821 -44.424 1.00 24.23 C ATOM 689 NH1 ARG A 45 18.954 -9.098 -44.585 1.00 62.21 N ATOM 690 NH2 ARG A 45 17.528 -7.343 -44.975 1.00 63.13 N ATOM 0 H ARG A 45 24.278 -6.212 -39.392 1.00 32.32 H new ATOM 0 HA ARG A 45 24.169 -5.659 -42.293 1.00 31.40 H new ATOM 0 HB2 ARG A 45 22.811 -7.693 -41.650 1.00 14.04 H new ATOM 0 HB3 ARG A 45 21.877 -6.677 -40.571 1.00 14.04 H new ATOM 0 HG2 ARG A 45 20.902 -5.459 -42.351 1.00 1.45 H new ATOM 0 HG3 ARG A 45 22.130 -5.962 -43.496 1.00 1.45 H new ATOM 0 HD2 ARG A 45 21.215 -8.103 -43.760 1.00 32.33 H new ATOM 0 HD3 ARG A 45 20.418 -8.073 -42.200 1.00 32.33 H new ATOM 0 HE ARG A 45 19.149 -6.045 -43.606 1.00 25.32 H new ATOM 0 HH11 ARG A 45 19.805 -9.469 -44.162 1.00 62.21 H new ATOM 0 HH12 ARG A 45 18.348 -9.709 -45.132 1.00 62.21 H new ATOM 0 HH21 ARG A 45 17.280 -6.361 -44.852 1.00 63.13 H new ATOM 0 HH22 ARG A 45 16.924 -7.957 -45.522 1.00 63.13 H new ATOM 704 N GLY A 46 22.926 -4.181 -39.627 1.00 64.30 N ATOM 705 CA GLY A 46 22.470 -2.899 -39.124 1.00 32.04 C ATOM 706 C GLY A 46 21.345 -3.039 -38.117 1.00 53.44 C ATOM 707 O GLY A 46 20.310 -2.381 -38.235 1.00 43.41 O ATOM 0 H GLY A 46 23.030 -4.907 -38.918 1.00 64.30 H new ATOM 0 HA2 GLY A 46 23.306 -2.376 -38.660 1.00 32.04 H new ATOM 0 HA3 GLY A 46 22.133 -2.284 -39.958 1.00 32.04 H new ATOM 711 N THR A 47 21.544 -3.900 -37.124 1.00 43.52 N ATOM 712 CA THR A 47 20.538 -4.126 -36.095 1.00 14.20 C ATOM 713 C THR A 47 21.186 -4.446 -34.753 1.00 13.42 C ATOM 714 O THR A 47 22.277 -5.013 -34.698 1.00 72.24 O ATOM 715 CB THR A 47 19.588 -5.276 -36.481 1.00 4.02 C ATOM 716 OG1 THR A 47 20.335 -6.481 -36.681 1.00 62.21 O ATOM 717 CG2 THR A 47 18.814 -4.937 -37.745 1.00 72.25 C ATOM 0 H THR A 47 22.394 -4.453 -37.011 1.00 43.52 H new ATOM 0 HA THR A 47 19.963 -3.204 -36.007 1.00 14.20 H new ATOM 0 HB THR A 47 18.877 -5.420 -35.667 1.00 4.02 H new ATOM 0 HG1 THR A 47 19.724 -7.208 -36.925 1.00 62.21 H new ATOM 0 HG21 THR A 47 18.150 -5.764 -37.998 1.00 72.25 H new ATOM 0 HG22 THR A 47 18.224 -4.035 -37.580 1.00 72.25 H new ATOM 0 HG23 THR A 47 19.512 -4.769 -38.565 1.00 72.25 H new ATOM 725 N VAL A 48 20.507 -4.078 -33.671 1.00 31.35 N ATOM 726 CA VAL A 48 21.016 -4.328 -32.327 1.00 42.14 C ATOM 727 C VAL A 48 20.305 -5.511 -31.681 1.00 34.21 C ATOM 728 O VAL A 48 19.095 -5.473 -31.456 1.00 43.24 O ATOM 729 CB VAL A 48 20.853 -3.090 -31.426 1.00 14.30 C ATOM 730 CG1 VAL A 48 21.383 -3.372 -30.029 1.00 24.32 C ATOM 731 CG2 VAL A 48 21.555 -1.888 -32.039 1.00 64.14 C ATOM 0 H VAL A 48 19.603 -3.606 -33.699 1.00 31.35 H new ATOM 0 HA VAL A 48 22.077 -4.557 -32.428 1.00 42.14 H new ATOM 0 HB VAL A 48 19.791 -2.859 -31.346 1.00 14.30 H new ATOM 0 HG11 VAL A 48 21.259 -2.485 -29.407 1.00 24.32 H new ATOM 0 HG12 VAL A 48 20.830 -4.203 -29.591 1.00 24.32 H new ATOM 0 HG13 VAL A 48 22.440 -3.630 -30.086 1.00 24.32 H new ATOM 0 HG21 VAL A 48 21.429 -1.022 -31.389 1.00 64.14 H new ATOM 0 HG22 VAL A 48 22.617 -2.106 -32.152 1.00 64.14 H new ATOM 0 HG23 VAL A 48 21.123 -1.673 -33.016 1.00 64.14 H new ATOM 741 N GLN A 49 21.064 -6.561 -31.384 1.00 11.21 N ATOM 742 CA GLN A 49 20.505 -7.756 -30.763 1.00 1.11 C ATOM 743 C GLN A 49 20.580 -7.665 -29.242 1.00 54.14 C ATOM 744 O GLN A 49 21.665 -7.646 -28.664 1.00 43.01 O ATOM 745 CB GLN A 49 21.247 -9.003 -31.248 1.00 52.30 C ATOM 746 CG GLN A 49 20.614 -9.651 -32.469 1.00 13.13 C ATOM 747 CD GLN A 49 21.574 -10.559 -33.211 1.00 71.03 C ATOM 748 OE1 GLN A 49 22.742 -10.682 -32.842 1.00 0.34 O ATOM 749 NE2 GLN A 49 21.085 -11.202 -34.265 1.00 65.05 N ATOM 0 H GLN A 49 22.067 -6.608 -31.563 1.00 11.21 H new ATOM 0 HA GLN A 49 19.457 -7.829 -31.053 1.00 1.11 H new ATOM 0 HB2 GLN A 49 22.277 -8.735 -31.482 1.00 52.30 H new ATOM 0 HB3 GLN A 49 21.284 -9.732 -30.438 1.00 52.30 H new ATOM 0 HG2 GLN A 49 19.742 -10.226 -32.159 1.00 13.13 H new ATOM 0 HG3 GLN A 49 20.259 -8.873 -33.145 1.00 13.13 H new ATOM 0 HE21 GLN A 49 20.110 -11.071 -34.536 1.00 65.05 H new ATOM 0 HE22 GLN A 49 21.684 -11.827 -34.804 1.00 65.05 H new ATOM 758 N GLY A 50 19.417 -7.608 -28.600 1.00 32.31 N ATOM 759 CA GLY A 50 19.373 -7.519 -27.152 1.00 72.31 C ATOM 760 C GLY A 50 18.007 -7.864 -26.591 1.00 64.22 C ATOM 761 O GLY A 50 17.022 -7.922 -27.327 1.00 31.21 O ATOM 0 H GLY A 50 18.505 -7.622 -29.057 1.00 32.31 H new ATOM 0 HA2 GLY A 50 20.118 -8.192 -26.727 1.00 72.31 H new ATOM 0 HA3 GLY A 50 19.644 -6.509 -26.845 1.00 72.31 H new ATOM 765 N LYS A 51 17.948 -8.096 -25.284 1.00 53.32 N ATOM 766 CA LYS A 51 16.694 -8.437 -24.624 1.00 35.42 C ATOM 767 C LYS A 51 16.408 -7.481 -23.470 1.00 70.22 C ATOM 768 O LYS A 51 17.255 -6.667 -23.101 1.00 24.12 O ATOM 769 CB LYS A 51 16.741 -9.877 -24.107 1.00 22.11 C ATOM 770 CG LYS A 51 17.687 -10.071 -22.934 1.00 70.34 C ATOM 771 CD LYS A 51 17.562 -11.465 -22.342 1.00 62.24 C ATOM 772 CE LYS A 51 18.064 -11.508 -20.907 1.00 61.22 C ATOM 773 NZ LYS A 51 19.549 -11.603 -20.841 1.00 72.14 N ATOM 0 H LYS A 51 18.755 -8.054 -24.661 1.00 53.32 H new ATOM 0 HA LYS A 51 15.891 -8.346 -25.356 1.00 35.42 H new ATOM 0 HB2 LYS A 51 15.738 -10.180 -23.808 1.00 22.11 H new ATOM 0 HB3 LYS A 51 17.044 -10.537 -24.920 1.00 22.11 H new ATOM 0 HG2 LYS A 51 18.713 -9.904 -23.262 1.00 70.34 H new ATOM 0 HG3 LYS A 51 17.473 -9.328 -22.166 1.00 70.34 H new ATOM 0 HD2 LYS A 51 16.520 -11.783 -22.374 1.00 62.24 H new ATOM 0 HD3 LYS A 51 18.129 -12.171 -22.948 1.00 62.24 H new ATOM 0 HE2 LYS A 51 17.734 -10.613 -20.380 1.00 61.22 H new ATOM 0 HE3 LYS A 51 17.622 -12.362 -20.393 1.00 61.22 H new ATOM 0 HZ1 LYS A 51 19.883 -11.201 -19.942 1.00 72.14 H new ATOM 0 HZ2 LYS A 51 19.836 -12.601 -20.902 1.00 72.14 H new ATOM 0 HZ3 LYS A 51 19.966 -11.074 -21.633 1.00 72.14 H new ATOM 787 N LEU A 52 15.211 -7.586 -22.904 1.00 12.41 N ATOM 788 CA LEU A 52 14.814 -6.731 -21.790 1.00 40.33 C ATOM 789 C LEU A 52 14.274 -7.562 -20.631 1.00 74.13 C ATOM 790 O LEU A 52 13.074 -7.554 -20.357 1.00 21.44 O ATOM 791 CB LEU A 52 13.757 -5.723 -22.246 1.00 63.25 C ATOM 792 CG LEU A 52 14.234 -4.644 -23.220 1.00 22.54 C ATOM 793 CD1 LEU A 52 13.087 -3.718 -23.594 1.00 24.51 C ATOM 794 CD2 LEU A 52 15.386 -3.853 -22.616 1.00 72.44 C ATOM 0 H LEU A 52 14.498 -8.254 -23.198 1.00 12.41 H new ATOM 0 HA LEU A 52 15.697 -6.192 -21.446 1.00 40.33 H new ATOM 0 HB2 LEU A 52 12.939 -6.271 -22.714 1.00 63.25 H new ATOM 0 HB3 LEU A 52 13.347 -5.232 -21.363 1.00 63.25 H new ATOM 0 HG LEU A 52 14.590 -5.132 -24.127 1.00 22.54 H new ATOM 0 HD11 LEU A 52 13.445 -2.957 -24.287 1.00 24.51 H new ATOM 0 HD12 LEU A 52 12.293 -4.295 -24.067 1.00 24.51 H new ATOM 0 HD13 LEU A 52 12.700 -3.237 -22.696 1.00 24.51 H new ATOM 0 HD21 LEU A 52 15.713 -3.090 -23.322 1.00 72.44 H new ATOM 0 HD22 LEU A 52 15.056 -3.376 -21.693 1.00 72.44 H new ATOM 0 HD23 LEU A 52 16.216 -4.526 -22.399 1.00 72.44 H new ATOM 806 N GLN A 53 15.167 -8.276 -19.955 1.00 5.04 N ATOM 807 CA GLN A 53 14.780 -9.111 -18.824 1.00 73.21 C ATOM 808 C GLN A 53 14.511 -8.262 -17.586 1.00 44.43 C ATOM 809 O GLN A 53 15.386 -7.534 -17.119 1.00 3.10 O ATOM 810 CB GLN A 53 15.872 -10.140 -18.524 1.00 54.34 C ATOM 811 CG GLN A 53 15.648 -10.905 -17.230 1.00 73.34 C ATOM 812 CD GLN A 53 16.471 -12.176 -17.154 1.00 4.41 C ATOM 813 OE1 GLN A 53 17.553 -12.193 -16.565 1.00 70.45 O ATOM 814 NE2 GLN A 53 15.963 -13.248 -17.750 1.00 1.02 N ATOM 0 H GLN A 53 16.164 -8.293 -20.170 1.00 5.04 H new ATOM 0 HA GLN A 53 13.861 -9.634 -19.090 1.00 73.21 H new ATOM 0 HB2 GLN A 53 15.929 -10.849 -19.350 1.00 54.34 H new ATOM 0 HB3 GLN A 53 16.835 -9.632 -18.474 1.00 54.34 H new ATOM 0 HG2 GLN A 53 15.898 -10.263 -16.385 1.00 73.34 H new ATOM 0 HG3 GLN A 53 14.591 -11.155 -17.138 1.00 73.34 H new ATOM 0 HE21 GLN A 53 15.063 -13.188 -18.226 1.00 1.02 H new ATOM 0 HE22 GLN A 53 16.473 -14.131 -17.731 1.00 1.02 H new ATOM 823 N GLY A 54 13.294 -8.359 -17.060 1.00 23.33 N ATOM 824 CA GLY A 54 12.932 -7.594 -15.881 1.00 44.21 C ATOM 825 C GLY A 54 11.432 -7.479 -15.703 1.00 15.13 C ATOM 826 O GLY A 54 10.651 -8.130 -16.397 1.00 33.53 O ATOM 0 H GLY A 54 12.552 -8.954 -17.429 1.00 23.33 H new ATOM 0 HA2 GLY A 54 13.364 -8.066 -14.999 1.00 44.21 H new ATOM 0 HA3 GLY A 54 13.364 -6.596 -15.953 1.00 44.21 H new ATOM 830 N PRO A 55 11.008 -6.634 -14.751 1.00 52.11 N ATOM 831 CA PRO A 55 9.587 -6.417 -14.460 1.00 44.05 C ATOM 832 C PRO A 55 8.874 -5.668 -15.581 1.00 4.31 C ATOM 833 O PRO A 55 9.438 -4.757 -16.188 1.00 45.00 O ATOM 834 CB PRO A 55 9.612 -5.573 -13.184 1.00 35.04 C ATOM 835 CG PRO A 55 10.928 -4.876 -13.215 1.00 20.42 C ATOM 836 CD PRO A 55 11.883 -5.825 -13.886 1.00 14.11 C ATOM 0 HA PRO A 55 9.044 -7.356 -14.356 1.00 44.05 H new ATOM 0 HB2 PRO A 55 8.787 -4.861 -13.165 1.00 35.04 H new ATOM 0 HB3 PRO A 55 9.515 -6.197 -12.295 1.00 35.04 H new ATOM 0 HG2 PRO A 55 10.860 -3.937 -13.765 1.00 20.42 H new ATOM 0 HG3 PRO A 55 11.264 -4.632 -12.207 1.00 20.42 H new ATOM 0 HD2 PRO A 55 12.639 -5.293 -14.464 1.00 14.11 H new ATOM 0 HD3 PRO A 55 12.413 -6.442 -13.160 1.00 14.11 H new ATOM 844 N ILE A 56 7.632 -6.056 -15.849 1.00 64.32 N ATOM 845 CA ILE A 56 6.843 -5.420 -16.896 1.00 14.42 C ATOM 846 C ILE A 56 6.622 -3.941 -16.595 1.00 50.13 C ATOM 847 O ILE A 56 6.528 -3.119 -17.507 1.00 34.02 O ATOM 848 CB ILE A 56 5.475 -6.107 -17.066 1.00 11.11 C ATOM 849 CG1 ILE A 56 5.662 -7.590 -17.392 1.00 21.15 C ATOM 850 CG2 ILE A 56 4.668 -5.418 -18.156 1.00 14.53 C ATOM 851 CD1 ILE A 56 4.374 -8.383 -17.358 1.00 64.25 C ATOM 0 H ILE A 56 7.151 -6.808 -15.355 1.00 64.32 H new ATOM 0 HA ILE A 56 7.408 -5.520 -17.822 1.00 14.42 H new ATOM 0 HB ILE A 56 4.926 -6.026 -16.128 1.00 11.11 H new ATOM 0 HG12 ILE A 56 6.110 -7.683 -18.381 1.00 21.15 H new ATOM 0 HG13 ILE A 56 6.365 -8.024 -16.681 1.00 21.15 H new ATOM 0 HG21 ILE A 56 3.704 -5.915 -18.264 1.00 14.53 H new ATOM 0 HG22 ILE A 56 4.510 -4.374 -17.887 1.00 14.53 H new ATOM 0 HG23 ILE A 56 5.211 -5.471 -19.099 1.00 14.53 H new ATOM 0 HD11 ILE A 56 4.582 -9.426 -17.599 1.00 64.25 H new ATOM 0 HD12 ILE A 56 3.935 -8.321 -16.362 1.00 64.25 H new ATOM 0 HD13 ILE A 56 3.676 -7.974 -18.089 1.00 64.25 H new ATOM 863 N SER A 57 6.542 -3.609 -15.311 1.00 24.24 N ATOM 864 CA SER A 57 6.331 -2.229 -14.889 1.00 60.32 C ATOM 865 C SER A 57 7.385 -1.308 -15.496 1.00 61.42 C ATOM 866 O SER A 57 7.143 -0.119 -15.702 1.00 4.20 O ATOM 867 CB SER A 57 6.367 -2.129 -13.363 1.00 45.30 C ATOM 868 OG SER A 57 5.822 -0.898 -12.920 1.00 5.11 O ATOM 0 H SER A 57 6.620 -4.277 -14.544 1.00 24.24 H new ATOM 0 HA SER A 57 5.350 -1.912 -15.243 1.00 60.32 H new ATOM 0 HB2 SER A 57 5.806 -2.956 -12.928 1.00 45.30 H new ATOM 0 HB3 SER A 57 7.395 -2.222 -13.013 1.00 45.30 H new ATOM 0 HG SER A 57 5.855 -0.859 -11.941 1.00 5.11 H new ATOM 874 N LYS A 58 8.556 -1.867 -15.781 1.00 64.20 N ATOM 875 CA LYS A 58 9.649 -1.099 -16.366 1.00 22.13 C ATOM 876 C LYS A 58 9.746 -1.347 -17.868 1.00 13.03 C ATOM 877 O LYS A 58 9.915 -0.413 -18.652 1.00 4.05 O ATOM 878 CB LYS A 58 10.974 -1.464 -15.692 1.00 11.42 C ATOM 879 CG LYS A 58 11.284 -0.622 -14.466 1.00 24.21 C ATOM 880 CD LYS A 58 10.559 -1.141 -13.235 1.00 45.13 C ATOM 881 CE LYS A 58 10.726 -0.199 -12.052 1.00 72.53 C ATOM 882 NZ LYS A 58 10.029 -0.706 -10.838 1.00 35.10 N ATOM 0 H LYS A 58 8.773 -2.850 -15.616 1.00 64.20 H new ATOM 0 HA LYS A 58 9.444 -0.041 -16.203 1.00 22.13 H new ATOM 0 HB2 LYS A 58 10.948 -2.515 -15.404 1.00 11.42 H new ATOM 0 HB3 LYS A 58 11.783 -1.351 -16.414 1.00 11.42 H new ATOM 0 HG2 LYS A 58 12.359 -0.624 -14.284 1.00 24.21 H new ATOM 0 HG3 LYS A 58 10.994 0.412 -14.651 1.00 24.21 H new ATOM 0 HD2 LYS A 58 9.499 -1.261 -13.459 1.00 45.13 H new ATOM 0 HD3 LYS A 58 10.943 -2.127 -12.974 1.00 45.13 H new ATOM 0 HE2 LYS A 58 11.787 -0.072 -11.836 1.00 72.53 H new ATOM 0 HE3 LYS A 58 10.334 0.784 -12.312 1.00 72.53 H new ATOM 0 HZ1 LYS A 58 10.166 -0.037 -10.054 1.00 35.10 H new ATOM 0 HZ2 LYS A 58 9.013 -0.803 -11.036 1.00 35.10 H new ATOM 0 HZ3 LYS A 58 10.421 -1.633 -10.574 1.00 35.10 H new ATOM 896 N VAL A 59 9.635 -2.611 -18.263 1.00 21.44 N ATOM 897 CA VAL A 59 9.707 -2.982 -19.671 1.00 43.40 C ATOM 898 C VAL A 59 8.697 -2.195 -20.498 1.00 75.44 C ATOM 899 O VAL A 59 8.919 -1.929 -21.679 1.00 42.44 O ATOM 900 CB VAL A 59 9.455 -4.488 -19.869 1.00 64.10 C ATOM 901 CG1 VAL A 59 9.517 -4.851 -21.345 1.00 51.50 C ATOM 902 CG2 VAL A 59 10.458 -5.305 -19.069 1.00 23.33 C ATOM 0 H VAL A 59 9.495 -3.396 -17.627 1.00 21.44 H new ATOM 0 HA VAL A 59 10.715 -2.743 -20.010 1.00 43.40 H new ATOM 0 HB VAL A 59 8.455 -4.722 -19.504 1.00 64.10 H new ATOM 0 HG11 VAL A 59 9.337 -5.919 -21.465 1.00 51.50 H new ATOM 0 HG12 VAL A 59 8.757 -4.291 -21.890 1.00 51.50 H new ATOM 0 HG13 VAL A 59 10.502 -4.603 -21.740 1.00 51.50 H new ATOM 0 HG21 VAL A 59 10.265 -6.367 -19.220 1.00 23.33 H new ATOM 0 HG22 VAL A 59 11.468 -5.068 -19.402 1.00 23.33 H new ATOM 0 HG23 VAL A 59 10.360 -5.066 -18.010 1.00 23.33 H new ATOM 912 N ARG A 60 7.585 -1.827 -19.870 1.00 51.32 N ATOM 913 CA ARG A 60 6.539 -1.071 -20.549 1.00 33.15 C ATOM 914 C ARG A 60 7.059 0.289 -21.003 1.00 54.53 C ATOM 915 O ARG A 60 6.547 0.871 -21.959 1.00 44.44 O ATOM 916 CB ARG A 60 5.333 -0.886 -19.625 1.00 4.21 C ATOM 917 CG ARG A 60 4.491 -2.141 -19.463 1.00 42.34 C ATOM 918 CD ARG A 60 3.527 -2.318 -20.626 1.00 13.33 C ATOM 919 NE ARG A 60 2.602 -1.194 -20.745 1.00 54.03 N ATOM 920 CZ ARG A 60 1.649 -1.121 -21.669 1.00 25.03 C ATOM 921 NH1 ARG A 60 1.498 -2.102 -22.548 1.00 53.40 N ATOM 922 NH2 ARG A 60 0.846 -0.066 -21.713 1.00 44.44 N ATOM 0 H ARG A 60 7.385 -2.040 -18.893 1.00 51.32 H new ATOM 0 HA ARG A 60 6.231 -1.635 -21.429 1.00 33.15 H new ATOM 0 HB2 ARG A 60 5.684 -0.565 -18.644 1.00 4.21 H new ATOM 0 HB3 ARG A 60 4.705 -0.086 -20.017 1.00 4.21 H new ATOM 0 HG2 ARG A 60 5.143 -3.012 -19.394 1.00 42.34 H new ATOM 0 HG3 ARG A 60 3.931 -2.087 -18.529 1.00 42.34 H new ATOM 0 HD2 ARG A 60 4.092 -2.423 -21.552 1.00 13.33 H new ATOM 0 HD3 ARG A 60 2.962 -3.240 -20.491 1.00 13.33 H new ATOM 0 HE ARG A 60 2.692 -0.423 -20.083 1.00 54.03 H new ATOM 0 HH11 ARG A 60 2.114 -2.915 -22.516 1.00 53.40 H new ATOM 0 HH12 ARG A 60 0.766 -2.044 -23.256 1.00 53.40 H new ATOM 0 HH21 ARG A 60 0.960 0.690 -21.038 1.00 44.44 H new ATOM 0 HH22 ARG A 60 0.115 -0.011 -22.422 1.00 44.44 H new ATOM 936 N GLU A 61 8.077 0.790 -20.311 1.00 21.22 N ATOM 937 CA GLU A 61 8.664 2.082 -20.643 1.00 44.44 C ATOM 938 C GLU A 61 9.914 1.908 -21.501 1.00 63.53 C ATOM 939 O GLU A 61 10.164 2.689 -22.419 1.00 21.51 O ATOM 940 CB GLU A 61 9.012 2.853 -19.368 1.00 13.11 C ATOM 941 CG GLU A 61 7.873 2.913 -18.364 1.00 11.11 C ATOM 942 CD GLU A 61 6.737 3.807 -18.823 1.00 2.03 C ATOM 943 OE1 GLU A 61 6.914 5.043 -18.809 1.00 53.41 O ATOM 944 OE2 GLU A 61 5.673 3.271 -19.195 1.00 14.02 O ATOM 0 H GLU A 61 8.512 0.321 -19.517 1.00 21.22 H new ATOM 0 HA GLU A 61 7.928 2.649 -21.213 1.00 44.44 H new ATOM 0 HB2 GLU A 61 9.877 2.387 -18.896 1.00 13.11 H new ATOM 0 HB3 GLU A 61 9.303 3.869 -19.636 1.00 13.11 H new ATOM 0 HG2 GLU A 61 7.492 1.906 -18.192 1.00 11.11 H new ATOM 0 HG3 GLU A 61 8.254 3.277 -17.410 1.00 11.11 H new ATOM 951 N MET A 62 10.696 0.877 -21.195 1.00 12.23 N ATOM 952 CA MET A 62 11.919 0.599 -21.938 1.00 4.02 C ATOM 953 C MET A 62 11.604 0.204 -23.377 1.00 13.21 C ATOM 954 O MET A 62 12.364 0.512 -24.295 1.00 33.34 O ATOM 955 CB MET A 62 12.715 -0.515 -21.254 1.00 13.42 C ATOM 956 CG MET A 62 13.980 -0.904 -22.001 1.00 21.35 C ATOM 957 SD MET A 62 15.124 0.475 -22.196 1.00 3.44 S ATOM 958 CE MET A 62 15.400 0.931 -20.485 1.00 62.15 C ATOM 0 H MET A 62 10.504 0.221 -20.438 1.00 12.23 H new ATOM 0 HA MET A 62 12.519 1.509 -21.953 1.00 4.02 H new ATOM 0 HB2 MET A 62 12.982 -0.194 -20.247 1.00 13.42 H new ATOM 0 HB3 MET A 62 12.079 -1.394 -21.151 1.00 13.42 H new ATOM 0 HG2 MET A 62 14.479 -1.712 -21.466 1.00 21.35 H new ATOM 0 HG3 MET A 62 13.712 -1.290 -22.984 1.00 21.35 H new ATOM 0 HE1 MET A 62 16.401 1.348 -20.376 1.00 62.15 H new ATOM 0 HE2 MET A 62 14.663 1.675 -20.183 1.00 62.15 H new ATOM 0 HE3 MET A 62 15.304 0.048 -19.853 1.00 62.15 H new ATOM 968 N GLN A 63 10.479 -0.478 -23.565 1.00 72.25 N ATOM 969 CA GLN A 63 10.065 -0.915 -24.893 1.00 74.44 C ATOM 970 C GLN A 63 9.975 0.267 -25.853 1.00 5.04 C ATOM 971 O GLN A 63 10.401 0.179 -27.005 1.00 1.45 O ATOM 972 CB GLN A 63 8.714 -1.630 -24.820 1.00 24.51 C ATOM 973 CG GLN A 63 7.612 -0.787 -24.199 1.00 63.23 C ATOM 974 CD GLN A 63 6.339 -1.575 -23.961 1.00 52.44 C ATOM 975 OE1 GLN A 63 6.359 -2.804 -23.895 1.00 54.03 O ATOM 976 NE2 GLN A 63 5.222 -0.869 -23.831 1.00 13.31 N ATOM 0 H GLN A 63 9.839 -0.740 -22.816 1.00 72.25 H new ATOM 0 HA GLN A 63 10.817 -1.609 -25.269 1.00 74.44 H new ATOM 0 HB2 GLN A 63 8.413 -1.923 -25.826 1.00 24.51 H new ATOM 0 HB3 GLN A 63 8.828 -2.547 -24.242 1.00 24.51 H new ATOM 0 HG2 GLN A 63 7.963 -0.377 -23.252 1.00 63.23 H new ATOM 0 HG3 GLN A 63 7.395 0.058 -24.852 1.00 63.23 H new ATOM 0 HE21 GLN A 63 5.252 0.149 -23.893 1.00 13.31 H new ATOM 0 HE22 GLN A 63 4.334 -1.344 -23.669 1.00 13.31 H new ATOM 985 N LYS A 64 9.419 1.373 -25.370 1.00 41.13 N ATOM 986 CA LYS A 64 9.274 2.575 -26.184 1.00 23.45 C ATOM 987 C LYS A 64 10.635 3.194 -26.486 1.00 51.11 C ATOM 988 O LYS A 64 10.846 3.757 -27.560 1.00 72.14 O ATOM 989 CB LYS A 64 8.385 3.595 -25.469 1.00 21.20 C ATOM 990 CG LYS A 64 6.910 3.453 -25.800 1.00 54.23 C ATOM 991 CD LYS A 64 6.035 4.081 -24.728 1.00 74.50 C ATOM 992 CE LYS A 64 6.191 5.593 -24.696 1.00 11.23 C ATOM 993 NZ LYS A 64 5.697 6.229 -25.949 1.00 32.35 N ATOM 0 H LYS A 64 9.061 1.462 -24.419 1.00 41.13 H new ATOM 0 HA LYS A 64 8.806 2.292 -27.127 1.00 23.45 H new ATOM 0 HB2 LYS A 64 8.519 3.490 -24.392 1.00 21.20 H new ATOM 0 HB3 LYS A 64 8.713 4.600 -25.734 1.00 21.20 H new ATOM 0 HG2 LYS A 64 6.705 3.925 -26.761 1.00 54.23 H new ATOM 0 HG3 LYS A 64 6.659 2.397 -25.903 1.00 54.23 H new ATOM 0 HD2 LYS A 64 4.992 3.826 -24.913 1.00 74.50 H new ATOM 0 HD3 LYS A 64 6.297 3.667 -23.754 1.00 74.50 H new ATOM 0 HE2 LYS A 64 5.644 5.996 -23.844 1.00 11.23 H new ATOM 0 HE3 LYS A 64 7.241 5.847 -24.550 1.00 11.23 H new ATOM 0 HZ1 LYS A 64 5.582 7.251 -25.797 1.00 32.35 H new ATOM 0 HZ2 LYS A 64 6.383 6.068 -26.714 1.00 32.35 H new ATOM 0 HZ3 LYS A 64 4.781 5.813 -26.212 1.00 32.35 H new ATOM 1007 N TRP A 65 11.554 3.085 -25.534 1.00 1.32 N ATOM 1008 CA TRP A 65 12.895 3.634 -25.700 1.00 23.10 C ATOM 1009 C TRP A 65 13.671 2.864 -26.763 1.00 74.31 C ATOM 1010 O TRP A 65 14.598 3.394 -27.376 1.00 3.44 O ATOM 1011 CB TRP A 65 13.652 3.596 -24.371 1.00 42.14 C ATOM 1012 CG TRP A 65 13.481 4.841 -23.555 1.00 3.22 C ATOM 1013 CD1 TRP A 65 12.421 5.157 -22.754 1.00 23.23 C ATOM 1014 CD2 TRP A 65 14.398 5.937 -23.462 1.00 15.53 C ATOM 1015 NE1 TRP A 65 12.623 6.383 -22.168 1.00 44.41 N ATOM 1016 CE2 TRP A 65 13.829 6.883 -22.586 1.00 33.55 C ATOM 1017 CE3 TRP A 65 15.644 6.212 -24.031 1.00 72.12 C ATOM 1018 CZ2 TRP A 65 14.464 8.080 -22.269 1.00 0.23 C ATOM 1019 CZ3 TRP A 65 16.273 7.401 -23.716 1.00 11.10 C ATOM 1020 CH2 TRP A 65 15.683 8.323 -22.841 1.00 22.02 C ATOM 0 H TRP A 65 11.396 2.622 -24.639 1.00 1.32 H new ATOM 0 HA TRP A 65 12.799 4.670 -26.026 1.00 23.10 H new ATOM 0 HB2 TRP A 65 13.310 2.740 -23.790 1.00 42.14 H new ATOM 0 HB3 TRP A 65 14.713 3.443 -24.569 1.00 42.14 H new ATOM 0 HD1 TRP A 65 11.551 4.534 -22.603 1.00 23.23 H new ATOM 0 HE1 TRP A 65 11.980 6.846 -21.526 1.00 44.41 H new ATOM 0 HE3 TRP A 65 16.107 5.507 -24.705 1.00 72.12 H new ATOM 0 HZ2 TRP A 65 14.011 8.792 -21.595 1.00 0.23 H new ATOM 0 HZ3 TRP A 65 17.236 7.624 -24.152 1.00 11.10 H new ATOM 0 HH2 TRP A 65 16.201 9.243 -22.614 1.00 22.02 H new ATOM 1031 N LEU A 66 13.286 1.611 -26.978 1.00 74.33 N ATOM 1032 CA LEU A 66 13.945 0.767 -27.969 1.00 22.01 C ATOM 1033 C LEU A 66 13.030 0.511 -29.162 1.00 20.20 C ATOM 1034 O LEU A 66 13.261 -0.408 -29.947 1.00 44.11 O ATOM 1035 CB LEU A 66 14.364 -0.562 -27.338 1.00 72.20 C ATOM 1036 CG LEU A 66 15.810 -0.647 -26.850 1.00 24.32 C ATOM 1037 CD1 LEU A 66 16.015 -1.892 -26.000 1.00 15.33 C ATOM 1038 CD2 LEU A 66 16.772 -0.641 -28.029 1.00 5.22 C ATOM 0 H LEU A 66 12.521 1.157 -26.479 1.00 74.33 H new ATOM 0 HA LEU A 66 14.833 1.290 -28.323 1.00 22.01 H new ATOM 0 HB2 LEU A 66 13.704 -0.764 -26.494 1.00 72.20 H new ATOM 0 HB3 LEU A 66 14.201 -1.355 -28.068 1.00 72.20 H new ATOM 0 HG LEU A 66 16.016 0.228 -26.233 1.00 24.32 H new ATOM 0 HD11 LEU A 66 17.050 -1.935 -25.662 1.00 15.33 H new ATOM 0 HD12 LEU A 66 15.352 -1.856 -25.136 1.00 15.33 H new ATOM 0 HD13 LEU A 66 15.790 -2.778 -26.593 1.00 15.33 H new ATOM 0 HD21 LEU A 66 17.797 -0.702 -27.663 1.00 5.22 H new ATOM 0 HD22 LEU A 66 16.565 -1.496 -28.672 1.00 5.22 H new ATOM 0 HD23 LEU A 66 16.644 0.280 -28.598 1.00 5.22 H new ATOM 1050 N GLU A 67 11.992 1.331 -29.292 1.00 32.11 N ATOM 1051 CA GLU A 67 11.043 1.193 -30.391 1.00 21.04 C ATOM 1052 C GLU A 67 11.023 2.452 -31.253 1.00 72.31 C ATOM 1053 O GLU A 67 11.316 2.405 -32.448 1.00 64.22 O ATOM 1054 CB GLU A 67 9.640 0.909 -29.850 1.00 1.32 C ATOM 1055 CG GLU A 67 8.571 0.858 -30.928 1.00 60.12 C ATOM 1056 CD GLU A 67 7.272 0.251 -30.434 1.00 24.03 C ATOM 1057 OE1 GLU A 67 6.790 0.672 -29.362 1.00 24.15 O ATOM 1058 OE2 GLU A 67 6.738 -0.645 -31.120 1.00 60.31 O ATOM 0 H GLU A 67 11.787 2.097 -28.651 1.00 32.11 H new ATOM 0 HA GLU A 67 11.362 0.355 -31.010 1.00 21.04 H new ATOM 0 HB2 GLU A 67 9.651 -0.041 -29.316 1.00 1.32 H new ATOM 0 HB3 GLU A 67 9.377 1.679 -29.125 1.00 1.32 H new ATOM 0 HG2 GLU A 67 8.380 1.867 -31.293 1.00 60.12 H new ATOM 0 HG3 GLU A 67 8.940 0.278 -31.773 1.00 60.12 H new ATOM 1065 N THR A 68 10.673 3.578 -30.639 1.00 22.44 N ATOM 1066 CA THR A 68 10.612 4.849 -31.349 1.00 23.23 C ATOM 1067 C THR A 68 11.615 5.846 -30.779 1.00 30.42 C ATOM 1068 O THR A 68 12.148 6.687 -31.503 1.00 22.43 O ATOM 1069 CB THR A 68 9.201 5.463 -31.282 1.00 61.50 C ATOM 1070 OG1 THR A 68 9.225 6.802 -31.789 1.00 33.42 O ATOM 1071 CG2 THR A 68 8.679 5.465 -29.853 1.00 71.22 C ATOM 0 H THR A 68 10.427 3.635 -29.651 1.00 22.44 H new ATOM 0 HA THR A 68 10.861 4.642 -32.390 1.00 23.23 H new ATOM 0 HB THR A 68 8.535 4.855 -31.894 1.00 61.50 H new ATOM 0 HG1 THR A 68 8.324 7.185 -31.744 1.00 33.42 H new ATOM 0 HG21 THR A 68 7.681 5.903 -29.831 1.00 71.22 H new ATOM 0 HG22 THR A 68 8.634 4.442 -29.481 1.00 71.22 H new ATOM 0 HG23 THR A 68 9.347 6.052 -29.222 1.00 71.22 H new ATOM 1079 N ARG A 69 11.868 5.745 -29.478 1.00 12.30 N ATOM 1080 CA ARG A 69 12.807 6.639 -28.811 1.00 51.21 C ATOM 1081 C ARG A 69 14.225 6.080 -28.870 1.00 63.31 C ATOM 1082 O ARG A 69 14.456 5.001 -29.414 1.00 71.24 O ATOM 1083 CB ARG A 69 12.392 6.854 -27.354 1.00 43.44 C ATOM 1084 CG ARG A 69 11.629 8.148 -27.123 1.00 52.23 C ATOM 1085 CD ARG A 69 10.396 8.234 -28.010 1.00 21.44 C ATOM 1086 NE ARG A 69 9.533 9.352 -27.640 1.00 52.22 N ATOM 1087 CZ ARG A 69 9.751 10.606 -28.022 1.00 34.23 C ATOM 1088 NH1 ARG A 69 10.798 10.899 -28.780 1.00 51.00 N ATOM 1089 NH2 ARG A 69 8.920 11.569 -27.645 1.00 14.11 N ATOM 0 H ARG A 69 11.436 5.053 -28.865 1.00 12.30 H new ATOM 0 HA ARG A 69 12.791 7.597 -29.331 1.00 51.21 H new ATOM 0 HB2 ARG A 69 11.774 6.015 -27.034 1.00 43.44 H new ATOM 0 HB3 ARG A 69 13.283 6.851 -26.727 1.00 43.44 H new ATOM 0 HG2 ARG A 69 11.331 8.214 -26.077 1.00 52.23 H new ATOM 0 HG3 ARG A 69 12.282 8.997 -27.323 1.00 52.23 H new ATOM 0 HD2 ARG A 69 10.704 8.343 -29.050 1.00 21.44 H new ATOM 0 HD3 ARG A 69 9.833 7.303 -27.940 1.00 21.44 H new ATOM 0 HE ARG A 69 8.719 9.160 -27.057 1.00 52.22 H new ATOM 0 HH11 ARG A 69 11.439 10.161 -29.072 1.00 51.00 H new ATOM 0 HH12 ARG A 69 10.963 11.862 -29.072 1.00 51.00 H new ATOM 0 HH21 ARG A 69 8.113 11.347 -27.062 1.00 14.11 H new ATOM 0 HH22 ARG A 69 9.088 12.531 -27.938 1.00 14.11 H new ATOM 1103 N GLY A 70 15.173 6.822 -28.306 1.00 1.41 N ATOM 1104 CA GLY A 70 16.557 6.385 -28.306 1.00 33.22 C ATOM 1105 C GLY A 70 17.531 7.542 -28.400 1.00 51.34 C ATOM 1106 O GLY A 70 17.158 8.695 -28.185 1.00 50.41 O ATOM 0 H GLY A 70 15.007 7.719 -27.849 1.00 1.41 H new ATOM 0 HA2 GLY A 70 16.756 5.820 -27.396 1.00 33.22 H new ATOM 0 HA3 GLY A 70 16.721 5.707 -29.144 1.00 33.22 H new ATOM 1110 N SER A 71 18.783 7.235 -28.722 1.00 25.23 N ATOM 1111 CA SER A 71 19.816 8.258 -28.839 1.00 12.03 C ATOM 1112 C SER A 71 19.708 8.988 -30.174 1.00 0.20 C ATOM 1113 O SER A 71 19.102 8.502 -31.129 1.00 52.41 O ATOM 1114 CB SER A 71 21.204 7.630 -28.698 1.00 51.43 C ATOM 1115 OG SER A 71 21.217 6.305 -29.200 1.00 5.04 O ATOM 0 H SER A 71 19.107 6.286 -28.907 1.00 25.23 H new ATOM 0 HA SER A 71 19.670 8.981 -28.037 1.00 12.03 H new ATOM 0 HB2 SER A 71 21.936 8.233 -29.235 1.00 51.43 H new ATOM 0 HB3 SER A 71 21.501 7.628 -27.649 1.00 51.43 H new ATOM 0 HG SER A 71 20.920 5.687 -28.500 1.00 5.04 H new ATOM 1121 N PRO A 72 20.310 10.185 -30.243 1.00 64.44 N ATOM 1122 CA PRO A 72 20.297 11.008 -31.456 1.00 4.21 C ATOM 1123 C PRO A 72 21.143 10.408 -32.574 1.00 5.04 C ATOM 1124 O PRO A 72 20.871 10.624 -33.754 1.00 4.00 O ATOM 1125 CB PRO A 72 20.895 12.338 -30.988 1.00 72.31 C ATOM 1126 CG PRO A 72 21.740 11.981 -29.815 1.00 23.14 C ATOM 1127 CD PRO A 72 21.051 10.825 -29.144 1.00 1.24 C ATOM 0 HA PRO A 72 19.295 11.099 -31.876 1.00 4.21 H new ATOM 0 HB2 PRO A 72 21.487 12.805 -31.775 1.00 72.31 H new ATOM 0 HB3 PRO A 72 20.115 13.048 -30.713 1.00 72.31 H new ATOM 0 HG2 PRO A 72 22.747 11.706 -30.129 1.00 23.14 H new ATOM 0 HG3 PRO A 72 21.838 12.826 -29.133 1.00 23.14 H new ATOM 0 HD2 PRO A 72 21.766 10.140 -28.689 1.00 1.24 H new ATOM 0 HD3 PRO A 72 20.383 11.161 -28.351 1.00 1.24 H new ATOM 1135 N GLU A 73 22.170 9.654 -32.193 1.00 34.52 N ATOM 1136 CA GLU A 73 23.055 9.023 -33.165 1.00 21.34 C ATOM 1137 C GLU A 73 22.328 7.918 -33.927 1.00 1.54 C ATOM 1138 O GLU A 73 21.973 8.085 -35.093 1.00 60.04 O ATOM 1139 CB GLU A 73 24.289 8.448 -32.466 1.00 30.04 C ATOM 1140 CG GLU A 73 25.248 9.509 -31.952 1.00 55.45 C ATOM 1141 CD GLU A 73 25.865 10.327 -33.070 1.00 63.01 C ATOM 1142 OE1 GLU A 73 26.223 9.734 -34.110 1.00 4.43 O ATOM 1143 OE2 GLU A 73 25.991 11.558 -32.906 1.00 1.34 O ATOM 0 H GLU A 73 22.409 9.466 -31.219 1.00 34.52 H new ATOM 0 HA GLU A 73 23.371 9.785 -33.878 1.00 21.34 H new ATOM 0 HB2 GLU A 73 23.966 7.827 -31.631 1.00 30.04 H new ATOM 0 HB3 GLU A 73 24.819 7.797 -33.161 1.00 30.04 H new ATOM 0 HG2 GLU A 73 24.717 10.174 -31.270 1.00 55.45 H new ATOM 0 HG3 GLU A 73 26.040 9.030 -31.377 1.00 55.45 H new ATOM 1150 N SER A 74 22.111 6.790 -33.258 1.00 51.40 N ATOM 1151 CA SER A 74 21.431 5.656 -33.873 1.00 15.54 C ATOM 1152 C SER A 74 19.934 5.925 -33.999 1.00 70.43 C ATOM 1153 O SER A 74 19.256 6.208 -33.011 1.00 3.11 O ATOM 1154 CB SER A 74 21.665 4.387 -33.051 1.00 0.52 C ATOM 1155 OG SER A 74 20.629 4.194 -32.104 1.00 55.21 O ATOM 0 H SER A 74 22.396 6.637 -32.291 1.00 51.40 H new ATOM 0 HA SER A 74 21.843 5.514 -34.872 1.00 15.54 H new ATOM 0 HB2 SER A 74 21.720 3.525 -33.715 1.00 0.52 H new ATOM 0 HB3 SER A 74 22.624 4.455 -32.537 1.00 0.52 H new ATOM 0 HG SER A 74 20.801 3.376 -31.593 1.00 55.21 H new ATOM 1161 N HIS A 75 19.424 5.833 -35.224 1.00 23.24 N ATOM 1162 CA HIS A 75 18.007 6.065 -35.481 1.00 65.33 C ATOM 1163 C HIS A 75 17.252 4.744 -35.593 1.00 23.30 C ATOM 1164 O HIS A 75 17.827 3.719 -35.962 1.00 74.02 O ATOM 1165 CB HIS A 75 17.827 6.879 -36.763 1.00 21.31 C ATOM 1166 CG HIS A 75 17.981 8.355 -36.562 1.00 33.24 C ATOM 1167 ND1 HIS A 75 17.605 9.286 -37.506 1.00 51.33 N ATOM 1168 CD2 HIS A 75 18.471 9.059 -35.515 1.00 42.31 C ATOM 1169 CE1 HIS A 75 17.859 10.500 -37.050 1.00 63.23 C ATOM 1170 NE2 HIS A 75 18.385 10.390 -35.844 1.00 30.24 N ATOM 0 H HIS A 75 19.971 5.600 -36.053 1.00 23.24 H new ATOM 0 HA HIS A 75 17.598 6.627 -34.642 1.00 65.33 H new ATOM 0 HB2 HIS A 75 18.555 6.543 -37.502 1.00 21.31 H new ATOM 0 HB3 HIS A 75 16.838 6.678 -37.175 1.00 21.31 H new ATOM 0 HD2 HIS A 75 18.857 8.651 -34.593 1.00 42.31 H new ATOM 0 HE1 HIS A 75 17.669 11.425 -37.575 1.00 63.23 H new ATOM 0 HE2 HIS A 75 18.680 11.167 -35.253 1.00 30.24 H new ATOM 1178 N ILE A 76 15.964 4.776 -35.271 1.00 74.51 N ATOM 1179 CA ILE A 76 15.131 3.581 -35.336 1.00 32.01 C ATOM 1180 C ILE A 76 13.959 3.779 -36.292 1.00 22.24 C ATOM 1181 O ILE A 76 12.914 4.304 -35.908 1.00 73.41 O ATOM 1182 CB ILE A 76 14.587 3.198 -33.947 1.00 14.11 C ATOM 1183 CG1 ILE A 76 15.741 2.950 -32.974 1.00 32.34 C ATOM 1184 CG2 ILE A 76 13.697 1.968 -34.047 1.00 61.02 C ATOM 1185 CD1 ILE A 76 15.339 3.057 -31.519 1.00 53.44 C ATOM 0 H ILE A 76 15.474 5.616 -34.963 1.00 74.51 H new ATOM 0 HA ILE A 76 15.765 2.774 -35.704 1.00 32.01 H new ATOM 0 HB ILE A 76 13.988 4.025 -33.567 1.00 14.11 H new ATOM 0 HG12 ILE A 76 16.153 1.957 -33.157 1.00 32.34 H new ATOM 0 HG13 ILE A 76 16.537 3.667 -33.176 1.00 32.34 H new ATOM 0 HG21 ILE A 76 13.320 1.710 -33.057 1.00 61.02 H new ATOM 0 HG22 ILE A 76 12.858 2.179 -34.711 1.00 61.02 H new ATOM 0 HG23 ILE A 76 14.274 1.133 -34.445 1.00 61.02 H new ATOM 0 HD11 ILE A 76 16.207 2.869 -30.887 1.00 53.44 H new ATOM 0 HD12 ILE A 76 14.955 4.058 -31.320 1.00 53.44 H new ATOM 0 HD13 ILE A 76 14.565 2.321 -31.300 1.00 53.44 H new ATOM 1197 N ASP A 77 14.141 3.354 -37.537 1.00 73.40 N ATOM 1198 CA ASP A 77 13.098 3.481 -38.548 1.00 54.01 C ATOM 1199 C ASP A 77 11.934 2.540 -38.250 1.00 42.32 C ATOM 1200 O ASP A 77 10.798 2.795 -38.649 1.00 74.12 O ATOM 1201 CB ASP A 77 13.665 3.186 -39.937 1.00 44.03 C ATOM 1202 CG ASP A 77 14.464 4.348 -40.495 1.00 74.12 C ATOM 1203 OD1 ASP A 77 13.843 5.344 -40.921 1.00 52.45 O ATOM 1204 OD2 ASP A 77 15.709 4.261 -40.505 1.00 2.22 O ATOM 0 H ASP A 77 15.001 2.919 -37.871 1.00 73.40 H new ATOM 0 HA ASP A 77 12.728 4.506 -38.525 1.00 54.01 H new ATOM 0 HB2 ASP A 77 14.301 2.302 -39.886 1.00 44.03 H new ATOM 0 HB3 ASP A 77 12.847 2.951 -40.618 1.00 44.03 H new ATOM 1209 N LYS A 78 12.226 1.451 -37.547 1.00 51.22 N ATOM 1210 CA LYS A 78 11.205 0.471 -37.195 1.00 3.21 C ATOM 1211 C LYS A 78 11.755 -0.558 -36.212 1.00 41.41 C ATOM 1212 O LYS A 78 12.957 -0.819 -36.180 1.00 43.42 O ATOM 1213 CB LYS A 78 10.690 -0.233 -38.452 1.00 32.11 C ATOM 1214 CG LYS A 78 11.793 -0.671 -39.400 1.00 1.23 C ATOM 1215 CD LYS A 78 11.337 -1.807 -40.299 1.00 61.14 C ATOM 1216 CE LYS A 78 10.646 -1.285 -41.550 1.00 32.13 C ATOM 1217 NZ LYS A 78 9.209 -0.982 -41.303 1.00 52.13 N ATOM 0 H LYS A 78 13.162 1.225 -37.210 1.00 51.22 H new ATOM 0 HA LYS A 78 10.379 0.999 -36.718 1.00 3.21 H new ATOM 0 HB2 LYS A 78 10.109 -1.106 -38.157 1.00 32.11 H new ATOM 0 HB3 LYS A 78 10.012 0.437 -38.981 1.00 32.11 H new ATOM 0 HG2 LYS A 78 12.105 0.175 -40.012 1.00 1.23 H new ATOM 0 HG3 LYS A 78 12.663 -0.988 -38.825 1.00 1.23 H new ATOM 0 HD2 LYS A 78 12.196 -2.415 -40.583 1.00 61.14 H new ATOM 0 HD3 LYS A 78 10.655 -2.456 -39.749 1.00 61.14 H new ATOM 0 HE2 LYS A 78 11.153 -0.384 -41.896 1.00 32.13 H new ATOM 0 HE3 LYS A 78 10.730 -2.024 -42.347 1.00 32.13 H new ATOM 0 HZ1 LYS A 78 8.683 -1.043 -42.198 1.00 52.13 H new ATOM 0 HZ2 LYS A 78 8.821 -1.669 -40.625 1.00 52.13 H new ATOM 0 HZ3 LYS A 78 9.119 -0.022 -40.913 1.00 52.13 H new ATOM 1231 N ALA A 79 10.867 -1.140 -35.413 1.00 52.41 N ATOM 1232 CA ALA A 79 11.263 -2.142 -34.432 1.00 62.43 C ATOM 1233 C ALA A 79 10.158 -3.172 -34.223 1.00 64.40 C ATOM 1234 O ALA A 79 9.062 -3.040 -34.766 1.00 5.20 O ATOM 1235 CB ALA A 79 11.623 -1.476 -33.113 1.00 24.44 C ATOM 0 H ALA A 79 9.868 -0.934 -35.426 1.00 52.41 H new ATOM 0 HA ALA A 79 12.141 -2.662 -34.815 1.00 62.43 H new ATOM 0 HB1 ALA A 79 11.917 -2.237 -32.390 1.00 24.44 H new ATOM 0 HB2 ALA A 79 12.451 -0.784 -33.269 1.00 24.44 H new ATOM 0 HB3 ALA A 79 10.760 -0.929 -32.734 1.00 24.44 H new ATOM 1241 N ASN A 80 10.455 -4.199 -33.433 1.00 32.13 N ATOM 1242 CA ASN A 80 9.486 -5.253 -33.153 1.00 2.10 C ATOM 1243 C ASN A 80 10.030 -6.230 -32.115 1.00 70.13 C ATOM 1244 O ASN A 80 11.231 -6.263 -31.847 1.00 2.21 O ATOM 1245 CB ASN A 80 9.131 -6.002 -34.439 1.00 31.23 C ATOM 1246 CG ASN A 80 7.845 -6.796 -34.309 1.00 24.11 C ATOM 1247 OD1 ASN A 80 6.756 -6.227 -34.235 1.00 22.12 O ATOM 1248 ND2 ASN A 80 7.967 -8.118 -34.280 1.00 71.25 N ATOM 0 H ASN A 80 11.358 -4.324 -32.976 1.00 32.13 H new ATOM 0 HA ASN A 80 8.586 -4.788 -32.751 1.00 2.10 H new ATOM 0 HB2 ASN A 80 9.033 -5.288 -35.257 1.00 31.23 H new ATOM 0 HB3 ASN A 80 9.946 -6.676 -34.700 1.00 31.23 H new ATOM 0 HD21 ASN A 80 7.137 -8.705 -34.193 1.00 71.25 H new ATOM 0 HD22 ASN A 80 8.890 -8.546 -34.344 1.00 71.25 H new ATOM 1255 N PHE A 81 9.138 -7.026 -31.535 1.00 14.30 N ATOM 1256 CA PHE A 81 9.527 -8.004 -30.526 1.00 63.13 C ATOM 1257 C PHE A 81 9.258 -9.425 -31.014 1.00 44.30 C ATOM 1258 O PHE A 81 8.393 -9.650 -31.861 1.00 2.24 O ATOM 1259 CB PHE A 81 8.772 -7.750 -29.220 1.00 43.30 C ATOM 1260 CG PHE A 81 7.292 -7.580 -29.407 1.00 34.33 C ATOM 1261 CD1 PHE A 81 6.462 -8.685 -29.511 1.00 62.23 C ATOM 1262 CD2 PHE A 81 6.729 -6.316 -29.478 1.00 43.12 C ATOM 1263 CE1 PHE A 81 5.099 -8.533 -29.683 1.00 1.21 C ATOM 1264 CE2 PHE A 81 5.367 -6.157 -29.649 1.00 60.31 C ATOM 1265 CZ PHE A 81 4.551 -7.267 -29.753 1.00 21.01 C ATOM 0 H PHE A 81 8.140 -7.013 -31.747 1.00 14.30 H new ATOM 0 HA PHE A 81 10.597 -7.896 -30.346 1.00 63.13 H new ATOM 0 HB2 PHE A 81 8.951 -8.582 -28.539 1.00 43.30 H new ATOM 0 HB3 PHE A 81 9.175 -6.856 -28.744 1.00 43.30 H new ATOM 0 HD1 PHE A 81 6.885 -9.677 -29.457 1.00 62.23 H new ATOM 0 HD2 PHE A 81 7.362 -5.445 -29.399 1.00 43.12 H new ATOM 0 HE1 PHE A 81 4.464 -9.403 -29.763 1.00 1.21 H new ATOM 0 HE2 PHE A 81 4.941 -5.166 -29.701 1.00 60.31 H new ATOM 0 HZ PHE A 81 3.487 -7.145 -29.889 1.00 21.01 H new ATOM 1275 N LYS A 82 10.007 -10.381 -30.474 1.00 54.31 N ATOM 1276 CA LYS A 82 9.851 -11.780 -30.852 1.00 35.31 C ATOM 1277 C LYS A 82 8.734 -12.439 -30.049 1.00 34.42 C ATOM 1278 O LYS A 82 7.654 -12.708 -30.574 1.00 42.12 O ATOM 1279 CB LYS A 82 11.163 -12.537 -30.637 1.00 30.53 C ATOM 1280 CG LYS A 82 12.276 -12.104 -31.575 1.00 2.24 C ATOM 1281 CD LYS A 82 13.221 -13.252 -31.887 1.00 70.01 C ATOM 1282 CE LYS A 82 13.923 -13.753 -30.634 1.00 42.13 C ATOM 1283 NZ LYS A 82 13.159 -14.844 -29.969 1.00 11.13 N ATOM 0 H LYS A 82 10.728 -10.212 -29.773 1.00 54.31 H new ATOM 0 HA LYS A 82 9.586 -11.818 -31.909 1.00 35.31 H new ATOM 0 HB2 LYS A 82 11.491 -12.394 -29.607 1.00 30.53 H new ATOM 0 HB3 LYS A 82 10.983 -13.604 -30.769 1.00 30.53 H new ATOM 0 HG2 LYS A 82 11.845 -11.724 -32.501 1.00 2.24 H new ATOM 0 HG3 LYS A 82 12.835 -11.284 -31.124 1.00 2.24 H new ATOM 0 HD2 LYS A 82 12.664 -14.069 -32.344 1.00 70.01 H new ATOM 0 HD3 LYS A 82 13.963 -12.926 -32.615 1.00 70.01 H new ATOM 0 HE2 LYS A 82 14.918 -14.113 -30.895 1.00 42.13 H new ATOM 0 HE3 LYS A 82 14.056 -12.926 -29.937 1.00 42.13 H new ATOM 0 HZ1 LYS A 82 13.790 -15.652 -29.793 1.00 11.13 H new ATOM 0 HZ2 LYS A 82 12.778 -14.500 -29.065 1.00 11.13 H new ATOM 0 HZ3 LYS A 82 12.375 -15.144 -30.584 1.00 11.13 H new ATOM 1297 N ASN A 83 9.001 -12.696 -28.772 1.00 53.24 N ATOM 1298 CA ASN A 83 8.017 -13.323 -27.897 1.00 2.43 C ATOM 1299 C ASN A 83 8.467 -13.259 -26.440 1.00 52.12 C ATOM 1300 O ASN A 83 9.383 -13.971 -26.032 1.00 21.40 O ATOM 1301 CB ASN A 83 7.791 -14.779 -28.309 1.00 51.50 C ATOM 1302 CG ASN A 83 6.441 -15.304 -27.859 1.00 42.33 C ATOM 1303 OD1 ASN A 83 5.448 -14.576 -27.861 1.00 31.44 O ATOM 1304 ND2 ASN A 83 6.400 -16.573 -27.471 1.00 72.15 N ATOM 0 H ASN A 83 9.890 -12.480 -28.321 1.00 53.24 H new ATOM 0 HA ASN A 83 7.079 -12.776 -27.994 1.00 2.43 H new ATOM 0 HB2 ASN A 83 7.868 -14.863 -29.393 1.00 51.50 H new ATOM 0 HB3 ASN A 83 8.579 -15.401 -27.885 1.00 51.50 H new ATOM 0 HD21 ASN A 83 5.520 -16.982 -27.158 1.00 72.15 H new ATOM 0 HD22 ASN A 83 7.249 -17.139 -27.486 1.00 72.15 H new ATOM 1311 N GLU A 84 7.814 -12.401 -25.662 1.00 43.21 N ATOM 1312 CA GLU A 84 8.148 -12.244 -24.251 1.00 74.51 C ATOM 1313 C GLU A 84 7.869 -13.532 -23.480 1.00 51.33 C ATOM 1314 O GLU A 84 6.992 -14.313 -23.850 1.00 12.24 O ATOM 1315 CB GLU A 84 7.351 -11.089 -23.641 1.00 61.21 C ATOM 1316 CG GLU A 84 5.848 -11.314 -23.651 1.00 24.15 C ATOM 1317 CD GLU A 84 5.188 -10.788 -24.910 1.00 14.43 C ATOM 1318 OE1 GLU A 84 4.988 -9.559 -25.007 1.00 3.25 O ATOM 1319 OE2 GLU A 84 4.870 -11.605 -25.799 1.00 21.44 O ATOM 0 H GLU A 84 7.052 -11.805 -25.984 1.00 43.21 H new ATOM 0 HA GLU A 84 9.212 -12.020 -24.178 1.00 74.51 H new ATOM 0 HB2 GLU A 84 7.680 -10.935 -22.613 1.00 61.21 H new ATOM 0 HB3 GLU A 84 7.577 -10.174 -24.189 1.00 61.21 H new ATOM 0 HG2 GLU A 84 5.643 -12.380 -23.556 1.00 24.15 H new ATOM 0 HG3 GLU A 84 5.406 -10.826 -22.782 1.00 24.15 H new ATOM 1326 N LYS A 85 8.622 -13.746 -22.407 1.00 63.51 N ATOM 1327 CA LYS A 85 8.458 -14.937 -21.582 1.00 71.53 C ATOM 1328 C LYS A 85 8.244 -14.561 -20.120 1.00 34.13 C ATOM 1329 O LYS A 85 8.975 -13.740 -19.566 1.00 53.21 O ATOM 1330 CB LYS A 85 9.683 -15.846 -21.712 1.00 12.20 C ATOM 1331 CG LYS A 85 9.801 -16.518 -23.069 1.00 13.21 C ATOM 1332 CD LYS A 85 8.937 -17.766 -23.150 1.00 43.52 C ATOM 1333 CE LYS A 85 9.658 -18.980 -22.584 1.00 14.41 C ATOM 1334 NZ LYS A 85 8.737 -20.136 -22.402 1.00 50.04 N ATOM 0 H LYS A 85 9.353 -13.110 -22.088 1.00 63.51 H new ATOM 0 HA LYS A 85 7.577 -15.473 -21.934 1.00 71.53 H new ATOM 0 HB2 LYS A 85 10.582 -15.258 -21.528 1.00 12.20 H new ATOM 0 HB3 LYS A 85 9.639 -16.613 -20.939 1.00 12.20 H new ATOM 0 HG2 LYS A 85 9.505 -15.818 -23.850 1.00 13.21 H new ATOM 0 HG3 LYS A 85 10.842 -16.782 -23.256 1.00 13.21 H new ATOM 0 HD2 LYS A 85 8.009 -17.604 -22.601 1.00 43.52 H new ATOM 0 HD3 LYS A 85 8.665 -17.955 -24.188 1.00 43.52 H new ATOM 0 HE2 LYS A 85 10.470 -19.265 -23.253 1.00 14.41 H new ATOM 0 HE3 LYS A 85 10.109 -18.721 -21.626 1.00 14.41 H new ATOM 0 HZ1 LYS A 85 9.266 -20.943 -22.015 1.00 50.04 H new ATOM 0 HZ2 LYS A 85 7.976 -19.873 -21.744 1.00 50.04 H new ATOM 0 HZ3 LYS A 85 8.326 -20.400 -23.320 1.00 50.04 H new ATOM 1348 N VAL A 86 7.237 -15.168 -19.498 1.00 63.05 N ATOM 1349 CA VAL A 86 6.929 -14.898 -18.099 1.00 74.43 C ATOM 1350 C VAL A 86 7.772 -15.767 -17.173 1.00 62.11 C ATOM 1351 O VAL A 86 7.553 -16.974 -17.068 1.00 64.31 O ATOM 1352 CB VAL A 86 5.438 -15.141 -17.796 1.00 61.24 C ATOM 1353 CG1 VAL A 86 5.098 -14.685 -16.386 1.00 3.51 C ATOM 1354 CG2 VAL A 86 4.564 -14.432 -18.820 1.00 64.22 C ATOM 0 H VAL A 86 6.621 -15.850 -19.941 1.00 63.05 H new ATOM 0 HA VAL A 86 7.163 -13.848 -17.920 1.00 74.43 H new ATOM 0 HB VAL A 86 5.241 -16.211 -17.863 1.00 61.24 H new ATOM 0 HG11 VAL A 86 4.041 -14.865 -16.190 1.00 3.51 H new ATOM 0 HG12 VAL A 86 5.700 -15.243 -15.668 1.00 3.51 H new ATOM 0 HG13 VAL A 86 5.309 -13.620 -16.287 1.00 3.51 H new ATOM 0 HG21 VAL A 86 3.514 -14.614 -18.591 1.00 64.22 H new ATOM 0 HG22 VAL A 86 4.762 -13.361 -18.788 1.00 64.22 H new ATOM 0 HG23 VAL A 86 4.789 -14.812 -19.816 1.00 64.22 H new ATOM 1364 N ILE A 87 8.736 -15.145 -16.503 1.00 63.11 N ATOM 1365 CA ILE A 87 9.612 -15.861 -15.584 1.00 70.50 C ATOM 1366 C ILE A 87 9.323 -15.477 -14.137 1.00 33.20 C ATOM 1367 O ILE A 87 8.521 -14.581 -13.869 1.00 74.53 O ATOM 1368 CB ILE A 87 11.096 -15.585 -15.890 1.00 31.41 C ATOM 1369 CG1 ILE A 87 11.348 -14.079 -15.983 1.00 63.24 C ATOM 1370 CG2 ILE A 87 11.509 -16.278 -17.180 1.00 34.20 C ATOM 1371 CD1 ILE A 87 12.802 -13.723 -16.205 1.00 55.32 C ATOM 0 H ILE A 87 8.930 -14.147 -16.579 1.00 63.11 H new ATOM 0 HA ILE A 87 9.413 -16.924 -15.722 1.00 70.50 H new ATOM 0 HB ILE A 87 11.700 -15.986 -15.076 1.00 31.41 H new ATOM 0 HG12 ILE A 87 10.753 -13.669 -16.799 1.00 63.24 H new ATOM 0 HG13 ILE A 87 11.002 -13.603 -15.065 1.00 63.24 H new ATOM 0 HG21 ILE A 87 12.560 -16.073 -17.383 1.00 34.20 H new ATOM 0 HG22 ILE A 87 11.362 -17.353 -17.079 1.00 34.20 H new ATOM 0 HG23 ILE A 87 10.901 -15.905 -18.004 1.00 34.20 H new ATOM 0 HD11 ILE A 87 12.907 -12.639 -16.261 1.00 55.32 H new ATOM 0 HD12 ILE A 87 13.400 -14.103 -15.377 1.00 55.32 H new ATOM 0 HD13 ILE A 87 13.148 -14.170 -17.137 1.00 55.32 H new ATOM 1383 N LEU A 88 9.982 -16.159 -13.207 1.00 0.23 N ATOM 1384 CA LEU A 88 9.798 -15.888 -11.785 1.00 53.01 C ATOM 1385 C LEU A 88 10.970 -15.087 -11.227 1.00 54.20 C ATOM 1386 O LEU A 88 10.827 -14.361 -10.243 1.00 40.30 O ATOM 1387 CB LEU A 88 9.647 -17.199 -11.011 1.00 51.14 C ATOM 1388 CG LEU A 88 8.634 -18.197 -11.573 1.00 71.13 C ATOM 1389 CD1 LEU A 88 8.974 -19.611 -11.127 1.00 52.33 C ATOM 1390 CD2 LEU A 88 7.223 -17.825 -11.142 1.00 52.33 C ATOM 0 H LEU A 88 10.648 -16.904 -13.412 1.00 0.23 H new ATOM 0 HA LEU A 88 8.890 -15.297 -11.668 1.00 53.01 H new ATOM 0 HB2 LEU A 88 10.621 -17.686 -10.967 1.00 51.14 H new ATOM 0 HB3 LEU A 88 9.363 -16.962 -9.986 1.00 51.14 H new ATOM 0 HG LEU A 88 8.682 -18.160 -12.661 1.00 71.13 H new ATOM 0 HD11 LEU A 88 8.242 -20.307 -11.536 1.00 52.33 H new ATOM 0 HD12 LEU A 88 9.968 -19.877 -11.486 1.00 52.33 H new ATOM 0 HD13 LEU A 88 8.955 -19.664 -10.038 1.00 52.33 H new ATOM 0 HD21 LEU A 88 6.516 -18.546 -11.551 1.00 52.33 H new ATOM 0 HD22 LEU A 88 7.161 -17.833 -10.054 1.00 52.33 H new ATOM 0 HD23 LEU A 88 6.980 -16.829 -11.512 1.00 52.33 H new ATOM 1402 N LYS A 89 12.128 -15.222 -11.863 1.00 63.11 N ATOM 1403 CA LYS A 89 13.325 -14.509 -11.434 1.00 3.25 C ATOM 1404 C LYS A 89 14.256 -14.247 -12.614 1.00 33.34 C ATOM 1405 O LYS A 89 14.164 -14.910 -13.648 1.00 42.42 O ATOM 1406 CB LYS A 89 14.062 -15.309 -10.357 1.00 40.00 C ATOM 1407 CG LYS A 89 14.509 -16.685 -10.821 1.00 13.33 C ATOM 1408 CD LYS A 89 14.568 -17.670 -9.666 1.00 31.42 C ATOM 1409 CE LYS A 89 13.180 -18.150 -9.271 1.00 33.21 C ATOM 1410 NZ LYS A 89 12.763 -19.347 -10.053 1.00 24.44 N ATOM 0 H LYS A 89 12.263 -15.819 -12.679 1.00 63.11 H new ATOM 0 HA LYS A 89 13.016 -13.550 -11.018 1.00 3.25 H new ATOM 0 HB2 LYS A 89 14.935 -14.744 -10.030 1.00 40.00 H new ATOM 0 HB3 LYS A 89 13.411 -15.421 -9.490 1.00 40.00 H new ATOM 0 HG2 LYS A 89 13.821 -17.055 -11.581 1.00 13.33 H new ATOM 0 HG3 LYS A 89 15.491 -16.611 -11.288 1.00 13.33 H new ATOM 0 HD2 LYS A 89 15.183 -18.525 -9.947 1.00 31.42 H new ATOM 0 HD3 LYS A 89 15.049 -17.199 -8.809 1.00 31.42 H new ATOM 0 HE2 LYS A 89 13.167 -18.389 -8.208 1.00 33.21 H new ATOM 0 HE3 LYS A 89 12.460 -17.346 -9.426 1.00 33.21 H new ATOM 0 HZ1 LYS A 89 11.812 -19.643 -9.754 1.00 24.44 H new ATOM 0 HZ2 LYS A 89 12.750 -19.113 -11.066 1.00 24.44 H new ATOM 0 HZ3 LYS A 89 13.435 -20.123 -9.886 1.00 24.44 H new ATOM 1424 N LEU A 90 15.151 -13.280 -12.452 1.00 4.23 N ATOM 1425 CA LEU A 90 16.100 -12.932 -13.504 1.00 5.14 C ATOM 1426 C LEU A 90 17.394 -13.727 -13.355 1.00 11.43 C ATOM 1427 O LEU A 90 17.980 -13.781 -12.273 1.00 74.12 O ATOM 1428 CB LEU A 90 16.403 -11.433 -13.469 1.00 52.25 C ATOM 1429 CG LEU A 90 15.218 -10.516 -13.164 1.00 52.24 C ATOM 1430 CD1 LEU A 90 15.691 -9.088 -12.941 1.00 24.01 C ATOM 1431 CD2 LEU A 90 14.197 -10.571 -14.292 1.00 11.25 C ATOM 0 H LEU A 90 15.240 -12.723 -11.602 1.00 4.23 H new ATOM 0 HA LEU A 90 15.649 -13.183 -14.464 1.00 5.14 H new ATOM 0 HB2 LEU A 90 17.176 -11.256 -12.721 1.00 52.25 H new ATOM 0 HB3 LEU A 90 16.821 -11.145 -14.433 1.00 52.25 H new ATOM 0 HG LEU A 90 14.739 -10.865 -12.249 1.00 52.24 H new ATOM 0 HD11 LEU A 90 14.834 -8.450 -12.725 1.00 24.01 H new ATOM 0 HD12 LEU A 90 16.384 -9.061 -12.100 1.00 24.01 H new ATOM 0 HD13 LEU A 90 16.195 -8.727 -13.838 1.00 24.01 H new ATOM 0 HD21 LEU A 90 13.361 -9.912 -14.058 1.00 11.25 H new ATOM 0 HD22 LEU A 90 14.664 -10.247 -15.222 1.00 11.25 H new ATOM 0 HD23 LEU A 90 13.834 -11.593 -14.405 1.00 11.25 H new ATOM 1443 N ASP A 91 17.835 -14.339 -14.448 1.00 34.42 N ATOM 1444 CA ASP A 91 19.061 -15.129 -14.440 1.00 51.40 C ATOM 1445 C ASP A 91 20.289 -14.224 -14.396 1.00 33.53 C ATOM 1446 O ASP A 91 21.349 -14.623 -13.913 1.00 32.42 O ATOM 1447 CB ASP A 91 19.120 -16.030 -15.674 1.00 63.12 C ATOM 1448 CG ASP A 91 19.307 -15.244 -16.957 1.00 10.11 C ATOM 1449 OD1 ASP A 91 18.362 -14.534 -17.360 1.00 43.00 O ATOM 1450 OD2 ASP A 91 20.398 -15.339 -17.558 1.00 74.23 O ATOM 0 H ASP A 91 17.362 -14.303 -15.351 1.00 34.42 H new ATOM 0 HA ASP A 91 19.058 -15.752 -13.545 1.00 51.40 H new ATOM 0 HB2 ASP A 91 19.940 -16.739 -15.563 1.00 63.12 H new ATOM 0 HB3 ASP A 91 18.201 -16.613 -15.739 1.00 63.12 H new ATOM 1455 N TYR A 92 20.138 -13.006 -14.903 1.00 65.22 N ATOM 1456 CA TYR A 92 21.236 -12.046 -14.925 1.00 31.52 C ATOM 1457 C TYR A 92 21.257 -11.214 -13.647 1.00 31.05 C ATOM 1458 O TYR A 92 20.305 -11.230 -12.867 1.00 12.45 O ATOM 1459 CB TYR A 92 21.115 -11.129 -16.142 1.00 53.35 C ATOM 1460 CG TYR A 92 21.830 -11.651 -17.368 1.00 75.21 C ATOM 1461 CD1 TYR A 92 21.242 -12.611 -18.183 1.00 50.53 C ATOM 1462 CD2 TYR A 92 23.093 -11.184 -17.711 1.00 75.44 C ATOM 1463 CE1 TYR A 92 21.892 -13.091 -19.304 1.00 31.15 C ATOM 1464 CE2 TYR A 92 23.749 -11.658 -18.831 1.00 23.24 C ATOM 1465 CZ TYR A 92 23.145 -12.612 -19.623 1.00 42.21 C ATOM 1466 OH TYR A 92 23.795 -13.087 -20.739 1.00 3.10 O ATOM 0 H TYR A 92 19.267 -12.660 -15.304 1.00 65.22 H new ATOM 0 HA TYR A 92 22.171 -12.603 -14.990 1.00 31.52 H new ATOM 0 HB2 TYR A 92 20.060 -10.991 -16.379 1.00 53.35 H new ATOM 0 HB3 TYR A 92 21.516 -10.148 -15.888 1.00 53.35 H new ATOM 0 HD1 TYR A 92 20.261 -12.988 -17.936 1.00 50.53 H new ATOM 0 HD2 TYR A 92 23.570 -10.438 -17.092 1.00 75.44 H new ATOM 0 HE1 TYR A 92 21.421 -13.837 -19.927 1.00 31.15 H new ATOM 0 HE2 TYR A 92 24.730 -11.283 -19.085 1.00 23.24 H new ATOM 0 HH TYR A 92 23.208 -13.004 -21.520 1.00 3.10 H new ATOM 1476 N SER A 93 22.350 -10.487 -13.440 1.00 23.05 N ATOM 1477 CA SER A 93 22.499 -9.650 -12.255 1.00 15.31 C ATOM 1478 C SER A 93 22.546 -8.173 -12.636 1.00 31.12 C ATOM 1479 O SER A 93 22.179 -7.304 -11.844 1.00 73.44 O ATOM 1480 CB SER A 93 23.767 -10.032 -11.490 1.00 2.31 C ATOM 1481 OG SER A 93 24.067 -9.074 -10.489 1.00 61.22 O ATOM 0 H SER A 93 23.146 -10.461 -14.078 1.00 23.05 H new ATOM 0 HA SER A 93 21.634 -9.815 -11.613 1.00 15.31 H new ATOM 0 HB2 SER A 93 23.638 -11.013 -11.032 1.00 2.31 H new ATOM 0 HB3 SER A 93 24.604 -10.112 -12.184 1.00 2.31 H new ATOM 0 HG SER A 93 24.881 -9.342 -10.013 1.00 61.22 H new ATOM 1487 N ASP A 94 23.001 -7.897 -13.853 1.00 32.10 N ATOM 1488 CA ASP A 94 23.096 -6.526 -14.341 1.00 70.20 C ATOM 1489 C ASP A 94 23.107 -6.492 -15.866 1.00 53.21 C ATOM 1490 O ASP A 94 23.104 -7.534 -16.521 1.00 62.40 O ATOM 1491 CB ASP A 94 24.356 -5.854 -13.794 1.00 64.05 C ATOM 1492 CG ASP A 94 24.196 -4.353 -13.650 1.00 30.41 C ATOM 1493 OD1 ASP A 94 23.377 -3.922 -12.811 1.00 3.00 O ATOM 1494 OD2 ASP A 94 24.890 -3.610 -14.375 1.00 33.41 O ATOM 0 H ASP A 94 23.310 -8.604 -14.520 1.00 32.10 H new ATOM 0 HA ASP A 94 22.221 -5.979 -13.990 1.00 70.20 H new ATOM 0 HB2 ASP A 94 24.602 -6.285 -12.823 1.00 64.05 H new ATOM 0 HB3 ASP A 94 25.194 -6.065 -14.458 1.00 64.05 H new ATOM 1499 N PHE A 95 23.118 -5.287 -16.426 1.00 14.54 N ATOM 1500 CA PHE A 95 23.127 -5.116 -17.874 1.00 35.01 C ATOM 1501 C PHE A 95 24.555 -5.026 -18.402 1.00 62.42 C ATOM 1502 O PHE A 95 25.354 -4.221 -17.925 1.00 42.14 O ATOM 1503 CB PHE A 95 22.346 -3.859 -18.266 1.00 22.55 C ATOM 1504 CG PHE A 95 21.658 -3.971 -19.596 1.00 62.50 C ATOM 1505 CD1 PHE A 95 22.390 -4.184 -20.753 1.00 73.13 C ATOM 1506 CD2 PHE A 95 20.280 -3.864 -19.689 1.00 50.53 C ATOM 1507 CE1 PHE A 95 21.760 -4.288 -21.979 1.00 73.13 C ATOM 1508 CE2 PHE A 95 19.645 -3.967 -20.912 1.00 75.03 C ATOM 1509 CZ PHE A 95 20.385 -4.178 -22.059 1.00 23.32 C ATOM 0 H PHE A 95 23.121 -4.414 -15.899 1.00 14.54 H new ATOM 0 HA PHE A 95 22.647 -5.987 -18.320 1.00 35.01 H new ATOM 0 HB2 PHE A 95 21.602 -3.649 -17.498 1.00 22.55 H new ATOM 0 HB3 PHE A 95 23.029 -3.009 -18.289 1.00 22.55 H new ATOM 0 HD1 PHE A 95 23.465 -4.270 -20.696 1.00 73.13 H new ATOM 0 HD2 PHE A 95 19.696 -3.698 -18.796 1.00 50.53 H new ATOM 0 HE1 PHE A 95 22.342 -4.455 -22.873 1.00 73.13 H new ATOM 0 HE2 PHE A 95 18.570 -3.883 -20.971 1.00 75.03 H new ATOM 0 HZ PHE A 95 19.890 -4.257 -23.016 1.00 23.32 H new ATOM 1519 N GLN A 96 24.868 -5.860 -19.389 1.00 42.21 N ATOM 1520 CA GLN A 96 26.200 -5.876 -19.981 1.00 45.33 C ATOM 1521 C GLN A 96 26.162 -5.377 -21.422 1.00 52.11 C ATOM 1522 O GLN A 96 25.090 -5.240 -22.013 1.00 22.10 O ATOM 1523 CB GLN A 96 26.786 -7.288 -19.934 1.00 20.04 C ATOM 1524 CG GLN A 96 28.304 -7.315 -19.858 1.00 61.13 C ATOM 1525 CD GLN A 96 28.838 -8.620 -19.302 1.00 34.33 C ATOM 1526 OE1 GLN A 96 28.320 -9.696 -19.606 1.00 5.33 O ATOM 1527 NE2 GLN A 96 29.878 -8.533 -18.481 1.00 63.15 N ATOM 0 H GLN A 96 24.218 -6.533 -19.795 1.00 42.21 H new ATOM 0 HA GLN A 96 26.835 -5.207 -19.400 1.00 45.33 H new ATOM 0 HB2 GLN A 96 26.378 -7.813 -19.070 1.00 20.04 H new ATOM 0 HB3 GLN A 96 26.465 -7.835 -20.820 1.00 20.04 H new ATOM 0 HG2 GLN A 96 28.717 -7.153 -20.854 1.00 61.13 H new ATOM 0 HG3 GLN A 96 28.647 -6.491 -19.233 1.00 61.13 H new ATOM 0 HE21 GLN A 96 30.276 -7.621 -18.256 1.00 63.15 H new ATOM 0 HE22 GLN A 96 30.279 -9.378 -18.075 1.00 63.15 H new ATOM 1536 N ILE A 97 27.336 -5.107 -21.981 1.00 45.40 N ATOM 1537 CA ILE A 97 27.436 -4.624 -23.353 1.00 1.23 C ATOM 1538 C ILE A 97 28.226 -5.596 -24.222 1.00 22.21 C ATOM 1539 O ILE A 97 29.154 -6.254 -23.751 1.00 30.14 O ATOM 1540 CB ILE A 97 28.105 -3.238 -23.414 1.00 51.25 C ATOM 1541 CG1 ILE A 97 27.389 -2.260 -22.481 1.00 54.31 C ATOM 1542 CG2 ILE A 97 28.104 -2.713 -24.842 1.00 44.43 C ATOM 1543 CD1 ILE A 97 28.102 -0.934 -22.332 1.00 70.21 C ATOM 0 H ILE A 97 28.232 -5.214 -21.505 1.00 45.40 H new ATOM 0 HA ILE A 97 26.418 -4.545 -23.735 1.00 1.23 H new ATOM 0 HB ILE A 97 29.139 -3.335 -23.083 1.00 51.25 H new ATOM 0 HG12 ILE A 97 26.382 -2.081 -22.859 1.00 54.31 H new ATOM 0 HG13 ILE A 97 27.284 -2.719 -21.498 1.00 54.31 H new ATOM 0 HG21 ILE A 97 28.580 -1.733 -24.870 1.00 44.43 H new ATOM 0 HG22 ILE A 97 28.654 -3.402 -25.483 1.00 44.43 H new ATOM 0 HG23 ILE A 97 27.077 -2.628 -25.198 1.00 44.43 H new ATOM 0 HD11 ILE A 97 27.537 -0.291 -21.657 1.00 70.21 H new ATOM 0 HD12 ILE A 97 29.099 -1.101 -21.925 1.00 70.21 H new ATOM 0 HD13 ILE A 97 28.184 -0.453 -23.307 1.00 70.21 H new ATOM 1555 N VAL A 98 27.853 -5.681 -25.495 1.00 2.01 N ATOM 1556 CA VAL A 98 28.529 -6.571 -26.432 1.00 14.21 C ATOM 1557 C VAL A 98 29.131 -5.790 -27.595 1.00 14.04 C ATOM 1558 O VAL A 98 28.451 -4.990 -28.239 1.00 31.54 O ATOM 1559 CB VAL A 98 27.565 -7.637 -26.987 1.00 44.55 C ATOM 1560 CG1 VAL A 98 28.310 -8.614 -27.884 1.00 30.10 C ATOM 1561 CG2 VAL A 98 26.868 -8.368 -25.851 1.00 32.13 C ATOM 0 H VAL A 98 27.086 -5.144 -25.901 1.00 2.01 H new ATOM 0 HA VAL A 98 29.328 -7.066 -25.879 1.00 14.21 H new ATOM 0 HB VAL A 98 26.804 -7.138 -27.587 1.00 44.55 H new ATOM 0 HG11 VAL A 98 27.614 -9.360 -28.267 1.00 30.10 H new ATOM 0 HG12 VAL A 98 28.758 -8.073 -28.718 1.00 30.10 H new ATOM 0 HG13 VAL A 98 29.093 -9.110 -27.311 1.00 30.10 H new ATOM 0 HG21 VAL A 98 26.191 -9.117 -26.262 1.00 32.13 H new ATOM 0 HG22 VAL A 98 27.612 -8.857 -25.222 1.00 32.13 H new ATOM 0 HG23 VAL A 98 26.300 -7.655 -25.253 1.00 32.13 H new ATOM 1571 N LYS A 99 30.411 -6.027 -27.859 1.00 51.04 N ATOM 1572 CA LYS A 99 31.106 -5.348 -28.946 1.00 45.02 C ATOM 1573 C LYS A 99 30.334 -5.482 -30.255 1.00 31.35 C ATOM 1574 O LYS A 99 30.083 -4.493 -30.943 1.00 42.21 O ATOM 1575 CB LYS A 99 32.516 -5.920 -29.113 1.00 2.30 C ATOM 1576 CG LYS A 99 33.499 -4.943 -29.735 1.00 71.14 C ATOM 1577 CD LYS A 99 34.926 -5.460 -29.655 1.00 15.03 C ATOM 1578 CE LYS A 99 35.901 -4.511 -30.334 1.00 23.32 C ATOM 1579 NZ LYS A 99 36.316 -3.402 -29.431 1.00 24.43 N ATOM 0 H LYS A 99 30.989 -6.684 -27.335 1.00 51.04 H new ATOM 0 HA LYS A 99 31.176 -4.290 -28.693 1.00 45.02 H new ATOM 0 HB2 LYS A 99 32.892 -6.229 -28.137 1.00 2.30 H new ATOM 0 HB3 LYS A 99 32.465 -6.815 -29.733 1.00 2.30 H new ATOM 0 HG2 LYS A 99 33.232 -4.771 -30.778 1.00 71.14 H new ATOM 0 HG3 LYS A 99 33.430 -3.982 -29.225 1.00 71.14 H new ATOM 0 HD2 LYS A 99 35.210 -5.589 -28.610 1.00 15.03 H new ATOM 0 HD3 LYS A 99 34.985 -6.442 -30.125 1.00 15.03 H new ATOM 0 HE2 LYS A 99 36.782 -5.065 -30.657 1.00 23.32 H new ATOM 0 HE3 LYS A 99 35.439 -4.096 -31.230 1.00 23.32 H new ATOM 0 HZ1 LYS A 99 36.980 -2.777 -29.931 1.00 24.43 H new ATOM 0 HZ2 LYS A 99 35.478 -2.857 -29.143 1.00 24.43 H new ATOM 0 HZ3 LYS A 99 36.779 -3.796 -28.587 1.00 24.43 H new