USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 800 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 7 LYS NZ :NH3+ 161:sc=-0.00362 (180deg=-0.125) USER MOD Single : A 12 ASN : amide:sc= -0.212 X(o=-0.21,f=-0.21) USER MOD Single : A 18 SER OG : rot 180:sc= 0.217 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -2 K(o=-2,f=-7.3!) USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 GLN : amide:sc= -0.255 K(o=-0.26,f=-1.9!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -2.43 K(o=-2.4,f=-11!) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= -0.0181 (180deg=-0.0181) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 103:sc= 0.508 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 MET CE :methyl 145:sc= -0.0767 (180deg=-0.187) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.969 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 90:sc= 0.576 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 HIS : no HD1:sc= -0.462 X(o=-0.46,f=-0.34) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 GLN : amide:sc= -0.254 K(o=-0.25,f=-2.1!) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN :FLIP amide:sc= -1.5 F(o=-2.7!,f=-1.5) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.364 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 26 N GLU A 3 -16.518 -25.013 -45.276 1.00 0.00 N ATOM 27 CA GLU A 3 -16.020 -25.105 -43.914 1.00 0.00 C ATOM 28 C GLU A 3 -14.546 -25.515 -43.914 1.00 0.00 C ATOM 29 O GLU A 3 -13.771 -25.056 -43.077 1.00 0.00 O ATOM 30 CB GLU A 3 -16.860 -26.081 -43.088 1.00 0.00 C ATOM 31 CG GLU A 3 -16.610 -27.526 -43.524 1.00 0.00 C ATOM 32 CD GLU A 3 -17.278 -28.512 -42.565 1.00 0.00 C ATOM 33 OE1 GLU A 3 -16.690 -28.740 -41.486 1.00 0.00 O ATOM 34 OE2 GLU A 3 -18.361 -29.016 -42.933 1.00 0.00 O ATOM 0 HA GLU A 3 -16.104 -24.122 -43.450 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -16.618 -25.970 -42.031 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -17.917 -25.841 -43.200 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -16.995 -27.677 -44.533 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -15.538 -27.718 -43.560 1.00 0.00 H new ATOM 39 N ALA A 4 -14.204 -26.372 -44.864 1.00 0.00 N ATOM 40 CA ALA A 4 -12.836 -26.848 -44.985 1.00 0.00 C ATOM 41 C ALA A 4 -11.872 -25.687 -44.732 1.00 0.00 C ATOM 42 O ALA A 4 -10.765 -25.892 -44.238 1.00 0.00 O ATOM 43 CB ALA A 4 -12.635 -27.482 -46.363 1.00 0.00 C ATOM 0 H ALA A 4 -14.850 -26.749 -45.557 1.00 0.00 H new ATOM 0 HA ALA A 4 -12.630 -27.616 -44.240 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -11.609 -27.839 -46.453 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -13.322 -28.320 -46.482 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -12.830 -26.740 -47.137 1.00 0.00 H new ATOM 49 N LEU A 5 -12.328 -24.493 -45.080 1.00 0.00 N ATOM 50 CA LEU A 5 -11.521 -23.300 -44.897 1.00 0.00 C ATOM 51 C LEU A 5 -10.874 -23.336 -43.511 1.00 0.00 C ATOM 52 O LEU A 5 -9.649 -23.309 -43.394 1.00 0.00 O ATOM 53 CB LEU A 5 -12.355 -22.043 -45.154 1.00 0.00 C ATOM 54 CG LEU A 5 -12.257 -21.449 -46.560 1.00 0.00 C ATOM 55 CD1 LEU A 5 -13.618 -20.940 -47.036 1.00 0.00 C ATOM 56 CD2 LEU A 5 -11.184 -20.359 -46.620 1.00 0.00 C ATOM 0 H LEU A 5 -13.248 -24.327 -45.488 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.712 -23.272 -45.627 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -13.400 -22.277 -44.952 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -12.055 -21.279 -44.437 1.00 0.00 H new ATOM 0 HG LEU A 5 -11.952 -22.240 -47.245 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -13.520 -20.523 -48.038 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -14.329 -21.766 -47.055 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -13.976 -20.168 -46.355 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -11.134 -19.953 -47.630 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -11.436 -19.562 -45.920 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -10.217 -20.785 -46.352 1.00 0.00 H new ATOM 67 N PHE A 6 -11.724 -23.396 -42.497 1.00 0.00 N ATOM 68 CA PHE A 6 -11.249 -23.436 -41.124 1.00 0.00 C ATOM 69 C PHE A 6 -10.193 -24.526 -40.940 1.00 0.00 C ATOM 70 O PHE A 6 -9.275 -24.377 -40.136 1.00 0.00 O ATOM 71 CB PHE A 6 -12.458 -23.760 -40.243 1.00 0.00 C ATOM 72 CG PHE A 6 -12.092 -24.253 -38.842 1.00 0.00 C ATOM 73 CD1 PHE A 6 -11.528 -25.479 -38.678 1.00 0.00 C ATOM 74 CD2 PHE A 6 -12.331 -23.465 -37.760 1.00 0.00 C ATOM 75 CE1 PHE A 6 -11.187 -25.937 -37.378 1.00 0.00 C ATOM 76 CE2 PHE A 6 -11.992 -23.922 -36.459 1.00 0.00 C ATOM 77 CZ PHE A 6 -11.427 -25.148 -36.295 1.00 0.00 C ATOM 0 H PHE A 6 -12.739 -23.418 -42.598 1.00 0.00 H new ATOM 0 HA PHE A 6 -10.796 -22.481 -40.859 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -13.078 -22.868 -40.153 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -13.062 -24.520 -40.738 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -11.339 -26.105 -39.537 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -12.779 -22.491 -37.890 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -10.738 -26.910 -37.249 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -12.183 -23.296 -35.600 1.00 0.00 H new ATOM 0 HZ PHE A 6 -11.169 -25.496 -35.306 1.00 0.00 H new ATOM 86 N LYS A 7 -10.358 -25.600 -41.700 1.00 0.00 N ATOM 87 CA LYS A 7 -9.429 -26.715 -41.631 1.00 0.00 C ATOM 88 C LYS A 7 -8.107 -26.314 -42.288 1.00 0.00 C ATOM 89 O LYS A 7 -7.035 -26.671 -41.802 1.00 0.00 O ATOM 90 CB LYS A 7 -10.058 -27.973 -42.233 1.00 0.00 C ATOM 91 CG LYS A 7 -9.366 -29.235 -41.713 1.00 0.00 C ATOM 92 CD LYS A 7 -8.090 -29.526 -42.506 1.00 0.00 C ATOM 93 CE LYS A 7 -8.028 -30.995 -42.927 1.00 0.00 C ATOM 94 NZ LYS A 7 -9.053 -31.282 -43.955 1.00 0.00 N ATOM 0 H LYS A 7 -11.121 -25.721 -42.366 1.00 0.00 H new ATOM 0 HA LYS A 7 -9.207 -26.962 -40.593 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -11.119 -28.008 -41.985 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -9.985 -27.936 -43.320 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -9.123 -29.112 -40.658 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -10.046 -30.084 -41.787 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -8.054 -28.889 -43.390 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -7.218 -29.281 -41.900 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -7.037 -31.226 -43.318 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -8.185 -31.635 -42.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -8.805 -32.158 -44.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -9.980 -31.396 -43.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -9.095 -30.494 -44.633 1.00 0.00 H new ATOM 104 N GLU A 8 -8.226 -25.576 -43.383 1.00 0.00 N ATOM 105 CA GLU A 8 -7.054 -25.123 -44.111 1.00 0.00 C ATOM 106 C GLU A 8 -6.193 -24.223 -43.223 1.00 0.00 C ATOM 107 O GLU A 8 -5.004 -24.480 -43.039 1.00 0.00 O ATOM 108 CB GLU A 8 -7.454 -24.401 -45.399 1.00 0.00 C ATOM 109 CG GLU A 8 -6.228 -23.814 -46.103 1.00 0.00 C ATOM 110 CD GLU A 8 -6.507 -23.585 -47.590 1.00 0.00 C ATOM 111 OE1 GLU A 8 -6.559 -24.597 -48.321 1.00 0.00 O ATOM 112 OE2 GLU A 8 -6.662 -22.402 -47.961 1.00 0.00 O ATOM 0 H GLU A 8 -9.117 -25.281 -43.783 1.00 0.00 H new ATOM 0 HA GLU A 8 -6.464 -25.996 -44.391 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -7.963 -25.096 -46.067 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -8.162 -23.604 -45.169 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -5.950 -22.871 -45.632 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -5.380 -24.489 -45.988 1.00 0.00 H new ATOM 117 N ILE A 9 -6.826 -23.185 -42.696 1.00 0.00 N ATOM 118 CA ILE A 9 -6.133 -22.245 -41.832 1.00 0.00 C ATOM 119 C ILE A 9 -5.345 -23.018 -40.773 1.00 0.00 C ATOM 120 O ILE A 9 -4.295 -22.565 -40.322 1.00 0.00 O ATOM 121 CB ILE A 9 -7.116 -21.228 -41.249 1.00 0.00 C ATOM 122 CG1 ILE A 9 -6.480 -19.840 -41.156 1.00 0.00 C ATOM 123 CG2 ILE A 9 -7.657 -21.702 -39.898 1.00 0.00 C ATOM 124 CD1 ILE A 9 -6.512 -19.129 -42.511 1.00 0.00 C ATOM 0 H ILE A 9 -7.812 -22.974 -42.851 1.00 0.00 H new ATOM 0 HA ILE A 9 -5.411 -21.662 -42.404 1.00 0.00 H new ATOM 0 HB ILE A 9 -7.966 -21.147 -41.927 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -7.011 -19.242 -40.415 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -5.449 -19.931 -40.813 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -8.353 -20.961 -39.505 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -8.173 -22.653 -40.026 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -6.830 -21.829 -39.199 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.054 -18.145 -42.416 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.960 -19.717 -43.244 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -7.545 -19.018 -42.839 1.00 0.00 H new ATOM 135 N ASP A 10 -5.885 -24.171 -40.405 1.00 0.00 N ATOM 136 CA ASP A 10 -5.247 -25.011 -39.407 1.00 0.00 C ATOM 137 C ASP A 10 -4.087 -25.772 -40.052 1.00 0.00 C ATOM 138 O ASP A 10 -4.178 -26.977 -40.277 1.00 0.00 O ATOM 139 CB ASP A 10 -6.229 -26.039 -38.842 1.00 0.00 C ATOM 140 CG ASP A 10 -5.720 -26.820 -37.628 1.00 0.00 C ATOM 141 OD1 ASP A 10 -4.484 -26.971 -37.528 1.00 0.00 O ATOM 142 OD2 ASP A 10 -6.580 -27.249 -36.829 1.00 0.00 O ATOM 0 H ASP A 10 -6.757 -24.543 -40.781 1.00 0.00 H new ATOM 0 HA ASP A 10 -4.895 -24.367 -38.601 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -7.150 -25.526 -38.565 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -6.484 -26.747 -39.630 1.00 0.00 H new ATOM 146 N VAL A 11 -3.021 -25.035 -40.333 1.00 0.00 N ATOM 147 CA VAL A 11 -1.845 -25.624 -40.948 1.00 0.00 C ATOM 148 C VAL A 11 -1.460 -26.896 -40.189 1.00 0.00 C ATOM 149 O VAL A 11 -1.026 -27.876 -40.792 1.00 0.00 O ATOM 150 CB VAL A 11 -0.714 -24.596 -41.006 1.00 0.00 C ATOM 151 CG1 VAL A 11 0.586 -25.236 -41.502 1.00 0.00 C ATOM 152 CG2 VAL A 11 -1.102 -23.400 -41.877 1.00 0.00 C ATOM 0 H VAL A 11 -2.948 -24.035 -40.145 1.00 0.00 H new ATOM 0 HA VAL A 11 -2.057 -25.912 -41.978 1.00 0.00 H new ATOM 0 HB VAL A 11 -0.543 -24.231 -39.993 1.00 0.00 H new ATOM 0 HG11 VAL A 11 1.373 -24.483 -41.534 1.00 0.00 H new ATOM 0 HG12 VAL A 11 0.878 -26.038 -40.824 1.00 0.00 H new ATOM 0 HG13 VAL A 11 0.433 -25.643 -42.502 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -0.280 -22.685 -41.900 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.315 -23.741 -42.890 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -1.988 -22.920 -41.462 1.00 0.00 H new ATOM 162 N ASN A 12 -1.633 -26.838 -38.877 1.00 0.00 N ATOM 163 CA ASN A 12 -1.310 -27.973 -38.029 1.00 0.00 C ATOM 164 C ASN A 12 -2.112 -29.192 -38.487 1.00 0.00 C ATOM 165 O ASN A 12 -1.540 -30.231 -38.809 1.00 0.00 O ATOM 166 CB ASN A 12 -1.669 -27.689 -36.569 1.00 0.00 C ATOM 167 CG ASN A 12 -1.265 -26.269 -36.170 1.00 0.00 C ATOM 168 OD1 ASN A 12 -2.092 -25.406 -35.925 1.00 0.00 O ATOM 169 ND2 ASN A 12 0.050 -26.075 -36.118 1.00 0.00 N ATOM 0 H ASN A 12 -1.993 -26.023 -38.380 1.00 0.00 H new ATOM 0 HA ASN A 12 -0.239 -28.158 -38.107 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -2.741 -27.820 -36.423 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -1.168 -28.409 -35.921 1.00 0.00 H new ATOM 0 HD21 ASN A 12 0.421 -25.160 -35.861 1.00 0.00 H new ATOM 0 HD22 ASN A 12 0.688 -26.841 -36.335 1.00 0.00 H new ATOM 175 N GLY A 13 -3.426 -29.023 -38.500 1.00 0.00 N ATOM 176 CA GLY A 13 -4.315 -30.097 -38.912 1.00 0.00 C ATOM 177 C GLY A 13 -4.864 -30.850 -37.699 1.00 0.00 C ATOM 178 O GLY A 13 -4.887 -32.080 -37.687 1.00 0.00 O ATOM 0 H GLY A 13 -3.897 -28.159 -38.232 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -5.140 -29.687 -39.494 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -3.779 -30.789 -39.562 1.00 0.00 H new ATOM 182 N ASP A 14 -5.292 -30.082 -36.709 1.00 0.00 N ATOM 183 CA ASP A 14 -5.840 -30.661 -35.495 1.00 0.00 C ATOM 184 C ASP A 14 -7.353 -30.436 -35.464 1.00 0.00 C ATOM 185 O ASP A 14 -8.091 -31.231 -34.885 1.00 0.00 O ATOM 186 CB ASP A 14 -5.239 -30.004 -34.251 1.00 0.00 C ATOM 187 CG ASP A 14 -5.276 -28.474 -34.247 1.00 0.00 C ATOM 188 OD1 ASP A 14 -4.338 -27.883 -34.823 1.00 0.00 O ATOM 189 OD2 ASP A 14 -6.241 -27.931 -33.667 1.00 0.00 O ATOM 0 H ASP A 14 -5.270 -29.062 -36.723 1.00 0.00 H new ATOM 0 HA ASP A 14 -5.601 -31.725 -35.492 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -5.772 -30.368 -33.373 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -4.203 -30.328 -34.152 1.00 0.00 H new ATOM 193 N GLY A 15 -7.770 -29.349 -36.096 1.00 0.00 N ATOM 194 CA GLY A 15 -9.182 -29.009 -36.148 1.00 0.00 C ATOM 195 C GLY A 15 -9.535 -27.966 -35.086 1.00 0.00 C ATOM 196 O GLY A 15 -10.592 -28.044 -34.462 1.00 0.00 O ATOM 0 H GLY A 15 -7.155 -28.692 -36.576 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -9.431 -28.624 -37.137 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -9.782 -29.906 -35.995 1.00 0.00 H new ATOM 200 N ALA A 16 -8.629 -27.016 -34.912 1.00 0.00 N ATOM 201 CA ALA A 16 -8.832 -25.958 -33.935 1.00 0.00 C ATOM 202 C ALA A 16 -8.265 -24.647 -34.484 1.00 0.00 C ATOM 203 O ALA A 16 -7.482 -24.654 -35.431 1.00 0.00 O ATOM 204 CB ALA A 16 -8.188 -26.361 -32.607 1.00 0.00 C ATOM 0 H ALA A 16 -7.753 -26.956 -35.430 1.00 0.00 H new ATOM 0 HA ALA A 16 -9.895 -25.805 -33.749 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -8.340 -25.569 -31.874 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -8.645 -27.282 -32.246 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -7.120 -26.520 -32.754 1.00 0.00 H new ATOM 210 N VAL A 17 -8.685 -23.554 -33.864 1.00 0.00 N ATOM 211 CA VAL A 17 -8.230 -22.238 -34.278 1.00 0.00 C ATOM 212 C VAL A 17 -7.589 -21.526 -33.086 1.00 0.00 C ATOM 213 O VAL A 17 -7.762 -21.944 -31.943 1.00 0.00 O ATOM 214 CB VAL A 17 -9.391 -21.451 -34.890 1.00 0.00 C ATOM 215 CG1 VAL A 17 -9.046 -19.965 -35.007 1.00 0.00 C ATOM 216 CG2 VAL A 17 -9.790 -22.030 -36.250 1.00 0.00 C ATOM 0 H VAL A 17 -9.335 -23.553 -33.078 1.00 0.00 H new ATOM 0 HA VAL A 17 -7.469 -22.324 -35.053 1.00 0.00 H new ATOM 0 HB VAL A 17 -10.247 -21.544 -34.222 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -9.888 -19.429 -35.445 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -8.835 -19.562 -34.017 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.169 -19.844 -35.643 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -10.617 -21.452 -36.663 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -8.939 -21.982 -36.930 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.098 -23.068 -36.127 1.00 0.00 H new ATOM 226 N SER A 18 -6.862 -20.462 -33.394 1.00 0.00 N ATOM 227 CA SER A 18 -6.193 -19.688 -32.362 1.00 0.00 C ATOM 228 C SER A 18 -6.266 -18.196 -32.697 1.00 0.00 C ATOM 229 O SER A 18 -6.778 -17.817 -33.749 1.00 0.00 O ATOM 230 CB SER A 18 -4.735 -20.125 -32.202 1.00 0.00 C ATOM 231 OG SER A 18 -3.880 -19.483 -33.144 1.00 0.00 O ATOM 0 H SER A 18 -6.722 -20.118 -34.344 1.00 0.00 H new ATOM 0 HA SER A 18 -6.703 -19.868 -31.416 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.397 -19.897 -31.191 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.665 -21.206 -32.326 1.00 0.00 H new ATOM 0 HG SER A 18 -2.958 -19.787 -33.009 1.00 0.00 H new ATOM 236 N TYR A 19 -5.747 -17.391 -31.782 1.00 0.00 N ATOM 237 CA TYR A 19 -5.747 -15.950 -31.965 1.00 0.00 C ATOM 238 C TYR A 19 -4.948 -15.556 -33.209 1.00 0.00 C ATOM 239 O TYR A 19 -5.358 -14.676 -33.962 1.00 0.00 O ATOM 240 CB TYR A 19 -5.063 -15.367 -30.728 1.00 0.00 C ATOM 241 CG TYR A 19 -3.541 -15.522 -30.726 1.00 0.00 C ATOM 242 CD1 TYR A 19 -2.747 -14.545 -31.292 1.00 0.00 C ATOM 243 CD2 TYR A 19 -2.962 -16.640 -30.160 1.00 0.00 C ATOM 244 CE1 TYR A 19 -1.315 -14.691 -31.290 1.00 0.00 C ATOM 245 CE2 TYR A 19 -1.530 -16.787 -30.159 1.00 0.00 C ATOM 246 CZ TYR A 19 -0.777 -15.805 -30.724 1.00 0.00 C ATOM 247 OH TYR A 19 0.576 -15.943 -30.723 1.00 0.00 O ATOM 0 H TYR A 19 -5.323 -17.710 -30.911 1.00 0.00 H new ATOM 0 HA TYR A 19 -6.764 -15.579 -32.093 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -5.310 -14.308 -30.654 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -5.468 -15.851 -29.840 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -3.200 -13.671 -31.736 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -3.584 -17.405 -29.718 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -0.682 -13.933 -31.728 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -1.064 -17.657 -29.720 1.00 0.00 H new ATOM 0 HH TYR A 19 0.819 -16.785 -30.285 1.00 0.00 H new ATOM 256 N GLU A 20 -3.819 -16.229 -33.385 1.00 0.00 N ATOM 257 CA GLU A 20 -2.958 -15.960 -34.524 1.00 0.00 C ATOM 258 C GLU A 20 -3.556 -16.564 -35.796 1.00 0.00 C ATOM 259 O GLU A 20 -3.402 -16.009 -36.883 1.00 0.00 O ATOM 260 CB GLU A 20 -1.543 -16.490 -34.279 1.00 0.00 C ATOM 261 CG GLU A 20 -0.632 -16.191 -35.470 1.00 0.00 C ATOM 262 CD GLU A 20 0.211 -17.414 -35.837 1.00 0.00 C ATOM 263 OE1 GLU A 20 0.897 -17.925 -34.926 1.00 0.00 O ATOM 264 OE2 GLU A 20 0.149 -17.811 -37.021 1.00 0.00 O ATOM 0 H GLU A 20 -3.481 -16.959 -32.758 1.00 0.00 H new ATOM 0 HA GLU A 20 -2.889 -14.880 -34.655 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -1.131 -16.035 -33.378 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -1.579 -17.565 -34.105 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -1.235 -15.890 -36.327 1.00 0.00 H new ATOM 0 HG3 GLU A 20 0.022 -15.353 -35.230 1.00 0.00 H new ATOM 269 N GLU A 21 -4.226 -17.694 -35.618 1.00 0.00 N ATOM 270 CA GLU A 21 -4.849 -18.379 -36.738 1.00 0.00 C ATOM 271 C GLU A 21 -6.114 -17.638 -37.177 1.00 0.00 C ATOM 272 O GLU A 21 -6.334 -17.430 -38.369 1.00 0.00 O ATOM 273 CB GLU A 21 -5.159 -19.834 -36.386 1.00 0.00 C ATOM 274 CG GLU A 21 -4.293 -20.794 -37.204 1.00 0.00 C ATOM 275 CD GLU A 21 -4.352 -22.211 -36.630 1.00 0.00 C ATOM 276 OE1 GLU A 21 -5.216 -22.433 -35.755 1.00 0.00 O ATOM 277 OE2 GLU A 21 -3.530 -23.039 -37.078 1.00 0.00 O ATOM 0 H GLU A 21 -4.351 -18.152 -34.715 1.00 0.00 H new ATOM 0 HA GLU A 21 -4.147 -18.383 -37.572 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -4.986 -19.999 -35.323 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -6.213 -20.040 -36.573 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -4.633 -20.803 -38.240 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.261 -20.443 -37.210 1.00 0.00 H new ATOM 282 N VAL A 22 -6.913 -17.261 -36.189 1.00 0.00 N ATOM 283 CA VAL A 22 -8.150 -16.548 -36.458 1.00 0.00 C ATOM 284 C VAL A 22 -7.829 -15.213 -37.132 1.00 0.00 C ATOM 285 O VAL A 22 -8.450 -14.850 -38.129 1.00 0.00 O ATOM 286 CB VAL A 22 -8.954 -16.388 -35.166 1.00 0.00 C ATOM 287 CG1 VAL A 22 -8.291 -15.374 -34.231 1.00 0.00 C ATOM 288 CG2 VAL A 22 -10.401 -15.994 -35.466 1.00 0.00 C ATOM 0 H VAL A 22 -6.728 -17.436 -35.201 1.00 0.00 H new ATOM 0 HA VAL A 22 -8.776 -17.116 -37.146 1.00 0.00 H new ATOM 0 HB VAL A 22 -8.969 -17.352 -34.658 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -8.882 -15.278 -33.320 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -7.287 -15.715 -33.978 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -8.231 -14.406 -34.728 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -10.950 -15.887 -34.531 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -10.416 -15.047 -36.006 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -10.870 -16.767 -36.075 1.00 0.00 H new ATOM 298 N LYS A 23 -6.856 -14.517 -36.560 1.00 0.00 N ATOM 299 CA LYS A 23 -6.444 -13.229 -37.092 1.00 0.00 C ATOM 300 C LYS A 23 -5.825 -13.430 -38.477 1.00 0.00 C ATOM 301 O LYS A 23 -6.009 -12.603 -39.369 1.00 0.00 O ATOM 302 CB LYS A 23 -5.524 -12.511 -36.104 1.00 0.00 C ATOM 303 CG LYS A 23 -4.082 -13.006 -36.238 1.00 0.00 C ATOM 304 CD LYS A 23 -3.156 -12.267 -35.270 1.00 0.00 C ATOM 305 CE LYS A 23 -2.431 -11.119 -35.975 1.00 0.00 C ATOM 306 NZ LYS A 23 -0.965 -11.322 -35.922 1.00 0.00 N ATOM 0 H LYS A 23 -6.341 -14.821 -35.734 1.00 0.00 H new ATOM 0 HA LYS A 23 -7.306 -12.575 -37.220 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -5.561 -11.436 -36.282 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -5.876 -12.678 -35.086 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -4.042 -14.077 -36.039 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -3.737 -12.858 -37.261 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -3.735 -11.877 -34.433 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -2.427 -12.963 -34.856 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -2.758 -11.057 -37.013 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -2.690 -10.172 -35.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -0.488 -10.534 -36.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -0.655 -11.359 -34.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -0.721 -12.216 -36.394 1.00 0.00 H new ATOM 316 N ALA A 24 -5.103 -14.532 -38.613 1.00 0.00 N ATOM 317 CA ALA A 24 -4.454 -14.851 -39.873 1.00 0.00 C ATOM 318 C ALA A 24 -5.520 -15.177 -40.921 1.00 0.00 C ATOM 319 O ALA A 24 -5.338 -14.894 -42.105 1.00 0.00 O ATOM 320 CB ALA A 24 -3.470 -16.003 -39.664 1.00 0.00 C ATOM 0 H ALA A 24 -4.953 -15.216 -37.871 1.00 0.00 H new ATOM 0 HA ALA A 24 -3.882 -13.997 -40.238 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -2.983 -16.242 -40.610 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -2.717 -15.710 -38.932 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.007 -16.879 -39.301 1.00 0.00 H new ATOM 326 N PHE A 25 -6.608 -15.769 -40.449 1.00 0.00 N ATOM 327 CA PHE A 25 -7.702 -16.136 -41.331 1.00 0.00 C ATOM 328 C PHE A 25 -8.391 -14.894 -41.898 1.00 0.00 C ATOM 329 O PHE A 25 -8.424 -14.698 -43.112 1.00 0.00 O ATOM 330 CB PHE A 25 -8.709 -16.923 -40.489 1.00 0.00 C ATOM 331 CG PHE A 25 -9.792 -17.624 -41.311 1.00 0.00 C ATOM 332 CD1 PHE A 25 -10.846 -16.914 -41.795 1.00 0.00 C ATOM 333 CD2 PHE A 25 -9.702 -18.959 -41.558 1.00 0.00 C ATOM 334 CE1 PHE A 25 -11.852 -17.565 -42.556 1.00 0.00 C ATOM 335 CE2 PHE A 25 -10.708 -19.609 -42.319 1.00 0.00 C ATOM 336 CZ PHE A 25 -11.762 -18.899 -42.803 1.00 0.00 C ATOM 0 H PHE A 25 -6.755 -16.003 -39.467 1.00 0.00 H new ATOM 0 HA PHE A 25 -7.324 -16.722 -42.169 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -8.173 -17.669 -39.902 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -9.186 -16.244 -39.782 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -10.918 -15.854 -41.600 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -8.865 -19.524 -41.175 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -12.689 -17.000 -42.939 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -10.636 -20.669 -42.514 1.00 0.00 H new ATOM 0 HZ PHE A 25 -12.527 -19.394 -43.383 1.00 0.00 H new ATOM 345 N VAL A 26 -8.922 -14.085 -40.994 1.00 0.00 N ATOM 346 CA VAL A 26 -9.608 -12.866 -41.388 1.00 0.00 C ATOM 347 C VAL A 26 -8.652 -11.989 -42.199 1.00 0.00 C ATOM 348 O VAL A 26 -9.051 -11.380 -43.190 1.00 0.00 O ATOM 349 CB VAL A 26 -10.169 -12.158 -40.154 1.00 0.00 C ATOM 350 CG1 VAL A 26 -9.123 -12.087 -39.040 1.00 0.00 C ATOM 351 CG2 VAL A 26 -10.685 -10.763 -40.510 1.00 0.00 C ATOM 0 H VAL A 26 -8.891 -14.250 -39.988 1.00 0.00 H new ATOM 0 HA VAL A 26 -10.460 -13.096 -42.028 1.00 0.00 H new ATOM 0 HB VAL A 26 -11.012 -12.743 -39.786 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.548 -11.579 -38.174 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -8.823 -13.096 -38.758 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -8.252 -11.535 -39.393 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -11.078 -10.281 -39.615 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -9.868 -10.165 -40.915 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -11.477 -10.847 -41.255 1.00 0.00 H new ATOM 361 N SER A 27 -7.406 -11.952 -41.747 1.00 0.00 N ATOM 362 CA SER A 27 -6.391 -11.158 -42.417 1.00 0.00 C ATOM 363 C SER A 27 -6.542 -11.287 -43.934 1.00 0.00 C ATOM 364 O SER A 27 -6.346 -10.318 -44.666 1.00 0.00 O ATOM 365 CB SER A 27 -4.985 -11.585 -41.987 1.00 0.00 C ATOM 366 OG SER A 27 -3.972 -10.847 -42.664 1.00 0.00 O ATOM 0 H SER A 27 -7.077 -12.459 -40.925 1.00 0.00 H new ATOM 0 HA SER A 27 -6.529 -10.115 -42.131 1.00 0.00 H new ATOM 0 HB2 SER A 27 -4.877 -11.446 -40.911 1.00 0.00 H new ATOM 0 HB3 SER A 27 -4.853 -12.649 -42.186 1.00 0.00 H new ATOM 0 HG SER A 27 -3.090 -11.148 -42.361 1.00 0.00 H new ATOM 371 N LYS A 28 -6.891 -12.492 -44.362 1.00 0.00 N ATOM 372 CA LYS A 28 -7.071 -12.760 -45.778 1.00 0.00 C ATOM 373 C LYS A 28 -7.789 -11.575 -46.429 1.00 0.00 C ATOM 374 O LYS A 28 -7.492 -11.214 -47.567 1.00 0.00 O ATOM 375 CB LYS A 28 -7.783 -14.098 -45.983 1.00 0.00 C ATOM 376 CG LYS A 28 -7.337 -14.761 -47.289 1.00 0.00 C ATOM 377 CD LYS A 28 -8.250 -15.937 -47.646 1.00 0.00 C ATOM 378 CE LYS A 28 -8.160 -16.266 -49.137 1.00 0.00 C ATOM 379 NZ LYS A 28 -7.676 -17.651 -49.334 1.00 0.00 N ATOM 0 H LYS A 28 -7.054 -13.293 -43.752 1.00 0.00 H new ATOM 0 HA LYS A 28 -6.105 -12.860 -46.273 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -7.570 -14.760 -45.144 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -8.862 -13.941 -46.000 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.349 -14.028 -48.096 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -6.309 -15.110 -47.191 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -7.969 -16.812 -47.059 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -9.280 -15.695 -47.385 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.139 -16.147 -49.601 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -7.486 -15.565 -49.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -7.621 -17.858 -50.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -6.733 -17.753 -48.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -8.334 -18.317 -48.881 1.00 0.00 H new ATOM 389 N LYS A 29 -8.720 -11.004 -45.679 1.00 0.00 N ATOM 390 CA LYS A 29 -9.483 -9.868 -46.169 1.00 0.00 C ATOM 391 C LYS A 29 -8.612 -8.612 -46.112 1.00 0.00 C ATOM 392 O LYS A 29 -8.029 -8.209 -47.117 1.00 0.00 O ATOM 393 CB LYS A 29 -10.802 -9.738 -45.404 1.00 0.00 C ATOM 394 CG LYS A 29 -11.678 -8.638 -46.006 1.00 0.00 C ATOM 395 CD LYS A 29 -12.953 -9.225 -46.616 1.00 0.00 C ATOM 396 CE LYS A 29 -14.144 -8.289 -46.403 1.00 0.00 C ATOM 397 NZ LYS A 29 -14.969 -8.753 -45.264 1.00 0.00 N ATOM 0 H LYS A 29 -8.963 -11.307 -44.736 1.00 0.00 H new ATOM 0 HA LYS A 29 -9.760 -10.017 -47.213 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -11.336 -10.688 -45.429 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -10.599 -9.514 -44.357 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -11.940 -7.914 -45.235 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -11.118 -8.100 -46.771 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -12.805 -9.395 -47.683 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -13.163 -10.195 -46.165 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -13.789 -7.276 -46.214 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -14.751 -8.251 -47.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -15.773 -8.107 -45.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -15.323 -9.711 -45.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -14.391 -8.767 -44.400 1.00 0.00 H new ATOM 407 N ARG A 30 -8.550 -8.027 -44.924 1.00 0.00 N ATOM 408 CA ARG A 30 -7.760 -6.824 -44.722 1.00 0.00 C ATOM 409 C ARG A 30 -6.941 -6.937 -43.434 1.00 0.00 C ATOM 410 O ARG A 30 -6.841 -8.015 -42.851 1.00 0.00 O ATOM 411 CB ARG A 30 -8.654 -5.585 -44.642 1.00 0.00 C ATOM 412 CG ARG A 30 -9.619 -5.527 -45.829 1.00 0.00 C ATOM 413 CD ARG A 30 -8.909 -5.027 -47.088 1.00 0.00 C ATOM 414 NE ARG A 30 -9.717 -3.972 -47.739 1.00 0.00 N ATOM 415 CZ ARG A 30 -9.219 -3.053 -48.578 1.00 0.00 C ATOM 416 NH1 ARG A 30 -7.911 -3.054 -48.872 1.00 0.00 N ATOM 417 NH2 ARG A 30 -10.027 -2.134 -49.121 1.00 0.00 N ATOM 0 H ARG A 30 -9.034 -8.364 -44.092 1.00 0.00 H new ATOM 0 HA ARG A 30 -7.090 -6.720 -45.575 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -9.219 -5.599 -43.710 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -8.036 -4.687 -44.627 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -10.037 -6.517 -46.012 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -10.454 -4.868 -45.592 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -7.925 -4.636 -46.830 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -8.751 -5.855 -47.780 1.00 0.00 H new ATOM 0 HE ARG A 30 -10.716 -3.942 -47.536 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -7.296 -3.754 -48.457 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -7.531 -2.355 -49.510 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -11.022 -2.133 -48.896 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -9.648 -1.435 -49.759 1.00 0.00 H new ATOM 428 N ALA A 31 -6.376 -5.809 -43.030 1.00 0.00 N ATOM 429 CA ALA A 31 -5.569 -5.769 -41.823 1.00 0.00 C ATOM 430 C ALA A 31 -5.753 -4.413 -41.137 1.00 0.00 C ATOM 431 O ALA A 31 -4.783 -3.690 -40.914 1.00 0.00 O ATOM 432 CB ALA A 31 -4.107 -6.049 -42.176 1.00 0.00 C ATOM 0 H ALA A 31 -6.461 -4.917 -43.517 1.00 0.00 H new ATOM 0 HA ALA A 31 -5.889 -6.540 -41.122 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -3.502 -6.019 -41.270 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -4.026 -7.035 -42.634 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -3.750 -5.293 -42.876 1.00 0.00 H new ATOM 438 N ILE A 32 -7.003 -4.111 -40.822 1.00 0.00 N ATOM 439 CA ILE A 32 -7.327 -2.856 -40.165 1.00 0.00 C ATOM 440 C ILE A 32 -7.330 -3.063 -38.649 1.00 0.00 C ATOM 441 O ILE A 32 -8.324 -2.780 -37.982 1.00 0.00 O ATOM 442 CB ILE A 32 -8.639 -2.289 -40.711 1.00 0.00 C ATOM 443 CG1 ILE A 32 -9.812 -3.219 -40.394 1.00 0.00 C ATOM 444 CG2 ILE A 32 -8.529 -1.994 -42.208 1.00 0.00 C ATOM 445 CD1 ILE A 32 -11.092 -2.420 -40.136 1.00 0.00 C ATOM 0 H ILE A 32 -7.804 -4.714 -41.009 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.567 -2.106 -40.382 1.00 0.00 H new ATOM 0 HB ILE A 32 -8.836 -1.341 -40.211 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -9.970 -3.907 -41.225 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -9.575 -3.824 -39.519 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -9.475 -1.592 -42.570 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -7.736 -1.265 -42.378 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -8.297 -2.914 -42.744 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -11.910 -3.105 -39.913 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -10.939 -1.751 -39.290 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -11.340 -1.835 -41.021 1.00 0.00 H new ATOM 456 N LYS A 33 -6.206 -3.555 -38.150 1.00 0.00 N ATOM 457 CA LYS A 33 -6.066 -3.804 -36.725 1.00 0.00 C ATOM 458 C LYS A 33 -7.153 -4.781 -36.273 1.00 0.00 C ATOM 459 O LYS A 33 -7.685 -4.657 -35.170 1.00 0.00 O ATOM 460 CB LYS A 33 -6.064 -2.485 -35.948 1.00 0.00 C ATOM 461 CG LYS A 33 -4.648 -2.118 -35.495 1.00 0.00 C ATOM 462 CD LYS A 33 -3.961 -1.217 -36.521 1.00 0.00 C ATOM 463 CE LYS A 33 -2.889 -0.349 -35.857 1.00 0.00 C ATOM 464 NZ LYS A 33 -1.917 0.135 -36.863 1.00 0.00 N ATOM 0 H LYS A 33 -5.384 -3.788 -38.707 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.106 -4.274 -36.513 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.467 -1.689 -36.574 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.717 -2.569 -35.080 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.691 -1.611 -34.531 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.061 -3.025 -35.352 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.507 -1.828 -37.301 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.702 -0.580 -37.005 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -3.357 0.499 -35.358 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -2.371 -0.924 -35.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -1.197 0.722 -36.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -1.457 -0.678 -37.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -2.413 0.701 -37.581 1.00 0.00 H new ATOM 474 N ASN A 34 -7.452 -5.730 -37.148 1.00 0.00 N ATOM 475 CA ASN A 34 -8.466 -6.727 -36.852 1.00 0.00 C ATOM 476 C ASN A 34 -8.063 -7.503 -35.597 1.00 0.00 C ATOM 477 O ASN A 34 -8.820 -7.564 -34.631 1.00 0.00 O ATOM 478 CB ASN A 34 -8.607 -7.727 -38.002 1.00 0.00 C ATOM 479 CG ASN A 34 -7.239 -8.087 -38.586 1.00 0.00 C ATOM 480 OD1 ASN A 34 -6.552 -7.269 -39.176 1.00 0.00 O ATOM 481 ND2 ASN A 34 -6.883 -9.353 -38.389 1.00 0.00 N ATOM 0 H ASN A 34 -7.010 -5.829 -38.062 1.00 0.00 H new ATOM 0 HA ASN A 34 -9.414 -6.210 -36.705 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -9.103 -8.630 -37.645 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -9.239 -7.303 -38.782 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -5.987 -9.691 -38.740 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -7.506 -9.986 -37.887 1.00 0.00 H new ATOM 487 N GLU A 35 -6.870 -8.077 -35.654 1.00 0.00 N ATOM 488 CA GLU A 35 -6.355 -8.846 -34.533 1.00 0.00 C ATOM 489 C GLU A 35 -6.715 -8.164 -33.212 1.00 0.00 C ATOM 490 O GLU A 35 -6.921 -8.833 -32.200 1.00 0.00 O ATOM 491 CB GLU A 35 -4.844 -9.046 -34.653 1.00 0.00 C ATOM 492 CG GLU A 35 -4.124 -7.707 -34.818 1.00 0.00 C ATOM 493 CD GLU A 35 -3.981 -7.338 -36.296 1.00 0.00 C ATOM 494 OE1 GLU A 35 -3.017 -7.837 -36.915 1.00 0.00 O ATOM 495 OE2 GLU A 35 -4.841 -6.566 -36.773 1.00 0.00 O ATOM 0 H GLU A 35 -6.245 -8.025 -36.459 1.00 0.00 H new ATOM 0 HA GLU A 35 -6.820 -9.831 -34.549 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -4.470 -9.557 -33.766 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -4.625 -9.688 -35.506 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -4.678 -6.926 -34.297 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -3.138 -7.761 -34.356 1.00 0.00 H new ATOM 500 N GLN A 36 -6.779 -6.842 -33.263 1.00 0.00 N ATOM 501 CA GLN A 36 -7.110 -6.062 -32.082 1.00 0.00 C ATOM 502 C GLN A 36 -8.535 -6.374 -31.623 1.00 0.00 C ATOM 503 O GLN A 36 -8.740 -6.859 -30.511 1.00 0.00 O ATOM 504 CB GLN A 36 -6.933 -4.566 -32.347 1.00 0.00 C ATOM 505 CG GLN A 36 -6.934 -3.774 -31.038 1.00 0.00 C ATOM 506 CD GLN A 36 -6.626 -2.297 -31.290 1.00 0.00 C ATOM 507 OE1 GLN A 36 -5.493 -1.850 -31.216 1.00 0.00 O ATOM 508 NE2 GLN A 36 -7.695 -1.565 -31.592 1.00 0.00 N ATOM 0 H GLN A 36 -6.607 -6.291 -34.104 1.00 0.00 H new ATOM 0 HA GLN A 36 -6.423 -6.339 -31.282 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -5.997 -4.395 -32.879 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -7.736 -4.210 -32.992 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -7.905 -3.869 -30.552 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -6.194 -4.192 -30.355 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -8.616 -2.002 -31.637 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -7.594 -0.567 -31.778 1.00 0.00 H new ATOM 515 N LEU A 37 -9.483 -6.083 -32.501 1.00 0.00 N ATOM 516 CA LEU A 37 -10.883 -6.327 -32.200 1.00 0.00 C ATOM 517 C LEU A 37 -11.130 -7.835 -32.124 1.00 0.00 C ATOM 518 O LEU A 37 -11.573 -8.344 -31.097 1.00 0.00 O ATOM 519 CB LEU A 37 -11.782 -5.607 -33.207 1.00 0.00 C ATOM 520 CG LEU A 37 -11.471 -4.127 -33.445 1.00 0.00 C ATOM 521 CD1 LEU A 37 -11.443 -3.806 -34.941 1.00 0.00 C ATOM 522 CD2 LEU A 37 -12.453 -3.232 -32.685 1.00 0.00 C ATOM 0 H LEU A 37 -9.309 -5.680 -33.422 1.00 0.00 H new ATOM 0 HA LEU A 37 -11.140 -5.912 -31.225 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.717 -6.130 -34.161 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.814 -5.691 -32.868 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.475 -3.919 -33.053 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -11.220 -2.748 -35.082 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.675 -4.407 -35.428 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -12.414 -4.034 -35.380 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -12.210 -2.186 -32.871 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -13.468 -3.435 -33.025 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -12.380 -3.437 -31.617 1.00 0.00 H new ATOM 533 N LEU A 38 -10.832 -8.507 -33.227 1.00 0.00 N ATOM 534 CA LEU A 38 -11.016 -9.946 -33.299 1.00 0.00 C ATOM 535 C LEU A 38 -10.582 -10.578 -31.975 1.00 0.00 C ATOM 536 O LEU A 38 -11.327 -11.355 -31.380 1.00 0.00 O ATOM 537 CB LEU A 38 -10.292 -10.518 -34.520 1.00 0.00 C ATOM 538 CG LEU A 38 -9.913 -11.999 -34.442 1.00 0.00 C ATOM 539 CD1 LEU A 38 -10.065 -12.676 -35.805 1.00 0.00 C ATOM 540 CD2 LEU A 38 -8.506 -12.174 -33.868 1.00 0.00 C ATOM 0 H LEU A 38 -10.464 -8.081 -34.078 1.00 0.00 H new ATOM 0 HA LEU A 38 -12.069 -10.189 -33.439 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -10.925 -10.371 -35.395 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.383 -9.939 -34.683 1.00 0.00 H new ATOM 0 HG LEU A 38 -10.603 -12.494 -33.759 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -9.789 -13.727 -35.722 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -11.100 -12.597 -36.137 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -9.414 -12.186 -36.529 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -8.261 -13.235 -33.823 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.786 -11.662 -34.507 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -8.467 -11.750 -32.865 1.00 0.00 H new ATOM 551 N GLN A 39 -9.379 -10.221 -31.552 1.00 0.00 N ATOM 552 CA GLN A 39 -8.837 -10.743 -30.308 1.00 0.00 C ATOM 553 C GLN A 39 -9.730 -10.347 -29.132 1.00 0.00 C ATOM 554 O GLN A 39 -10.019 -11.168 -28.263 1.00 0.00 O ATOM 555 CB GLN A 39 -7.400 -10.265 -30.093 1.00 0.00 C ATOM 556 CG GLN A 39 -6.838 -10.795 -28.772 1.00 0.00 C ATOM 557 CD GLN A 39 -6.253 -9.659 -27.929 1.00 0.00 C ATOM 558 OE1 GLN A 39 -5.952 -8.581 -28.417 1.00 0.00 O ATOM 559 NE2 GLN A 39 -6.111 -9.959 -26.642 1.00 0.00 N ATOM 0 H GLN A 39 -8.763 -9.576 -32.048 1.00 0.00 H new ATOM 0 HA GLN A 39 -8.817 -11.831 -30.371 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -6.774 -10.601 -30.920 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -7.371 -9.175 -30.093 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -7.627 -11.298 -28.213 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -6.066 -11.538 -28.973 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -6.383 -10.881 -26.300 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -5.730 -9.268 -25.996 1.00 0.00 H new ATOM 566 N LEU A 40 -10.142 -9.087 -29.142 1.00 0.00 N ATOM 567 CA LEU A 40 -10.996 -8.571 -28.086 1.00 0.00 C ATOM 568 C LEU A 40 -12.149 -9.547 -27.846 1.00 0.00 C ATOM 569 O LEU A 40 -12.391 -9.961 -26.713 1.00 0.00 O ATOM 570 CB LEU A 40 -11.453 -7.148 -28.414 1.00 0.00 C ATOM 571 CG LEU A 40 -11.066 -6.068 -27.401 1.00 0.00 C ATOM 572 CD1 LEU A 40 -10.310 -4.925 -28.080 1.00 0.00 C ATOM 573 CD2 LEU A 40 -12.293 -5.570 -26.635 1.00 0.00 C ATOM 0 H LEU A 40 -9.900 -8.409 -29.865 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.442 -8.496 -27.150 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -11.043 -6.871 -29.385 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -12.538 -7.151 -28.515 1.00 0.00 H new ATOM 0 HG LEU A 40 -10.389 -6.511 -26.671 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -10.047 -4.171 -27.338 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -9.402 -5.313 -28.541 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -10.942 -4.475 -28.846 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -11.990 -4.803 -25.922 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -13.014 -5.149 -27.336 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -12.751 -6.402 -26.100 1.00 0.00 H new ATOM 584 N ILE A 41 -12.830 -9.886 -28.931 1.00 0.00 N ATOM 585 CA ILE A 41 -13.953 -10.806 -28.852 1.00 0.00 C ATOM 586 C ILE A 41 -13.430 -12.222 -28.606 1.00 0.00 C ATOM 587 O ILE A 41 -14.069 -13.013 -27.913 1.00 0.00 O ATOM 588 CB ILE A 41 -14.833 -10.683 -30.097 1.00 0.00 C ATOM 589 CG1 ILE A 41 -16.317 -10.674 -29.721 1.00 0.00 C ATOM 590 CG2 ILE A 41 -14.506 -11.783 -31.110 1.00 0.00 C ATOM 591 CD1 ILE A 41 -16.860 -12.099 -29.596 1.00 0.00 C ATOM 0 H ILE A 41 -12.626 -9.541 -29.869 1.00 0.00 H new ATOM 0 HA ILE A 41 -14.596 -10.553 -28.009 1.00 0.00 H new ATOM 0 HB ILE A 41 -14.616 -9.728 -30.576 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -16.454 -10.145 -28.778 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -16.884 -10.130 -30.477 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -15.146 -11.673 -31.986 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -13.462 -11.702 -31.411 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -14.678 -12.759 -30.656 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -17.916 -12.064 -29.328 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -16.744 -12.617 -30.548 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -16.307 -12.632 -28.823 1.00 0.00 H new ATOM 602 N PHE A 42 -12.272 -12.501 -29.187 1.00 0.00 N ATOM 603 CA PHE A 42 -11.655 -13.808 -29.040 1.00 0.00 C ATOM 604 C PHE A 42 -11.512 -14.183 -27.563 1.00 0.00 C ATOM 605 O PHE A 42 -11.899 -15.279 -27.158 1.00 0.00 O ATOM 606 CB PHE A 42 -10.263 -13.719 -29.668 1.00 0.00 C ATOM 607 CG PHE A 42 -9.643 -15.078 -30.002 1.00 0.00 C ATOM 608 CD1 PHE A 42 -10.169 -15.839 -30.998 1.00 0.00 C ATOM 609 CD2 PHE A 42 -8.566 -15.524 -29.302 1.00 0.00 C ATOM 610 CE1 PHE A 42 -9.594 -17.099 -31.309 1.00 0.00 C ATOM 611 CE2 PHE A 42 -7.991 -16.785 -29.611 1.00 0.00 C ATOM 612 CZ PHE A 42 -8.517 -17.546 -30.608 1.00 0.00 C ATOM 0 H PHE A 42 -11.745 -11.843 -29.761 1.00 0.00 H new ATOM 0 HA PHE A 42 -12.271 -14.567 -29.523 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -10.324 -13.125 -30.580 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -9.601 -13.187 -28.985 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -11.025 -15.485 -31.553 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -8.148 -14.919 -28.511 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -10.011 -17.702 -32.102 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -7.136 -17.140 -29.054 1.00 0.00 H new ATOM 0 HZ PHE A 42 -8.080 -18.505 -30.843 1.00 0.00 H new ATOM 621 N LYS A 43 -10.957 -13.254 -26.800 1.00 0.00 N ATOM 622 CA LYS A 43 -10.760 -13.473 -25.378 1.00 0.00 C ATOM 623 C LYS A 43 -12.107 -13.386 -24.660 1.00 0.00 C ATOM 624 O LYS A 43 -12.413 -14.214 -23.803 1.00 0.00 O ATOM 625 CB LYS A 43 -9.706 -12.510 -24.828 1.00 0.00 C ATOM 626 CG LYS A 43 -9.198 -12.973 -23.462 1.00 0.00 C ATOM 627 CD LYS A 43 -10.116 -12.482 -22.340 1.00 0.00 C ATOM 628 CE LYS A 43 -10.320 -13.568 -21.282 1.00 0.00 C ATOM 629 NZ LYS A 43 -9.928 -13.070 -19.945 1.00 0.00 N ATOM 0 H LYS A 43 -10.637 -12.347 -27.140 1.00 0.00 H new ATOM 0 HA LYS A 43 -10.368 -14.474 -25.198 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -8.872 -12.442 -25.526 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -10.132 -11.510 -24.742 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.142 -14.061 -23.441 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -8.187 -12.598 -23.300 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -9.686 -11.594 -21.876 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -11.080 -12.189 -22.756 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -11.365 -13.879 -21.269 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.729 -14.448 -21.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -10.073 -13.820 -19.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -8.925 -12.795 -19.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -10.510 -12.244 -19.698 1.00 0.00 H new ATOM 639 N SER A 44 -12.877 -12.374 -25.035 1.00 0.00 N ATOM 640 CA SER A 44 -14.186 -12.168 -24.438 1.00 0.00 C ATOM 641 C SER A 44 -14.953 -13.490 -24.390 1.00 0.00 C ATOM 642 O SER A 44 -15.391 -13.920 -23.324 1.00 0.00 O ATOM 643 CB SER A 44 -14.984 -11.118 -25.212 1.00 0.00 C ATOM 644 OG SER A 44 -15.924 -10.442 -24.381 1.00 0.00 O ATOM 0 H SER A 44 -12.619 -11.688 -25.745 1.00 0.00 H new ATOM 0 HA SER A 44 -14.045 -11.801 -23.421 1.00 0.00 H new ATOM 0 HB2 SER A 44 -14.299 -10.392 -25.649 1.00 0.00 H new ATOM 0 HB3 SER A 44 -15.509 -11.598 -26.038 1.00 0.00 H new ATOM 0 HG SER A 44 -16.412 -9.779 -24.912 1.00 0.00 H new ATOM 649 N ILE A 45 -15.094 -14.098 -25.559 1.00 0.00 N ATOM 650 CA ILE A 45 -15.802 -15.363 -25.664 1.00 0.00 C ATOM 651 C ILE A 45 -15.041 -16.435 -24.881 1.00 0.00 C ATOM 652 O ILE A 45 -15.648 -17.252 -24.189 1.00 0.00 O ATOM 653 CB ILE A 45 -16.038 -15.725 -27.131 1.00 0.00 C ATOM 654 CG1 ILE A 45 -17.141 -16.776 -27.267 1.00 0.00 C ATOM 655 CG2 ILE A 45 -14.737 -16.171 -27.802 1.00 0.00 C ATOM 656 CD1 ILE A 45 -18.464 -16.131 -27.684 1.00 0.00 C ATOM 0 H ILE A 45 -14.730 -13.738 -26.441 1.00 0.00 H new ATOM 0 HA ILE A 45 -16.793 -15.283 -25.216 1.00 0.00 H new ATOM 0 HB ILE A 45 -16.380 -14.830 -27.652 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -16.848 -17.523 -28.005 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -17.270 -17.298 -26.319 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -14.933 -16.423 -28.844 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -14.008 -15.362 -27.755 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -14.343 -17.046 -27.285 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -19.231 -16.900 -27.774 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -18.767 -15.402 -26.932 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -18.338 -15.630 -28.644 1.00 0.00 H new ATOM 667 N ASP A 46 -13.724 -16.397 -25.015 1.00 0.00 N ATOM 668 CA ASP A 46 -12.874 -17.355 -24.328 1.00 0.00 C ATOM 669 C ASP A 46 -13.203 -17.344 -22.834 1.00 0.00 C ATOM 670 O ASP A 46 -12.797 -16.433 -22.112 1.00 0.00 O ATOM 671 CB ASP A 46 -11.396 -16.994 -24.489 1.00 0.00 C ATOM 672 CG ASP A 46 -10.476 -18.172 -24.819 1.00 0.00 C ATOM 673 OD1 ASP A 46 -11.017 -19.286 -24.983 1.00 0.00 O ATOM 674 OD2 ASP A 46 -9.252 -17.931 -24.898 1.00 0.00 O ATOM 0 H ASP A 46 -13.224 -15.718 -25.589 1.00 0.00 H new ATOM 0 HA ASP A 46 -13.055 -18.338 -24.762 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -11.303 -16.248 -25.278 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -11.049 -16.528 -23.567 1.00 0.00 H new ATOM 678 N ALA A 47 -13.934 -18.365 -22.414 1.00 0.00 N ATOM 679 CA ALA A 47 -14.323 -18.484 -21.018 1.00 0.00 C ATOM 680 C ALA A 47 -13.229 -19.231 -20.252 1.00 0.00 C ATOM 681 O ALA A 47 -13.030 -18.994 -19.061 1.00 0.00 O ATOM 682 CB ALA A 47 -15.682 -19.180 -20.924 1.00 0.00 C ATOM 0 H ALA A 47 -14.268 -19.118 -23.015 1.00 0.00 H new ATOM 0 HA ALA A 47 -14.431 -17.499 -20.563 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -15.973 -19.269 -19.877 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -16.429 -18.594 -21.460 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -15.613 -20.173 -21.367 1.00 0.00 H new ATOM 688 N ASP A 48 -12.550 -20.117 -20.965 1.00 0.00 N ATOM 689 CA ASP A 48 -11.483 -20.899 -20.366 1.00 0.00 C ATOM 690 C ASP A 48 -10.170 -20.119 -20.458 1.00 0.00 C ATOM 691 O ASP A 48 -9.425 -20.035 -19.484 1.00 0.00 O ATOM 692 CB ASP A 48 -11.296 -22.228 -21.101 1.00 0.00 C ATOM 693 CG ASP A 48 -11.512 -22.166 -22.615 1.00 0.00 C ATOM 694 OD1 ASP A 48 -10.997 -21.204 -23.223 1.00 0.00 O ATOM 695 OD2 ASP A 48 -12.190 -23.082 -23.129 1.00 0.00 O ATOM 0 H ASP A 48 -12.718 -20.311 -21.952 1.00 0.00 H new ATOM 0 HA ASP A 48 -11.751 -21.095 -19.328 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.288 -22.594 -20.908 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -11.987 -22.959 -20.680 1.00 0.00 H new ATOM 699 N GLY A 49 -9.928 -19.568 -21.638 1.00 0.00 N ATOM 700 CA GLY A 49 -8.719 -18.797 -21.870 1.00 0.00 C ATOM 701 C GLY A 49 -7.659 -19.640 -22.583 1.00 0.00 C ATOM 702 O GLY A 49 -6.463 -19.388 -22.444 1.00 0.00 O ATOM 0 H GLY A 49 -10.549 -19.640 -22.444 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -8.954 -17.918 -22.470 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -8.324 -18.438 -20.919 1.00 0.00 H new ATOM 706 N ASN A 50 -8.137 -20.625 -23.331 1.00 0.00 N ATOM 707 CA ASN A 50 -7.245 -21.506 -24.065 1.00 0.00 C ATOM 708 C ASN A 50 -6.701 -20.769 -25.290 1.00 0.00 C ATOM 709 O ASN A 50 -5.878 -21.308 -26.029 1.00 0.00 O ATOM 710 CB ASN A 50 -7.984 -22.754 -24.553 1.00 0.00 C ATOM 711 CG ASN A 50 -9.348 -22.388 -25.143 1.00 0.00 C ATOM 712 OD1 ASN A 50 -9.586 -21.272 -25.576 1.00 0.00 O ATOM 713 ND2 ASN A 50 -10.226 -23.386 -25.135 1.00 0.00 N ATOM 0 H ASN A 50 -9.129 -20.832 -23.444 1.00 0.00 H new ATOM 0 HA ASN A 50 -6.438 -21.803 -23.396 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -7.384 -23.266 -25.305 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -8.117 -23.450 -23.724 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -11.165 -23.242 -25.507 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -9.961 -24.296 -24.757 1.00 0.00 H new ATOM 719 N GLY A 51 -7.183 -19.547 -25.468 1.00 0.00 N ATOM 720 CA GLY A 51 -6.755 -18.731 -26.591 1.00 0.00 C ATOM 721 C GLY A 51 -6.913 -19.487 -27.912 1.00 0.00 C ATOM 722 O GLY A 51 -6.263 -19.158 -28.902 1.00 0.00 O ATOM 0 H GLY A 51 -7.865 -19.103 -24.853 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -7.341 -17.812 -26.622 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -5.713 -18.440 -26.457 1.00 0.00 H new ATOM 726 N GLU A 52 -7.780 -20.489 -27.882 1.00 0.00 N ATOM 727 CA GLU A 52 -8.032 -21.296 -29.065 1.00 0.00 C ATOM 728 C GLU A 52 -9.521 -21.627 -29.174 1.00 0.00 C ATOM 729 O GLU A 52 -10.285 -21.383 -28.241 1.00 0.00 O ATOM 730 CB GLU A 52 -7.186 -22.571 -29.049 1.00 0.00 C ATOM 731 CG GLU A 52 -5.797 -22.315 -29.636 1.00 0.00 C ATOM 732 CD GLU A 52 -4.870 -23.507 -29.390 1.00 0.00 C ATOM 733 OE1 GLU A 52 -4.995 -24.490 -30.153 1.00 0.00 O ATOM 734 OE2 GLU A 52 -4.056 -23.408 -28.447 1.00 0.00 O ATOM 0 H GLU A 52 -8.316 -20.760 -27.058 1.00 0.00 H new ATOM 0 HA GLU A 52 -7.743 -20.719 -29.943 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -7.091 -22.936 -28.026 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -7.688 -23.352 -29.620 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -5.879 -22.129 -30.707 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -5.369 -21.418 -29.188 1.00 0.00 H new ATOM 739 N ILE A 53 -9.890 -22.177 -30.321 1.00 0.00 N ATOM 740 CA ILE A 53 -11.275 -22.544 -30.565 1.00 0.00 C ATOM 741 C ILE A 53 -11.320 -23.770 -31.479 1.00 0.00 C ATOM 742 O ILE A 53 -10.281 -24.339 -31.813 1.00 0.00 O ATOM 743 CB ILE A 53 -12.059 -21.346 -31.103 1.00 0.00 C ATOM 744 CG1 ILE A 53 -11.171 -20.454 -31.973 1.00 0.00 C ATOM 745 CG2 ILE A 53 -12.717 -20.565 -29.965 1.00 0.00 C ATOM 746 CD1 ILE A 53 -11.915 -19.999 -33.230 1.00 0.00 C ATOM 0 H ILE A 53 -9.254 -22.378 -31.093 1.00 0.00 H new ATOM 0 HA ILE A 53 -11.765 -22.824 -29.633 1.00 0.00 H new ATOM 0 HB ILE A 53 -12.860 -21.721 -31.740 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -10.851 -19.583 -31.400 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -10.270 -20.998 -32.256 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -13.268 -19.719 -30.375 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -13.403 -21.217 -29.425 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -11.949 -20.201 -29.282 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -11.261 -19.366 -33.831 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -12.212 -20.871 -33.813 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -12.803 -19.435 -32.943 1.00 0.00 H new ATOM 757 N ASP A 54 -12.534 -24.141 -31.858 1.00 0.00 N ATOM 758 CA ASP A 54 -12.728 -25.290 -32.727 1.00 0.00 C ATOM 759 C ASP A 54 -13.676 -24.909 -33.865 1.00 0.00 C ATOM 760 O ASP A 54 -14.068 -23.749 -33.989 1.00 0.00 O ATOM 761 CB ASP A 54 -13.351 -26.460 -31.964 1.00 0.00 C ATOM 762 CG ASP A 54 -14.878 -26.530 -32.023 1.00 0.00 C ATOM 763 OD1 ASP A 54 -15.380 -27.171 -32.971 1.00 0.00 O ATOM 764 OD2 ASP A 54 -15.510 -25.940 -31.119 1.00 0.00 O ATOM 0 H ASP A 54 -13.393 -23.667 -31.580 1.00 0.00 H new ATOM 0 HA ASP A 54 -11.753 -25.590 -33.112 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -12.944 -27.390 -32.360 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -13.045 -26.397 -30.920 1.00 0.00 H new ATOM 768 N GLN A 55 -14.019 -25.906 -34.667 1.00 0.00 N ATOM 769 CA GLN A 55 -14.914 -25.689 -35.790 1.00 0.00 C ATOM 770 C GLN A 55 -16.215 -25.039 -35.315 1.00 0.00 C ATOM 771 O GLN A 55 -16.613 -23.993 -35.826 1.00 0.00 O ATOM 772 CB GLN A 55 -15.194 -27.000 -36.529 1.00 0.00 C ATOM 773 CG GLN A 55 -13.916 -27.560 -37.156 1.00 0.00 C ATOM 774 CD GLN A 55 -14.185 -28.900 -37.843 1.00 0.00 C ATOM 775 OE1 GLN A 55 -14.613 -28.967 -38.983 1.00 0.00 O ATOM 776 NE2 GLN A 55 -13.912 -29.961 -37.088 1.00 0.00 N ATOM 0 H GLN A 55 -13.693 -26.867 -34.561 1.00 0.00 H new ATOM 0 HA GLN A 55 -14.427 -25.011 -36.491 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -15.613 -27.730 -35.836 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -15.941 -26.832 -37.305 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -13.520 -26.849 -37.881 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -13.155 -27.688 -36.386 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -13.556 -29.835 -36.141 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -14.059 -30.901 -37.457 1.00 0.00 H new ATOM 783 N ASN A 56 -16.841 -25.685 -34.343 1.00 0.00 N ATOM 784 CA ASN A 56 -18.088 -25.182 -33.792 1.00 0.00 C ATOM 785 C ASN A 56 -17.841 -23.820 -33.141 1.00 0.00 C ATOM 786 O ASN A 56 -18.454 -22.824 -33.524 1.00 0.00 O ATOM 787 CB ASN A 56 -18.637 -26.125 -32.721 1.00 0.00 C ATOM 788 CG ASN A 56 -19.172 -27.415 -33.347 1.00 0.00 C ATOM 789 OD1 ASN A 56 -18.548 -28.463 -33.302 1.00 0.00 O ATOM 790 ND2 ASN A 56 -20.359 -27.281 -33.930 1.00 0.00 N ATOM 0 H ASN A 56 -16.508 -26.553 -33.922 1.00 0.00 H new ATOM 0 HA ASN A 56 -18.808 -25.103 -34.606 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -17.851 -26.363 -32.004 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -19.434 -25.628 -32.167 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -20.802 -28.084 -34.376 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -20.827 -26.375 -33.932 1.00 0.00 H new ATOM 796 N GLU A 57 -16.942 -23.819 -32.168 1.00 0.00 N ATOM 797 CA GLU A 57 -16.607 -22.595 -31.460 1.00 0.00 C ATOM 798 C GLU A 57 -16.307 -21.473 -32.454 1.00 0.00 C ATOM 799 O GLU A 57 -16.579 -20.305 -32.179 1.00 0.00 O ATOM 800 CB GLU A 57 -15.427 -22.817 -30.510 1.00 0.00 C ATOM 801 CG GLU A 57 -15.811 -22.473 -29.070 1.00 0.00 C ATOM 802 CD GLU A 57 -14.581 -22.055 -28.261 1.00 0.00 C ATOM 803 OE1 GLU A 57 -13.754 -22.950 -27.984 1.00 0.00 O ATOM 804 OE2 GLU A 57 -14.497 -20.851 -27.936 1.00 0.00 O ATOM 0 H GLU A 57 -16.435 -24.646 -31.853 1.00 0.00 H new ATOM 0 HA GLU A 57 -17.466 -22.300 -30.857 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -15.101 -23.856 -30.565 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -14.583 -22.202 -30.822 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.544 -21.666 -29.068 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -16.284 -23.335 -28.600 1.00 0.00 H new ATOM 809 N PHE A 58 -15.749 -21.865 -33.591 1.00 0.00 N ATOM 810 CA PHE A 58 -15.408 -20.905 -34.627 1.00 0.00 C ATOM 811 C PHE A 58 -16.661 -20.427 -35.365 1.00 0.00 C ATOM 812 O PHE A 58 -16.787 -19.245 -35.681 1.00 0.00 O ATOM 813 CB PHE A 58 -14.491 -21.624 -35.619 1.00 0.00 C ATOM 814 CG PHE A 58 -14.292 -20.875 -36.938 1.00 0.00 C ATOM 815 CD1 PHE A 58 -15.225 -20.974 -37.923 1.00 0.00 C ATOM 816 CD2 PHE A 58 -13.182 -20.112 -37.126 1.00 0.00 C ATOM 817 CE1 PHE A 58 -15.040 -20.279 -39.147 1.00 0.00 C ATOM 818 CE2 PHE A 58 -12.997 -19.417 -38.350 1.00 0.00 C ATOM 819 CZ PHE A 58 -13.930 -19.515 -39.335 1.00 0.00 C ATOM 0 H PHE A 58 -15.525 -22.834 -33.817 1.00 0.00 H new ATOM 0 HA PHE A 58 -14.925 -20.035 -34.183 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -13.519 -21.780 -35.152 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -14.905 -22.610 -35.832 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -16.106 -21.581 -37.774 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -12.441 -20.035 -36.344 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -15.781 -20.357 -39.929 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -12.116 -18.811 -38.499 1.00 0.00 H new ATOM 0 HZ PHE A 58 -13.790 -18.986 -40.266 1.00 0.00 H new ATOM 828 N ALA A 59 -17.556 -21.370 -35.617 1.00 0.00 N ATOM 829 CA ALA A 59 -18.795 -21.061 -36.311 1.00 0.00 C ATOM 830 C ALA A 59 -19.572 -20.012 -35.513 1.00 0.00 C ATOM 831 O ALA A 59 -20.114 -19.068 -36.086 1.00 0.00 O ATOM 832 CB ALA A 59 -19.598 -22.346 -36.521 1.00 0.00 C ATOM 0 H ALA A 59 -17.448 -22.349 -35.353 1.00 0.00 H new ATOM 0 HA ALA A 59 -18.589 -20.642 -37.296 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -20.527 -22.114 -37.041 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -19.014 -23.047 -37.117 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -19.826 -22.795 -35.554 1.00 0.00 H new ATOM 838 N LYS A 60 -19.603 -20.213 -34.204 1.00 0.00 N ATOM 839 CA LYS A 60 -20.305 -19.296 -33.323 1.00 0.00 C ATOM 840 C LYS A 60 -19.535 -17.977 -33.247 1.00 0.00 C ATOM 841 O LYS A 60 -20.064 -16.923 -33.598 1.00 0.00 O ATOM 842 CB LYS A 60 -20.549 -19.946 -31.959 1.00 0.00 C ATOM 843 CG LYS A 60 -22.039 -20.216 -31.738 1.00 0.00 C ATOM 844 CD LYS A 60 -22.247 -21.403 -30.795 1.00 0.00 C ATOM 845 CE LYS A 60 -22.582 -20.926 -29.381 1.00 0.00 C ATOM 846 NZ LYS A 60 -23.170 -22.028 -28.588 1.00 0.00 N ATOM 0 H LYS A 60 -19.153 -20.998 -33.732 1.00 0.00 H new ATOM 0 HA LYS A 60 -21.293 -19.065 -33.722 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -19.993 -20.881 -31.893 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -20.173 -19.295 -31.170 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -22.515 -19.328 -31.322 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -22.521 -20.418 -32.694 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -23.053 -22.034 -31.171 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -21.346 -22.016 -30.772 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -21.680 -20.559 -28.891 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -23.281 -20.091 -29.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -23.392 -21.687 -27.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -24.042 -22.360 -29.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -22.490 -22.813 -28.527 1.00 0.00 H new ATOM 856 N PHE A 61 -18.296 -18.078 -32.787 1.00 0.00 N ATOM 857 CA PHE A 61 -17.447 -16.905 -32.660 1.00 0.00 C ATOM 858 C PHE A 61 -17.605 -15.981 -33.869 1.00 0.00 C ATOM 859 O PHE A 61 -17.634 -14.760 -33.722 1.00 0.00 O ATOM 860 CB PHE A 61 -16.002 -17.404 -32.599 1.00 0.00 C ATOM 861 CG PHE A 61 -14.966 -16.363 -33.026 1.00 0.00 C ATOM 862 CD1 PHE A 61 -14.543 -15.420 -32.140 1.00 0.00 C ATOM 863 CD2 PHE A 61 -14.467 -16.379 -34.291 1.00 0.00 C ATOM 864 CE1 PHE A 61 -13.581 -14.455 -32.536 1.00 0.00 C ATOM 865 CE2 PHE A 61 -13.505 -15.412 -34.687 1.00 0.00 C ATOM 866 CZ PHE A 61 -13.083 -14.470 -33.801 1.00 0.00 C ATOM 0 H PHE A 61 -17.860 -18.954 -32.498 1.00 0.00 H new ATOM 0 HA PHE A 61 -17.721 -16.342 -31.768 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -15.782 -17.724 -31.581 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -15.904 -18.282 -33.238 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -14.940 -15.406 -31.136 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -14.802 -17.127 -34.994 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -13.244 -13.708 -31.832 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -13.109 -15.425 -35.692 1.00 0.00 H new ATOM 0 HZ PHE A 61 -12.352 -13.734 -34.102 1.00 0.00 H new ATOM 875 N TYR A 62 -17.702 -16.599 -35.037 1.00 0.00 N ATOM 876 CA TYR A 62 -17.855 -15.847 -36.271 1.00 0.00 C ATOM 877 C TYR A 62 -18.980 -14.817 -36.148 1.00 0.00 C ATOM 878 O TYR A 62 -18.756 -13.623 -36.346 1.00 0.00 O ATOM 879 CB TYR A 62 -18.232 -16.871 -37.344 1.00 0.00 C ATOM 880 CG TYR A 62 -17.902 -16.427 -38.771 1.00 0.00 C ATOM 881 CD1 TYR A 62 -16.637 -16.635 -39.282 1.00 0.00 C ATOM 882 CD2 TYR A 62 -18.867 -15.818 -39.545 1.00 0.00 C ATOM 883 CE1 TYR A 62 -16.325 -16.218 -40.625 1.00 0.00 C ATOM 884 CE2 TYR A 62 -18.556 -15.401 -40.888 1.00 0.00 C ATOM 885 CZ TYR A 62 -17.300 -15.621 -41.361 1.00 0.00 C ATOM 886 OH TYR A 62 -17.006 -15.227 -42.629 1.00 0.00 O ATOM 0 H TYR A 62 -17.678 -17.612 -35.155 1.00 0.00 H new ATOM 0 HA TYR A 62 -16.938 -15.309 -36.510 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -17.713 -17.807 -37.137 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -19.300 -17.077 -37.276 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -15.881 -17.110 -38.675 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -19.856 -15.654 -39.144 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -15.340 -16.376 -41.038 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -19.303 -14.924 -41.505 1.00 0.00 H new ATOM 0 HH TYR A 62 -17.798 -14.817 -43.036 1.00 0.00 H new ATOM 1028 N LYS A 74 -6.233 -1.062 -19.539 1.00 0.00 N ATOM 1029 CA LYS A 74 -5.751 0.248 -19.137 1.00 0.00 C ATOM 1030 C LYS A 74 -5.816 0.364 -17.612 1.00 0.00 C ATOM 1031 O LYS A 74 -4.805 0.625 -16.963 1.00 0.00 O ATOM 1032 CB LYS A 74 -6.518 1.350 -19.871 1.00 0.00 C ATOM 1033 CG LYS A 74 -6.632 1.037 -21.364 1.00 0.00 C ATOM 1034 CD LYS A 74 -6.743 2.322 -22.187 1.00 0.00 C ATOM 1035 CE LYS A 74 -5.387 3.024 -22.293 1.00 0.00 C ATOM 1036 NZ LYS A 74 -5.570 4.475 -22.514 1.00 0.00 N ATOM 0 HA LYS A 74 -4.707 0.374 -19.423 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.514 1.454 -19.440 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -6.010 2.305 -19.734 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -5.760 0.468 -21.687 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -7.506 0.410 -21.542 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -7.114 2.088 -23.185 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -7.468 2.992 -21.726 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -4.813 2.859 -21.381 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -4.812 2.595 -23.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -4.640 4.936 -22.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -6.099 4.628 -23.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -6.100 4.883 -21.718 1.00 0.00 H new ATOM 1046 N ILE A 75 -7.015 0.165 -17.086 1.00 0.00 N ATOM 1047 CA ILE A 75 -7.225 0.246 -15.651 1.00 0.00 C ATOM 1048 C ILE A 75 -6.412 -0.851 -14.959 1.00 0.00 C ATOM 1049 O ILE A 75 -5.983 -0.684 -13.818 1.00 0.00 O ATOM 1050 CB ILE A 75 -8.720 0.202 -15.324 1.00 0.00 C ATOM 1051 CG1 ILE A 75 -9.016 0.932 -14.013 1.00 0.00 C ATOM 1052 CG2 ILE A 75 -9.234 -1.240 -15.306 1.00 0.00 C ATOM 1053 CD1 ILE A 75 -10.207 1.880 -14.171 1.00 0.00 C ATOM 0 H ILE A 75 -7.851 -0.052 -17.628 1.00 0.00 H new ATOM 0 HA ILE A 75 -6.866 1.201 -15.267 1.00 0.00 H new ATOM 0 HB ILE A 75 -9.259 0.727 -16.113 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -9.226 0.206 -13.228 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -8.137 1.495 -13.700 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -10.298 -1.244 -15.071 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -9.076 -1.695 -16.284 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -8.694 -1.809 -14.550 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -10.397 2.387 -13.225 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -9.984 2.619 -14.940 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -11.090 1.310 -14.461 1.00 0.00 H new ATOM 1064 N GLY A 76 -6.224 -1.946 -15.678 1.00 0.00 N ATOM 1065 CA GLY A 76 -5.470 -3.070 -15.148 1.00 0.00 C ATOM 1066 C GLY A 76 -3.985 -2.722 -15.021 1.00 0.00 C ATOM 1067 O GLY A 76 -3.419 -2.794 -13.932 1.00 0.00 O ATOM 0 H GLY A 76 -6.581 -2.080 -16.624 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.866 -3.351 -14.172 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -5.590 -3.934 -15.802 1.00 0.00 H new ATOM 1071 N LEU A 77 -3.397 -2.354 -16.150 1.00 0.00 N ATOM 1072 CA LEU A 77 -1.991 -1.995 -16.178 1.00 0.00 C ATOM 1073 C LEU A 77 -1.745 -0.834 -15.212 1.00 0.00 C ATOM 1074 O LEU A 77 -0.657 -0.708 -14.651 1.00 0.00 O ATOM 1075 CB LEU A 77 -1.540 -1.708 -17.612 1.00 0.00 C ATOM 1076 CG LEU A 77 -0.238 -2.381 -18.053 1.00 0.00 C ATOM 1077 CD1 LEU A 77 -0.368 -3.905 -18.010 1.00 0.00 C ATOM 1078 CD2 LEU A 77 0.198 -1.881 -19.432 1.00 0.00 C ATOM 0 H LEU A 77 -3.870 -2.297 -17.052 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.378 -2.829 -15.836 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.334 -2.019 -18.291 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.426 -0.630 -17.727 1.00 0.00 H new ATOM 0 HG LEU A 77 0.546 -2.104 -17.348 1.00 0.00 H new ATOM 0 HD11 LEU A 77 0.570 -4.359 -18.328 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.598 -4.222 -16.993 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.169 -4.221 -18.679 1.00 0.00 H new ATOM 0 HD21 LEU A 77 1.126 -2.375 -19.722 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -0.578 -2.108 -20.163 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.357 -0.803 -19.395 1.00 0.00 H new ATOM 1089 N LYS A 78 -2.774 -0.015 -15.047 1.00 0.00 N ATOM 1090 CA LYS A 78 -2.684 1.131 -14.159 1.00 0.00 C ATOM 1091 C LYS A 78 -2.679 0.646 -12.707 1.00 0.00 C ATOM 1092 O LYS A 78 -1.862 1.093 -11.903 1.00 0.00 O ATOM 1093 CB LYS A 78 -3.793 2.137 -14.468 1.00 0.00 C ATOM 1094 CG LYS A 78 -3.848 3.237 -13.405 1.00 0.00 C ATOM 1095 CD LYS A 78 -3.767 4.624 -14.047 1.00 0.00 C ATOM 1096 CE LYS A 78 -4.439 5.676 -13.164 1.00 0.00 C ATOM 1097 NZ LYS A 78 -5.246 6.604 -13.987 1.00 0.00 N ATOM 0 H LYS A 78 -3.674 -0.123 -15.514 1.00 0.00 H new ATOM 0 HA LYS A 78 -1.748 1.666 -14.320 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -3.622 2.582 -15.448 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -4.753 1.623 -14.514 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -4.772 3.150 -12.834 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -3.025 3.109 -12.701 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -2.723 4.893 -14.209 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -4.247 4.605 -15.025 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -5.075 5.187 -12.426 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -3.682 6.234 -12.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -5.696 7.312 -13.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -4.630 7.083 -14.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -5.980 6.070 -14.494 1.00 0.00 H new ATOM 1107 N VAL A 79 -3.600 -0.260 -12.417 1.00 0.00 N ATOM 1108 CA VAL A 79 -3.712 -0.810 -11.076 1.00 0.00 C ATOM 1109 C VAL A 79 -2.366 -1.407 -10.661 1.00 0.00 C ATOM 1110 O VAL A 79 -1.857 -1.108 -9.581 1.00 0.00 O ATOM 1111 CB VAL A 79 -4.858 -1.823 -11.021 1.00 0.00 C ATOM 1112 CG1 VAL A 79 -4.698 -2.767 -9.827 1.00 0.00 C ATOM 1113 CG2 VAL A 79 -6.213 -1.114 -10.981 1.00 0.00 C ATOM 0 H VAL A 79 -4.276 -0.627 -13.087 1.00 0.00 H new ATOM 0 HA VAL A 79 -3.954 -0.025 -10.359 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.820 -2.423 -11.930 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -5.525 -3.477 -9.811 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.756 -3.309 -9.915 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -4.698 -2.188 -8.903 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -7.011 -1.856 -10.942 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.265 -0.478 -10.097 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -6.330 -0.502 -11.875 1.00 0.00 H new ATOM 1123 N LEU A 80 -1.828 -2.240 -11.538 1.00 0.00 N ATOM 1124 CA LEU A 80 -0.551 -2.882 -11.276 1.00 0.00 C ATOM 1125 C LEU A 80 0.514 -1.810 -11.035 1.00 0.00 C ATOM 1126 O LEU A 80 1.205 -1.834 -10.018 1.00 0.00 O ATOM 1127 CB LEU A 80 -0.198 -3.856 -12.402 1.00 0.00 C ATOM 1128 CG LEU A 80 -0.133 -5.334 -12.013 1.00 0.00 C ATOM 1129 CD1 LEU A 80 -1.308 -6.111 -12.612 1.00 0.00 C ATOM 1130 CD2 LEU A 80 1.215 -5.944 -12.404 1.00 0.00 C ATOM 0 H LEU A 80 -2.253 -2.486 -12.432 1.00 0.00 H new ATOM 0 HA LEU A 80 -0.608 -3.486 -10.370 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.934 -3.742 -13.198 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.768 -3.567 -12.817 1.00 0.00 H new ATOM 0 HG LEU A 80 -0.218 -5.406 -10.929 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -1.238 -7.159 -12.320 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -2.245 -5.694 -12.244 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -1.279 -6.034 -13.699 1.00 0.00 H new ATOM 0 HD21 LEU A 80 1.236 -6.995 -12.117 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.354 -5.860 -13.482 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.017 -5.412 -11.892 1.00 0.00 H new ATOM 1141 N TYR A 81 0.612 -0.894 -11.988 1.00 0.00 N ATOM 1142 CA TYR A 81 1.581 0.184 -11.893 1.00 0.00 C ATOM 1143 C TYR A 81 1.496 0.878 -10.531 1.00 0.00 C ATOM 1144 O TYR A 81 2.511 1.309 -9.986 1.00 0.00 O ATOM 1145 CB TYR A 81 1.206 1.186 -12.987 1.00 0.00 C ATOM 1146 CG TYR A 81 2.174 1.205 -14.171 1.00 0.00 C ATOM 1147 CD1 TYR A 81 2.541 0.023 -14.782 1.00 0.00 C ATOM 1148 CD2 TYR A 81 2.682 2.404 -14.628 1.00 0.00 C ATOM 1149 CE1 TYR A 81 3.452 0.042 -15.897 1.00 0.00 C ATOM 1150 CE2 TYR A 81 3.593 2.423 -15.742 1.00 0.00 C ATOM 1151 CZ TYR A 81 3.934 1.241 -16.321 1.00 0.00 C ATOM 1152 OH TYR A 81 4.794 1.259 -17.374 1.00 0.00 O ATOM 0 H TYR A 81 0.036 -0.877 -12.830 1.00 0.00 H new ATOM 0 HA TYR A 81 2.595 -0.199 -12.007 1.00 0.00 H new ATOM 0 HB2 TYR A 81 0.206 0.952 -13.352 1.00 0.00 H new ATOM 0 HB3 TYR A 81 1.161 2.184 -12.551 1.00 0.00 H new ATOM 0 HD1 TYR A 81 2.145 -0.916 -14.424 1.00 0.00 H new ATOM 0 HD2 TYR A 81 2.396 3.329 -14.149 1.00 0.00 H new ATOM 0 HE1 TYR A 81 3.746 -0.875 -16.386 1.00 0.00 H new ATOM 0 HE2 TYR A 81 3.997 3.355 -16.110 1.00 0.00 H new ATOM 0 HH TYR A 81 4.320 1.556 -18.179 1.00 0.00 H new ATOM 1161 N LYS A 82 0.276 0.965 -10.022 1.00 0.00 N ATOM 1162 CA LYS A 82 0.045 1.599 -8.735 1.00 0.00 C ATOM 1163 C LYS A 82 0.564 0.687 -7.622 1.00 0.00 C ATOM 1164 O LYS A 82 1.128 1.162 -6.637 1.00 0.00 O ATOM 1165 CB LYS A 82 -1.429 1.979 -8.581 1.00 0.00 C ATOM 1166 CG LYS A 82 -1.720 2.489 -7.169 1.00 0.00 C ATOM 1167 CD LYS A 82 -1.818 1.329 -6.176 1.00 0.00 C ATOM 1168 CE LYS A 82 -2.893 1.598 -5.122 1.00 0.00 C ATOM 1169 NZ LYS A 82 -2.987 0.464 -4.175 1.00 0.00 N ATOM 0 H LYS A 82 -0.563 0.607 -10.478 1.00 0.00 H new ATOM 0 HA LYS A 82 0.600 2.535 -8.667 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -1.688 2.747 -9.309 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -2.056 1.113 -8.795 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -0.932 3.174 -6.856 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -2.652 3.053 -7.167 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -2.050 0.407 -6.710 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -0.855 1.181 -5.688 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -2.658 2.514 -4.580 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -3.856 1.754 -5.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -3.722 0.663 -3.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -3.233 -0.403 -4.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -2.072 0.333 -3.698 1.00 0.00 H new ATOM 1179 N LEU A 83 0.356 -0.608 -7.815 1.00 0.00 N ATOM 1180 CA LEU A 83 0.796 -1.590 -6.839 1.00 0.00 C ATOM 1181 C LEU A 83 2.325 -1.586 -6.771 1.00 0.00 C ATOM 1182 O LEU A 83 2.902 -1.723 -5.694 1.00 0.00 O ATOM 1183 CB LEU A 83 0.198 -2.963 -7.154 1.00 0.00 C ATOM 1184 CG LEU A 83 0.579 -4.096 -6.200 1.00 0.00 C ATOM 1185 CD1 LEU A 83 -0.629 -4.980 -5.887 1.00 0.00 C ATOM 1186 CD2 LEU A 83 1.755 -4.906 -6.752 1.00 0.00 C ATOM 0 H LEU A 83 -0.111 -0.999 -8.633 1.00 0.00 H new ATOM 0 HA LEU A 83 0.432 -1.329 -5.845 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -0.888 -2.871 -7.161 1.00 0.00 H new ATOM 0 HB3 LEU A 83 0.501 -3.246 -8.162 1.00 0.00 H new ATOM 0 HG LEU A 83 0.906 -3.654 -5.259 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -0.330 -5.777 -5.207 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.409 -4.378 -5.420 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -1.010 -5.415 -6.811 1.00 0.00 H new ATOM 0 HD21 LEU A 83 2.006 -5.705 -6.054 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.480 -5.337 -7.714 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.618 -4.253 -6.881 1.00 0.00 H new ATOM 1197 N MET A 84 2.937 -1.429 -7.936 1.00 0.00 N ATOM 1198 CA MET A 84 4.387 -1.406 -8.022 1.00 0.00 C ATOM 1199 C MET A 84 4.968 -0.267 -7.180 1.00 0.00 C ATOM 1200 O MET A 84 5.841 -0.494 -6.344 1.00 0.00 O ATOM 1201 CB MET A 84 4.809 -1.226 -9.482 1.00 0.00 C ATOM 1202 CG MET A 84 4.311 -2.389 -10.343 1.00 0.00 C ATOM 1203 SD MET A 84 5.685 -3.413 -10.840 1.00 0.00 S ATOM 1204 CE MET A 84 4.967 -5.030 -10.608 1.00 0.00 C ATOM 0 H MET A 84 2.455 -1.317 -8.828 1.00 0.00 H new ATOM 0 HA MET A 84 4.770 -2.351 -7.637 1.00 0.00 H new ATOM 0 HB2 MET A 84 4.410 -0.287 -9.867 1.00 0.00 H new ATOM 0 HB3 MET A 84 5.895 -1.161 -9.545 1.00 0.00 H new ATOM 0 HG2 MET A 84 3.588 -2.983 -9.784 1.00 0.00 H new ATOM 0 HG3 MET A 84 3.795 -2.006 -11.224 1.00 0.00 H new ATOM 0 HE1 MET A 84 5.343 -5.708 -11.374 1.00 0.00 H new ATOM 0 HE2 MET A 84 5.237 -5.410 -9.623 1.00 0.00 H new ATOM 0 HE3 MET A 84 3.882 -4.961 -10.685 1.00 0.00 H new ATOM 1212 N ASP A 85 4.459 0.930 -7.429 1.00 0.00 N ATOM 1213 CA ASP A 85 4.916 2.103 -6.703 1.00 0.00 C ATOM 1214 C ASP A 85 4.532 1.968 -5.229 1.00 0.00 C ATOM 1215 O ASP A 85 3.418 2.314 -4.839 1.00 0.00 O ATOM 1216 CB ASP A 85 4.264 3.375 -7.247 1.00 0.00 C ATOM 1217 CG ASP A 85 4.535 4.641 -6.431 1.00 0.00 C ATOM 1218 OD1 ASP A 85 5.698 4.803 -6.006 1.00 0.00 O ATOM 1219 OD2 ASP A 85 3.571 5.415 -6.248 1.00 0.00 O ATOM 0 H ASP A 85 3.735 1.113 -8.123 1.00 0.00 H new ATOM 0 HA ASP A 85 5.997 2.172 -6.821 1.00 0.00 H new ATOM 0 HB2 ASP A 85 4.613 3.537 -8.267 1.00 0.00 H new ATOM 0 HB3 ASP A 85 3.187 3.219 -7.300 1.00 0.00 H new ATOM 1223 N VAL A 86 5.476 1.462 -4.448 1.00 0.00 N ATOM 1224 CA VAL A 86 5.250 1.276 -3.025 1.00 0.00 C ATOM 1225 C VAL A 86 5.716 2.524 -2.272 1.00 0.00 C ATOM 1226 O VAL A 86 5.527 2.629 -1.061 1.00 0.00 O ATOM 1227 CB VAL A 86 5.940 -0.003 -2.548 1.00 0.00 C ATOM 1228 CG1 VAL A 86 7.452 0.076 -2.769 1.00 0.00 C ATOM 1229 CG2 VAL A 86 5.614 -0.287 -1.081 1.00 0.00 C ATOM 0 H VAL A 86 6.399 1.175 -4.774 1.00 0.00 H new ATOM 0 HA VAL A 86 4.187 1.151 -2.820 1.00 0.00 H new ATOM 0 HB VAL A 86 5.557 -0.833 -3.142 1.00 0.00 H new ATOM 0 HG11 VAL A 86 7.919 -0.846 -2.422 1.00 0.00 H new ATOM 0 HG12 VAL A 86 7.658 0.209 -3.831 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.857 0.921 -2.212 1.00 0.00 H new ATOM 0 HG21 VAL A 86 6.117 -1.202 -0.767 1.00 0.00 H new ATOM 0 HG22 VAL A 86 5.955 0.545 -0.465 1.00 0.00 H new ATOM 0 HG23 VAL A 86 4.537 -0.407 -0.964 1.00 0.00 H new ATOM 1239 N ASP A 87 6.318 3.437 -3.020 1.00 0.00 N ATOM 1240 CA ASP A 87 6.813 4.673 -2.439 1.00 0.00 C ATOM 1241 C ASP A 87 5.628 5.570 -2.073 1.00 0.00 C ATOM 1242 O ASP A 87 5.716 6.373 -1.144 1.00 0.00 O ATOM 1243 CB ASP A 87 7.694 5.435 -3.431 1.00 0.00 C ATOM 1244 CG ASP A 87 8.642 4.563 -4.255 1.00 0.00 C ATOM 1245 OD1 ASP A 87 8.139 3.900 -5.188 1.00 0.00 O ATOM 1246 OD2 ASP A 87 9.851 4.578 -3.934 1.00 0.00 O ATOM 0 H ASP A 87 6.474 3.345 -4.024 1.00 0.00 H new ATOM 0 HA ASP A 87 7.401 4.419 -1.557 1.00 0.00 H new ATOM 0 HB2 ASP A 87 7.050 5.991 -4.113 1.00 0.00 H new ATOM 0 HB3 ASP A 87 8.284 6.168 -2.881 1.00 0.00 H new ATOM 1250 N GLY A 88 4.548 5.404 -2.821 1.00 0.00 N ATOM 1251 CA GLY A 88 3.347 6.188 -2.587 1.00 0.00 C ATOM 1252 C GLY A 88 3.497 7.602 -3.153 1.00 0.00 C ATOM 1253 O GLY A 88 3.704 8.555 -2.404 1.00 0.00 O ATOM 0 H GLY A 88 4.479 4.738 -3.590 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.491 5.696 -3.049 1.00 0.00 H new ATOM 0 HA3 GLY A 88 3.145 6.240 -1.517 1.00 0.00 H new ATOM 1257 N ASP A 89 3.386 7.691 -4.470 1.00 0.00 N ATOM 1258 CA ASP A 89 3.506 8.972 -5.146 1.00 0.00 C ATOM 1259 C ASP A 89 2.551 9.006 -6.340 1.00 0.00 C ATOM 1260 O ASP A 89 1.814 9.974 -6.522 1.00 0.00 O ATOM 1261 CB ASP A 89 4.928 9.187 -5.672 1.00 0.00 C ATOM 1262 CG ASP A 89 5.594 7.941 -6.260 1.00 0.00 C ATOM 1263 OD1 ASP A 89 5.073 7.448 -7.282 1.00 0.00 O ATOM 1264 OD2 ASP A 89 6.610 7.511 -5.673 1.00 0.00 O ATOM 0 H ASP A 89 3.214 6.897 -5.087 1.00 0.00 H new ATOM 0 HA ASP A 89 3.264 9.755 -4.428 1.00 0.00 H new ATOM 0 HB2 ASP A 89 4.903 9.963 -6.437 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.548 9.562 -4.858 1.00 0.00 H new ATOM 1268 N GLY A 90 2.594 7.937 -7.122 1.00 0.00 N ATOM 1269 CA GLY A 90 1.741 7.833 -8.293 1.00 0.00 C ATOM 1270 C GLY A 90 2.507 8.205 -9.565 1.00 0.00 C ATOM 1271 O GLY A 90 1.935 8.772 -10.494 1.00 0.00 O ATOM 0 H GLY A 90 3.206 7.136 -6.967 1.00 0.00 H new ATOM 0 HA2 GLY A 90 1.358 6.816 -8.379 1.00 0.00 H new ATOM 0 HA3 GLY A 90 0.879 8.490 -8.178 1.00 0.00 H new ATOM 1275 N LYS A 91 3.789 7.871 -9.564 1.00 0.00 N ATOM 1276 CA LYS A 91 4.640 8.164 -10.705 1.00 0.00 C ATOM 1277 C LYS A 91 5.775 7.141 -10.765 1.00 0.00 C ATOM 1278 O LYS A 91 6.151 6.564 -9.745 1.00 0.00 O ATOM 1279 CB LYS A 91 5.122 9.615 -10.656 1.00 0.00 C ATOM 1280 CG LYS A 91 6.382 9.746 -9.799 1.00 0.00 C ATOM 1281 CD LYS A 91 7.611 10.019 -10.668 1.00 0.00 C ATOM 1282 CE LYS A 91 8.046 11.481 -10.557 1.00 0.00 C ATOM 1283 NZ LYS A 91 8.933 11.671 -9.387 1.00 0.00 N ATOM 0 H LYS A 91 4.259 7.400 -8.791 1.00 0.00 H new ATOM 0 HA LYS A 91 4.077 8.071 -11.634 1.00 0.00 H new ATOM 0 HB2 LYS A 91 5.327 9.968 -11.667 1.00 0.00 H new ATOM 0 HB3 LYS A 91 4.334 10.250 -10.250 1.00 0.00 H new ATOM 0 HG2 LYS A 91 6.254 10.555 -9.080 1.00 0.00 H new ATOM 0 HG3 LYS A 91 6.533 8.831 -9.226 1.00 0.00 H new ATOM 0 HD2 LYS A 91 8.430 9.368 -10.361 1.00 0.00 H new ATOM 0 HD3 LYS A 91 7.386 9.781 -11.708 1.00 0.00 H new ATOM 0 HE2 LYS A 91 8.565 11.782 -11.467 1.00 0.00 H new ATOM 0 HE3 LYS A 91 7.169 12.121 -10.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 9.219 12.669 -9.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 8.426 11.403 -8.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 9.778 11.074 -9.492 1.00 0.00 H new ATOM 1293 N LEU A 92 6.289 6.945 -11.970 1.00 0.00 N ATOM 1294 CA LEU A 92 7.374 6.001 -12.177 1.00 0.00 C ATOM 1295 C LEU A 92 8.449 6.648 -13.053 1.00 0.00 C ATOM 1296 O LEU A 92 8.178 7.619 -13.757 1.00 0.00 O ATOM 1297 CB LEU A 92 6.838 4.682 -12.736 1.00 0.00 C ATOM 1298 CG LEU A 92 5.782 3.973 -11.887 1.00 0.00 C ATOM 1299 CD1 LEU A 92 4.426 4.671 -12.003 1.00 0.00 C ATOM 1300 CD2 LEU A 92 5.695 2.488 -12.246 1.00 0.00 C ATOM 0 H LEU A 92 5.974 7.424 -12.814 1.00 0.00 H new ATOM 0 HA LEU A 92 7.845 5.750 -11.227 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.414 4.874 -13.722 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.678 4.002 -12.877 1.00 0.00 H new ATOM 0 HG LEU A 92 6.087 4.034 -10.842 1.00 0.00 H new ATOM 0 HD11 LEU A 92 3.693 4.147 -11.390 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.517 5.701 -11.659 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.101 4.663 -13.043 1.00 0.00 H new ATOM 0 HD21 LEU A 92 4.937 2.008 -11.627 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.426 2.383 -13.297 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.660 2.014 -12.070 1.00 0.00 H new ATOM 1311 N THR A 93 9.646 6.086 -12.979 1.00 0.00 N ATOM 1312 CA THR A 93 10.762 6.596 -13.756 1.00 0.00 C ATOM 1313 C THR A 93 11.299 5.513 -14.694 1.00 0.00 C ATOM 1314 O THR A 93 10.756 4.411 -14.750 1.00 0.00 O ATOM 1315 CB THR A 93 11.813 7.129 -12.780 1.00 0.00 C ATOM 1316 OG1 THR A 93 12.536 5.969 -12.379 1.00 0.00 O ATOM 1317 CG2 THR A 93 11.195 7.650 -11.481 1.00 0.00 C ATOM 0 H THR A 93 9.867 5.282 -12.392 1.00 0.00 H new ATOM 0 HA THR A 93 10.451 7.417 -14.402 1.00 0.00 H new ATOM 0 HB THR A 93 12.380 7.928 -13.259 1.00 0.00 H new ATOM 0 HG1 THR A 93 13.239 6.224 -11.746 1.00 0.00 H new ATOM 0 HG21 THR A 93 11.984 8.016 -10.824 1.00 0.00 H new ATOM 0 HG22 THR A 93 10.504 8.463 -11.707 1.00 0.00 H new ATOM 0 HG23 THR A 93 10.656 6.843 -10.985 1.00 0.00 H new ATOM 1325 N LYS A 94 12.358 5.865 -15.408 1.00 0.00 N ATOM 1326 CA LYS A 94 12.974 4.937 -16.341 1.00 0.00 C ATOM 1327 C LYS A 94 13.727 3.860 -15.559 1.00 0.00 C ATOM 1328 O LYS A 94 13.855 2.727 -16.022 1.00 0.00 O ATOM 1329 CB LYS A 94 13.846 5.689 -17.348 1.00 0.00 C ATOM 1330 CG LYS A 94 14.746 4.725 -18.122 1.00 0.00 C ATOM 1331 CD LYS A 94 16.172 4.738 -17.564 1.00 0.00 C ATOM 1332 CE LYS A 94 17.115 5.511 -18.488 1.00 0.00 C ATOM 1333 NZ LYS A 94 18.526 5.258 -18.119 1.00 0.00 N ATOM 0 H LYS A 94 12.805 6.780 -15.359 1.00 0.00 H new ATOM 0 HA LYS A 94 12.212 4.429 -16.932 1.00 0.00 H new ATOM 0 HB2 LYS A 94 13.212 6.238 -18.044 1.00 0.00 H new ATOM 0 HB3 LYS A 94 14.459 6.424 -16.826 1.00 0.00 H new ATOM 0 HG2 LYS A 94 14.338 3.716 -18.065 1.00 0.00 H new ATOM 0 HG3 LYS A 94 14.761 5.003 -19.176 1.00 0.00 H new ATOM 0 HD2 LYS A 94 16.175 5.192 -16.573 1.00 0.00 H new ATOM 0 HD3 LYS A 94 16.530 3.715 -17.447 1.00 0.00 H new ATOM 0 HE2 LYS A 94 16.945 5.213 -19.523 1.00 0.00 H new ATOM 0 HE3 LYS A 94 16.902 6.578 -18.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 19.152 5.790 -18.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 18.689 5.564 -17.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 18.730 4.242 -18.203 1.00 0.00 H new ATOM 1343 N GLU A 95 14.207 4.250 -14.387 1.00 0.00 N ATOM 1344 CA GLU A 95 14.944 3.331 -13.536 1.00 0.00 C ATOM 1345 C GLU A 95 13.987 2.344 -12.865 1.00 0.00 C ATOM 1346 O GLU A 95 14.281 1.153 -12.774 1.00 0.00 O ATOM 1347 CB GLU A 95 15.768 4.090 -12.494 1.00 0.00 C ATOM 1348 CG GLU A 95 17.224 3.621 -12.498 1.00 0.00 C ATOM 1349 CD GLU A 95 17.982 4.177 -11.292 1.00 0.00 C ATOM 1350 OE1 GLU A 95 17.948 3.504 -10.240 1.00 0.00 O ATOM 1351 OE2 GLU A 95 18.580 5.264 -11.449 1.00 0.00 O ATOM 0 H GLU A 95 14.100 5.190 -14.007 1.00 0.00 H new ATOM 0 HA GLU A 95 15.638 2.767 -14.159 1.00 0.00 H new ATOM 0 HB2 GLU A 95 15.726 5.159 -12.701 1.00 0.00 H new ATOM 0 HB3 GLU A 95 15.337 3.940 -11.504 1.00 0.00 H new ATOM 0 HG2 GLU A 95 17.259 2.532 -12.483 1.00 0.00 H new ATOM 0 HG3 GLU A 95 17.711 3.943 -13.418 1.00 0.00 H new ATOM 1356 N GLU A 96 12.860 2.876 -12.413 1.00 0.00 N ATOM 1357 CA GLU A 96 11.858 2.057 -11.754 1.00 0.00 C ATOM 1358 C GLU A 96 11.142 1.170 -12.775 1.00 0.00 C ATOM 1359 O GLU A 96 10.762 0.041 -12.465 1.00 0.00 O ATOM 1360 CB GLU A 96 10.859 2.925 -10.985 1.00 0.00 C ATOM 1361 CG GLU A 96 11.583 3.912 -10.068 1.00 0.00 C ATOM 1362 CD GLU A 96 10.651 4.423 -8.968 1.00 0.00 C ATOM 1363 OE1 GLU A 96 9.896 3.584 -8.429 1.00 0.00 O ATOM 1364 OE2 GLU A 96 10.714 5.640 -8.691 1.00 0.00 O ATOM 0 H GLU A 96 12.619 3.864 -12.491 1.00 0.00 H new ATOM 0 HA GLU A 96 12.361 1.413 -11.032 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.229 3.471 -11.688 1.00 0.00 H new ATOM 0 HB3 GLU A 96 10.200 2.290 -10.393 1.00 0.00 H new ATOM 0 HG2 GLU A 96 12.450 3.428 -9.619 1.00 0.00 H new ATOM 0 HG3 GLU A 96 11.955 4.752 -10.654 1.00 0.00 H new ATOM 1369 N VAL A 97 10.978 1.714 -13.972 1.00 0.00 N ATOM 1370 CA VAL A 97 10.314 0.986 -15.040 1.00 0.00 C ATOM 1371 C VAL A 97 11.246 -0.110 -15.560 1.00 0.00 C ATOM 1372 O VAL A 97 10.827 -1.253 -15.737 1.00 0.00 O ATOM 1373 CB VAL A 97 9.864 1.957 -16.133 1.00 0.00 C ATOM 1374 CG1 VAL A 97 9.820 1.265 -17.497 1.00 0.00 C ATOM 1375 CG2 VAL A 97 8.510 2.580 -15.790 1.00 0.00 C ATOM 0 H VAL A 97 11.293 2.650 -14.226 1.00 0.00 H new ATOM 0 HA VAL A 97 9.414 0.497 -14.668 1.00 0.00 H new ATOM 0 HB VAL A 97 10.598 2.761 -16.189 1.00 0.00 H new ATOM 0 HG11 VAL A 97 9.497 1.977 -18.256 1.00 0.00 H new ATOM 0 HG12 VAL A 97 10.813 0.892 -17.748 1.00 0.00 H new ATOM 0 HG13 VAL A 97 9.118 0.432 -17.460 1.00 0.00 H new ATOM 0 HG21 VAL A 97 8.214 3.266 -16.583 1.00 0.00 H new ATOM 0 HG22 VAL A 97 7.762 1.793 -15.692 1.00 0.00 H new ATOM 0 HG23 VAL A 97 8.588 3.125 -14.849 1.00 0.00 H new ATOM 1385 N THR A 98 12.492 0.276 -15.791 1.00 0.00 N ATOM 1386 CA THR A 98 13.486 -0.659 -16.287 1.00 0.00 C ATOM 1387 C THR A 98 13.840 -1.684 -15.208 1.00 0.00 C ATOM 1388 O THR A 98 14.174 -2.827 -15.517 1.00 0.00 O ATOM 1389 CB THR A 98 14.690 0.147 -16.777 1.00 0.00 C ATOM 1390 OG1 THR A 98 14.212 0.814 -17.942 1.00 0.00 O ATOM 1391 CG2 THR A 98 15.820 -0.744 -17.297 1.00 0.00 C ATOM 0 H THR A 98 12.836 1.225 -15.643 1.00 0.00 H new ATOM 0 HA THR A 98 13.100 -1.238 -17.126 1.00 0.00 H new ATOM 0 HB THR A 98 15.063 0.770 -15.964 1.00 0.00 H new ATOM 0 HG1 THR A 98 13.840 1.685 -17.691 1.00 0.00 H new ATOM 0 HG21 THR A 98 16.649 -0.121 -17.632 1.00 0.00 H new ATOM 0 HG22 THR A 98 16.161 -1.403 -16.498 1.00 0.00 H new ATOM 0 HG23 THR A 98 15.456 -1.343 -18.132 1.00 0.00 H new ATOM 1399 N SER A 99 13.754 -1.238 -13.963 1.00 0.00 N ATOM 1400 CA SER A 99 14.060 -2.103 -12.836 1.00 0.00 C ATOM 1401 C SER A 99 12.949 -3.138 -12.653 1.00 0.00 C ATOM 1402 O SER A 99 13.224 -4.313 -12.415 1.00 0.00 O ATOM 1403 CB SER A 99 14.245 -1.290 -11.553 1.00 0.00 C ATOM 1404 OG SER A 99 14.413 -2.126 -10.411 1.00 0.00 O ATOM 0 H SER A 99 13.477 -0.289 -13.710 1.00 0.00 H new ATOM 0 HA SER A 99 14.997 -2.619 -13.046 1.00 0.00 H new ATOM 0 HB2 SER A 99 15.114 -0.640 -11.658 1.00 0.00 H new ATOM 0 HB3 SER A 99 13.380 -0.644 -11.405 1.00 0.00 H new ATOM 0 HG SER A 99 14.530 -1.570 -9.613 1.00 0.00 H new ATOM 1409 N PHE A 100 11.718 -2.664 -12.771 1.00 0.00 N ATOM 1410 CA PHE A 100 10.564 -3.535 -12.621 1.00 0.00 C ATOM 1411 C PHE A 100 10.495 -4.556 -13.759 1.00 0.00 C ATOM 1412 O PHE A 100 10.179 -5.723 -13.532 1.00 0.00 O ATOM 1413 CB PHE A 100 9.321 -2.643 -12.678 1.00 0.00 C ATOM 1414 CG PHE A 100 8.959 -1.994 -11.341 1.00 0.00 C ATOM 1415 CD1 PHE A 100 9.017 -2.722 -10.194 1.00 0.00 C ATOM 1416 CD2 PHE A 100 8.579 -0.689 -11.300 1.00 0.00 C ATOM 1417 CE1 PHE A 100 8.681 -2.120 -8.953 1.00 0.00 C ATOM 1418 CE2 PHE A 100 8.245 -0.086 -10.059 1.00 0.00 C ATOM 1419 CZ PHE A 100 8.302 -0.814 -8.911 1.00 0.00 C ATOM 0 H PHE A 100 11.494 -1.689 -12.969 1.00 0.00 H new ATOM 0 HA PHE A 100 10.631 -4.082 -11.681 1.00 0.00 H new ATOM 0 HB2 PHE A 100 9.482 -1.860 -13.419 1.00 0.00 H new ATOM 0 HB3 PHE A 100 8.475 -3.238 -13.022 1.00 0.00 H new ATOM 0 HD1 PHE A 100 9.319 -3.758 -10.227 1.00 0.00 H new ATOM 0 HD2 PHE A 100 8.531 -0.111 -12.211 1.00 0.00 H new ATOM 0 HE1 PHE A 100 8.726 -2.699 -8.042 1.00 0.00 H new ATOM 0 HE2 PHE A 100 7.946 0.951 -10.026 1.00 0.00 H new ATOM 0 HZ PHE A 100 8.047 -0.356 -7.967 1.00 0.00 H new ATOM 1428 N PHE A 101 10.799 -4.081 -14.957 1.00 0.00 N ATOM 1429 CA PHE A 101 10.777 -4.938 -16.130 1.00 0.00 C ATOM 1430 C PHE A 101 11.983 -5.880 -16.144 1.00 0.00 C ATOM 1431 O PHE A 101 11.903 -6.988 -16.670 1.00 0.00 O ATOM 1432 CB PHE A 101 10.846 -4.022 -17.354 1.00 0.00 C ATOM 1433 CG PHE A 101 9.484 -3.726 -17.987 1.00 0.00 C ATOM 1434 CD1 PHE A 101 8.774 -4.727 -18.571 1.00 0.00 C ATOM 1435 CD2 PHE A 101 8.986 -2.460 -17.965 1.00 0.00 C ATOM 1436 CE1 PHE A 101 7.510 -4.452 -19.158 1.00 0.00 C ATOM 1437 CE2 PHE A 101 7.722 -2.186 -18.552 1.00 0.00 C ATOM 1438 CZ PHE A 101 7.011 -3.187 -19.136 1.00 0.00 C ATOM 0 H PHE A 101 11.062 -3.113 -15.141 1.00 0.00 H new ATOM 0 HA PHE A 101 9.874 -5.548 -16.128 1.00 0.00 H new ATOM 0 HB2 PHE A 101 11.313 -3.081 -17.065 1.00 0.00 H new ATOM 0 HB3 PHE A 101 11.491 -4.481 -18.103 1.00 0.00 H new ATOM 0 HD1 PHE A 101 9.171 -5.731 -18.589 1.00 0.00 H new ATOM 0 HD2 PHE A 101 9.551 -1.665 -17.502 1.00 0.00 H new ATOM 0 HE1 PHE A 101 6.945 -5.247 -19.622 1.00 0.00 H new ATOM 0 HE2 PHE A 101 7.325 -1.182 -18.534 1.00 0.00 H new ATOM 0 HZ PHE A 101 6.050 -2.978 -19.582 1.00 0.00 H new ATOM 1447 N LYS A 102 13.072 -5.403 -15.559 1.00 0.00 N ATOM 1448 CA LYS A 102 14.293 -6.189 -15.497 1.00 0.00 C ATOM 1449 C LYS A 102 13.948 -7.629 -15.113 1.00 0.00 C ATOM 1450 O LYS A 102 14.541 -8.573 -15.632 1.00 0.00 O ATOM 1451 CB LYS A 102 15.308 -5.529 -14.561 1.00 0.00 C ATOM 1452 CG LYS A 102 16.711 -5.555 -15.170 1.00 0.00 C ATOM 1453 CD LYS A 102 17.274 -4.139 -15.311 1.00 0.00 C ATOM 1454 CE LYS A 102 18.759 -4.100 -14.944 1.00 0.00 C ATOM 1455 NZ LYS A 102 19.389 -2.867 -15.467 1.00 0.00 N ATOM 0 H LYS A 102 13.134 -4.483 -15.124 1.00 0.00 H new ATOM 0 HA LYS A 102 14.773 -6.226 -16.475 1.00 0.00 H new ATOM 0 HB2 LYS A 102 15.011 -4.499 -14.365 1.00 0.00 H new ATOM 0 HB3 LYS A 102 15.314 -6.047 -13.602 1.00 0.00 H new ATOM 0 HG2 LYS A 102 17.373 -6.152 -14.543 1.00 0.00 H new ATOM 0 HG3 LYS A 102 16.678 -6.036 -16.148 1.00 0.00 H new ATOM 0 HD2 LYS A 102 17.140 -3.791 -16.335 1.00 0.00 H new ATOM 0 HD3 LYS A 102 16.719 -3.457 -14.667 1.00 0.00 H new ATOM 0 HE2 LYS A 102 18.873 -4.143 -13.861 1.00 0.00 H new ATOM 0 HE3 LYS A 102 19.264 -4.975 -15.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 20.397 -2.856 -15.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 19.296 -2.842 -16.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 18.918 -2.036 -15.057 1.00 0.00 H new ATOM 1465 N LYS A 103 12.990 -7.753 -14.206 1.00 0.00 N ATOM 1466 CA LYS A 103 12.559 -9.063 -13.746 1.00 0.00 C ATOM 1467 C LYS A 103 12.341 -9.976 -14.954 1.00 0.00 C ATOM 1468 O LYS A 103 12.696 -11.153 -14.919 1.00 0.00 O ATOM 1469 CB LYS A 103 11.332 -8.936 -12.842 1.00 0.00 C ATOM 1470 CG LYS A 103 11.737 -8.918 -11.367 1.00 0.00 C ATOM 1471 CD LYS A 103 11.311 -7.612 -10.696 1.00 0.00 C ATOM 1472 CE LYS A 103 12.422 -7.067 -9.797 1.00 0.00 C ATOM 1473 NZ LYS A 103 12.228 -7.518 -8.401 1.00 0.00 N ATOM 0 H LYS A 103 12.500 -6.968 -13.777 1.00 0.00 H new ATOM 0 HA LYS A 103 13.332 -9.525 -13.132 1.00 0.00 H new ATOM 0 HB2 LYS A 103 10.790 -8.022 -13.085 1.00 0.00 H new ATOM 0 HB3 LYS A 103 10.653 -9.768 -13.026 1.00 0.00 H new ATOM 0 HG2 LYS A 103 11.280 -9.762 -10.851 1.00 0.00 H new ATOM 0 HG3 LYS A 103 12.817 -9.039 -11.282 1.00 0.00 H new ATOM 0 HD2 LYS A 103 11.060 -6.873 -11.457 1.00 0.00 H new ATOM 0 HD3 LYS A 103 10.410 -7.780 -10.105 1.00 0.00 H new ATOM 0 HE2 LYS A 103 13.392 -7.404 -10.163 1.00 0.00 H new ATOM 0 HE3 LYS A 103 12.428 -5.978 -9.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 12.991 -7.139 -7.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 11.311 -7.175 -8.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 12.245 -8.557 -8.366 1.00 0.00 H new ATOM 1483 N HIS A 104 11.759 -9.399 -15.995 1.00 0.00 N ATOM 1484 CA HIS A 104 11.489 -10.146 -17.211 1.00 0.00 C ATOM 1485 C HIS A 104 12.784 -10.311 -18.010 1.00 0.00 C ATOM 1486 O HIS A 104 13.147 -11.424 -18.388 1.00 0.00 O ATOM 1487 CB HIS A 104 10.374 -9.482 -18.021 1.00 0.00 C ATOM 1488 CG HIS A 104 9.173 -10.369 -18.254 1.00 0.00 C ATOM 1489 ND1 HIS A 104 7.971 -9.888 -18.742 1.00 0.00 N ATOM 1490 CD2 HIS A 104 9.005 -11.709 -18.063 1.00 0.00 C ATOM 1491 CE1 HIS A 104 7.123 -10.903 -18.835 1.00 0.00 C ATOM 1492 NE2 HIS A 104 7.765 -12.029 -18.413 1.00 0.00 N ATOM 0 H HIS A 104 11.467 -8.422 -16.021 1.00 0.00 H new ATOM 0 HA HIS A 104 11.129 -11.143 -16.957 1.00 0.00 H new ATOM 0 HB2 HIS A 104 10.051 -8.579 -17.503 1.00 0.00 H new ATOM 0 HB3 HIS A 104 10.775 -9.170 -18.985 1.00 0.00 H new ATOM 0 HD2 HIS A 104 9.753 -12.393 -17.691 1.00 0.00 H new ATOM 0 HE1 HIS A 104 6.102 -10.847 -19.184 1.00 0.00 H new ATOM 0 HE2 HIS A 104 7.359 -12.964 -18.373 1.00 0.00 H new ATOM 1499 N GLY A 105 13.444 -9.187 -18.244 1.00 0.00 N ATOM 1500 CA GLY A 105 14.691 -9.192 -18.990 1.00 0.00 C ATOM 1501 C GLY A 105 14.622 -8.231 -20.180 1.00 0.00 C ATOM 1502 O GLY A 105 15.636 -7.955 -20.819 1.00 0.00 O ATOM 0 H GLY A 105 13.139 -8.266 -17.930 1.00 0.00 H new ATOM 0 HA2 GLY A 105 15.513 -8.905 -18.334 1.00 0.00 H new ATOM 0 HA3 GLY A 105 14.903 -10.201 -19.344 1.00 0.00 H new ATOM 1506 N ILE A 106 13.416 -7.749 -20.440 1.00 0.00 N ATOM 1507 CA ILE A 106 13.201 -6.825 -21.540 1.00 0.00 C ATOM 1508 C ILE A 106 13.871 -5.487 -21.217 1.00 0.00 C ATOM 1509 O ILE A 106 13.203 -4.532 -20.827 1.00 0.00 O ATOM 1510 CB ILE A 106 11.709 -6.704 -21.856 1.00 0.00 C ATOM 1511 CG1 ILE A 106 11.481 -5.865 -23.115 1.00 0.00 C ATOM 1512 CG2 ILE A 106 10.937 -6.156 -20.654 1.00 0.00 C ATOM 1513 CD1 ILE A 106 10.029 -5.967 -23.586 1.00 0.00 C ATOM 0 H ILE A 106 12.577 -7.981 -19.908 1.00 0.00 H new ATOM 0 HA ILE A 106 13.666 -7.204 -22.450 1.00 0.00 H new ATOM 0 HB ILE A 106 11.321 -7.702 -22.060 1.00 0.00 H new ATOM 0 HG12 ILE A 106 11.729 -4.823 -22.912 1.00 0.00 H new ATOM 0 HG13 ILE A 106 12.149 -6.203 -23.907 1.00 0.00 H new ATOM 0 HG21 ILE A 106 9.879 -6.080 -20.905 1.00 0.00 H new ATOM 0 HG22 ILE A 106 11.061 -6.828 -19.805 1.00 0.00 H new ATOM 0 HG23 ILE A 106 11.320 -5.169 -20.395 1.00 0.00 H new ATOM 0 HD11 ILE A 106 9.894 -5.361 -24.482 1.00 0.00 H new ATOM 0 HD12 ILE A 106 9.792 -7.007 -23.811 1.00 0.00 H new ATOM 0 HD13 ILE A 106 9.365 -5.606 -22.800 1.00 0.00 H new ATOM 1524 N GLU A 107 15.185 -5.463 -21.390 1.00 0.00 N ATOM 1525 CA GLU A 107 15.953 -4.260 -21.121 1.00 0.00 C ATOM 1526 C GLU A 107 15.651 -3.191 -22.173 1.00 0.00 C ATOM 1527 O GLU A 107 15.699 -1.997 -21.883 1.00 0.00 O ATOM 1528 CB GLU A 107 17.450 -4.566 -21.064 1.00 0.00 C ATOM 1529 CG GLU A 107 17.961 -4.548 -19.622 1.00 0.00 C ATOM 1530 CD GLU A 107 19.361 -5.159 -19.527 1.00 0.00 C ATOM 1531 OE1 GLU A 107 19.500 -6.327 -19.950 1.00 0.00 O ATOM 1532 OE2 GLU A 107 20.260 -4.443 -19.034 1.00 0.00 O ATOM 0 H GLU A 107 15.737 -6.258 -21.713 1.00 0.00 H new ATOM 0 HA GLU A 107 15.658 -3.875 -20.145 1.00 0.00 H new ATOM 0 HB2 GLU A 107 17.642 -5.542 -21.509 1.00 0.00 H new ATOM 0 HB3 GLU A 107 17.997 -3.833 -21.656 1.00 0.00 H new ATOM 0 HG2 GLU A 107 17.982 -3.523 -19.253 1.00 0.00 H new ATOM 0 HG3 GLU A 107 17.274 -5.103 -18.982 1.00 0.00 H new ATOM 1537 N LYS A 108 15.346 -3.658 -23.375 1.00 0.00 N ATOM 1538 CA LYS A 108 15.037 -2.758 -24.472 1.00 0.00 C ATOM 1539 C LYS A 108 14.009 -1.726 -24.004 1.00 0.00 C ATOM 1540 O LYS A 108 14.004 -0.591 -24.479 1.00 0.00 O ATOM 1541 CB LYS A 108 14.597 -3.549 -25.706 1.00 0.00 C ATOM 1542 CG LYS A 108 13.256 -4.244 -25.461 1.00 0.00 C ATOM 1543 CD LYS A 108 13.216 -5.613 -26.144 1.00 0.00 C ATOM 1544 CE LYS A 108 14.028 -6.643 -25.357 1.00 0.00 C ATOM 1545 NZ LYS A 108 15.110 -7.201 -26.197 1.00 0.00 N ATOM 0 H LYS A 108 15.306 -4.649 -23.613 1.00 0.00 H new ATOM 0 HA LYS A 108 15.927 -2.207 -24.776 1.00 0.00 H new ATOM 0 HB2 LYS A 108 14.513 -2.879 -26.561 1.00 0.00 H new ATOM 0 HB3 LYS A 108 15.355 -4.291 -25.956 1.00 0.00 H new ATOM 0 HG2 LYS A 108 13.094 -4.363 -24.390 1.00 0.00 H new ATOM 0 HG3 LYS A 108 12.445 -3.621 -25.839 1.00 0.00 H new ATOM 0 HD2 LYS A 108 12.183 -5.949 -26.232 1.00 0.00 H new ATOM 0 HD3 LYS A 108 13.611 -5.530 -27.156 1.00 0.00 H new ATOM 0 HE2 LYS A 108 14.453 -6.177 -24.468 1.00 0.00 H new ATOM 0 HE3 LYS A 108 13.375 -7.446 -25.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 15.651 -7.898 -25.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 14.698 -7.663 -27.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 15.743 -6.434 -26.502 1.00 0.00 H new ATOM 1555 N VAL A 109 13.165 -2.155 -23.077 1.00 0.00 N ATOM 1556 CA VAL A 109 12.135 -1.282 -22.541 1.00 0.00 C ATOM 1557 C VAL A 109 12.773 0.034 -22.090 1.00 0.00 C ATOM 1558 O VAL A 109 12.131 1.083 -22.127 1.00 0.00 O ATOM 1559 CB VAL A 109 11.379 -1.995 -21.418 1.00 0.00 C ATOM 1560 CG1 VAL A 109 12.153 -1.919 -20.100 1.00 0.00 C ATOM 1561 CG2 VAL A 109 9.968 -1.424 -21.259 1.00 0.00 C ATOM 0 H VAL A 109 13.174 -3.096 -22.684 1.00 0.00 H new ATOM 0 HA VAL A 109 11.400 -1.041 -23.309 1.00 0.00 H new ATOM 0 HB VAL A 109 11.287 -3.046 -21.691 1.00 0.00 H new ATOM 0 HG11 VAL A 109 11.593 -2.434 -19.319 1.00 0.00 H new ATOM 0 HG12 VAL A 109 13.126 -2.394 -20.222 1.00 0.00 H new ATOM 0 HG13 VAL A 109 12.292 -0.875 -19.819 1.00 0.00 H new ATOM 0 HG21 VAL A 109 9.452 -1.948 -20.454 1.00 0.00 H new ATOM 0 HG22 VAL A 109 10.030 -0.362 -21.020 1.00 0.00 H new ATOM 0 HG23 VAL A 109 9.416 -1.554 -22.190 1.00 0.00 H new ATOM 1571 N ALA A 110 14.028 -0.065 -21.675 1.00 0.00 N ATOM 1572 CA ALA A 110 14.760 1.104 -21.218 1.00 0.00 C ATOM 1573 C ALA A 110 14.985 2.052 -22.397 1.00 0.00 C ATOM 1574 O ALA A 110 14.896 3.270 -22.246 1.00 0.00 O ATOM 1575 CB ALA A 110 16.070 0.663 -20.565 1.00 0.00 C ATOM 0 H ALA A 110 14.556 -0.937 -21.646 1.00 0.00 H new ATOM 0 HA ALA A 110 14.188 1.645 -20.465 1.00 0.00 H new ATOM 0 HB1 ALA A 110 16.619 1.540 -20.222 1.00 0.00 H new ATOM 0 HB2 ALA A 110 15.853 0.016 -19.715 1.00 0.00 H new ATOM 0 HB3 ALA A 110 16.673 0.118 -21.291 1.00 0.00 H new ATOM 1581 N GLU A 111 15.275 1.458 -23.546 1.00 0.00 N ATOM 1582 CA GLU A 111 15.514 2.234 -24.750 1.00 0.00 C ATOM 1583 C GLU A 111 14.217 2.889 -25.226 1.00 0.00 C ATOM 1584 O GLU A 111 14.221 4.040 -25.661 1.00 0.00 O ATOM 1585 CB GLU A 111 16.126 1.365 -25.851 1.00 0.00 C ATOM 1586 CG GLU A 111 16.957 2.209 -26.818 1.00 0.00 C ATOM 1587 CD GLU A 111 18.251 2.687 -26.157 1.00 0.00 C ATOM 1588 OE1 GLU A 111 19.030 1.806 -25.731 1.00 0.00 O ATOM 1589 OE2 GLU A 111 18.433 3.922 -26.090 1.00 0.00 O ATOM 0 H GLU A 111 15.350 0.448 -23.668 1.00 0.00 H new ATOM 0 HA GLU A 111 16.230 3.021 -24.514 1.00 0.00 H new ATOM 0 HB2 GLU A 111 16.754 0.594 -25.404 1.00 0.00 H new ATOM 0 HB3 GLU A 111 15.334 0.853 -26.398 1.00 0.00 H new ATOM 0 HG2 GLU A 111 17.193 1.623 -27.706 1.00 0.00 H new ATOM 0 HG3 GLU A 111 16.374 3.069 -27.149 1.00 0.00 H new ATOM 1594 N GLN A 112 13.136 2.129 -25.129 1.00 0.00 N ATOM 1595 CA GLN A 112 11.834 2.621 -25.545 1.00 0.00 C ATOM 1596 C GLN A 112 11.396 3.784 -24.653 1.00 0.00 C ATOM 1597 O GLN A 112 10.858 4.776 -25.140 1.00 0.00 O ATOM 1598 CB GLN A 112 10.794 1.498 -25.533 1.00 0.00 C ATOM 1599 CG GLN A 112 9.499 1.943 -26.214 1.00 0.00 C ATOM 1600 CD GLN A 112 9.618 1.842 -27.736 1.00 0.00 C ATOM 1601 OE1 GLN A 112 10.374 2.557 -28.374 1.00 0.00 O ATOM 1602 NE2 GLN A 112 8.831 0.919 -28.280 1.00 0.00 N ATOM 0 H GLN A 112 13.135 1.175 -24.768 1.00 0.00 H new ATOM 0 HA GLN A 112 11.915 2.985 -26.569 1.00 0.00 H new ATOM 0 HB2 GLN A 112 11.194 0.621 -26.042 1.00 0.00 H new ATOM 0 HB3 GLN A 112 10.585 1.202 -24.505 1.00 0.00 H new ATOM 0 HG2 GLN A 112 8.671 1.324 -25.868 1.00 0.00 H new ATOM 0 HG3 GLN A 112 9.269 2.970 -25.931 1.00 0.00 H new ATOM 0 HE21 GLN A 112 8.222 0.355 -27.688 1.00 0.00 H new ATOM 0 HE22 GLN A 112 8.836 0.775 -29.290 1.00 0.00 H new ATOM 1609 N VAL A 113 11.645 3.622 -23.360 1.00 0.00 N ATOM 1610 CA VAL A 113 11.283 4.646 -22.396 1.00 0.00 C ATOM 1611 C VAL A 113 12.162 5.880 -22.614 1.00 0.00 C ATOM 1612 O VAL A 113 11.703 7.009 -22.454 1.00 0.00 O ATOM 1613 CB VAL A 113 11.381 4.085 -20.976 1.00 0.00 C ATOM 1614 CG1 VAL A 113 11.527 5.212 -19.950 1.00 0.00 C ATOM 1615 CG2 VAL A 113 10.176 3.201 -20.651 1.00 0.00 C ATOM 0 H VAL A 113 12.093 2.798 -22.959 1.00 0.00 H new ATOM 0 HA VAL A 113 10.248 4.956 -22.538 1.00 0.00 H new ATOM 0 HB VAL A 113 12.276 3.465 -20.922 1.00 0.00 H new ATOM 0 HG11 VAL A 113 11.595 4.786 -18.949 1.00 0.00 H new ATOM 0 HG12 VAL A 113 12.431 5.783 -20.163 1.00 0.00 H new ATOM 0 HG13 VAL A 113 10.660 5.870 -20.007 1.00 0.00 H new ATOM 0 HG21 VAL A 113 10.271 2.815 -19.636 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.261 3.788 -20.732 1.00 0.00 H new ATOM 0 HG23 VAL A 113 10.136 2.368 -21.353 1.00 0.00 H new ATOM 1625 N MET A 114 13.410 5.621 -22.975 1.00 0.00 N ATOM 1626 CA MET A 114 14.358 6.695 -23.216 1.00 0.00 C ATOM 1627 C MET A 114 13.944 7.529 -24.430 1.00 0.00 C ATOM 1628 O MET A 114 14.070 8.753 -24.421 1.00 0.00 O ATOM 1629 CB MET A 114 15.750 6.106 -23.451 1.00 0.00 C ATOM 1630 CG MET A 114 16.837 7.030 -22.897 1.00 0.00 C ATOM 1631 SD MET A 114 18.285 6.960 -23.939 1.00 0.00 S ATOM 1632 CE MET A 114 18.093 8.490 -24.837 1.00 0.00 C ATOM 0 H MET A 114 13.787 4.682 -23.106 1.00 0.00 H new ATOM 0 HA MET A 114 14.373 7.344 -22.341 1.00 0.00 H new ATOM 0 HB2 MET A 114 15.821 5.129 -22.974 1.00 0.00 H new ATOM 0 HB3 MET A 114 15.908 5.952 -24.518 1.00 0.00 H new ATOM 0 HG2 MET A 114 16.465 8.053 -22.845 1.00 0.00 H new ATOM 0 HG3 MET A 114 17.095 6.733 -21.881 1.00 0.00 H new ATOM 0 HE1 MET A 114 18.919 8.606 -25.538 1.00 0.00 H new ATOM 0 HE2 MET A 114 17.151 8.474 -25.385 1.00 0.00 H new ATOM 0 HE3 MET A 114 18.091 9.325 -24.137 1.00 0.00 H new ATOM 1640 N LYS A 115 13.457 6.833 -25.447 1.00 0.00 N ATOM 1641 CA LYS A 115 13.023 7.494 -26.667 1.00 0.00 C ATOM 1642 C LYS A 115 11.679 8.181 -26.420 1.00 0.00 C ATOM 1643 O LYS A 115 11.378 9.202 -27.035 1.00 0.00 O ATOM 1644 CB LYS A 115 13.003 6.504 -27.833 1.00 0.00 C ATOM 1645 CG LYS A 115 14.333 6.517 -28.588 1.00 0.00 C ATOM 1646 CD LYS A 115 14.363 7.641 -29.627 1.00 0.00 C ATOM 1647 CE LYS A 115 15.801 8.002 -30.002 1.00 0.00 C ATOM 1648 NZ LYS A 115 15.821 8.893 -31.184 1.00 0.00 N ATOM 0 H LYS A 115 13.353 5.818 -25.452 1.00 0.00 H new ATOM 0 HA LYS A 115 13.731 8.273 -26.951 1.00 0.00 H new ATOM 0 HB2 LYS A 115 12.804 5.500 -27.458 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.191 6.757 -28.515 1.00 0.00 H new ATOM 0 HG2 LYS A 115 15.154 6.647 -27.883 1.00 0.00 H new ATOM 0 HG3 LYS A 115 14.485 5.557 -29.081 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.818 7.332 -30.519 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.855 8.520 -29.232 1.00 0.00 H new ATOM 0 HE2 LYS A 115 16.290 8.493 -29.161 1.00 0.00 H new ATOM 0 HE3 LYS A 115 16.366 7.095 -30.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 16.805 9.128 -31.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 15.373 8.411 -31.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 15.299 9.766 -30.969 1.00 0.00 H new ATOM 1658 N ALA A 116 10.907 7.593 -25.517 1.00 0.00 N ATOM 1659 CA ALA A 116 9.603 8.136 -25.181 1.00 0.00 C ATOM 1660 C ALA A 116 9.783 9.467 -24.447 1.00 0.00 C ATOM 1661 O ALA A 116 9.074 10.434 -24.725 1.00 0.00 O ATOM 1662 CB ALA A 116 8.822 7.114 -24.351 1.00 0.00 C ATOM 0 H ALA A 116 11.160 6.746 -25.008 1.00 0.00 H new ATOM 0 HA ALA A 116 9.025 8.333 -26.084 1.00 0.00 H new ATOM 0 HB1 ALA A 116 7.843 7.522 -24.099 1.00 0.00 H new ATOM 0 HB2 ALA A 116 8.696 6.197 -24.927 1.00 0.00 H new ATOM 0 HB3 ALA A 116 9.370 6.894 -23.435 1.00 0.00 H new ATOM 1668 N ASP A 117 10.733 9.473 -23.525 1.00 0.00 N ATOM 1669 CA ASP A 117 11.015 10.669 -22.749 1.00 0.00 C ATOM 1670 C ASP A 117 11.615 11.738 -23.666 1.00 0.00 C ATOM 1671 O ASP A 117 12.830 11.931 -23.688 1.00 0.00 O ATOM 1672 CB ASP A 117 12.025 10.380 -21.637 1.00 0.00 C ATOM 1673 CG ASP A 117 11.969 11.339 -20.447 1.00 0.00 C ATOM 1674 OD1 ASP A 117 10.892 11.399 -19.815 1.00 0.00 O ATOM 1675 OD2 ASP A 117 13.006 11.992 -20.195 1.00 0.00 O ATOM 0 H ASP A 117 11.318 8.669 -23.297 1.00 0.00 H new ATOM 0 HA ASP A 117 10.079 11.011 -22.306 1.00 0.00 H new ATOM 0 HB2 ASP A 117 11.863 9.365 -21.274 1.00 0.00 H new ATOM 0 HB3 ASP A 117 13.028 10.410 -22.062 1.00 0.00 H new ATOM 1679 N ALA A 118 10.736 12.402 -24.401 1.00 0.00 N ATOM 1680 CA ALA A 118 11.163 13.445 -25.318 1.00 0.00 C ATOM 1681 C ALA A 118 11.410 14.736 -24.536 1.00 0.00 C ATOM 1682 O ALA A 118 12.408 15.419 -24.759 1.00 0.00 O ATOM 1683 CB ALA A 118 10.114 13.621 -26.417 1.00 0.00 C ATOM 0 H ALA A 118 9.729 12.238 -24.380 1.00 0.00 H new ATOM 0 HA ALA A 118 12.099 13.169 -25.803 1.00 0.00 H new ATOM 0 HB1 ALA A 118 10.435 14.404 -27.104 1.00 0.00 H new ATOM 0 HB2 ALA A 118 9.998 12.684 -26.962 1.00 0.00 H new ATOM 0 HB3 ALA A 118 9.161 13.901 -25.969 1.00 0.00 H new ATOM 1689 N ASN A 119 10.485 15.031 -23.635 1.00 0.00 N ATOM 1690 CA ASN A 119 10.590 16.228 -22.818 1.00 0.00 C ATOM 1691 C ASN A 119 11.982 16.289 -22.187 1.00 0.00 C ATOM 1692 O ASN A 119 12.601 17.351 -22.143 1.00 0.00 O ATOM 1693 CB ASN A 119 9.558 16.215 -21.688 1.00 0.00 C ATOM 1694 CG ASN A 119 9.500 14.843 -21.014 1.00 0.00 C ATOM 1695 OD1 ASN A 119 10.410 14.670 -20.060 1.00 0.00 O flip ATOM 1696 ND2 ASN A 119 8.683 13.997 -21.339 1.00 0.00 N flip ATOM 0 H ASN A 119 9.659 14.461 -23.453 1.00 0.00 H new ATOM 0 HA ASN A 119 10.412 17.091 -23.459 1.00 0.00 H new ATOM 0 HB2 ASN A 119 9.812 16.976 -20.950 1.00 0.00 H new ATOM 0 HB3 ASN A 119 8.576 16.471 -22.085 1.00 0.00 H new ATOM 0 HD21 ASN A 119 8.011 14.195 -22.081 1.00 0.00 H new ATOM 0 HD22 ASN A 119 8.672 13.092 -20.869 1.00 0.00 H new ATOM 1702 N GLY A 120 12.433 15.137 -21.715 1.00 0.00 N ATOM 1703 CA GLY A 120 13.741 15.046 -21.088 1.00 0.00 C ATOM 1704 C GLY A 120 13.661 15.389 -19.599 1.00 0.00 C ATOM 1705 O GLY A 120 13.356 16.523 -19.235 1.00 0.00 O ATOM 0 H GLY A 120 11.916 14.258 -21.754 1.00 0.00 H new ATOM 0 HA2 GLY A 120 14.138 14.039 -21.212 1.00 0.00 H new ATOM 0 HA3 GLY A 120 14.434 15.725 -21.584 1.00 0.00 H new ATOM 1709 N ASP A 121 13.941 14.387 -18.778 1.00 0.00 N ATOM 1710 CA ASP A 121 13.904 14.568 -17.336 1.00 0.00 C ATOM 1711 C ASP A 121 14.309 13.260 -16.653 1.00 0.00 C ATOM 1712 O ASP A 121 15.070 13.272 -15.686 1.00 0.00 O ATOM 1713 CB ASP A 121 12.496 14.933 -16.863 1.00 0.00 C ATOM 1714 CG ASP A 121 11.395 13.965 -17.301 1.00 0.00 C ATOM 1715 OD1 ASP A 121 11.675 13.166 -18.222 1.00 0.00 O ATOM 1716 OD2 ASP A 121 10.299 14.044 -16.706 1.00 0.00 O ATOM 0 H ASP A 121 14.194 13.447 -19.084 1.00 0.00 H new ATOM 0 HA ASP A 121 14.591 15.375 -17.079 1.00 0.00 H new ATOM 0 HB2 ASP A 121 12.498 14.989 -15.774 1.00 0.00 H new ATOM 0 HB3 ASP A 121 12.252 15.929 -17.233 1.00 0.00 H new ATOM 1720 N GLY A 122 13.784 12.165 -17.181 1.00 0.00 N ATOM 1721 CA GLY A 122 14.081 10.852 -16.634 1.00 0.00 C ATOM 1722 C GLY A 122 13.002 10.417 -15.639 1.00 0.00 C ATOM 1723 O GLY A 122 13.302 9.761 -14.642 1.00 0.00 O ATOM 0 H GLY A 122 13.154 12.160 -17.983 1.00 0.00 H new ATOM 0 HA2 GLY A 122 14.150 10.124 -17.442 1.00 0.00 H new ATOM 0 HA3 GLY A 122 15.052 10.871 -16.138 1.00 0.00 H new ATOM 1727 N TYR A 123 11.771 10.798 -15.945 1.00 0.00 N ATOM 1728 CA TYR A 123 10.647 10.454 -15.091 1.00 0.00 C ATOM 1729 C TYR A 123 9.331 10.508 -15.869 1.00 0.00 C ATOM 1730 O TYR A 123 9.241 11.173 -16.900 1.00 0.00 O ATOM 1731 CB TYR A 123 10.616 11.514 -13.988 1.00 0.00 C ATOM 1732 CG TYR A 123 11.880 11.551 -13.127 1.00 0.00 C ATOM 1733 CD1 TYR A 123 11.973 10.757 -12.002 1.00 0.00 C ATOM 1734 CD2 TYR A 123 12.929 12.380 -13.475 1.00 0.00 C ATOM 1735 CE1 TYR A 123 13.163 10.793 -11.191 1.00 0.00 C ATOM 1736 CE2 TYR A 123 14.118 12.415 -12.664 1.00 0.00 C ATOM 1737 CZ TYR A 123 14.176 11.620 -11.562 1.00 0.00 C ATOM 1738 OH TYR A 123 15.300 11.654 -10.796 1.00 0.00 O ATOM 0 H TYR A 123 11.527 11.342 -16.773 1.00 0.00 H new ATOM 0 HA TYR A 123 10.759 9.444 -14.698 1.00 0.00 H new ATOM 0 HB2 TYR A 123 10.470 12.494 -14.443 1.00 0.00 H new ATOM 0 HB3 TYR A 123 9.756 11.330 -13.345 1.00 0.00 H new ATOM 0 HD1 TYR A 123 11.153 10.109 -11.730 1.00 0.00 H new ATOM 0 HD2 TYR A 123 12.857 13.002 -14.355 1.00 0.00 H new ATOM 0 HE1 TYR A 123 13.248 10.177 -10.308 1.00 0.00 H new ATOM 0 HE2 TYR A 123 14.945 13.058 -12.925 1.00 0.00 H new ATOM 0 HH TYR A 123 15.940 12.288 -11.182 1.00 0.00 H new ATOM 1747 N ILE A 124 8.342 9.798 -15.345 1.00 0.00 N ATOM 1748 CA ILE A 124 7.034 9.756 -15.978 1.00 0.00 C ATOM 1749 C ILE A 124 5.963 9.527 -14.910 1.00 0.00 C ATOM 1750 O ILE A 124 6.279 9.375 -13.731 1.00 0.00 O ATOM 1751 CB ILE A 124 7.015 8.718 -17.100 1.00 0.00 C ATOM 1752 CG1 ILE A 124 6.911 7.300 -16.534 1.00 0.00 C ATOM 1753 CG2 ILE A 124 8.228 8.881 -18.019 1.00 0.00 C ATOM 1754 CD1 ILE A 124 6.644 6.284 -17.646 1.00 0.00 C ATOM 0 H ILE A 124 8.420 9.248 -14.490 1.00 0.00 H new ATOM 0 HA ILE A 124 6.811 10.710 -16.455 1.00 0.00 H new ATOM 0 HB ILE A 124 6.126 8.888 -17.707 1.00 0.00 H new ATOM 0 HG12 ILE A 124 7.835 7.043 -16.016 1.00 0.00 H new ATOM 0 HG13 ILE A 124 6.109 7.257 -15.797 1.00 0.00 H new ATOM 0 HG21 ILE A 124 8.190 8.130 -18.808 1.00 0.00 H new ATOM 0 HG22 ILE A 124 8.216 9.876 -18.464 1.00 0.00 H new ATOM 0 HG23 ILE A 124 9.143 8.753 -17.440 1.00 0.00 H new ATOM 0 HD11 ILE A 124 6.575 5.285 -17.217 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.707 6.530 -18.146 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.460 6.313 -18.369 1.00 0.00 H new ATOM 1765 N THR A 125 4.718 9.511 -15.361 1.00 0.00 N ATOM 1766 CA THR A 125 3.598 9.303 -14.458 1.00 0.00 C ATOM 1767 C THR A 125 2.588 8.335 -15.077 1.00 0.00 C ATOM 1768 O THR A 125 2.810 7.813 -16.167 1.00 0.00 O ATOM 1769 CB THR A 125 3.000 10.672 -14.123 1.00 0.00 C ATOM 1770 OG1 THR A 125 2.397 11.096 -15.342 1.00 0.00 O ATOM 1771 CG2 THR A 125 4.073 11.728 -13.851 1.00 0.00 C ATOM 0 H THR A 125 4.459 9.639 -16.339 1.00 0.00 H new ATOM 0 HA THR A 125 3.921 8.837 -13.527 1.00 0.00 H new ATOM 0 HB THR A 125 2.351 10.581 -13.252 1.00 0.00 H new ATOM 0 HG1 THR A 125 1.983 11.975 -15.214 1.00 0.00 H new ATOM 0 HG21 THR A 125 3.596 12.680 -13.619 1.00 0.00 H new ATOM 0 HG22 THR A 125 4.687 11.414 -13.007 1.00 0.00 H new ATOM 0 HG23 THR A 125 4.702 11.843 -14.734 1.00 0.00 H new ATOM 1779 N LEU A 126 1.499 8.123 -14.351 1.00 0.00 N ATOM 1780 CA LEU A 126 0.454 7.226 -14.814 1.00 0.00 C ATOM 1781 C LEU A 126 -0.347 7.912 -15.923 1.00 0.00 C ATOM 1782 O LEU A 126 -0.739 7.271 -16.898 1.00 0.00 O ATOM 1783 CB LEU A 126 -0.404 6.751 -13.640 1.00 0.00 C ATOM 1784 CG LEU A 126 0.356 6.317 -12.386 1.00 0.00 C ATOM 1785 CD1 LEU A 126 -0.247 6.952 -11.131 1.00 0.00 C ATOM 1786 CD2 LEU A 126 0.419 4.791 -12.283 1.00 0.00 C ATOM 0 H LEU A 126 1.318 8.557 -13.446 1.00 0.00 H new ATOM 0 HA LEU A 126 0.890 6.325 -15.245 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -1.087 7.555 -13.366 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.015 5.914 -13.978 1.00 0.00 H new ATOM 0 HG LEU A 126 1.382 6.677 -12.467 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.312 6.627 -10.254 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -0.196 8.038 -11.212 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -1.288 6.645 -11.032 1.00 0.00 H new ATOM 0 HD21 LEU A 126 0.965 4.509 -11.383 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.592 4.387 -12.235 1.00 0.00 H new ATOM 0 HD23 LEU A 126 0.930 4.388 -13.158 1.00 0.00 H new ATOM 1797 N GLU A 127 -0.566 9.205 -15.738 1.00 0.00 N ATOM 1798 CA GLU A 127 -1.312 9.985 -16.711 1.00 0.00 C ATOM 1799 C GLU A 127 -0.508 10.129 -18.004 1.00 0.00 C ATOM 1800 O GLU A 127 -1.056 9.996 -19.097 1.00 0.00 O ATOM 1801 CB GLU A 127 -1.688 11.355 -16.142 1.00 0.00 C ATOM 1802 CG GLU A 127 -3.197 11.457 -15.910 1.00 0.00 C ATOM 1803 CD GLU A 127 -3.505 12.301 -14.672 1.00 0.00 C ATOM 1804 OE1 GLU A 127 -2.663 12.282 -13.748 1.00 0.00 O ATOM 1805 OE2 GLU A 127 -4.575 12.948 -14.677 1.00 0.00 O ATOM 0 H GLU A 127 -0.240 9.733 -14.928 1.00 0.00 H new ATOM 0 HA GLU A 127 -2.238 9.457 -16.940 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -1.160 11.520 -15.203 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -1.368 12.138 -16.829 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -3.674 11.900 -16.784 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -3.618 10.459 -15.788 1.00 0.00 H new ATOM 1810 N GLU A 128 0.778 10.401 -17.838 1.00 0.00 N ATOM 1811 CA GLU A 128 1.661 10.565 -18.979 1.00 0.00 C ATOM 1812 C GLU A 128 1.813 9.239 -19.728 1.00 0.00 C ATOM 1813 O GLU A 128 1.942 9.225 -20.951 1.00 0.00 O ATOM 1814 CB GLU A 128 3.024 11.107 -18.542 1.00 0.00 C ATOM 1815 CG GLU A 128 3.984 11.197 -19.732 1.00 0.00 C ATOM 1816 CD GLU A 128 5.374 11.650 -19.280 1.00 0.00 C ATOM 1817 OE1 GLU A 128 6.149 10.766 -18.855 1.00 0.00 O ATOM 1818 OE2 GLU A 128 5.631 12.870 -19.370 1.00 0.00 O ATOM 0 H GLU A 128 1.229 10.512 -16.930 1.00 0.00 H new ATOM 0 HA GLU A 128 1.216 11.293 -19.657 1.00 0.00 H new ATOM 0 HB2 GLU A 128 2.901 12.093 -18.094 1.00 0.00 H new ATOM 0 HB3 GLU A 128 3.449 10.459 -17.775 1.00 0.00 H new ATOM 0 HG2 GLU A 128 4.055 10.226 -20.221 1.00 0.00 H new ATOM 0 HG3 GLU A 128 3.591 11.897 -20.469 1.00 0.00 H new ATOM 1823 N PHE A 129 1.793 8.158 -18.963 1.00 0.00 N ATOM 1824 CA PHE A 129 1.926 6.831 -19.539 1.00 0.00 C ATOM 1825 C PHE A 129 0.645 6.418 -20.267 1.00 0.00 C ATOM 1826 O PHE A 129 0.700 5.732 -21.287 1.00 0.00 O ATOM 1827 CB PHE A 129 2.175 5.863 -18.381 1.00 0.00 C ATOM 1828 CG PHE A 129 2.184 4.389 -18.791 1.00 0.00 C ATOM 1829 CD1 PHE A 129 3.132 3.930 -19.652 1.00 0.00 C ATOM 1830 CD2 PHE A 129 1.246 3.539 -18.296 1.00 0.00 C ATOM 1831 CE1 PHE A 129 3.141 2.562 -20.033 1.00 0.00 C ATOM 1832 CE2 PHE A 129 1.255 2.171 -18.678 1.00 0.00 C ATOM 1833 CZ PHE A 129 2.203 1.712 -19.538 1.00 0.00 C ATOM 0 H PHE A 129 1.687 8.174 -17.949 1.00 0.00 H new ATOM 0 HA PHE A 129 2.742 6.820 -20.261 1.00 0.00 H new ATOM 0 HB2 PHE A 129 3.131 6.106 -17.917 1.00 0.00 H new ATOM 0 HB3 PHE A 129 1.406 6.014 -17.623 1.00 0.00 H new ATOM 0 HD1 PHE A 129 3.877 4.605 -20.045 1.00 0.00 H new ATOM 0 HD2 PHE A 129 0.494 3.904 -17.612 1.00 0.00 H new ATOM 0 HE1 PHE A 129 3.893 2.197 -20.716 1.00 0.00 H new ATOM 0 HE2 PHE A 129 0.509 1.496 -18.286 1.00 0.00 H new ATOM 0 HZ PHE A 129 2.211 0.672 -19.828 1.00 0.00 H new ATOM 1842 N LEU A 130 -0.478 6.852 -19.713 1.00 0.00 N ATOM 1843 CA LEU A 130 -1.771 6.536 -20.298 1.00 0.00 C ATOM 1844 C LEU A 130 -1.941 7.317 -21.601 1.00 0.00 C ATOM 1845 O LEU A 130 -2.197 6.732 -22.652 1.00 0.00 O ATOM 1846 CB LEU A 130 -2.890 6.778 -19.284 1.00 0.00 C ATOM 1847 CG LEU A 130 -4.313 6.518 -19.782 1.00 0.00 C ATOM 1848 CD1 LEU A 130 -5.212 6.030 -18.643 1.00 0.00 C ATOM 1849 CD2 LEU A 130 -4.887 7.757 -20.473 1.00 0.00 C ATOM 0 H LEU A 130 -0.520 7.419 -18.866 1.00 0.00 H new ATOM 0 HA LEU A 130 -1.826 5.478 -20.552 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -2.709 6.145 -18.415 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -2.828 7.812 -18.944 1.00 0.00 H new ATOM 0 HG LEU A 130 -4.274 5.722 -20.526 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -6.218 5.853 -19.024 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -4.810 5.103 -18.234 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -5.249 6.786 -17.859 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -5.899 7.545 -20.818 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -4.910 8.589 -19.769 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -4.261 8.021 -21.326 1.00 0.00 H new ATOM 1860 N GLU A 131 -1.794 8.630 -21.490 1.00 0.00 N ATOM 1861 CA GLU A 131 -1.929 9.499 -22.647 1.00 0.00 C ATOM 1862 C GLU A 131 -0.892 9.131 -23.711 1.00 0.00 C ATOM 1863 O GLU A 131 -1.176 9.188 -24.907 1.00 0.00 O ATOM 1864 CB GLU A 131 -1.805 10.970 -22.246 1.00 0.00 C ATOM 1865 CG GLU A 131 -3.069 11.746 -22.614 1.00 0.00 C ATOM 1866 CD GLU A 131 -3.471 12.705 -21.491 1.00 0.00 C ATOM 1867 OE1 GLU A 131 -3.530 12.232 -20.336 1.00 0.00 O ATOM 1868 OE2 GLU A 131 -3.708 13.890 -21.813 1.00 0.00 O ATOM 0 H GLU A 131 -1.583 9.113 -20.617 1.00 0.00 H new ATOM 0 HA GLU A 131 -2.923 9.355 -23.071 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -1.628 11.045 -21.173 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -0.943 11.415 -22.743 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -2.901 12.307 -23.533 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -3.884 11.049 -22.811 1.00 0.00 H new ATOM 1873 N PHE A 132 0.290 8.762 -23.237 1.00 0.00 N ATOM 1874 CA PHE A 132 1.371 8.385 -24.132 1.00 0.00 C ATOM 1875 C PHE A 132 1.003 7.139 -24.941 1.00 0.00 C ATOM 1876 O PHE A 132 1.435 6.986 -26.082 1.00 0.00 O ATOM 1877 CB PHE A 132 2.587 8.073 -23.258 1.00 0.00 C ATOM 1878 CG PHE A 132 3.697 7.313 -23.987 1.00 0.00 C ATOM 1879 CD1 PHE A 132 4.557 7.981 -24.802 1.00 0.00 C ATOM 1880 CD2 PHE A 132 3.826 5.970 -23.819 1.00 0.00 C ATOM 1881 CE1 PHE A 132 5.588 7.277 -25.477 1.00 0.00 C ATOM 1882 CE2 PHE A 132 4.857 5.265 -24.495 1.00 0.00 C ATOM 1883 CZ PHE A 132 5.716 5.934 -25.310 1.00 0.00 C ATOM 0 H PHE A 132 0.522 8.716 -22.245 1.00 0.00 H new ATOM 0 HA PHE A 132 1.573 9.194 -24.834 1.00 0.00 H new ATOM 0 HB2 PHE A 132 2.994 9.008 -22.872 1.00 0.00 H new ATOM 0 HB3 PHE A 132 2.263 7.487 -22.398 1.00 0.00 H new ATOM 0 HD1 PHE A 132 4.455 9.048 -24.936 1.00 0.00 H new ATOM 0 HD2 PHE A 132 3.144 5.439 -23.171 1.00 0.00 H new ATOM 0 HE1 PHE A 132 6.271 7.808 -26.123 1.00 0.00 H new ATOM 0 HE2 PHE A 132 4.959 4.198 -24.362 1.00 0.00 H new ATOM 0 HZ PHE A 132 6.500 5.398 -25.825 1.00 0.00 H new ATOM 1892 N SER A 133 0.211 6.280 -24.316 1.00 0.00 N ATOM 1893 CA SER A 133 -0.219 5.052 -24.964 1.00 0.00 C ATOM 1894 C SER A 133 -1.226 5.369 -26.070 1.00 0.00 C ATOM 1895 O SER A 133 -1.238 4.712 -27.110 1.00 0.00 O ATOM 1896 CB SER A 133 -0.830 4.081 -23.951 1.00 0.00 C ATOM 1897 OG SER A 133 -1.273 2.875 -24.568 1.00 0.00 O ATOM 0 H SER A 133 -0.144 6.410 -23.369 1.00 0.00 H new ATOM 0 HA SER A 133 0.655 4.573 -25.405 1.00 0.00 H new ATOM 0 HB2 SER A 133 -0.092 3.846 -23.184 1.00 0.00 H new ATOM 0 HB3 SER A 133 -1.670 4.561 -23.449 1.00 0.00 H new ATOM 0 HG SER A 133 -1.655 2.281 -23.889 1.00 0.00 H new ATOM 1902 N LEU A 134 -2.049 6.374 -25.808 1.00 0.00 N ATOM 1903 CA LEU A 134 -3.058 6.786 -26.769 1.00 0.00 C ATOM 1904 C LEU A 134 -2.387 7.553 -27.910 1.00 0.00 C ATOM 1905 O LEU A 134 -2.792 7.435 -29.066 1.00 0.00 O ATOM 1906 CB LEU A 134 -4.172 7.569 -26.073 1.00 0.00 C ATOM 1907 CG LEU A 134 -5.571 6.953 -26.145 1.00 0.00 C ATOM 1908 CD1 LEU A 134 -6.398 7.322 -24.912 1.00 0.00 C ATOM 1909 CD2 LEU A 134 -6.276 7.345 -27.445 1.00 0.00 C ATOM 0 H LEU A 134 -2.038 6.915 -24.944 1.00 0.00 H new ATOM 0 HA LEU A 134 -3.541 5.915 -27.211 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -3.903 7.689 -25.024 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -4.214 8.568 -26.508 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.466 5.868 -26.149 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -7.387 6.871 -24.989 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -5.900 6.952 -24.016 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -6.497 8.406 -24.851 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -7.268 6.894 -27.471 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -6.369 8.430 -27.496 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -5.694 6.991 -28.296 1.00 0.00 H new