USER MOD reduce.3.24.130724 H: found=0, std=0, add=809, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 813 hydrogens (26 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 NoAdj-H: A 98 ASNHD21 : A 98 ASN ND2 : A 135 NAG C1 :(H bumps) USER MOD Set 1.1: A 63 TYR OH : rot 162:sc= -0.39 USER MOD Set 1.2: A 120 LYS NZ :NH3+ 164:sc=-0.00654 (180deg=-0.704) USER MOD Set 1.3: A 136 RAM O2 : rot 180:sc= -0.136 USER MOD Set 1.4: A 136 RAM O3 : rot 133:sc= 0.877 USER MOD Set 2.1: A 66 THR OG1 : rot -70:sc= 1.25 USER MOD Set 2.2: A 121 TYR OH : rot 133:sc= 1.2! USER MOD Single : A 35 MET CE :methyl -127:sc= 0 (180deg=-0.0974) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 57 MET CE :methyl -157:sc= -0.24 (180deg=-1.51) USER MOD Single : A 60 ASN : amide:sc= -2.31! C(o=-2.3!,f=-2.8!) USER MOD Single : A 62 ASN : amide:sc= -2.67! C(o=-2.7!,f=-9.9!) USER MOD Single : A 69 LYS NZ :NH3+ -111:sc= -0.41 (180deg=-1.69) USER MOD Single : A 77 GLN : amide:sc= -9! C(o=-9!,f=-14!) USER MOD Single : A 78 MET CE :methyl -118:sc= -4.96! (180deg=-8.3!) USER MOD Single : A 80 ASN : amide:sc= 0.0365 K(o=0.037,f=-0.57) USER MOD Single : A 82 GLN : amide:sc= -0.348 X(o=-0.35,f=-0.25) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 133:sc= -0.805 (180deg=-3.35!) USER MOD Single : A 92 MET CE :methyl -119:sc= -2.95! (180deg=-4.76!) USER MOD Single : A 93 SER OG : rot 97:sc= 0.896 USER MOD Single : A 94 GLN : amide:sc= -0.118 X(o=-0.12,f=0) USER MOD Single : A 97 ASN : amide:sc= -12.9! C(o=-13!,f=-25!) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -1.4! C(o=-1.4!,f=-2.2!) USER MOD Single : A 108 SER OG : rot 180:sc= 0.364 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot -76:sc= 0.153 USER MOD Single : A 125 GLN :FLIP amide:sc= -0.0391 F(o=-2!,f=-0.039) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ -159:sc= -0.0923 (180deg=-0.635) USER MOD Single : A 135 NAG O3 : rot 180:sc= 0 USER MOD Single : A 135 NAG O4 : rot 140:sc= 0 USER MOD Single : A 135 NAG O6 : rot 9:sc= 0.498 USER MOD Single : A 136 RAM O1 : rot 180:sc= -0.0145 USER MOD Single : A 136 RAM O4 : rot -126:sc= 0.0624 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 29 6.054 -14.678 5.187 1.00 0.00 N ATOM 2 CA GLY A 29 7.117 -15.701 4.974 1.00 0.00 C ATOM 3 C GLY A 29 8.351 -15.049 4.354 1.00 0.00 C ATOM 4 O GLY A 29 8.385 -13.838 4.143 1.00 0.00 O ATOM 0 HA2 GLY A 29 7.380 -16.168 5.923 1.00 0.00 H new ATOM 0 HA3 GLY A 29 6.747 -16.492 4.322 1.00 0.00 H new ATOM 10 N LEU A 30 9.361 -15.867 4.070 1.00 0.00 N ATOM 11 CA LEU A 30 10.604 -15.374 3.479 1.00 0.00 C ATOM 12 C LEU A 30 10.368 -14.866 2.057 1.00 0.00 C ATOM 13 O LEU A 30 9.480 -15.345 1.351 1.00 0.00 O ATOM 14 CB LEU A 30 11.643 -16.500 3.445 1.00 0.00 C ATOM 15 CG LEU A 30 12.361 -16.595 4.795 1.00 0.00 C ATOM 16 CD1 LEU A 30 12.920 -18.008 4.978 1.00 0.00 C ATOM 17 CD2 LEU A 30 13.513 -15.584 4.839 1.00 0.00 C ATOM 0 H LEU A 30 9.344 -16.873 4.239 1.00 0.00 H new ATOM 0 HA LEU A 30 10.968 -14.549 4.091 1.00 0.00 H new ATOM 0 HB2 LEU A 30 11.156 -17.448 3.216 1.00 0.00 H new ATOM 0 HB3 LEU A 30 12.367 -16.314 2.652 1.00 0.00 H new ATOM 0 HG LEU A 30 11.654 -16.375 5.595 1.00 0.00 H new ATOM 0 HD11 LEU A 30 13.431 -18.076 5.938 1.00 0.00 H new ATOM 0 HD12 LEU A 30 12.103 -18.729 4.950 1.00 0.00 H new ATOM 0 HD13 LEU A 30 13.625 -18.227 4.176 1.00 0.00 H new ATOM 0 HD21 LEU A 30 14.022 -15.654 5.800 1.00 0.00 H new ATOM 0 HD22 LEU A 30 14.219 -15.802 4.038 1.00 0.00 H new ATOM 0 HD23 LEU A 30 13.118 -14.576 4.710 1.00 0.00 H new ATOM 29 N PRO A 31 11.155 -13.910 1.628 1.00 0.00 N ATOM 30 CA PRO A 31 11.046 -13.325 0.257 1.00 0.00 C ATOM 31 C PRO A 31 11.334 -14.355 -0.830 1.00 0.00 C ATOM 32 O PRO A 31 11.738 -15.482 -0.541 1.00 0.00 O ATOM 33 CB PRO A 31 12.088 -12.201 0.235 1.00 0.00 C ATOM 34 CG PRO A 31 13.015 -12.472 1.376 1.00 0.00 C ATOM 35 CD PRO A 31 12.234 -13.288 2.405 1.00 0.00 C ATOM 0 HA PRO A 31 10.037 -12.967 0.053 1.00 0.00 H new ATOM 0 HB2 PRO A 31 12.628 -12.189 -0.712 1.00 0.00 H new ATOM 0 HB3 PRO A 31 11.612 -11.226 0.343 1.00 0.00 H new ATOM 0 HG2 PRO A 31 13.894 -13.020 1.036 1.00 0.00 H new ATOM 0 HG3 PRO A 31 13.370 -11.539 1.814 1.00 0.00 H new ATOM 0 HD2 PRO A 31 12.866 -14.038 2.881 1.00 0.00 H new ATOM 0 HD3 PRO A 31 11.839 -12.654 3.199 1.00 0.00 H new ATOM 43 N PHE A 32 11.124 -13.966 -2.085 1.00 0.00 N ATOM 44 CA PHE A 32 11.368 -14.877 -3.197 1.00 0.00 C ATOM 45 C PHE A 32 12.867 -15.056 -3.403 1.00 0.00 C ATOM 46 O PHE A 32 13.303 -15.699 -4.360 1.00 0.00 O ATOM 47 CB PHE A 32 10.740 -14.340 -4.483 1.00 0.00 C ATOM 48 CG PHE A 32 10.833 -15.406 -5.546 1.00 0.00 C ATOM 49 CD1 PHE A 32 9.854 -16.402 -5.618 1.00 0.00 C ATOM 50 CD2 PHE A 32 11.906 -15.409 -6.444 1.00 0.00 C ATOM 51 CE1 PHE A 32 9.944 -17.402 -6.591 1.00 0.00 C ATOM 52 CE2 PHE A 32 11.995 -16.408 -7.419 1.00 0.00 C ATOM 53 CZ PHE A 32 11.014 -17.405 -7.493 1.00 0.00 C ATOM 0 H PHE A 32 10.791 -13.040 -2.354 1.00 0.00 H new ATOM 0 HA PHE A 32 10.914 -15.838 -2.958 1.00 0.00 H new ATOM 0 HB2 PHE A 32 9.699 -14.068 -4.310 1.00 0.00 H new ATOM 0 HB3 PHE A 32 11.256 -13.436 -4.807 1.00 0.00 H new ATOM 0 HD1 PHE A 32 9.028 -16.399 -4.922 1.00 0.00 H new ATOM 0 HD2 PHE A 32 12.664 -14.642 -6.384 1.00 0.00 H new ATOM 0 HE1 PHE A 32 9.188 -18.172 -6.646 1.00 0.00 H new ATOM 0 HE2 PHE A 32 12.821 -16.411 -8.115 1.00 0.00 H new ATOM 0 HZ PHE A 32 11.083 -18.176 -8.246 1.00 0.00 H new ATOM 63 N GLY A 33 13.648 -14.492 -2.490 1.00 0.00 N ATOM 64 CA GLY A 33 15.098 -14.601 -2.557 1.00 0.00 C ATOM 65 C GLY A 33 15.659 -13.957 -3.821 1.00 0.00 C ATOM 66 O GLY A 33 16.874 -13.937 -4.021 1.00 0.00 O ATOM 0 H GLY A 33 13.301 -13.955 -1.695 1.00 0.00 H new ATOM 0 HA2 GLY A 33 15.539 -14.125 -1.681 1.00 0.00 H new ATOM 0 HA3 GLY A 33 15.385 -15.652 -2.527 1.00 0.00 H new ATOM 70 N LEU A 34 14.787 -13.430 -4.676 1.00 0.00 N ATOM 71 CA LEU A 34 15.258 -12.801 -5.905 1.00 0.00 C ATOM 72 C LEU A 34 14.235 -11.822 -6.476 1.00 0.00 C ATOM 73 O LEU A 34 13.309 -12.221 -7.183 1.00 0.00 O ATOM 74 CB LEU A 34 15.556 -13.876 -6.953 1.00 0.00 C ATOM 75 CG LEU A 34 16.451 -13.290 -8.050 1.00 0.00 C ATOM 76 CD1 LEU A 34 17.070 -14.423 -8.867 1.00 0.00 C ATOM 77 CD2 LEU A 34 15.622 -12.395 -8.975 1.00 0.00 C ATOM 0 H LEU A 34 13.775 -13.425 -4.546 1.00 0.00 H new ATOM 0 HA LEU A 34 16.162 -12.243 -5.660 1.00 0.00 H new ATOM 0 HB2 LEU A 34 16.048 -14.728 -6.485 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.626 -14.244 -7.386 1.00 0.00 H new ATOM 0 HG LEU A 34 17.241 -12.699 -7.586 1.00 0.00 H new ATOM 0 HD11 LEU A 34 17.706 -14.004 -9.647 1.00 0.00 H new ATOM 0 HD12 LEU A 34 17.668 -15.058 -8.213 1.00 0.00 H new ATOM 0 HD13 LEU A 34 16.278 -15.016 -9.325 1.00 0.00 H new ATOM 0 HD21 LEU A 34 16.264 -11.982 -9.753 1.00 0.00 H new ATOM 0 HD22 LEU A 34 14.828 -12.983 -9.435 1.00 0.00 H new ATOM 0 HD23 LEU A 34 15.183 -11.582 -8.397 1.00 0.00 H new ATOM 89 N MET A 35 14.434 -10.536 -6.192 1.00 0.00 N ATOM 90 CA MET A 35 13.550 -9.494 -6.707 1.00 0.00 C ATOM 91 C MET A 35 12.077 -9.856 -6.500 1.00 0.00 C ATOM 92 O MET A 35 11.741 -11.007 -6.224 1.00 0.00 O ATOM 93 CB MET A 35 13.840 -9.295 -8.202 1.00 0.00 C ATOM 94 CG MET A 35 13.364 -7.915 -8.667 1.00 0.00 C ATOM 95 SD MET A 35 14.610 -7.191 -9.764 1.00 0.00 S ATOM 96 CE MET A 35 14.200 -8.135 -11.256 1.00 0.00 C ATOM 0 H MET A 35 15.198 -10.192 -5.610 1.00 0.00 H new ATOM 0 HA MET A 35 13.739 -8.570 -6.160 1.00 0.00 H new ATOM 0 HB2 MET A 35 14.909 -9.398 -8.387 1.00 0.00 H new ATOM 0 HB3 MET A 35 13.340 -10.072 -8.781 1.00 0.00 H new ATOM 0 HG2 MET A 35 12.411 -8.003 -9.188 1.00 0.00 H new ATOM 0 HG3 MET A 35 13.198 -7.266 -7.807 1.00 0.00 H new ATOM 0 HE1 MET A 35 15.100 -8.614 -11.642 1.00 0.00 H new ATOM 0 HE2 MET A 35 13.460 -8.897 -11.012 1.00 0.00 H new ATOM 0 HE3 MET A 35 13.794 -7.463 -12.012 1.00 0.00 H new ATOM 106 N ARG A 36 11.202 -8.864 -6.653 1.00 0.00 N ATOM 107 CA ARG A 36 9.765 -9.086 -6.502 1.00 0.00 C ATOM 108 C ARG A 36 9.154 -9.441 -7.860 1.00 0.00 C ATOM 109 O ARG A 36 9.504 -8.837 -8.875 1.00 0.00 O ATOM 110 CB ARG A 36 9.100 -7.820 -5.944 1.00 0.00 C ATOM 111 CG ARG A 36 9.841 -7.346 -4.682 1.00 0.00 C ATOM 112 CD ARG A 36 9.590 -8.325 -3.532 1.00 0.00 C ATOM 113 NE ARG A 36 10.186 -7.835 -2.289 1.00 0.00 N ATOM 114 CZ ARG A 36 11.358 -8.296 -1.857 1.00 0.00 C ATOM 115 NH1 ARG A 36 12.058 -9.105 -2.603 1.00 0.00 N ATOM 116 NH2 ARG A 36 11.822 -7.921 -0.694 1.00 0.00 N ATOM 0 H ARG A 36 11.461 -7.904 -6.880 1.00 0.00 H new ATOM 0 HA ARG A 36 9.598 -9.910 -5.808 1.00 0.00 H new ATOM 0 HB2 ARG A 36 9.109 -7.033 -6.698 1.00 0.00 H new ATOM 0 HB3 ARG A 36 8.055 -8.023 -5.707 1.00 0.00 H new ATOM 0 HG2 ARG A 36 10.910 -7.274 -4.883 1.00 0.00 H new ATOM 0 HG3 ARG A 36 9.501 -6.349 -4.403 1.00 0.00 H new ATOM 0 HD2 ARG A 36 8.518 -8.464 -3.395 1.00 0.00 H new ATOM 0 HD3 ARG A 36 10.009 -9.300 -3.781 1.00 0.00 H new ATOM 0 HE ARG A 36 9.695 -7.127 -1.743 1.00 0.00 H new ATOM 0 HH11 ARG A 36 11.708 -9.386 -3.519 1.00 0.00 H new ATOM 0 HH12 ARG A 36 12.956 -9.457 -2.270 1.00 0.00 H new ATOM 0 HH21 ARG A 36 11.286 -7.274 -0.116 1.00 0.00 H new ATOM 0 HH22 ARG A 36 12.720 -8.275 -0.365 1.00 0.00 H new ATOM 130 N ARG A 37 8.251 -10.421 -7.890 1.00 0.00 N ATOM 131 CA ARG A 37 7.636 -10.818 -9.154 1.00 0.00 C ATOM 132 C ARG A 37 6.217 -11.344 -8.970 1.00 0.00 C ATOM 133 O ARG A 37 5.941 -12.132 -8.066 1.00 0.00 O ATOM 134 CB ARG A 37 8.474 -11.906 -9.828 1.00 0.00 C ATOM 135 CG ARG A 37 7.778 -12.364 -11.113 1.00 0.00 C ATOM 136 CD ARG A 37 8.640 -13.415 -11.818 1.00 0.00 C ATOM 137 NE ARG A 37 8.588 -14.682 -11.098 1.00 0.00 N ATOM 138 CZ ARG A 37 8.710 -15.837 -11.743 1.00 0.00 C ATOM 139 NH1 ARG A 37 8.918 -15.841 -13.030 1.00 0.00 N ATOM 140 NH2 ARG A 37 8.630 -16.965 -11.092 1.00 0.00 N ATOM 0 H ARG A 37 7.935 -10.944 -7.073 1.00 0.00 H new ATOM 0 HA ARG A 37 7.593 -9.924 -9.776 1.00 0.00 H new ATOM 0 HB2 ARG A 37 9.469 -11.524 -10.057 1.00 0.00 H new ATOM 0 HB3 ARG A 37 8.605 -12.751 -9.152 1.00 0.00 H new ATOM 0 HG2 ARG A 37 6.798 -12.780 -10.879 1.00 0.00 H new ATOM 0 HG3 ARG A 37 7.613 -11.512 -11.773 1.00 0.00 H new ATOM 0 HD2 ARG A 37 8.289 -13.556 -12.840 1.00 0.00 H new ATOM 0 HD3 ARG A 37 9.671 -13.067 -11.880 1.00 0.00 H new ATOM 0 HE ARG A 37 8.456 -14.681 -10.087 1.00 0.00 H new ATOM 0 HH11 ARG A 37 8.987 -14.959 -13.538 1.00 0.00 H new ATOM 0 HH12 ARG A 37 9.012 -16.726 -13.529 1.00 0.00 H new ATOM 0 HH21 ARG A 37 8.473 -16.962 -10.084 1.00 0.00 H new ATOM 0 HH22 ARG A 37 8.724 -17.850 -11.591 1.00 0.00 H new ATOM 154 N GLU A 38 5.334 -10.922 -9.864 1.00 0.00 N ATOM 155 CA GLU A 38 3.950 -11.380 -9.825 1.00 0.00 C ATOM 156 C GLU A 38 3.466 -11.762 -11.214 1.00 0.00 C ATOM 157 O GLU A 38 3.895 -11.196 -12.222 1.00 0.00 O ATOM 158 CB GLU A 38 3.012 -10.319 -9.233 1.00 0.00 C ATOM 159 CG GLU A 38 3.194 -10.232 -7.713 1.00 0.00 C ATOM 160 CD GLU A 38 3.002 -11.607 -7.070 1.00 0.00 C ATOM 161 OE1 GLU A 38 2.363 -12.444 -7.684 1.00 0.00 O ATOM 162 OE2 GLU A 38 3.494 -11.798 -5.970 1.00 0.00 O ATOM 0 H GLU A 38 5.547 -10.270 -10.619 1.00 0.00 H new ATOM 0 HA GLU A 38 3.927 -12.258 -9.179 1.00 0.00 H new ATOM 0 HB2 GLU A 38 3.218 -9.349 -9.686 1.00 0.00 H new ATOM 0 HB3 GLU A 38 1.977 -10.568 -9.468 1.00 0.00 H new ATOM 0 HG2 GLU A 38 4.189 -9.852 -7.481 1.00 0.00 H new ATOM 0 HG3 GLU A 38 2.477 -9.525 -7.295 1.00 0.00 H new ATOM 169 N LEU A 39 2.563 -12.729 -11.247 1.00 0.00 N ATOM 170 CA LEU A 39 1.998 -13.208 -12.496 1.00 0.00 C ATOM 171 C LEU A 39 0.510 -13.474 -12.305 1.00 0.00 C ATOM 172 O LEU A 39 0.087 -13.902 -11.229 1.00 0.00 O ATOM 173 CB LEU A 39 2.711 -14.491 -12.923 1.00 0.00 C ATOM 174 CG LEU A 39 2.501 -14.729 -14.417 1.00 0.00 C ATOM 175 CD1 LEU A 39 3.542 -15.730 -14.917 1.00 0.00 C ATOM 176 CD2 LEU A 39 1.095 -15.285 -14.665 1.00 0.00 C ATOM 0 H LEU A 39 2.204 -13.200 -10.416 1.00 0.00 H new ATOM 0 HA LEU A 39 2.131 -12.455 -13.273 1.00 0.00 H new ATOM 0 HB2 LEU A 39 3.776 -14.416 -12.704 1.00 0.00 H new ATOM 0 HB3 LEU A 39 2.327 -15.338 -12.353 1.00 0.00 H new ATOM 0 HG LEU A 39 2.609 -13.786 -14.952 1.00 0.00 H new ATOM 0 HD11 LEU A 39 3.397 -15.904 -15.983 1.00 0.00 H new ATOM 0 HD12 LEU A 39 4.542 -15.331 -14.747 1.00 0.00 H new ATOM 0 HD13 LEU A 39 3.431 -16.671 -14.378 1.00 0.00 H new ATOM 0 HD21 LEU A 39 0.953 -15.452 -15.733 1.00 0.00 H new ATOM 0 HD22 LEU A 39 0.977 -16.228 -14.131 1.00 0.00 H new ATOM 0 HD23 LEU A 39 0.353 -14.571 -14.308 1.00 0.00 H new ATOM 188 N ALA A 40 -0.290 -13.211 -13.331 1.00 0.00 N ATOM 189 CA ALA A 40 -1.725 -13.428 -13.207 1.00 0.00 C ATOM 190 C ALA A 40 -2.349 -13.885 -14.514 1.00 0.00 C ATOM 191 O ALA A 40 -1.927 -13.486 -15.601 1.00 0.00 O ATOM 192 CB ALA A 40 -2.404 -12.140 -12.750 1.00 0.00 C ATOM 0 H ALA A 40 0.020 -12.856 -14.236 1.00 0.00 H new ATOM 0 HA ALA A 40 -1.873 -14.217 -12.470 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -3.477 -12.307 -12.659 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -2.000 -11.839 -11.783 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -2.220 -11.353 -13.481 1.00 0.00 H new ATOM 198 N CYS A 41 -3.353 -14.744 -14.390 1.00 0.00 N ATOM 199 CA CYS A 41 -4.044 -15.284 -15.547 1.00 0.00 C ATOM 200 C CYS A 41 -4.803 -14.186 -16.283 1.00 0.00 C ATOM 201 O CYS A 41 -5.526 -13.392 -15.680 1.00 0.00 O ATOM 202 CB CYS A 41 -5.018 -16.369 -15.095 1.00 0.00 C ATOM 203 SG CYS A 41 -4.142 -17.583 -14.080 1.00 0.00 S ATOM 0 H CYS A 41 -3.706 -15.081 -13.494 1.00 0.00 H new ATOM 0 HA CYS A 41 -3.307 -15.710 -16.228 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -5.835 -15.925 -14.526 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -5.463 -16.857 -15.962 1.00 0.00 H new ATOM 208 N GLU A 42 -4.610 -14.144 -17.593 1.00 0.00 N ATOM 209 CA GLU A 42 -5.245 -13.139 -18.432 1.00 0.00 C ATOM 210 C GLU A 42 -6.705 -12.898 -18.059 1.00 0.00 C ATOM 211 O GLU A 42 -7.495 -13.835 -17.922 1.00 0.00 O ATOM 212 CB GLU A 42 -5.160 -13.572 -19.894 1.00 0.00 C ATOM 213 CG GLU A 42 -6.237 -12.847 -20.705 1.00 0.00 C ATOM 214 CD GLU A 42 -5.871 -12.864 -22.186 1.00 0.00 C ATOM 215 OE1 GLU A 42 -5.070 -13.702 -22.566 1.00 0.00 O ATOM 216 OE2 GLU A 42 -6.393 -12.038 -22.915 1.00 0.00 O ATOM 0 H GLU A 42 -4.015 -14.799 -18.100 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.711 -12.202 -18.275 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -4.173 -13.344 -20.295 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -5.295 -14.651 -19.973 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -7.203 -13.328 -20.555 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -6.336 -11.819 -20.358 1.00 0.00 H new ATOM 223 N GLY A 43 -7.051 -11.620 -17.934 1.00 0.00 N ATOM 224 CA GLY A 43 -8.416 -11.218 -17.618 1.00 0.00 C ATOM 225 C GLY A 43 -8.669 -11.071 -16.122 1.00 0.00 C ATOM 226 O GLY A 43 -9.780 -10.721 -15.721 1.00 0.00 O ATOM 0 H GLY A 43 -6.401 -10.842 -18.048 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -8.632 -10.270 -18.111 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -9.108 -11.954 -18.026 1.00 0.00 H new ATOM 230 N TYR A 44 -7.671 -11.343 -15.285 1.00 0.00 N ATOM 231 CA TYR A 44 -7.855 -11.235 -13.845 1.00 0.00 C ATOM 232 C TYR A 44 -6.914 -10.174 -13.267 1.00 0.00 C ATOM 233 O TYR A 44 -5.832 -9.937 -13.804 1.00 0.00 O ATOM 234 CB TYR A 44 -7.552 -12.589 -13.200 1.00 0.00 C ATOM 235 CG TYR A 44 -8.627 -13.586 -13.561 1.00 0.00 C ATOM 236 CD1 TYR A 44 -8.730 -14.074 -14.873 1.00 0.00 C ATOM 237 CD2 TYR A 44 -9.520 -14.033 -12.578 1.00 0.00 C ATOM 238 CE1 TYR A 44 -9.726 -15.007 -15.198 1.00 0.00 C ATOM 239 CE2 TYR A 44 -10.516 -14.963 -12.904 1.00 0.00 C ATOM 240 CZ TYR A 44 -10.618 -15.451 -14.213 1.00 0.00 C ATOM 241 OH TYR A 44 -11.593 -16.373 -14.531 1.00 0.00 O ATOM 0 H TYR A 44 -6.739 -11.636 -15.576 1.00 0.00 H new ATOM 0 HA TYR A 44 -8.884 -10.943 -13.636 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -6.581 -12.952 -13.536 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -7.494 -12.480 -12.117 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -8.043 -13.731 -15.632 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -9.440 -13.660 -11.568 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -9.805 -15.383 -16.207 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -11.205 -15.304 -12.146 1.00 0.00 H new ATOM 0 HH TYR A 44 -12.126 -16.574 -13.733 1.00 0.00 H new ATOM 251 N PRO A 45 -7.294 -9.538 -12.190 1.00 0.00 N ATOM 252 CA PRO A 45 -6.452 -8.489 -11.533 1.00 0.00 C ATOM 253 C PRO A 45 -5.228 -9.056 -10.814 1.00 0.00 C ATOM 254 O PRO A 45 -5.308 -10.078 -10.135 1.00 0.00 O ATOM 255 CB PRO A 45 -7.409 -7.839 -10.534 1.00 0.00 C ATOM 256 CG PRO A 45 -8.398 -8.904 -10.202 1.00 0.00 C ATOM 257 CD PRO A 45 -8.569 -9.734 -11.476 1.00 0.00 C ATOM 0 HA PRO A 45 -6.037 -7.797 -12.266 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -6.880 -7.500 -9.643 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -7.898 -6.966 -10.966 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -8.043 -9.523 -9.378 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -9.348 -8.470 -9.889 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -8.744 -10.786 -11.249 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -9.417 -9.390 -12.068 1.00 0.00 H new ATOM 265 N ILE A 46 -4.107 -8.350 -10.943 1.00 0.00 N ATOM 266 CA ILE A 46 -2.863 -8.742 -10.281 1.00 0.00 C ATOM 267 C ILE A 46 -2.523 -7.666 -9.260 1.00 0.00 C ATOM 268 O ILE A 46 -2.726 -6.483 -9.527 1.00 0.00 O ATOM 269 CB ILE A 46 -1.725 -8.856 -11.301 1.00 0.00 C ATOM 270 CG1 ILE A 46 -0.484 -9.457 -10.631 1.00 0.00 C ATOM 271 CG2 ILE A 46 -1.382 -7.462 -11.820 1.00 0.00 C ATOM 272 CD1 ILE A 46 0.520 -9.891 -11.704 1.00 0.00 C ATOM 0 H ILE A 46 -4.034 -7.500 -11.502 1.00 0.00 H new ATOM 0 HA ILE A 46 -2.987 -9.712 -9.799 1.00 0.00 H new ATOM 0 HB ILE A 46 -2.040 -9.498 -12.124 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -0.027 -8.725 -9.966 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -0.768 -10.312 -10.017 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -0.573 -7.533 -12.547 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.260 -7.025 -12.296 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -1.068 -6.831 -10.988 1.00 0.00 H new ATOM 0 HD11 ILE A 46 1.402 -10.318 -11.226 1.00 0.00 H new ATOM 0 HD12 ILE A 46 0.061 -10.638 -12.351 1.00 0.00 H new ATOM 0 HD13 ILE A 46 0.813 -9.026 -12.299 1.00 0.00 H new ATOM 284 N GLU A 47 -2.030 -8.055 -8.092 1.00 0.00 N ATOM 285 CA GLU A 47 -1.716 -7.058 -7.078 1.00 0.00 C ATOM 286 C GLU A 47 -0.238 -7.047 -6.742 1.00 0.00 C ATOM 287 O GLU A 47 0.373 -8.086 -6.495 1.00 0.00 O ATOM 288 CB GLU A 47 -2.518 -7.304 -5.800 1.00 0.00 C ATOM 289 CG GLU A 47 -2.376 -6.081 -4.889 1.00 0.00 C ATOM 290 CD GLU A 47 -3.081 -6.323 -3.560 1.00 0.00 C ATOM 291 OE1 GLU A 47 -3.533 -7.433 -3.342 1.00 0.00 O ATOM 292 OE2 GLU A 47 -3.162 -5.388 -2.779 1.00 0.00 O ATOM 0 H GLU A 47 -1.843 -9.022 -7.828 1.00 0.00 H new ATOM 0 HA GLU A 47 -1.988 -6.089 -7.496 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -3.567 -7.477 -6.040 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.155 -8.198 -5.292 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -1.321 -5.870 -4.715 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -2.800 -5.204 -5.378 1.00 0.00 H new ATOM 299 N LEU A 48 0.313 -5.849 -6.722 1.00 0.00 N ATOM 300 CA LEU A 48 1.709 -5.651 -6.401 1.00 0.00 C ATOM 301 C LEU A 48 1.796 -4.867 -5.103 1.00 0.00 C ATOM 302 O LEU A 48 0.985 -3.976 -4.871 1.00 0.00 O ATOM 303 CB LEU A 48 2.373 -4.880 -7.538 1.00 0.00 C ATOM 304 CG LEU A 48 1.956 -5.510 -8.871 1.00 0.00 C ATOM 305 CD1 LEU A 48 2.202 -4.521 -10.010 1.00 0.00 C ATOM 306 CD2 LEU A 48 2.774 -6.777 -9.120 1.00 0.00 C ATOM 0 H LEU A 48 -0.195 -4.989 -6.928 1.00 0.00 H new ATOM 0 HA LEU A 48 2.220 -6.606 -6.279 1.00 0.00 H new ATOM 0 HB2 LEU A 48 2.076 -3.832 -7.507 1.00 0.00 H new ATOM 0 HB3 LEU A 48 3.457 -4.908 -7.430 1.00 0.00 H new ATOM 0 HG LEU A 48 0.896 -5.761 -8.829 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.904 -4.974 -10.956 1.00 0.00 H new ATOM 0 HD12 LEU A 48 1.617 -3.617 -9.840 1.00 0.00 H new ATOM 0 HD13 LEU A 48 3.261 -4.266 -10.048 1.00 0.00 H new ATOM 0 HD21 LEU A 48 2.475 -7.223 -10.069 1.00 0.00 H new ATOM 0 HD22 LEU A 48 3.834 -6.525 -9.156 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.597 -7.489 -8.313 1.00 0.00 H new ATOM 318 N ARG A 49 2.759 -5.188 -4.249 1.00 0.00 N ATOM 319 CA ARG A 49 2.872 -4.468 -2.993 1.00 0.00 C ATOM 320 C ARG A 49 4.312 -4.401 -2.513 1.00 0.00 C ATOM 321 O ARG A 49 5.040 -5.393 -2.527 1.00 0.00 O ATOM 322 CB ARG A 49 2.009 -5.134 -1.925 1.00 0.00 C ATOM 323 CG ARG A 49 0.542 -5.043 -2.341 1.00 0.00 C ATOM 324 CD ARG A 49 -0.344 -5.509 -1.188 1.00 0.00 C ATOM 325 NE ARG A 49 -0.183 -4.617 -0.044 1.00 0.00 N ATOM 326 CZ ARG A 49 -0.794 -4.860 1.110 1.00 0.00 C ATOM 327 NH1 ARG A 49 -1.556 -5.911 1.232 1.00 0.00 N ATOM 328 NH2 ARG A 49 -0.626 -4.051 2.123 1.00 0.00 N ATOM 0 H ARG A 49 3.453 -5.920 -4.398 1.00 0.00 H new ATOM 0 HA ARG A 49 2.523 -3.450 -3.166 1.00 0.00 H new ATOM 0 HB2 ARG A 49 2.301 -6.177 -1.802 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.158 -4.645 -0.962 1.00 0.00 H new ATOM 0 HG2 ARG A 49 0.293 -4.017 -2.613 1.00 0.00 H new ATOM 0 HG3 ARG A 49 0.364 -5.659 -3.222 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -1.387 -5.525 -1.503 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -0.081 -6.528 -0.905 1.00 0.00 H new ATOM 0 HE ARG A 49 0.410 -3.792 -0.132 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -1.682 -6.544 0.442 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -2.026 -6.100 2.117 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -0.025 -3.232 2.028 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -1.096 -4.239 3.009 1.00 0.00 H new ATOM 342 N CYS A 50 4.704 -3.213 -2.082 1.00 0.00 N ATOM 343 CA CYS A 50 6.049 -2.999 -1.584 1.00 0.00 C ATOM 344 C CYS A 50 6.039 -2.961 -0.060 1.00 0.00 C ATOM 345 O CYS A 50 5.108 -2.436 0.550 1.00 0.00 O ATOM 346 CB CYS A 50 6.606 -1.687 -2.141 1.00 0.00 C ATOM 347 SG CYS A 50 7.350 -1.996 -3.762 1.00 0.00 S ATOM 0 H CYS A 50 4.109 -2.384 -2.068 1.00 0.00 H new ATOM 0 HA CYS A 50 6.686 -3.821 -1.911 1.00 0.00 H new ATOM 0 HB2 CYS A 50 5.810 -0.948 -2.228 1.00 0.00 H new ATOM 0 HB3 CYS A 50 7.350 -1.275 -1.459 1.00 0.00 H new ATOM 352 N PRO A 51 7.051 -3.503 0.557 1.00 0.00 N ATOM 353 CA PRO A 51 7.166 -3.541 2.042 1.00 0.00 C ATOM 354 C PRO A 51 7.417 -2.158 2.631 1.00 0.00 C ATOM 355 O PRO A 51 7.948 -1.273 1.959 1.00 0.00 O ATOM 356 CB PRO A 51 8.362 -4.465 2.291 1.00 0.00 C ATOM 357 CG PRO A 51 9.182 -4.391 1.046 1.00 0.00 C ATOM 358 CD PRO A 51 8.201 -4.143 -0.097 1.00 0.00 C ATOM 0 HA PRO A 51 6.248 -3.890 2.515 1.00 0.00 H new ATOM 0 HB2 PRO A 51 8.935 -4.141 3.160 1.00 0.00 H new ATOM 0 HB3 PRO A 51 8.036 -5.486 2.487 1.00 0.00 H new ATOM 0 HG2 PRO A 51 9.916 -3.587 1.110 1.00 0.00 H new ATOM 0 HG3 PRO A 51 9.736 -5.317 0.889 1.00 0.00 H new ATOM 0 HD2 PRO A 51 8.634 -3.500 -0.863 1.00 0.00 H new ATOM 0 HD3 PRO A 51 7.915 -5.074 -0.587 1.00 0.00 H new ATOM 366 N GLY A 52 7.063 -1.986 3.898 1.00 0.00 N ATOM 367 CA GLY A 52 7.286 -0.719 4.580 1.00 0.00 C ATOM 368 C GLY A 52 6.744 0.466 3.788 1.00 0.00 C ATOM 369 O GLY A 52 5.582 0.486 3.379 1.00 0.00 O ATOM 0 H GLY A 52 6.622 -2.705 4.472 1.00 0.00 H new ATOM 0 HA2 GLY A 52 6.809 -0.747 5.560 1.00 0.00 H new ATOM 0 HA3 GLY A 52 8.354 -0.583 4.749 1.00 0.00 H new ATOM 373 N SER A 53 7.610 1.451 3.588 1.00 0.00 N ATOM 374 CA SER A 53 7.241 2.658 2.854 1.00 0.00 C ATOM 375 C SER A 53 7.950 2.725 1.506 1.00 0.00 C ATOM 376 O SER A 53 8.107 3.803 0.934 1.00 0.00 O ATOM 377 CB SER A 53 7.588 3.897 3.680 1.00 0.00 C ATOM 378 OG SER A 53 8.991 4.126 3.617 1.00 0.00 O ATOM 0 H SER A 53 8.573 1.439 3.923 1.00 0.00 H new ATOM 0 HA SER A 53 6.167 2.627 2.673 1.00 0.00 H new ATOM 0 HB2 SER A 53 7.049 4.765 3.300 1.00 0.00 H new ATOM 0 HB3 SER A 53 7.277 3.757 4.715 1.00 0.00 H new ATOM 0 HG SER A 53 9.217 4.921 4.144 1.00 0.00 H new ATOM 384 N ASP A 54 8.352 1.572 0.987 1.00 0.00 N ATOM 385 CA ASP A 54 9.014 1.519 -0.307 1.00 0.00 C ATOM 386 C ASP A 54 7.979 1.613 -1.421 1.00 0.00 C ATOM 387 O ASP A 54 6.779 1.500 -1.170 1.00 0.00 O ATOM 388 CB ASP A 54 9.804 0.218 -0.441 1.00 0.00 C ATOM 389 CG ASP A 54 10.915 0.175 0.603 1.00 0.00 C ATOM 390 OD1 ASP A 54 11.178 1.206 1.202 1.00 0.00 O ATOM 391 OD2 ASP A 54 11.489 -0.885 0.786 1.00 0.00 O ATOM 0 H ASP A 54 8.232 0.666 1.440 1.00 0.00 H new ATOM 0 HA ASP A 54 9.703 2.360 -0.386 1.00 0.00 H new ATOM 0 HB2 ASP A 54 9.139 -0.636 -0.312 1.00 0.00 H new ATOM 0 HB3 ASP A 54 10.230 0.143 -1.441 1.00 0.00 H new ATOM 396 N VAL A 55 8.444 1.797 -2.649 1.00 0.00 N ATOM 397 CA VAL A 55 7.535 1.880 -3.781 1.00 0.00 C ATOM 398 C VAL A 55 7.950 0.908 -4.872 1.00 0.00 C ATOM 399 O VAL A 55 9.134 0.635 -5.072 1.00 0.00 O ATOM 400 CB VAL A 55 7.520 3.294 -4.350 1.00 0.00 C ATOM 401 CG1 VAL A 55 7.074 4.277 -3.271 1.00 0.00 C ATOM 402 CG2 VAL A 55 8.927 3.657 -4.825 1.00 0.00 C ATOM 0 H VAL A 55 9.432 1.890 -2.884 1.00 0.00 H new ATOM 0 HA VAL A 55 6.536 1.621 -3.429 1.00 0.00 H new ATOM 0 HB VAL A 55 6.825 3.344 -5.188 1.00 0.00 H new ATOM 0 HG11 VAL A 55 7.064 5.287 -3.681 1.00 0.00 H new ATOM 0 HG12 VAL A 55 6.073 4.014 -2.930 1.00 0.00 H new ATOM 0 HG13 VAL A 55 7.766 4.233 -2.430 1.00 0.00 H new ATOM 0 HG21 VAL A 55 8.924 4.668 -5.233 1.00 0.00 H new ATOM 0 HG22 VAL A 55 9.619 3.608 -3.984 1.00 0.00 H new ATOM 0 HG23 VAL A 55 9.243 2.955 -5.597 1.00 0.00 H new ATOM 412 N ILE A 56 6.954 0.392 -5.566 1.00 0.00 N ATOM 413 CA ILE A 56 7.172 -0.554 -6.642 1.00 0.00 C ATOM 414 C ILE A 56 7.860 0.115 -7.830 1.00 0.00 C ATOM 415 O ILE A 56 7.496 1.220 -8.231 1.00 0.00 O ATOM 416 CB ILE A 56 5.817 -1.120 -7.067 1.00 0.00 C ATOM 417 CG1 ILE A 56 5.169 -1.813 -5.866 1.00 0.00 C ATOM 418 CG2 ILE A 56 5.998 -2.127 -8.204 1.00 0.00 C ATOM 419 CD1 ILE A 56 3.726 -2.188 -6.209 1.00 0.00 C ATOM 0 H ILE A 56 5.973 0.616 -5.400 1.00 0.00 H new ATOM 0 HA ILE A 56 7.824 -1.355 -6.294 1.00 0.00 H new ATOM 0 HB ILE A 56 5.180 -0.308 -7.417 1.00 0.00 H new ATOM 0 HG12 ILE A 56 5.734 -2.706 -5.600 1.00 0.00 H new ATOM 0 HG13 ILE A 56 5.188 -1.153 -4.998 1.00 0.00 H new ATOM 0 HG21 ILE A 56 5.026 -2.523 -8.498 1.00 0.00 H new ATOM 0 HG22 ILE A 56 6.461 -1.632 -9.058 1.00 0.00 H new ATOM 0 HG23 ILE A 56 6.636 -2.944 -7.868 1.00 0.00 H new ATOM 0 HD11 ILE A 56 3.265 -2.681 -5.353 1.00 0.00 H new ATOM 0 HD12 ILE A 56 3.164 -1.287 -6.454 1.00 0.00 H new ATOM 0 HD13 ILE A 56 3.719 -2.863 -7.064 1.00 0.00 H new ATOM 431 N MET A 57 8.834 -0.577 -8.404 1.00 0.00 N ATOM 432 CA MET A 57 9.541 -0.058 -9.563 1.00 0.00 C ATOM 433 C MET A 57 9.617 -1.154 -10.622 1.00 0.00 C ATOM 434 O MET A 57 10.414 -2.084 -10.527 1.00 0.00 O ATOM 435 CB MET A 57 10.936 0.449 -9.171 1.00 0.00 C ATOM 436 CG MET A 57 11.949 -0.694 -9.175 1.00 0.00 C ATOM 437 SD MET A 57 13.416 -0.179 -8.248 1.00 0.00 S ATOM 438 CE MET A 57 13.696 1.403 -9.088 1.00 0.00 C ATOM 0 H MET A 57 9.150 -1.494 -8.087 1.00 0.00 H new ATOM 0 HA MET A 57 9.001 0.795 -9.974 1.00 0.00 H new ATOM 0 HB2 MET A 57 11.254 1.226 -9.866 1.00 0.00 H new ATOM 0 HB3 MET A 57 10.898 0.904 -8.181 1.00 0.00 H new ATOM 0 HG2 MET A 57 11.513 -1.586 -8.725 1.00 0.00 H new ATOM 0 HG3 MET A 57 12.221 -0.953 -10.198 1.00 0.00 H new ATOM 0 HE1 MET A 57 14.740 1.694 -8.976 1.00 0.00 H new ATOM 0 HE2 MET A 57 13.459 1.300 -10.147 1.00 0.00 H new ATOM 0 HE3 MET A 57 13.057 2.168 -8.646 1.00 0.00 H new ATOM 448 N VAL A 58 8.734 -1.047 -11.607 1.00 0.00 N ATOM 449 CA VAL A 58 8.657 -2.039 -12.669 1.00 0.00 C ATOM 450 C VAL A 58 9.929 -2.065 -13.508 1.00 0.00 C ATOM 451 O VAL A 58 10.354 -1.045 -14.049 1.00 0.00 O ATOM 452 CB VAL A 58 7.453 -1.739 -13.564 1.00 0.00 C ATOM 453 CG1 VAL A 58 7.295 -2.840 -14.616 1.00 0.00 C ATOM 454 CG2 VAL A 58 6.192 -1.674 -12.703 1.00 0.00 C ATOM 0 H VAL A 58 8.062 -0.284 -11.692 1.00 0.00 H new ATOM 0 HA VAL A 58 8.542 -3.019 -12.207 1.00 0.00 H new ATOM 0 HB VAL A 58 7.607 -0.785 -14.068 1.00 0.00 H new ATOM 0 HG11 VAL A 58 6.436 -2.618 -15.249 1.00 0.00 H new ATOM 0 HG12 VAL A 58 8.194 -2.889 -15.230 1.00 0.00 H new ATOM 0 HG13 VAL A 58 7.142 -3.798 -14.120 1.00 0.00 H new ATOM 0 HG21 VAL A 58 5.330 -1.460 -13.335 1.00 0.00 H new ATOM 0 HG22 VAL A 58 6.045 -2.630 -12.200 1.00 0.00 H new ATOM 0 HG23 VAL A 58 6.300 -0.885 -11.958 1.00 0.00 H new ATOM 464 N GLU A 59 10.521 -3.249 -13.619 1.00 0.00 N ATOM 465 CA GLU A 59 11.735 -3.422 -14.405 1.00 0.00 C ATOM 466 C GLU A 59 11.391 -4.052 -15.747 1.00 0.00 C ATOM 467 O GLU A 59 11.815 -3.568 -16.797 1.00 0.00 O ATOM 468 CB GLU A 59 12.729 -4.301 -13.645 1.00 0.00 C ATOM 469 CG GLU A 59 13.264 -3.520 -12.446 1.00 0.00 C ATOM 470 CD GLU A 59 13.980 -2.266 -12.931 1.00 0.00 C ATOM 471 OE1 GLU A 59 14.383 -2.247 -14.083 1.00 0.00 O ATOM 472 OE2 GLU A 59 14.118 -1.343 -12.145 1.00 0.00 O ATOM 0 H GLU A 59 10.180 -4.102 -13.175 1.00 0.00 H new ATOM 0 HA GLU A 59 12.193 -2.448 -14.578 1.00 0.00 H new ATOM 0 HB2 GLU A 59 12.243 -5.218 -13.311 1.00 0.00 H new ATOM 0 HB3 GLU A 59 13.549 -4.595 -14.300 1.00 0.00 H new ATOM 0 HG2 GLU A 59 12.444 -3.249 -11.781 1.00 0.00 H new ATOM 0 HG3 GLU A 59 13.949 -4.142 -11.870 1.00 0.00 H new ATOM 479 N ASN A 60 10.616 -5.128 -15.708 1.00 0.00 N ATOM 480 CA ASN A 60 10.218 -5.804 -16.933 1.00 0.00 C ATOM 481 C ASN A 60 8.899 -6.530 -16.733 1.00 0.00 C ATOM 482 O ASN A 60 8.570 -6.973 -15.632 1.00 0.00 O ATOM 483 CB ASN A 60 11.291 -6.801 -17.369 1.00 0.00 C ATOM 484 CG ASN A 60 12.635 -6.095 -17.465 1.00 0.00 C ATOM 485 OD1 ASN A 60 12.888 -5.360 -18.419 1.00 0.00 O ATOM 486 ND2 ASN A 60 13.515 -6.269 -16.519 1.00 0.00 N ATOM 0 H ASN A 60 10.254 -5.547 -14.851 1.00 0.00 H new ATOM 0 HA ASN A 60 10.097 -5.051 -17.712 1.00 0.00 H new ATOM 0 HB2 ASN A 60 11.350 -7.622 -16.655 1.00 0.00 H new ATOM 0 HB3 ASN A 60 11.028 -7.236 -18.333 1.00 0.00 H new ATOM 0 HD21 ASN A 60 14.417 -5.795 -16.568 1.00 0.00 H new ATOM 0 HD22 ASN A 60 13.302 -6.879 -15.730 1.00 0.00 H new ATOM 493 N ALA A 61 8.151 -6.644 -17.818 1.00 0.00 N ATOM 494 CA ALA A 61 6.863 -7.313 -17.785 1.00 0.00 C ATOM 495 C ALA A 61 6.348 -7.496 -19.201 1.00 0.00 C ATOM 496 O ALA A 61 6.746 -6.767 -20.111 1.00 0.00 O ATOM 497 CB ALA A 61 5.863 -6.495 -16.970 1.00 0.00 C ATOM 0 H ALA A 61 8.415 -6.281 -18.734 1.00 0.00 H new ATOM 0 HA ALA A 61 6.982 -8.289 -17.315 1.00 0.00 H new ATOM 0 HB1 ALA A 61 4.901 -7.008 -16.953 1.00 0.00 H new ATOM 0 HB2 ALA A 61 6.231 -6.381 -15.950 1.00 0.00 H new ATOM 0 HB3 ALA A 61 5.742 -5.511 -17.424 1.00 0.00 H new ATOM 503 N ASN A 62 5.476 -8.476 -19.394 1.00 0.00 N ATOM 504 CA ASN A 62 4.941 -8.733 -20.723 1.00 0.00 C ATOM 505 C ASN A 62 3.530 -9.323 -20.663 1.00 0.00 C ATOM 506 O ASN A 62 3.154 -9.966 -19.682 1.00 0.00 O ATOM 507 CB ASN A 62 5.868 -9.704 -21.455 1.00 0.00 C ATOM 508 CG ASN A 62 5.396 -9.887 -22.890 1.00 0.00 C ATOM 509 OD1 ASN A 62 5.767 -9.120 -23.776 1.00 0.00 O ATOM 510 ND2 ASN A 62 4.591 -10.871 -23.169 1.00 0.00 N ATOM 0 H ASN A 62 5.129 -9.096 -18.662 1.00 0.00 H new ATOM 0 HA ASN A 62 4.883 -7.784 -21.256 1.00 0.00 H new ATOM 0 HB2 ASN A 62 6.889 -9.323 -21.444 1.00 0.00 H new ATOM 0 HB3 ASN A 62 5.881 -10.665 -20.942 1.00 0.00 H new ATOM 0 HD21 ASN A 62 4.266 -11.008 -24.126 1.00 0.00 H new ATOM 0 HD22 ASN A 62 4.286 -11.505 -22.431 1.00 0.00 H new ATOM 517 N TYR A 63 2.765 -9.119 -21.735 1.00 0.00 N ATOM 518 CA TYR A 63 1.408 -9.649 -21.835 1.00 0.00 C ATOM 519 C TYR A 63 1.374 -10.626 -23.007 1.00 0.00 C ATOM 520 O TYR A 63 1.650 -10.242 -24.142 1.00 0.00 O ATOM 521 CB TYR A 63 0.432 -8.488 -22.075 1.00 0.00 C ATOM 522 CG TYR A 63 -0.949 -8.996 -22.429 1.00 0.00 C ATOM 523 CD1 TYR A 63 -1.269 -9.278 -23.763 1.00 0.00 C ATOM 524 CD2 TYR A 63 -1.917 -9.159 -21.431 1.00 0.00 C ATOM 525 CE1 TYR A 63 -2.554 -9.726 -24.099 1.00 0.00 C ATOM 526 CE2 TYR A 63 -3.205 -9.604 -21.768 1.00 0.00 C ATOM 527 CZ TYR A 63 -3.522 -9.888 -23.102 1.00 0.00 C ATOM 528 OH TYR A 63 -4.788 -10.326 -23.435 1.00 0.00 O ATOM 0 H TYR A 63 3.066 -8.586 -22.551 1.00 0.00 H new ATOM 0 HA TYR A 63 1.117 -10.162 -20.918 1.00 0.00 H new ATOM 0 HB2 TYR A 63 0.375 -7.867 -21.181 1.00 0.00 H new ATOM 0 HB3 TYR A 63 0.807 -7.855 -22.880 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -0.524 -9.150 -24.534 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -1.673 -8.942 -20.402 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -2.797 -9.946 -25.128 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -3.952 -9.727 -20.998 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.242 -10.657 -22.632 1.00 0.00 H new ATOM 538 N GLY A 64 1.091 -11.898 -22.737 1.00 0.00 N ATOM 539 CA GLY A 64 1.105 -12.891 -23.805 1.00 0.00 C ATOM 540 C GLY A 64 1.279 -14.290 -23.230 1.00 0.00 C ATOM 541 O GLY A 64 0.669 -14.638 -22.220 1.00 0.00 O ATOM 0 H GLY A 64 0.855 -12.258 -21.812 1.00 0.00 H new ATOM 0 HA2 GLY A 64 0.175 -12.837 -24.372 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.915 -12.674 -24.501 1.00 0.00 H new ATOM 545 N ARG A 65 2.116 -15.084 -23.889 1.00 0.00 N ATOM 546 CA ARG A 65 2.364 -16.448 -23.444 1.00 0.00 C ATOM 547 C ARG A 65 3.658 -17.010 -24.018 1.00 0.00 C ATOM 548 O ARG A 65 3.837 -17.093 -25.232 1.00 0.00 O ATOM 549 CB ARG A 65 1.203 -17.350 -23.840 1.00 0.00 C ATOM 550 CG ARG A 65 1.676 -18.801 -23.842 1.00 0.00 C ATOM 551 CD ARG A 65 0.494 -19.734 -23.568 1.00 0.00 C ATOM 552 NE ARG A 65 0.651 -20.364 -22.262 1.00 0.00 N ATOM 553 CZ ARG A 65 0.165 -19.804 -21.157 1.00 0.00 C ATOM 554 NH1 ARG A 65 -0.484 -18.672 -21.230 1.00 0.00 N ATOM 555 NH2 ARG A 65 0.331 -20.388 -20.004 1.00 0.00 N ATOM 0 H ARG A 65 2.630 -14.809 -24.726 1.00 0.00 H new ATOM 0 HA ARG A 65 2.460 -16.420 -22.359 1.00 0.00 H new ATOM 0 HB2 ARG A 65 0.375 -17.225 -23.142 1.00 0.00 H new ATOM 0 HB3 ARG A 65 0.832 -17.074 -24.827 1.00 0.00 H new ATOM 0 HG2 ARG A 65 2.127 -19.044 -24.804 1.00 0.00 H new ATOM 0 HG3 ARG A 65 2.446 -18.943 -23.084 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -0.439 -19.172 -23.600 1.00 0.00 H new ATOM 0 HD3 ARG A 65 0.434 -20.497 -24.344 1.00 0.00 H new ATOM 0 HE ARG A 65 1.145 -21.254 -22.194 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -0.618 -18.218 -22.134 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -0.857 -18.242 -20.383 1.00 0.00 H new ATOM 0 HH21 ARG A 65 0.833 -21.274 -19.949 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -0.041 -19.959 -19.157 1.00 0.00 H new ATOM 569 N THR A 66 4.548 -17.407 -23.117 1.00 0.00 N ATOM 570 CA THR A 66 5.826 -17.979 -23.503 1.00 0.00 C ATOM 571 C THR A 66 5.986 -19.353 -22.858 1.00 0.00 C ATOM 572 O THR A 66 7.060 -19.957 -22.900 1.00 0.00 O ATOM 573 CB THR A 66 6.964 -17.063 -23.053 1.00 0.00 C ATOM 574 OG1 THR A 66 7.194 -17.247 -21.663 1.00 0.00 O ATOM 575 CG2 THR A 66 6.585 -15.603 -23.316 1.00 0.00 C ATOM 0 H THR A 66 4.404 -17.342 -22.109 1.00 0.00 H new ATOM 0 HA THR A 66 5.860 -18.081 -24.588 1.00 0.00 H new ATOM 0 HB THR A 66 7.868 -17.308 -23.611 1.00 0.00 H new ATOM 0 HG1 THR A 66 6.445 -16.871 -21.155 1.00 0.00 H new ATOM 0 HG21 THR A 66 7.398 -14.952 -22.994 1.00 0.00 H new ATOM 0 HG22 THR A 66 6.406 -15.460 -24.382 1.00 0.00 H new ATOM 0 HG23 THR A 66 5.681 -15.356 -22.760 1.00 0.00 H new ATOM 583 N ASP A 67 4.903 -19.828 -22.253 1.00 0.00 N ATOM 584 CA ASP A 67 4.902 -21.119 -21.583 1.00 0.00 C ATOM 585 C ASP A 67 3.553 -21.804 -21.781 1.00 0.00 C ATOM 586 O ASP A 67 2.725 -21.346 -22.567 1.00 0.00 O ATOM 587 CB ASP A 67 5.171 -20.924 -20.090 1.00 0.00 C ATOM 588 CG ASP A 67 5.453 -22.266 -19.423 1.00 0.00 C ATOM 589 OD1 ASP A 67 5.558 -23.250 -20.137 1.00 0.00 O ATOM 590 OD2 ASP A 67 5.561 -22.286 -18.209 1.00 0.00 O ATOM 0 H ASP A 67 4.011 -19.334 -22.214 1.00 0.00 H new ATOM 0 HA ASP A 67 5.685 -21.746 -22.010 1.00 0.00 H new ATOM 0 HB2 ASP A 67 6.021 -20.256 -19.951 1.00 0.00 H new ATOM 0 HB3 ASP A 67 4.311 -20.449 -19.618 1.00 0.00 H new ATOM 595 N ASP A 68 3.335 -22.895 -21.060 1.00 0.00 N ATOM 596 CA ASP A 68 2.078 -23.627 -21.166 1.00 0.00 C ATOM 597 C ASP A 68 1.717 -24.272 -19.838 1.00 0.00 C ATOM 598 O ASP A 68 0.683 -24.926 -19.716 1.00 0.00 O ATOM 599 CB ASP A 68 2.183 -24.694 -22.256 1.00 0.00 C ATOM 600 CG ASP A 68 3.405 -25.573 -22.022 1.00 0.00 C ATOM 601 OD1 ASP A 68 3.868 -25.628 -20.896 1.00 0.00 O ATOM 602 OD2 ASP A 68 3.867 -26.175 -22.978 1.00 0.00 O ATOM 0 H ASP A 68 4.005 -23.291 -20.401 1.00 0.00 H new ATOM 0 HA ASP A 68 1.290 -22.922 -21.431 1.00 0.00 H new ATOM 0 HB2 ASP A 68 1.282 -25.307 -22.262 1.00 0.00 H new ATOM 0 HB3 ASP A 68 2.251 -24.218 -23.234 1.00 0.00 H new ATOM 607 N LYS A 69 2.568 -24.083 -18.840 1.00 0.00 N ATOM 608 CA LYS A 69 2.307 -24.653 -17.528 1.00 0.00 C ATOM 609 C LYS A 69 1.834 -23.589 -16.541 1.00 0.00 C ATOM 610 O LYS A 69 1.690 -23.869 -15.351 1.00 0.00 O ATOM 611 CB LYS A 69 3.557 -25.332 -16.977 1.00 0.00 C ATOM 612 CG LYS A 69 3.943 -26.496 -17.891 1.00 0.00 C ATOM 613 CD LYS A 69 4.932 -27.408 -17.164 1.00 0.00 C ATOM 614 CE LYS A 69 6.229 -26.644 -16.900 1.00 0.00 C ATOM 615 NZ LYS A 69 6.163 -26.005 -15.555 1.00 0.00 N ATOM 0 H LYS A 69 3.433 -23.547 -18.912 1.00 0.00 H new ATOM 0 HA LYS A 69 1.516 -25.393 -17.649 1.00 0.00 H new ATOM 0 HB2 LYS A 69 4.376 -24.616 -16.915 1.00 0.00 H new ATOM 0 HB3 LYS A 69 3.373 -25.694 -15.966 1.00 0.00 H new ATOM 0 HG2 LYS A 69 3.054 -27.059 -18.176 1.00 0.00 H new ATOM 0 HG3 LYS A 69 4.389 -26.118 -18.811 1.00 0.00 H new ATOM 0 HD2 LYS A 69 4.502 -27.752 -16.223 1.00 0.00 H new ATOM 0 HD3 LYS A 69 5.135 -28.294 -17.765 1.00 0.00 H new ATOM 0 HE2 LYS A 69 7.080 -27.323 -16.951 1.00 0.00 H new ATOM 0 HE3 LYS A 69 6.380 -25.885 -17.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 6.103 -24.972 -15.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 5.323 -26.349 -15.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 7.017 -26.247 -15.013 1.00 0.00 H new ATOM 629 N ILE A 70 1.581 -22.377 -17.027 1.00 0.00 N ATOM 630 CA ILE A 70 1.116 -21.299 -16.156 1.00 0.00 C ATOM 631 C ILE A 70 -0.345 -21.002 -16.442 1.00 0.00 C ATOM 632 O ILE A 70 -0.759 -20.939 -17.600 1.00 0.00 O ATOM 633 CB ILE A 70 1.942 -20.031 -16.384 1.00 0.00 C ATOM 634 CG1 ILE A 70 3.423 -20.349 -16.189 1.00 0.00 C ATOM 635 CG2 ILE A 70 1.519 -18.958 -15.379 1.00 0.00 C ATOM 636 CD1 ILE A 70 3.619 -21.008 -14.828 1.00 0.00 C ATOM 0 H ILE A 70 1.688 -22.117 -18.008 1.00 0.00 H new ATOM 0 HA ILE A 70 1.232 -21.617 -15.120 1.00 0.00 H new ATOM 0 HB ILE A 70 1.775 -19.667 -17.398 1.00 0.00 H new ATOM 0 HG12 ILE A 70 3.772 -21.011 -16.981 1.00 0.00 H new ATOM 0 HG13 ILE A 70 4.015 -19.436 -16.253 1.00 0.00 H new ATOM 0 HG21 ILE A 70 2.107 -18.055 -15.542 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.461 -18.731 -15.513 1.00 0.00 H new ATOM 0 HG23 ILE A 70 1.686 -19.323 -14.365 1.00 0.00 H new ATOM 0 HD11 ILE A 70 4.675 -21.237 -14.683 1.00 0.00 H new ATOM 0 HD12 ILE A 70 3.284 -20.329 -14.044 1.00 0.00 H new ATOM 0 HD13 ILE A 70 3.038 -21.929 -14.783 1.00 0.00 H new ATOM 648 N CYS A 71 -1.125 -20.842 -15.386 1.00 0.00 N ATOM 649 CA CYS A 71 -2.548 -20.576 -15.544 1.00 0.00 C ATOM 650 C CYS A 71 -3.173 -21.673 -16.390 1.00 0.00 C ATOM 651 O CYS A 71 -3.553 -21.450 -17.540 1.00 0.00 O ATOM 652 CB CYS A 71 -2.779 -19.224 -16.220 1.00 0.00 C ATOM 653 SG CYS A 71 -2.399 -17.893 -15.055 1.00 0.00 S ATOM 0 H CYS A 71 -0.803 -20.891 -14.419 1.00 0.00 H new ATOM 0 HA CYS A 71 -3.008 -20.553 -14.556 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -2.150 -19.136 -17.106 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -3.813 -19.145 -16.554 1.00 0.00 H new ATOM 658 N ASP A 72 -3.257 -22.862 -15.813 1.00 0.00 N ATOM 659 CA ASP A 72 -3.818 -24.004 -16.515 1.00 0.00 C ATOM 660 C ASP A 72 -5.147 -23.660 -17.174 1.00 0.00 C ATOM 661 O ASP A 72 -6.154 -23.439 -16.502 1.00 0.00 O ATOM 662 CB ASP A 72 -4.016 -25.158 -15.535 1.00 0.00 C ATOM 663 CG ASP A 72 -4.847 -24.687 -14.346 1.00 0.00 C ATOM 664 OD1 ASP A 72 -5.384 -23.595 -14.422 1.00 0.00 O ATOM 665 OD2 ASP A 72 -4.925 -25.421 -13.375 1.00 0.00 O ATOM 0 H ASP A 72 -2.944 -23.060 -14.863 1.00 0.00 H new ATOM 0 HA ASP A 72 -3.119 -24.294 -17.300 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -4.515 -25.989 -16.033 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -3.049 -25.526 -15.192 1.00 0.00 H new ATOM 670 N ALA A 73 -5.130 -23.646 -18.500 1.00 0.00 N ATOM 671 CA ALA A 73 -6.322 -23.364 -19.288 1.00 0.00 C ATOM 672 C ALA A 73 -6.477 -24.464 -20.333 1.00 0.00 C ATOM 673 O ALA A 73 -5.882 -25.534 -20.193 1.00 0.00 O ATOM 674 CB ALA A 73 -6.206 -21.997 -19.968 1.00 0.00 C ATOM 0 H ALA A 73 -4.295 -23.829 -19.057 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.197 -23.340 -18.639 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -7.106 -21.804 -20.552 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.092 -21.222 -19.210 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -5.337 -21.991 -20.627 1.00 0.00 H new ATOM 680 N ASP A 74 -7.269 -24.223 -21.372 1.00 0.00 N ATOM 681 CA ASP A 74 -7.457 -25.239 -22.398 1.00 0.00 C ATOM 682 C ASP A 74 -6.138 -25.520 -23.121 1.00 0.00 C ATOM 683 O ASP A 74 -5.348 -24.612 -23.381 1.00 0.00 O ATOM 684 CB ASP A 74 -8.512 -24.794 -23.401 1.00 0.00 C ATOM 685 CG ASP A 74 -8.431 -23.291 -23.601 1.00 0.00 C ATOM 686 OD1 ASP A 74 -7.583 -22.671 -22.978 1.00 0.00 O ATOM 687 OD2 ASP A 74 -9.210 -22.782 -24.380 1.00 0.00 O ATOM 0 H ASP A 74 -7.780 -23.354 -21.524 1.00 0.00 H new ATOM 0 HA ASP A 74 -7.795 -26.155 -21.913 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -8.361 -25.305 -24.352 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -9.505 -25.070 -23.045 1.00 0.00 H new ATOM 692 N PRO A 75 -5.884 -26.758 -23.442 1.00 0.00 N ATOM 693 CA PRO A 75 -4.620 -27.164 -24.121 1.00 0.00 C ATOM 694 C PRO A 75 -4.379 -26.412 -25.425 1.00 0.00 C ATOM 695 O PRO A 75 -3.243 -26.049 -25.734 1.00 0.00 O ATOM 696 CB PRO A 75 -4.792 -28.665 -24.379 1.00 0.00 C ATOM 697 CG PRO A 75 -6.240 -28.952 -24.182 1.00 0.00 C ATOM 698 CD PRO A 75 -6.767 -27.905 -23.211 1.00 0.00 C ATOM 0 HA PRO A 75 -3.751 -26.932 -23.505 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -4.476 -28.926 -25.389 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -4.181 -29.251 -23.693 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -6.776 -28.905 -25.130 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -6.384 -29.956 -23.784 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -7.809 -27.658 -23.413 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -6.715 -28.251 -22.179 1.00 0.00 H new ATOM 706 N PHE A 76 -5.445 -26.183 -26.184 1.00 0.00 N ATOM 707 CA PHE A 76 -5.319 -25.485 -27.459 1.00 0.00 C ATOM 708 C PHE A 76 -4.811 -24.060 -27.256 1.00 0.00 C ATOM 709 O PHE A 76 -4.074 -23.535 -28.091 1.00 0.00 O ATOM 710 CB PHE A 76 -6.670 -25.446 -28.181 1.00 0.00 C ATOM 711 CG PHE A 76 -7.140 -26.851 -28.467 1.00 0.00 C ATOM 712 CD1 PHE A 76 -6.558 -27.594 -29.502 1.00 0.00 C ATOM 713 CD2 PHE A 76 -8.168 -27.409 -27.700 1.00 0.00 C ATOM 714 CE1 PHE A 76 -7.002 -28.896 -29.766 1.00 0.00 C ATOM 715 CE2 PHE A 76 -8.612 -28.711 -27.963 1.00 0.00 C ATOM 716 CZ PHE A 76 -8.030 -29.454 -28.997 1.00 0.00 C ATOM 0 H PHE A 76 -6.395 -26.466 -25.943 1.00 0.00 H new ATOM 0 HA PHE A 76 -4.598 -26.031 -28.067 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -7.405 -24.925 -27.568 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -6.579 -24.887 -29.112 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -5.766 -27.163 -30.097 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -8.620 -26.835 -26.904 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -6.551 -29.469 -30.563 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -9.404 -29.142 -27.368 1.00 0.00 H new ATOM 0 HZ PHE A 76 -8.374 -30.457 -29.201 1.00 0.00 H new ATOM 726 N GLN A 77 -5.208 -23.429 -26.154 1.00 0.00 N ATOM 727 CA GLN A 77 -4.766 -22.063 -25.892 1.00 0.00 C ATOM 728 C GLN A 77 -3.431 -22.071 -25.158 1.00 0.00 C ATOM 729 O GLN A 77 -2.776 -21.037 -25.034 1.00 0.00 O ATOM 730 CB GLN A 77 -5.803 -21.324 -25.050 1.00 0.00 C ATOM 731 CG GLN A 77 -7.157 -21.347 -25.756 1.00 0.00 C ATOM 732 CD GLN A 77 -8.165 -20.537 -24.945 1.00 0.00 C ATOM 733 OE1 GLN A 77 -7.779 -19.710 -24.122 1.00 0.00 O ATOM 734 NE2 GLN A 77 -9.442 -20.742 -25.117 1.00 0.00 N ATOM 0 H GLN A 77 -5.820 -23.830 -25.444 1.00 0.00 H new ATOM 0 HA GLN A 77 -4.648 -21.552 -26.847 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -5.887 -21.791 -24.068 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -5.485 -20.294 -24.887 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -7.063 -20.932 -26.760 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -7.504 -22.374 -25.867 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -9.761 -21.429 -25.801 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -10.122 -20.215 -24.568 1.00 0.00 H new ATOM 743 N MET A 78 -3.037 -23.242 -24.676 1.00 0.00 N ATOM 744 CA MET A 78 -1.777 -23.373 -23.959 1.00 0.00 C ATOM 745 C MET A 78 -0.702 -23.954 -24.875 1.00 0.00 C ATOM 746 O MET A 78 0.450 -24.105 -24.468 1.00 0.00 O ATOM 747 CB MET A 78 -1.961 -24.284 -22.744 1.00 0.00 C ATOM 748 CG MET A 78 -3.026 -23.691 -21.817 1.00 0.00 C ATOM 749 SD MET A 78 -2.331 -22.295 -20.898 1.00 0.00 S ATOM 750 CE MET A 78 -1.338 -23.268 -19.741 1.00 0.00 C ATOM 0 H MET A 78 -3.567 -24.108 -24.768 1.00 0.00 H new ATOM 0 HA MET A 78 -1.462 -22.384 -23.626 1.00 0.00 H new ATOM 0 HB2 MET A 78 -2.259 -25.282 -23.066 1.00 0.00 H new ATOM 0 HB3 MET A 78 -1.017 -24.390 -22.210 1.00 0.00 H new ATOM 0 HG2 MET A 78 -3.886 -23.362 -22.400 1.00 0.00 H new ATOM 0 HG3 MET A 78 -3.383 -24.453 -21.124 1.00 0.00 H new ATOM 0 HE1 MET A 78 -1.684 -23.088 -18.723 1.00 0.00 H new ATOM 0 HE2 MET A 78 -1.439 -24.327 -19.976 1.00 0.00 H new ATOM 0 HE3 MET A 78 -0.291 -22.976 -19.825 1.00 0.00 H new ATOM 760 N GLU A 79 -1.086 -24.314 -26.104 1.00 0.00 N ATOM 761 CA GLU A 79 -0.133 -24.910 -27.041 1.00 0.00 C ATOM 762 C GLU A 79 0.956 -23.934 -27.481 1.00 0.00 C ATOM 763 O GLU A 79 2.133 -24.297 -27.489 1.00 0.00 O ATOM 764 CB GLU A 79 -0.853 -25.444 -28.289 1.00 0.00 C ATOM 765 CG GLU A 79 -1.496 -26.802 -27.989 1.00 0.00 C ATOM 766 CD GLU A 79 -1.564 -27.640 -29.260 1.00 0.00 C ATOM 767 OE1 GLU A 79 -1.340 -27.087 -30.324 1.00 0.00 O ATOM 768 OE2 GLU A 79 -1.838 -28.823 -29.149 1.00 0.00 O ATOM 0 H GLU A 79 -2.033 -24.205 -26.467 1.00 0.00 H new ATOM 0 HA GLU A 79 0.344 -25.729 -26.502 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -1.616 -24.735 -28.609 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -0.145 -25.543 -29.112 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -0.918 -27.327 -27.228 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -2.498 -26.658 -27.585 1.00 0.00 H new ATOM 775 N ASN A 80 0.594 -22.719 -27.872 1.00 0.00 N ATOM 776 CA ASN A 80 1.602 -21.765 -28.330 1.00 0.00 C ATOM 777 C ASN A 80 2.331 -21.111 -27.164 1.00 0.00 C ATOM 778 O ASN A 80 1.720 -20.454 -26.329 1.00 0.00 O ATOM 779 CB ASN A 80 0.949 -20.672 -29.183 1.00 0.00 C ATOM 780 CG ASN A 80 2.025 -19.872 -29.916 1.00 0.00 C ATOM 781 OD1 ASN A 80 2.961 -20.449 -30.465 1.00 0.00 O ATOM 782 ND2 ASN A 80 1.951 -18.569 -29.949 1.00 0.00 N ATOM 0 H ASN A 80 -0.366 -22.374 -27.883 1.00 0.00 H new ATOM 0 HA ASN A 80 2.326 -22.322 -28.924 1.00 0.00 H new ATOM 0 HB2 ASN A 80 0.264 -21.121 -29.902 1.00 0.00 H new ATOM 0 HB3 ASN A 80 0.358 -20.009 -28.551 1.00 0.00 H new ATOM 0 HD21 ASN A 80 2.670 -18.029 -30.431 1.00 0.00 H new ATOM 0 HD22 ASN A 80 1.174 -18.091 -29.493 1.00 0.00 H new ATOM 789 N VAL A 81 3.643 -21.309 -27.129 1.00 0.00 N ATOM 790 CA VAL A 81 4.471 -20.740 -26.070 1.00 0.00 C ATOM 791 C VAL A 81 5.366 -19.636 -26.618 1.00 0.00 C ATOM 792 O VAL A 81 6.488 -19.443 -26.153 1.00 0.00 O ATOM 793 CB VAL A 81 5.331 -21.825 -25.425 1.00 0.00 C ATOM 794 CG1 VAL A 81 4.443 -22.998 -25.004 1.00 0.00 C ATOM 795 CG2 VAL A 81 6.382 -22.308 -26.427 1.00 0.00 C ATOM 0 H VAL A 81 4.156 -21.857 -27.819 1.00 0.00 H new ATOM 0 HA VAL A 81 3.808 -20.314 -25.317 1.00 0.00 H new ATOM 0 HB VAL A 81 5.831 -21.418 -24.546 1.00 0.00 H new ATOM 0 HG11 VAL A 81 5.057 -23.772 -24.544 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.698 -22.652 -24.287 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.940 -23.407 -25.881 1.00 0.00 H new ATOM 0 HG21 VAL A 81 6.995 -23.082 -25.966 1.00 0.00 H new ATOM 0 HG22 VAL A 81 5.885 -22.715 -27.308 1.00 0.00 H new ATOM 0 HG23 VAL A 81 7.015 -21.471 -26.722 1.00 0.00 H new ATOM 805 N GLN A 82 4.863 -18.911 -27.610 1.00 0.00 N ATOM 806 CA GLN A 82 5.627 -17.821 -28.207 1.00 0.00 C ATOM 807 C GLN A 82 4.711 -16.652 -28.535 1.00 0.00 C ATOM 808 O GLN A 82 4.197 -16.533 -29.649 1.00 0.00 O ATOM 809 CB GLN A 82 6.341 -18.295 -29.472 1.00 0.00 C ATOM 810 CG GLN A 82 7.382 -19.351 -29.100 1.00 0.00 C ATOM 811 CD GLN A 82 8.578 -18.685 -28.427 1.00 0.00 C ATOM 812 OE1 GLN A 82 8.995 -19.101 -27.346 1.00 0.00 O ATOM 813 NE2 GLN A 82 9.156 -17.669 -29.007 1.00 0.00 N ATOM 0 H GLN A 82 3.938 -19.055 -28.015 1.00 0.00 H new ATOM 0 HA GLN A 82 6.376 -17.493 -27.486 1.00 0.00 H new ATOM 0 HB2 GLN A 82 5.620 -18.711 -30.176 1.00 0.00 H new ATOM 0 HB3 GLN A 82 6.822 -17.453 -29.969 1.00 0.00 H new ATOM 0 HG2 GLN A 82 6.941 -20.089 -28.430 1.00 0.00 H new ATOM 0 HG3 GLN A 82 7.707 -19.885 -29.993 1.00 0.00 H new ATOM 0 HE21 GLN A 82 8.808 -17.327 -29.903 1.00 0.00 H new ATOM 0 HE22 GLN A 82 9.956 -17.217 -28.565 1.00 0.00 H new ATOM 822 N CYS A 83 4.519 -15.796 -27.544 1.00 0.00 N ATOM 823 CA CYS A 83 3.675 -14.623 -27.694 1.00 0.00 C ATOM 824 C CYS A 83 4.200 -13.519 -26.787 1.00 0.00 C ATOM 825 O CYS A 83 4.303 -13.705 -25.574 1.00 0.00 O ATOM 826 CB CYS A 83 2.230 -14.971 -27.327 1.00 0.00 C ATOM 827 SG CYS A 83 1.184 -13.503 -27.509 1.00 0.00 S ATOM 0 H CYS A 83 4.940 -15.894 -26.620 1.00 0.00 H new ATOM 0 HA CYS A 83 3.695 -14.282 -28.729 1.00 0.00 H new ATOM 0 HB2 CYS A 83 1.864 -15.772 -27.969 1.00 0.00 H new ATOM 0 HB3 CYS A 83 2.183 -15.338 -26.302 1.00 0.00 H new ATOM 832 N TYR A 84 4.561 -12.381 -27.366 1.00 0.00 N ATOM 833 CA TYR A 84 5.100 -11.290 -26.563 1.00 0.00 C ATOM 834 C TYR A 84 4.418 -9.956 -26.880 1.00 0.00 C ATOM 835 O TYR A 84 4.007 -9.712 -28.014 1.00 0.00 O ATOM 836 CB TYR A 84 6.604 -11.155 -26.819 1.00 0.00 C ATOM 837 CG TYR A 84 7.337 -12.390 -26.335 1.00 0.00 C ATOM 838 CD1 TYR A 84 7.790 -12.458 -25.011 1.00 0.00 C ATOM 839 CD2 TYR A 84 7.583 -13.453 -27.214 1.00 0.00 C ATOM 840 CE1 TYR A 84 8.489 -13.587 -24.566 1.00 0.00 C ATOM 841 CE2 TYR A 84 8.277 -14.586 -26.768 1.00 0.00 C ATOM 842 CZ TYR A 84 8.733 -14.651 -25.443 1.00 0.00 C ATOM 843 OH TYR A 84 9.431 -15.758 -25.002 1.00 0.00 O ATOM 0 H TYR A 84 4.493 -12.191 -28.366 1.00 0.00 H new ATOM 0 HA TYR A 84 4.911 -11.529 -25.516 1.00 0.00 H new ATOM 0 HB2 TYR A 84 6.786 -11.011 -27.884 1.00 0.00 H new ATOM 0 HB3 TYR A 84 6.988 -10.273 -26.307 1.00 0.00 H new ATOM 0 HD1 TYR A 84 7.600 -11.639 -24.333 1.00 0.00 H new ATOM 0 HD2 TYR A 84 7.238 -13.399 -28.236 1.00 0.00 H new ATOM 0 HE1 TYR A 84 8.840 -13.637 -23.546 1.00 0.00 H new ATOM 0 HE2 TYR A 84 8.461 -15.408 -27.444 1.00 0.00 H new ATOM 0 HH TYR A 84 9.513 -16.405 -25.733 1.00 0.00 H new ATOM 853 N LEU A 85 4.339 -9.083 -25.870 1.00 0.00 N ATOM 854 CA LEU A 85 3.751 -7.753 -26.030 1.00 0.00 C ATOM 855 C LEU A 85 4.617 -6.747 -25.278 1.00 0.00 C ATOM 856 O LEU A 85 4.425 -6.522 -24.084 1.00 0.00 O ATOM 857 CB LEU A 85 2.330 -7.709 -25.469 1.00 0.00 C ATOM 858 CG LEU A 85 1.749 -6.305 -25.661 1.00 0.00 C ATOM 859 CD1 LEU A 85 1.848 -5.912 -27.135 1.00 0.00 C ATOM 860 CD2 LEU A 85 0.278 -6.292 -25.229 1.00 0.00 C ATOM 0 H LEU A 85 4.678 -9.278 -24.928 1.00 0.00 H new ATOM 0 HA LEU A 85 3.707 -7.511 -27.092 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.705 -8.445 -25.975 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.337 -7.970 -24.411 1.00 0.00 H new ATOM 0 HG LEU A 85 2.311 -5.595 -25.054 1.00 0.00 H new ATOM 0 HD11 LEU A 85 1.435 -4.913 -27.274 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.893 -5.919 -27.444 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.286 -6.624 -27.740 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.133 -5.292 -25.367 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.285 -7.002 -25.834 1.00 0.00 H new ATOM 0 HD23 LEU A 85 0.205 -6.573 -24.178 1.00 0.00 H new ATOM 872 N PRO A 86 5.580 -6.175 -25.942 1.00 0.00 N ATOM 873 CA PRO A 86 6.528 -5.210 -25.314 1.00 0.00 C ATOM 874 C PRO A 86 5.829 -4.056 -24.590 1.00 0.00 C ATOM 875 O PRO A 86 6.194 -3.714 -23.466 1.00 0.00 O ATOM 876 CB PRO A 86 7.368 -4.693 -26.486 1.00 0.00 C ATOM 877 CG PRO A 86 7.209 -5.697 -27.581 1.00 0.00 C ATOM 878 CD PRO A 86 5.862 -6.381 -27.367 1.00 0.00 C ATOM 0 HA PRO A 86 7.120 -5.694 -24.537 1.00 0.00 H new ATOM 0 HB2 PRO A 86 7.027 -3.709 -26.807 1.00 0.00 H new ATOM 0 HB3 PRO A 86 8.415 -4.590 -26.200 1.00 0.00 H new ATOM 0 HG2 PRO A 86 7.245 -5.212 -28.557 1.00 0.00 H new ATOM 0 HG3 PRO A 86 8.020 -6.425 -27.557 1.00 0.00 H new ATOM 0 HD2 PRO A 86 5.087 -5.941 -27.995 1.00 0.00 H new ATOM 0 HD3 PRO A 86 5.909 -7.441 -27.615 1.00 0.00 H new ATOM 886 N ASP A 87 4.857 -3.434 -25.248 1.00 0.00 N ATOM 887 CA ASP A 87 4.158 -2.292 -24.663 1.00 0.00 C ATOM 888 C ASP A 87 3.576 -2.612 -23.287 1.00 0.00 C ATOM 889 O ASP A 87 3.337 -1.707 -22.491 1.00 0.00 O ATOM 890 CB ASP A 87 3.018 -1.853 -25.586 1.00 0.00 C ATOM 891 CG ASP A 87 3.574 -1.406 -26.934 1.00 0.00 C ATOM 892 OD1 ASP A 87 4.467 -0.575 -26.939 1.00 0.00 O ATOM 893 OD2 ASP A 87 3.090 -1.895 -27.942 1.00 0.00 O ATOM 0 H ASP A 87 4.536 -3.697 -26.180 1.00 0.00 H new ATOM 0 HA ASP A 87 4.891 -1.494 -24.547 1.00 0.00 H new ATOM 0 HB2 ASP A 87 2.318 -2.676 -25.728 1.00 0.00 H new ATOM 0 HB3 ASP A 87 2.461 -1.037 -25.125 1.00 0.00 H new ATOM 898 N ALA A 88 3.329 -3.883 -23.009 1.00 0.00 N ATOM 899 CA ALA A 88 2.757 -4.258 -21.721 1.00 0.00 C ATOM 900 C ALA A 88 3.594 -3.707 -20.572 1.00 0.00 C ATOM 901 O ALA A 88 3.064 -3.374 -19.512 1.00 0.00 O ATOM 902 CB ALA A 88 2.674 -5.779 -21.603 1.00 0.00 C ATOM 0 H ALA A 88 3.511 -4.661 -23.643 1.00 0.00 H new ATOM 0 HA ALA A 88 1.755 -3.832 -21.662 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.245 -6.046 -20.637 1.00 0.00 H new ATOM 0 HB2 ALA A 88 2.044 -6.172 -22.401 1.00 0.00 H new ATOM 0 HB3 ALA A 88 3.674 -6.206 -21.687 1.00 0.00 H new ATOM 908 N PHE A 89 4.900 -3.604 -20.790 1.00 0.00 N ATOM 909 CA PHE A 89 5.799 -3.081 -19.770 1.00 0.00 C ATOM 910 C PHE A 89 5.515 -1.612 -19.462 1.00 0.00 C ATOM 911 O PHE A 89 5.518 -1.206 -18.301 1.00 0.00 O ATOM 912 CB PHE A 89 7.244 -3.235 -20.240 1.00 0.00 C ATOM 913 CG PHE A 89 8.151 -2.453 -19.321 1.00 0.00 C ATOM 914 CD1 PHE A 89 8.456 -2.946 -18.049 1.00 0.00 C ATOM 915 CD2 PHE A 89 8.680 -1.229 -19.746 1.00 0.00 C ATOM 916 CE1 PHE A 89 9.292 -2.214 -17.200 1.00 0.00 C ATOM 917 CE2 PHE A 89 9.516 -0.498 -18.898 1.00 0.00 C ATOM 918 CZ PHE A 89 9.822 -0.990 -17.623 1.00 0.00 C ATOM 0 H PHE A 89 5.358 -3.875 -21.660 1.00 0.00 H new ATOM 0 HA PHE A 89 5.637 -3.651 -18.855 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.528 -4.287 -20.242 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.346 -2.875 -21.264 1.00 0.00 H new ATOM 0 HD1 PHE A 89 8.047 -3.891 -17.723 1.00 0.00 H new ATOM 0 HD2 PHE A 89 8.442 -0.850 -20.729 1.00 0.00 H new ATOM 0 HE1 PHE A 89 9.529 -2.594 -16.217 1.00 0.00 H new ATOM 0 HE2 PHE A 89 9.926 0.446 -19.226 1.00 0.00 H new ATOM 0 HZ PHE A 89 10.467 -0.425 -16.966 1.00 0.00 H new ATOM 928 N LYS A 90 5.295 -0.816 -20.506 1.00 0.00 N ATOM 929 CA LYS A 90 5.044 0.609 -20.317 1.00 0.00 C ATOM 930 C LYS A 90 3.741 0.820 -19.549 1.00 0.00 C ATOM 931 O LYS A 90 3.655 1.696 -18.688 1.00 0.00 O ATOM 932 CB LYS A 90 4.962 1.332 -21.671 1.00 0.00 C ATOM 933 CG LYS A 90 3.509 1.389 -22.155 1.00 0.00 C ATOM 934 CD LYS A 90 3.462 1.960 -23.574 1.00 0.00 C ATOM 935 CE LYS A 90 2.007 2.232 -23.958 1.00 0.00 C ATOM 936 NZ LYS A 90 1.285 0.936 -24.116 1.00 0.00 N ATOM 0 H LYS A 90 5.285 -1.128 -21.477 1.00 0.00 H new ATOM 0 HA LYS A 90 5.873 1.024 -19.744 1.00 0.00 H new ATOM 0 HB2 LYS A 90 5.361 2.342 -21.577 1.00 0.00 H new ATOM 0 HB3 LYS A 90 5.577 0.813 -22.406 1.00 0.00 H new ATOM 0 HG2 LYS A 90 3.071 0.391 -22.139 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.915 2.009 -21.483 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.043 2.881 -23.628 1.00 0.00 H new ATOM 0 HD3 LYS A 90 3.911 1.258 -24.277 1.00 0.00 H new ATOM 0 HE2 LYS A 90 1.524 2.839 -23.192 1.00 0.00 H new ATOM 0 HE3 LYS A 90 1.965 2.800 -24.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 0.376 0.981 -23.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 1.112 0.756 -25.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 1.862 0.167 -23.721 1.00 0.00 H new ATOM 950 N ILE A 91 2.734 0.014 -19.874 1.00 0.00 N ATOM 951 CA ILE A 91 1.433 0.123 -19.215 1.00 0.00 C ATOM 952 C ILE A 91 1.565 -0.069 -17.711 1.00 0.00 C ATOM 953 O ILE A 91 1.063 0.734 -16.927 1.00 0.00 O ATOM 954 CB ILE A 91 0.470 -0.935 -19.765 1.00 0.00 C ATOM 955 CG1 ILE A 91 0.291 -0.746 -21.275 1.00 0.00 C ATOM 956 CG2 ILE A 91 -0.888 -0.798 -19.073 1.00 0.00 C ATOM 957 CD1 ILE A 91 -0.611 -1.855 -21.819 1.00 0.00 C ATOM 0 H ILE A 91 2.791 -0.717 -20.584 1.00 0.00 H new ATOM 0 HA ILE A 91 1.043 1.121 -19.415 1.00 0.00 H new ATOM 0 HB ILE A 91 0.882 -1.926 -19.574 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.148 0.230 -21.482 1.00 0.00 H new ATOM 0 HG13 ILE A 91 1.260 -0.772 -21.774 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -1.573 -1.550 -19.464 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -0.765 -0.942 -17.999 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -1.294 0.196 -19.262 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -0.741 -1.724 -22.893 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -0.153 -2.825 -21.624 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -1.583 -1.807 -21.328 1.00 0.00 H new ATOM 969 N MET A 92 2.232 -1.141 -17.309 1.00 0.00 N ATOM 970 CA MET A 92 2.405 -1.430 -15.894 1.00 0.00 C ATOM 971 C MET A 92 3.320 -0.410 -15.236 1.00 0.00 C ATOM 972 O MET A 92 3.124 -0.047 -14.079 1.00 0.00 O ATOM 973 CB MET A 92 3.001 -2.821 -15.731 1.00 0.00 C ATOM 974 CG MET A 92 2.028 -3.864 -16.285 1.00 0.00 C ATOM 975 SD MET A 92 0.518 -3.885 -15.287 1.00 0.00 S ATOM 976 CE MET A 92 1.269 -4.413 -13.729 1.00 0.00 C ATOM 0 H MET A 92 2.659 -1.821 -17.938 1.00 0.00 H new ATOM 0 HA MET A 92 1.429 -1.381 -15.411 1.00 0.00 H new ATOM 0 HB2 MET A 92 3.954 -2.883 -16.256 1.00 0.00 H new ATOM 0 HB3 MET A 92 3.203 -3.020 -14.679 1.00 0.00 H new ATOM 0 HG2 MET A 92 1.786 -3.634 -17.323 1.00 0.00 H new ATOM 0 HG3 MET A 92 2.494 -4.849 -16.277 1.00 0.00 H new ATOM 0 HE1 MET A 92 0.837 -5.365 -13.421 1.00 0.00 H new ATOM 0 HE2 MET A 92 2.344 -4.530 -13.865 1.00 0.00 H new ATOM 0 HE3 MET A 92 1.080 -3.663 -12.961 1.00 0.00 H new ATOM 986 N SER A 93 4.317 0.041 -15.981 1.00 0.00 N ATOM 987 CA SER A 93 5.263 1.013 -15.460 1.00 0.00 C ATOM 988 C SER A 93 4.543 2.273 -15.009 1.00 0.00 C ATOM 989 O SER A 93 4.754 2.769 -13.907 1.00 0.00 O ATOM 990 CB SER A 93 6.258 1.379 -16.558 1.00 0.00 C ATOM 991 OG SER A 93 6.923 0.206 -17.004 1.00 0.00 O ATOM 0 H SER A 93 4.491 -0.249 -16.943 1.00 0.00 H new ATOM 0 HA SER A 93 5.780 0.576 -14.606 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.739 1.854 -17.390 1.00 0.00 H new ATOM 0 HB3 SER A 93 6.983 2.100 -16.181 1.00 0.00 H new ATOM 0 HG SER A 93 6.487 -0.129 -17.816 1.00 0.00 H new ATOM 997 N GLN A 94 3.679 2.769 -15.874 1.00 0.00 N ATOM 998 CA GLN A 94 2.911 3.965 -15.582 1.00 0.00 C ATOM 999 C GLN A 94 1.902 3.721 -14.460 1.00 0.00 C ATOM 1000 O GLN A 94 1.639 4.603 -13.643 1.00 0.00 O ATOM 1001 CB GLN A 94 2.192 4.406 -16.856 1.00 0.00 C ATOM 1002 CG GLN A 94 3.238 4.746 -17.921 1.00 0.00 C ATOM 1003 CD GLN A 94 2.564 5.244 -19.194 1.00 0.00 C ATOM 1004 OE1 GLN A 94 1.954 6.312 -19.200 1.00 0.00 O ATOM 1005 NE2 GLN A 94 2.649 4.528 -20.283 1.00 0.00 N ATOM 0 H GLN A 94 3.491 2.360 -16.789 1.00 0.00 H new ATOM 0 HA GLN A 94 3.589 4.748 -15.243 1.00 0.00 H new ATOM 0 HB2 GLN A 94 1.535 3.613 -17.212 1.00 0.00 H new ATOM 0 HB3 GLN A 94 1.564 5.273 -16.654 1.00 0.00 H new ATOM 0 HG2 GLN A 94 3.918 5.508 -17.541 1.00 0.00 H new ATOM 0 HG3 GLN A 94 3.840 3.864 -18.142 1.00 0.00 H new ATOM 0 HE21 GLN A 94 3.156 3.643 -20.273 1.00 0.00 H new ATOM 0 HE22 GLN A 94 2.208 4.854 -21.143 1.00 0.00 H new ATOM 1014 N ARG A 95 1.315 2.530 -14.458 1.00 0.00 N ATOM 1015 CA ARG A 95 0.296 2.168 -13.474 1.00 0.00 C ATOM 1016 C ARG A 95 0.842 1.826 -12.080 1.00 0.00 C ATOM 1017 O ARG A 95 0.172 2.094 -11.083 1.00 0.00 O ATOM 1018 CB ARG A 95 -0.484 0.957 -13.988 1.00 0.00 C ATOM 1019 CG ARG A 95 -1.316 1.340 -15.214 1.00 0.00 C ATOM 1020 CD ARG A 95 -2.091 0.109 -15.697 1.00 0.00 C ATOM 1021 NE ARG A 95 -2.684 0.354 -17.010 1.00 0.00 N ATOM 1022 CZ ARG A 95 -3.590 1.309 -17.200 1.00 0.00 C ATOM 1023 NH1 ARG A 95 -3.987 2.045 -16.196 1.00 0.00 N ATOM 1024 NH2 ARG A 95 -4.090 1.499 -18.392 1.00 0.00 N ATOM 0 H ARG A 95 1.527 1.793 -15.130 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.330 3.053 -13.357 1.00 0.00 H new ATOM 0 HB2 ARG A 95 0.207 0.154 -14.246 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -1.136 0.576 -13.202 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -2.007 2.145 -14.963 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -0.668 1.712 -16.008 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -1.422 -0.750 -15.749 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -2.873 -0.139 -14.980 1.00 0.00 H new ATOM 0 HE ARG A 95 -2.396 -0.222 -17.801 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -3.602 1.888 -15.265 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -4.682 2.777 -16.344 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -3.785 0.916 -19.172 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -4.785 2.230 -18.543 1.00 0.00 H new ATOM 1038 N CYS A 96 2.004 1.177 -11.997 1.00 0.00 N ATOM 1039 CA CYS A 96 2.510 0.761 -10.682 1.00 0.00 C ATOM 1040 C CYS A 96 3.803 1.456 -10.232 1.00 0.00 C ATOM 1041 O CYS A 96 4.122 1.458 -9.039 1.00 0.00 O ATOM 1042 CB CYS A 96 2.719 -0.755 -10.695 1.00 0.00 C ATOM 1043 SG CYS A 96 1.330 -1.547 -11.552 1.00 0.00 S ATOM 0 H CYS A 96 2.596 0.933 -12.791 1.00 0.00 H new ATOM 0 HA CYS A 96 1.756 1.064 -9.956 1.00 0.00 H new ATOM 0 HB2 CYS A 96 3.656 -1.000 -11.195 1.00 0.00 H new ATOM 0 HB3 CYS A 96 2.794 -1.132 -9.675 1.00 0.00 H new ATOM 1048 N ASN A 97 4.569 2.014 -11.154 1.00 0.00 N ATOM 1049 CA ASN A 97 5.818 2.649 -10.760 1.00 0.00 C ATOM 1050 C ASN A 97 5.585 3.782 -9.764 1.00 0.00 C ATOM 1051 O ASN A 97 4.642 4.560 -9.896 1.00 0.00 O ATOM 1052 CB ASN A 97 6.566 3.187 -11.980 1.00 0.00 C ATOM 1053 CG ASN A 97 6.945 2.036 -12.910 1.00 0.00 C ATOM 1054 OD1 ASN A 97 6.673 0.877 -12.603 1.00 0.00 O ATOM 1055 ND2 ASN A 97 7.574 2.285 -14.027 1.00 0.00 N ATOM 0 H ASN A 97 4.359 2.042 -12.152 1.00 0.00 H new ATOM 0 HA ASN A 97 6.425 1.884 -10.276 1.00 0.00 H new ATOM 0 HB2 ASN A 97 5.942 3.905 -12.512 1.00 0.00 H new ATOM 0 HB3 ASN A 97 7.463 3.719 -11.662 1.00 0.00 H new ATOM 0 HD21 ASN A 97 7.840 1.518 -14.645 1.00 0.00 H new ATOM 0 HD22 ASN A 97 7.800 3.247 -14.282 1.00 0.00 H new ATOM 1062 N ASN A 98 6.478 3.860 -8.775 1.00 0.00 N ATOM 1063 CA ASN A 98 6.424 4.895 -7.745 1.00 0.00 C ATOM 1064 C ASN A 98 5.255 4.710 -6.773 1.00 0.00 C ATOM 1065 O ASN A 98 4.931 5.622 -6.013 1.00 0.00 O ATOM 1066 CB ASN A 98 6.389 6.291 -8.378 1.00 0.00 C ATOM 1067 CG ASN A 98 7.783 6.632 -8.893 1.00 0.00 C ATOM 1068 OD1 ASN A 98 8.647 5.760 -8.972 1.00 0.00 O ATOM 1069 ND2 ASN A 98 8.009 7.895 -9.241 1.00 0.00 N ATOM 0 H ASN A 98 7.256 3.209 -8.667 1.00 0.00 H new ATOM 0 HA ASN A 98 7.336 4.796 -7.157 1.00 0.00 H new ATOM 0 HB2 ASN A 98 5.668 6.317 -9.195 1.00 0.00 H new ATOM 0 HB3 ASN A 98 6.066 7.030 -7.645 1.00 0.00 H new ATOM 0 HD22 ASN A 98 7.264 8.587 -9.160 1.00 0.00 H new ATOM 1075 N ARG A 99 4.643 3.529 -6.770 1.00 0.00 N ATOM 1076 CA ARG A 99 3.540 3.270 -5.839 1.00 0.00 C ATOM 1077 C ARG A 99 3.874 2.113 -4.902 1.00 0.00 C ATOM 1078 O ARG A 99 4.606 1.198 -5.271 1.00 0.00 O ATOM 1079 CB ARG A 99 2.252 2.966 -6.598 1.00 0.00 C ATOM 1080 CG ARG A 99 1.680 4.273 -7.144 1.00 0.00 C ATOM 1081 CD ARG A 99 0.366 3.993 -7.870 1.00 0.00 C ATOM 1082 NE ARG A 99 -0.608 3.426 -6.947 1.00 0.00 N ATOM 1083 CZ ARG A 99 -1.726 2.867 -7.395 1.00 0.00 C ATOM 1084 NH1 ARG A 99 -1.999 2.890 -8.670 1.00 0.00 N ATOM 1085 NH2 ARG A 99 -2.559 2.310 -6.561 1.00 0.00 N ATOM 0 H ARG A 99 4.882 2.751 -7.384 1.00 0.00 H new ATOM 0 HA ARG A 99 3.394 4.170 -5.242 1.00 0.00 H new ATOM 0 HB2 ARG A 99 2.450 2.271 -7.414 1.00 0.00 H new ATOM 0 HB3 ARG A 99 1.530 2.485 -5.938 1.00 0.00 H new ATOM 0 HG2 ARG A 99 1.514 4.978 -6.329 1.00 0.00 H new ATOM 0 HG3 ARG A 99 2.393 4.737 -7.826 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -0.024 4.916 -8.300 1.00 0.00 H new ATOM 0 HD3 ARG A 99 0.539 3.304 -8.697 1.00 0.00 H new ATOM 0 HE ARG A 99 -0.429 3.459 -5.943 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -1.354 3.337 -9.322 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -2.857 2.461 -9.016 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -2.352 2.303 -5.562 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -3.417 1.881 -6.907 1.00 0.00 H new ATOM 1099 N THR A 100 3.321 2.162 -3.693 1.00 0.00 N ATOM 1100 CA THR A 100 3.556 1.112 -2.704 1.00 0.00 C ATOM 1101 C THR A 100 2.844 -0.161 -3.137 1.00 0.00 C ATOM 1102 O THR A 100 3.313 -1.269 -2.886 1.00 0.00 O ATOM 1103 CB THR A 100 3.023 1.552 -1.342 1.00 0.00 C ATOM 1104 OG1 THR A 100 3.471 2.870 -1.062 1.00 0.00 O ATOM 1105 CG2 THR A 100 3.528 0.600 -0.255 1.00 0.00 C ATOM 0 H THR A 100 2.710 2.914 -3.375 1.00 0.00 H new ATOM 0 HA THR A 100 4.627 0.926 -2.628 1.00 0.00 H new ATOM 0 HB THR A 100 1.933 1.532 -1.359 1.00 0.00 H new ATOM 0 HG1 THR A 100 3.128 3.154 -0.189 1.00 0.00 H new ATOM 0 HG21 THR A 100 3.145 0.919 0.714 1.00 0.00 H new ATOM 0 HG22 THR A 100 3.182 -0.411 -0.468 1.00 0.00 H new ATOM 0 HG23 THR A 100 4.618 0.614 -0.237 1.00 0.00 H new ATOM 1113 N GLN A 101 1.709 0.022 -3.796 1.00 0.00 N ATOM 1114 CA GLN A 101 0.926 -1.102 -4.280 1.00 0.00 C ATOM 1115 C GLN A 101 0.276 -0.745 -5.605 1.00 0.00 C ATOM 1116 O GLN A 101 0.130 0.431 -5.936 1.00 0.00 O ATOM 1117 CB GLN A 101 -0.150 -1.487 -3.265 1.00 0.00 C ATOM 1118 CG GLN A 101 -1.093 -0.307 -3.051 1.00 0.00 C ATOM 1119 CD GLN A 101 -2.379 -0.520 -3.841 1.00 0.00 C ATOM 1120 OE1 GLN A 101 -2.933 0.430 -4.393 1.00 0.00 O ATOM 1121 NE2 GLN A 101 -2.892 -1.716 -3.930 1.00 0.00 N ATOM 0 H GLN A 101 1.311 0.937 -4.007 1.00 0.00 H new ATOM 0 HA GLN A 101 1.593 -1.953 -4.420 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -0.708 -2.352 -3.622 1.00 0.00 H new ATOM 0 HB3 GLN A 101 0.312 -1.773 -2.320 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -1.321 -0.200 -1.990 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -0.610 0.617 -3.368 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -2.433 -2.503 -3.472 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -3.753 -1.864 -4.457 1.00 0.00 H new ATOM 1130 N CYS A 102 -0.094 -1.760 -6.370 1.00 0.00 N ATOM 1131 CA CYS A 102 -0.702 -1.523 -7.670 1.00 0.00 C ATOM 1132 C CYS A 102 -1.573 -2.697 -8.096 1.00 0.00 C ATOM 1133 O CYS A 102 -1.237 -3.856 -7.853 1.00 0.00 O ATOM 1134 CB CYS A 102 0.412 -1.301 -8.694 1.00 0.00 C ATOM 1135 SG CYS A 102 -0.272 -1.212 -10.364 1.00 0.00 S ATOM 0 H CYS A 102 0.014 -2.743 -6.118 1.00 0.00 H new ATOM 0 HA CYS A 102 -1.343 -0.643 -7.608 1.00 0.00 H new ATOM 0 HB2 CYS A 102 0.947 -0.379 -8.464 1.00 0.00 H new ATOM 0 HB3 CYS A 102 1.136 -2.113 -8.634 1.00 0.00 H new ATOM 1140 N VAL A 103 -2.688 -2.384 -8.745 1.00 0.00 N ATOM 1141 CA VAL A 103 -3.601 -3.413 -9.223 1.00 0.00 C ATOM 1142 C VAL A 103 -3.920 -3.188 -10.692 1.00 0.00 C ATOM 1143 O VAL A 103 -4.303 -2.088 -11.087 1.00 0.00 O ATOM 1144 CB VAL A 103 -4.904 -3.380 -8.430 1.00 0.00 C ATOM 1145 CG1 VAL A 103 -5.835 -4.482 -8.937 1.00 0.00 C ATOM 1146 CG2 VAL A 103 -4.611 -3.601 -6.945 1.00 0.00 C ATOM 0 H VAL A 103 -2.980 -1.429 -8.952 1.00 0.00 H new ATOM 0 HA VAL A 103 -3.118 -4.381 -9.092 1.00 0.00 H new ATOM 0 HB VAL A 103 -5.382 -2.409 -8.561 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -6.767 -4.460 -8.372 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.048 -4.321 -9.994 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -5.355 -5.452 -8.808 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -5.544 -3.577 -6.382 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -4.131 -4.570 -6.809 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -3.949 -2.814 -6.584 1.00 0.00 H new ATOM 1156 N VAL A 104 -3.772 -4.224 -11.502 1.00 0.00 N ATOM 1157 CA VAL A 104 -4.066 -4.094 -12.920 1.00 0.00 C ATOM 1158 C VAL A 104 -4.654 -5.382 -13.483 1.00 0.00 C ATOM 1159 O VAL A 104 -4.248 -6.482 -13.105 1.00 0.00 O ATOM 1160 CB VAL A 104 -2.804 -3.725 -13.689 1.00 0.00 C ATOM 1161 CG1 VAL A 104 -3.170 -3.455 -15.147 1.00 0.00 C ATOM 1162 CG2 VAL A 104 -2.181 -2.468 -13.076 1.00 0.00 C ATOM 0 H VAL A 104 -3.456 -5.149 -11.209 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.805 -3.301 -13.036 1.00 0.00 H new ATOM 0 HB VAL A 104 -2.087 -4.544 -13.635 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -2.272 -3.190 -15.705 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -3.616 -4.349 -15.582 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.884 -2.633 -15.197 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -1.278 -2.204 -13.626 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -2.893 -1.645 -13.131 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -1.928 -2.659 -12.033 1.00 0.00 H new ATOM 1172 N VAL A 105 -5.611 -5.233 -14.396 1.00 0.00 N ATOM 1173 CA VAL A 105 -6.238 -6.393 -15.011 1.00 0.00 C ATOM 1174 C VAL A 105 -5.303 -6.976 -16.058 1.00 0.00 C ATOM 1175 O VAL A 105 -4.937 -6.305 -17.024 1.00 0.00 O ATOM 1176 CB VAL A 105 -7.571 -6.018 -15.664 1.00 0.00 C ATOM 1177 CG1 VAL A 105 -8.399 -7.283 -15.890 1.00 0.00 C ATOM 1178 CG2 VAL A 105 -8.348 -5.068 -14.750 1.00 0.00 C ATOM 0 H VAL A 105 -5.963 -4.333 -14.721 1.00 0.00 H new ATOM 0 HA VAL A 105 -6.435 -7.132 -14.234 1.00 0.00 H new ATOM 0 HB VAL A 105 -7.377 -5.527 -16.617 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -9.349 -7.018 -16.355 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -7.853 -7.964 -16.543 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -8.587 -7.771 -14.933 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -9.296 -4.805 -15.220 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -8.540 -5.558 -13.795 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -7.762 -4.164 -14.583 1.00 0.00 H new ATOM 1188 N ALA A 106 -4.910 -8.223 -15.855 1.00 0.00 N ATOM 1189 CA ALA A 106 -4.001 -8.878 -16.787 1.00 0.00 C ATOM 1190 C ALA A 106 -4.685 -9.144 -18.124 1.00 0.00 C ATOM 1191 O ALA A 106 -4.360 -10.108 -18.817 1.00 0.00 O ATOM 1192 CB ALA A 106 -3.491 -10.194 -16.200 1.00 0.00 C ATOM 0 H ALA A 106 -5.201 -8.798 -15.064 1.00 0.00 H new ATOM 0 HA ALA A 106 -3.157 -8.209 -16.955 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -2.813 -10.670 -16.909 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -2.961 -9.996 -15.268 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.334 -10.856 -16.004 1.00 0.00 H new ATOM 1198 N GLY A 107 -5.622 -8.277 -18.488 1.00 0.00 N ATOM 1199 CA GLY A 107 -6.337 -8.423 -19.750 1.00 0.00 C ATOM 1200 C GLY A 107 -7.390 -7.337 -19.912 1.00 0.00 C ATOM 1201 O GLY A 107 -7.606 -6.534 -19.007 1.00 0.00 O ATOM 0 H GLY A 107 -5.903 -7.470 -17.931 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -5.631 -8.376 -20.579 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -6.812 -9.403 -19.791 1.00 0.00 H new ATOM 1205 N SER A 108 -8.045 -7.330 -21.071 1.00 0.00 N ATOM 1206 CA SER A 108 -9.085 -6.348 -21.353 1.00 0.00 C ATOM 1207 C SER A 108 -8.520 -5.168 -22.136 1.00 0.00 C ATOM 1208 O SER A 108 -7.483 -5.273 -22.789 1.00 0.00 O ATOM 1209 CB SER A 108 -9.708 -5.839 -20.051 1.00 0.00 C ATOM 1210 OG SER A 108 -11.010 -5.336 -20.320 1.00 0.00 O ATOM 0 H SER A 108 -7.873 -7.992 -21.827 1.00 0.00 H new ATOM 0 HA SER A 108 -9.851 -6.838 -21.954 1.00 0.00 H new ATOM 0 HB2 SER A 108 -9.761 -6.646 -19.320 1.00 0.00 H new ATOM 0 HB3 SER A 108 -9.085 -5.056 -19.618 1.00 0.00 H new ATOM 0 HG SER A 108 -11.413 -5.011 -19.488 1.00 0.00 H new ATOM 1216 N ASP A 109 -9.225 -4.050 -22.062 1.00 0.00 N ATOM 1217 CA ASP A 109 -8.837 -2.828 -22.752 1.00 0.00 C ATOM 1218 C ASP A 109 -7.530 -2.266 -22.196 1.00 0.00 C ATOM 1219 O ASP A 109 -6.970 -1.319 -22.747 1.00 0.00 O ATOM 1220 CB ASP A 109 -9.948 -1.786 -22.613 1.00 0.00 C ATOM 1221 CG ASP A 109 -11.131 -2.167 -23.496 1.00 0.00 C ATOM 1222 OD1 ASP A 109 -11.021 -3.151 -24.207 1.00 0.00 O ATOM 1223 OD2 ASP A 109 -12.129 -1.467 -23.448 1.00 0.00 O ATOM 0 H ASP A 109 -10.085 -3.963 -21.520 1.00 0.00 H new ATOM 0 HA ASP A 109 -8.682 -3.066 -23.804 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -10.267 -1.718 -21.573 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -9.573 -0.802 -22.897 1.00 0.00 H new ATOM 1228 N ALA A 110 -7.060 -2.844 -21.098 1.00 0.00 N ATOM 1229 CA ALA A 110 -5.826 -2.370 -20.483 1.00 0.00 C ATOM 1230 C ALA A 110 -4.602 -2.956 -21.185 1.00 0.00 C ATOM 1231 O ALA A 110 -3.479 -2.507 -20.957 1.00 0.00 O ATOM 1232 CB ALA A 110 -5.790 -2.760 -19.007 1.00 0.00 C ATOM 0 H ALA A 110 -7.505 -3.628 -20.621 1.00 0.00 H new ATOM 0 HA ALA A 110 -5.802 -1.285 -20.579 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -4.864 -2.401 -18.558 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -6.640 -2.313 -18.492 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -5.840 -3.845 -18.916 1.00 0.00 H new ATOM 1238 N PHE A 111 -4.815 -3.949 -22.047 1.00 0.00 N ATOM 1239 CA PHE A 111 -3.699 -4.556 -22.765 1.00 0.00 C ATOM 1240 C PHE A 111 -4.082 -4.865 -24.209 1.00 0.00 C ATOM 1241 O PHE A 111 -5.074 -5.550 -24.458 1.00 0.00 O ATOM 1242 CB PHE A 111 -3.261 -5.848 -22.083 1.00 0.00 C ATOM 1243 CG PHE A 111 -2.478 -5.508 -20.837 1.00 0.00 C ATOM 1244 CD1 PHE A 111 -1.124 -5.168 -20.936 1.00 0.00 C ATOM 1245 CD2 PHE A 111 -3.106 -5.528 -19.586 1.00 0.00 C ATOM 1246 CE1 PHE A 111 -0.397 -4.850 -19.783 1.00 0.00 C ATOM 1247 CE2 PHE A 111 -2.379 -5.209 -18.432 1.00 0.00 C ATOM 1248 CZ PHE A 111 -1.023 -4.870 -18.531 1.00 0.00 C ATOM 0 H PHE A 111 -5.731 -4.343 -22.262 1.00 0.00 H new ATOM 0 HA PHE A 111 -2.877 -3.841 -22.757 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -4.132 -6.452 -21.827 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -2.649 -6.442 -22.761 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -0.640 -5.151 -21.902 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -4.151 -5.789 -19.511 1.00 0.00 H new ATOM 0 HE1 PHE A 111 0.648 -4.589 -19.859 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -2.863 -5.224 -17.467 1.00 0.00 H new ATOM 0 HZ PHE A 111 -0.461 -4.624 -17.642 1.00 0.00 H new ATOM 1258 N PRO A 112 -3.311 -4.395 -25.156 1.00 0.00 N ATOM 1259 CA PRO A 112 -3.571 -4.645 -26.600 1.00 0.00 C ATOM 1260 C PRO A 112 -3.897 -6.107 -26.898 1.00 0.00 C ATOM 1261 O PRO A 112 -4.293 -6.868 -26.017 1.00 0.00 O ATOM 1262 CB PRO A 112 -2.262 -4.246 -27.280 1.00 0.00 C ATOM 1263 CG PRO A 112 -1.597 -3.279 -26.359 1.00 0.00 C ATOM 1264 CD PRO A 112 -2.108 -3.570 -24.952 1.00 0.00 C ATOM 0 HA PRO A 112 -4.438 -4.085 -26.950 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -1.631 -5.118 -27.452 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -2.451 -3.792 -28.253 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -0.513 -3.388 -26.405 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -1.827 -2.253 -26.647 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -1.361 -4.099 -24.360 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -2.345 -2.650 -24.418 1.00 0.00 H new ATOM 1272 N ASP A 113 -3.722 -6.481 -28.157 1.00 0.00 N ATOM 1273 CA ASP A 113 -3.993 -7.841 -28.605 1.00 0.00 C ATOM 1274 C ASP A 113 -2.888 -8.318 -29.548 1.00 0.00 C ATOM 1275 O ASP A 113 -2.932 -8.061 -30.753 1.00 0.00 O ATOM 1276 CB ASP A 113 -5.344 -7.869 -29.322 1.00 0.00 C ATOM 1277 CG ASP A 113 -5.423 -9.070 -30.256 1.00 0.00 C ATOM 1278 OD1 ASP A 113 -5.705 -10.155 -29.776 1.00 0.00 O ATOM 1279 OD2 ASP A 113 -5.205 -8.884 -31.442 1.00 0.00 O ATOM 0 H ASP A 113 -3.391 -5.857 -28.892 1.00 0.00 H new ATOM 0 HA ASP A 113 -4.021 -8.508 -27.744 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -6.151 -7.915 -28.590 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -5.481 -6.949 -29.890 1.00 0.00 H new ATOM 1284 N PRO A 114 -1.890 -8.980 -29.020 1.00 0.00 N ATOM 1285 CA PRO A 114 -0.732 -9.481 -29.813 1.00 0.00 C ATOM 1286 C PRO A 114 -1.014 -10.816 -30.504 1.00 0.00 C ATOM 1287 O PRO A 114 -0.853 -10.940 -31.718 1.00 0.00 O ATOM 1288 CB PRO A 114 0.357 -9.636 -28.757 1.00 0.00 C ATOM 1289 CG PRO A 114 -0.376 -10.003 -27.510 1.00 0.00 C ATOM 1290 CD PRO A 114 -1.752 -9.330 -27.596 1.00 0.00 C ATOM 0 HA PRO A 114 -0.471 -8.807 -30.629 1.00 0.00 H new ATOM 0 HB2 PRO A 114 1.074 -10.408 -29.037 1.00 0.00 H new ATOM 0 HB3 PRO A 114 0.919 -8.711 -28.629 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -0.478 -11.085 -27.425 1.00 0.00 H new ATOM 0 HG3 PRO A 114 0.167 -9.664 -26.628 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -2.546 -10.003 -27.272 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -1.804 -8.446 -26.961 1.00 0.00 H new ATOM 1298 N CYS A 115 -1.419 -11.815 -29.727 1.00 0.00 N ATOM 1299 CA CYS A 115 -1.697 -13.131 -30.290 1.00 0.00 C ATOM 1300 C CYS A 115 -3.088 -13.629 -29.892 1.00 0.00 C ATOM 1301 O CYS A 115 -3.247 -14.300 -28.872 1.00 0.00 O ATOM 1302 CB CYS A 115 -0.639 -14.138 -29.827 1.00 0.00 C ATOM 1303 SG CYS A 115 -0.627 -14.236 -28.022 1.00 0.00 S ATOM 0 H CYS A 115 -1.561 -11.741 -28.720 1.00 0.00 H new ATOM 0 HA CYS A 115 -1.665 -13.039 -31.376 1.00 0.00 H new ATOM 0 HB2 CYS A 115 -0.849 -15.120 -30.251 1.00 0.00 H new ATOM 0 HB3 CYS A 115 0.344 -13.838 -30.190 1.00 0.00 H new ATOM 1308 N PRO A 116 -4.081 -13.326 -30.691 1.00 0.00 N ATOM 1309 CA PRO A 116 -5.484 -13.762 -30.440 1.00 0.00 C ATOM 1310 C PRO A 116 -5.646 -15.275 -30.598 1.00 0.00 C ATOM 1311 O PRO A 116 -5.080 -15.872 -31.515 1.00 0.00 O ATOM 1312 CB PRO A 116 -6.330 -13.014 -31.490 1.00 0.00 C ATOM 1313 CG PRO A 116 -5.394 -12.193 -32.321 1.00 0.00 C ATOM 1314 CD PRO A 116 -3.957 -12.531 -31.916 1.00 0.00 C ATOM 0 HA PRO A 116 -5.791 -13.535 -29.419 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -6.878 -13.720 -32.114 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.069 -12.378 -31.004 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -5.547 -12.400 -33.380 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -5.589 -11.131 -32.173 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -3.448 -13.092 -32.700 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -3.374 -11.627 -31.742 1.00 0.00 H new ATOM 1322 N GLY A 117 -6.435 -15.886 -29.713 1.00 0.00 N ATOM 1323 CA GLY A 117 -6.674 -17.329 -29.790 1.00 0.00 C ATOM 1324 C GLY A 117 -5.800 -18.127 -28.816 1.00 0.00 C ATOM 1325 O GLY A 117 -5.835 -19.357 -28.821 1.00 0.00 O ATOM 0 H GLY A 117 -6.913 -15.414 -28.946 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -7.724 -17.531 -29.578 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -6.482 -17.671 -30.807 1.00 0.00 H new ATOM 1329 N THR A 118 -5.030 -17.443 -27.981 1.00 0.00 N ATOM 1330 CA THR A 118 -4.178 -18.128 -27.016 1.00 0.00 C ATOM 1331 C THR A 118 -4.440 -17.568 -25.625 1.00 0.00 C ATOM 1332 O THR A 118 -4.735 -16.382 -25.476 1.00 0.00 O ATOM 1333 CB THR A 118 -2.703 -17.947 -27.399 1.00 0.00 C ATOM 1334 OG1 THR A 118 -2.510 -18.340 -28.753 1.00 0.00 O ATOM 1335 CG2 THR A 118 -1.827 -18.807 -26.492 1.00 0.00 C ATOM 0 H THR A 118 -4.977 -16.425 -27.951 1.00 0.00 H new ATOM 0 HA THR A 118 -4.406 -19.194 -27.019 1.00 0.00 H new ATOM 0 HB THR A 118 -2.428 -16.899 -27.281 1.00 0.00 H new ATOM 0 HG1 THR A 118 -1.568 -18.222 -28.997 1.00 0.00 H new ATOM 0 HG21 THR A 118 -0.780 -18.676 -26.767 1.00 0.00 H new ATOM 0 HG22 THR A 118 -1.970 -18.505 -25.455 1.00 0.00 H new ATOM 0 HG23 THR A 118 -2.104 -19.855 -26.606 1.00 0.00 H new ATOM 1343 N TYR A 119 -4.340 -18.408 -24.600 1.00 0.00 N ATOM 1344 CA TYR A 119 -4.583 -17.929 -23.250 1.00 0.00 C ATOM 1345 C TYR A 119 -3.290 -17.360 -22.695 1.00 0.00 C ATOM 1346 O TYR A 119 -2.398 -18.090 -22.270 1.00 0.00 O ATOM 1347 CB TYR A 119 -5.096 -19.067 -22.368 1.00 0.00 C ATOM 1348 CG TYR A 119 -5.736 -18.504 -21.125 1.00 0.00 C ATOM 1349 CD1 TYR A 119 -7.043 -17.999 -21.179 1.00 0.00 C ATOM 1350 CD2 TYR A 119 -5.035 -18.501 -19.913 1.00 0.00 C ATOM 1351 CE1 TYR A 119 -7.646 -17.493 -20.023 1.00 0.00 C ATOM 1352 CE2 TYR A 119 -5.639 -17.993 -18.759 1.00 0.00 C ATOM 1353 CZ TYR A 119 -6.944 -17.490 -18.812 1.00 0.00 C ATOM 1354 OH TYR A 119 -7.536 -16.990 -17.674 1.00 0.00 O ATOM 0 H TYR A 119 -4.099 -19.396 -24.676 1.00 0.00 H new ATOM 0 HA TYR A 119 -5.345 -17.150 -23.265 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -5.819 -19.668 -22.919 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -4.273 -19.728 -22.096 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -7.584 -18.001 -22.114 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -4.029 -18.891 -19.870 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -8.653 -17.105 -20.065 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -5.097 -17.989 -17.825 1.00 0.00 H new ATOM 0 HH TYR A 119 -7.542 -16.011 -17.712 1.00 0.00 H new ATOM 1364 N LYS A 120 -3.191 -16.048 -22.758 1.00 0.00 N ATOM 1365 CA LYS A 120 -1.994 -15.343 -22.322 1.00 0.00 C ATOM 1366 C LYS A 120 -1.827 -15.298 -20.795 1.00 0.00 C ATOM 1367 O LYS A 120 -2.397 -16.090 -20.045 1.00 0.00 O ATOM 1368 CB LYS A 120 -2.043 -13.918 -22.885 1.00 0.00 C ATOM 1369 CG LYS A 120 -2.216 -14.009 -24.394 1.00 0.00 C ATOM 1370 CD LYS A 120 -2.554 -12.635 -24.974 1.00 0.00 C ATOM 1371 CE LYS A 120 -2.907 -12.794 -26.455 1.00 0.00 C ATOM 1372 NZ LYS A 120 -4.131 -12.004 -26.765 1.00 0.00 N ATOM 0 H LYS A 120 -3.930 -15.440 -23.110 1.00 0.00 H new ATOM 0 HA LYS A 120 -1.132 -15.892 -22.700 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -2.868 -13.362 -22.441 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -1.127 -13.380 -22.639 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -1.301 -14.388 -24.849 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -3.009 -14.717 -24.634 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -3.390 -12.193 -24.433 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -1.707 -11.959 -24.859 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -2.077 -12.456 -27.075 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -3.072 -13.846 -26.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -4.218 -11.888 -27.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -4.968 -12.503 -26.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -4.064 -11.069 -26.315 1.00 0.00 H new ATOM 1386 N TYR A 121 -1.080 -14.291 -20.394 1.00 0.00 N ATOM 1387 CA TYR A 121 -0.827 -13.991 -18.995 1.00 0.00 C ATOM 1388 C TYR A 121 -0.031 -12.716 -18.874 1.00 0.00 C ATOM 1389 O TYR A 121 0.415 -12.154 -19.874 1.00 0.00 O ATOM 1390 CB TYR A 121 -0.115 -15.141 -18.262 1.00 0.00 C ATOM 1391 CG TYR A 121 1.172 -15.548 -18.945 1.00 0.00 C ATOM 1392 CD1 TYR A 121 2.278 -14.683 -18.981 1.00 0.00 C ATOM 1393 CD2 TYR A 121 1.267 -16.824 -19.509 1.00 0.00 C ATOM 1394 CE1 TYR A 121 3.475 -15.103 -19.591 1.00 0.00 C ATOM 1395 CE2 TYR A 121 2.458 -17.243 -20.108 1.00 0.00 C ATOM 1396 CZ TYR A 121 3.562 -16.385 -20.151 1.00 0.00 C ATOM 1397 OH TYR A 121 4.738 -16.805 -20.740 1.00 0.00 O ATOM 0 H TYR A 121 -0.623 -13.646 -21.039 1.00 0.00 H new ATOM 0 HA TYR A 121 -1.796 -13.862 -18.513 1.00 0.00 H new ATOM 0 HB2 TYR A 121 0.100 -14.838 -17.237 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.782 -16.001 -18.206 1.00 0.00 H new ATOM 0 HD1 TYR A 121 2.210 -13.699 -18.542 1.00 0.00 H new ATOM 0 HD2 TYR A 121 0.416 -17.489 -19.482 1.00 0.00 H new ATOM 0 HE1 TYR A 121 4.325 -14.438 -19.628 1.00 0.00 H new ATOM 0 HE2 TYR A 121 2.526 -18.231 -20.539 1.00 0.00 H new ATOM 0 HH TYR A 121 4.961 -17.704 -20.420 1.00 0.00 H new ATOM 1407 N LEU A 122 0.177 -12.277 -17.651 1.00 0.00 N ATOM 1408 CA LEU A 122 0.957 -11.087 -17.435 1.00 0.00 C ATOM 1409 C LEU A 122 1.986 -11.353 -16.356 1.00 0.00 C ATOM 1410 O LEU A 122 1.646 -11.732 -15.239 1.00 0.00 O ATOM 1411 CB LEU A 122 0.057 -9.923 -17.032 1.00 0.00 C ATOM 1412 CG LEU A 122 0.902 -8.658 -16.873 1.00 0.00 C ATOM 1413 CD1 LEU A 122 1.231 -8.086 -18.252 1.00 0.00 C ATOM 1414 CD2 LEU A 122 0.118 -7.619 -16.073 1.00 0.00 C ATOM 0 H LEU A 122 -0.179 -12.722 -16.805 1.00 0.00 H new ATOM 0 HA LEU A 122 1.464 -10.818 -18.362 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -0.713 -9.766 -17.787 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.455 -10.152 -16.097 1.00 0.00 H new ATOM 0 HG LEU A 122 1.825 -8.905 -16.349 1.00 0.00 H new ATOM 0 HD11 LEU A 122 1.833 -7.185 -18.138 1.00 0.00 H new ATOM 0 HD12 LEU A 122 1.789 -8.824 -18.829 1.00 0.00 H new ATOM 0 HD13 LEU A 122 0.306 -7.841 -18.774 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.720 -6.717 -15.959 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -0.805 -7.375 -16.599 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -0.121 -8.022 -15.089 1.00 0.00 H new ATOM 1426 N GLU A 123 3.242 -11.135 -16.702 1.00 0.00 N ATOM 1427 CA GLU A 123 4.327 -11.339 -15.765 1.00 0.00 C ATOM 1428 C GLU A 123 4.978 -9.999 -15.494 1.00 0.00 C ATOM 1429 O GLU A 123 5.304 -9.275 -16.426 1.00 0.00 O ATOM 1430 CB GLU A 123 5.349 -12.306 -16.359 1.00 0.00 C ATOM 1431 CG GLU A 123 6.368 -12.683 -15.287 1.00 0.00 C ATOM 1432 CD GLU A 123 7.442 -13.590 -15.880 1.00 0.00 C ATOM 1433 OE1 GLU A 123 7.328 -13.927 -17.046 1.00 0.00 O ATOM 1434 OE2 GLU A 123 8.363 -13.938 -15.157 1.00 0.00 O ATOM 0 H GLU A 123 3.534 -10.817 -17.626 1.00 0.00 H new ATOM 0 HA GLU A 123 3.948 -11.765 -14.836 1.00 0.00 H new ATOM 0 HB2 GLU A 123 4.848 -13.200 -16.731 1.00 0.00 H new ATOM 0 HB3 GLU A 123 5.852 -11.845 -17.209 1.00 0.00 H new ATOM 0 HG2 GLU A 123 6.827 -11.783 -14.878 1.00 0.00 H new ATOM 0 HG3 GLU A 123 5.868 -13.190 -14.461 1.00 0.00 H new ATOM 1441 N VAL A 124 5.127 -9.650 -14.225 1.00 0.00 N ATOM 1442 CA VAL A 124 5.700 -8.357 -13.890 1.00 0.00 C ATOM 1443 C VAL A 124 6.808 -8.483 -12.847 1.00 0.00 C ATOM 1444 O VAL A 124 6.566 -8.917 -11.722 1.00 0.00 O ATOM 1445 CB VAL A 124 4.584 -7.455 -13.348 1.00 0.00 C ATOM 1446 CG1 VAL A 124 5.076 -6.013 -13.254 1.00 0.00 C ATOM 1447 CG2 VAL A 124 3.369 -7.516 -14.282 1.00 0.00 C ATOM 0 H VAL A 124 4.866 -10.229 -13.427 1.00 0.00 H new ATOM 0 HA VAL A 124 6.142 -7.928 -14.789 1.00 0.00 H new ATOM 0 HB VAL A 124 4.300 -7.804 -12.355 1.00 0.00 H new ATOM 0 HG11 VAL A 124 4.277 -5.380 -12.868 1.00 0.00 H new ATOM 0 HG12 VAL A 124 5.933 -5.964 -12.583 1.00 0.00 H new ATOM 0 HG13 VAL A 124 5.370 -5.664 -14.244 1.00 0.00 H new ATOM 0 HG21 VAL A 124 2.579 -6.874 -13.893 1.00 0.00 H new ATOM 0 HG22 VAL A 124 3.657 -7.175 -15.276 1.00 0.00 H new ATOM 0 HG23 VAL A 124 3.007 -8.542 -14.341 1.00 0.00 H new ATOM 1457 N GLN A 125 8.022 -8.086 -13.228 1.00 0.00 N ATOM 1458 CA GLN A 125 9.162 -8.144 -12.318 1.00 0.00 C ATOM 1459 C GLN A 125 9.516 -6.735 -11.856 1.00 0.00 C ATOM 1460 O GLN A 125 9.651 -5.825 -12.673 1.00 0.00 O ATOM 1461 CB GLN A 125 10.366 -8.773 -13.029 1.00 0.00 C ATOM 1462 CG GLN A 125 10.072 -10.242 -13.332 1.00 0.00 C ATOM 1463 CD GLN A 125 10.267 -10.529 -14.816 1.00 0.00 C ATOM 1464 OE1 GLN A 125 9.292 -11.062 -15.496 1.00 0.00 O flip ATOM 1465 NE2 GLN A 125 11.332 -10.263 -15.373 1.00 0.00 N flip ATOM 0 H GLN A 125 8.239 -7.723 -14.156 1.00 0.00 H new ATOM 0 HA GLN A 125 8.901 -8.755 -11.454 1.00 0.00 H new ATOM 0 HB2 GLN A 125 10.577 -8.236 -13.954 1.00 0.00 H new ATOM 0 HB3 GLN A 125 11.255 -8.691 -12.403 1.00 0.00 H new ATOM 0 HG2 GLN A 125 10.730 -10.880 -12.742 1.00 0.00 H new ATOM 0 HG3 GLN A 125 9.050 -10.482 -13.040 1.00 0.00 H new ATOM 0 HE21 GLN A 125 12.096 -9.846 -14.841 1.00 0.00 H new ATOM 0 HE22 GLN A 125 11.451 -10.460 -16.367 1.00 0.00 H new ATOM 1474 N TYR A 126 9.639 -6.554 -10.546 1.00 0.00 N ATOM 1475 CA TYR A 126 9.948 -5.237 -10.005 1.00 0.00 C ATOM 1476 C TYR A 126 10.668 -5.331 -8.664 1.00 0.00 C ATOM 1477 O TYR A 126 10.773 -6.400 -8.066 1.00 0.00 O ATOM 1478 CB TYR A 126 8.653 -4.445 -9.818 1.00 0.00 C ATOM 1479 CG TYR A 126 7.866 -5.037 -8.676 1.00 0.00 C ATOM 1480 CD1 TYR A 126 8.078 -4.590 -7.366 1.00 0.00 C ATOM 1481 CD2 TYR A 126 6.924 -6.040 -8.929 1.00 0.00 C ATOM 1482 CE1 TYR A 126 7.346 -5.147 -6.311 1.00 0.00 C ATOM 1483 CE2 TYR A 126 6.192 -6.596 -7.876 1.00 0.00 C ATOM 1484 CZ TYR A 126 6.402 -6.150 -6.566 1.00 0.00 C ATOM 1485 OH TYR A 126 5.682 -6.699 -5.526 1.00 0.00 O ATOM 0 H TYR A 126 9.531 -7.290 -9.849 1.00 0.00 H new ATOM 0 HA TYR A 126 10.607 -4.734 -10.713 1.00 0.00 H new ATOM 0 HB2 TYR A 126 8.880 -3.398 -9.614 1.00 0.00 H new ATOM 0 HB3 TYR A 126 8.062 -4.471 -10.734 1.00 0.00 H new ATOM 0 HD1 TYR A 126 8.806 -3.816 -7.170 1.00 0.00 H new ATOM 0 HD2 TYR A 126 6.762 -6.385 -9.939 1.00 0.00 H new ATOM 0 HE1 TYR A 126 7.509 -4.803 -5.300 1.00 0.00 H new ATOM 0 HE2 TYR A 126 5.465 -7.370 -8.073 1.00 0.00 H new ATOM 0 HH TYR A 126 5.070 -7.380 -5.875 1.00 0.00 H new ATOM 1495 N ASP A 127 11.141 -4.181 -8.190 1.00 0.00 N ATOM 1496 CA ASP A 127 11.827 -4.104 -6.909 1.00 0.00 C ATOM 1497 C ASP A 127 11.211 -2.986 -6.077 1.00 0.00 C ATOM 1498 O ASP A 127 10.536 -2.107 -6.614 1.00 0.00 O ATOM 1499 CB ASP A 127 13.320 -3.832 -7.115 1.00 0.00 C ATOM 1500 CG ASP A 127 13.906 -4.846 -8.092 1.00 0.00 C ATOM 1501 OD1 ASP A 127 13.269 -5.109 -9.096 1.00 0.00 O ATOM 1502 OD2 ASP A 127 14.990 -5.339 -7.824 1.00 0.00 O ATOM 0 H ASP A 127 11.060 -3.289 -8.678 1.00 0.00 H new ATOM 0 HA ASP A 127 11.717 -5.056 -6.389 1.00 0.00 H new ATOM 0 HB2 ASP A 127 13.464 -2.821 -7.497 1.00 0.00 H new ATOM 0 HB3 ASP A 127 13.843 -3.890 -6.161 1.00 0.00 H new ATOM 1507 N CYS A 128 11.431 -3.023 -4.768 1.00 0.00 N ATOM 1508 CA CYS A 128 10.875 -2.001 -3.893 1.00 0.00 C ATOM 1509 C CYS A 128 11.979 -1.104 -3.340 1.00 0.00 C ATOM 1510 O CYS A 128 12.930 -1.586 -2.725 1.00 0.00 O ATOM 1511 CB CYS A 128 10.114 -2.669 -2.748 1.00 0.00 C ATOM 1512 SG CYS A 128 8.653 -3.500 -3.419 1.00 0.00 S ATOM 0 H CYS A 128 11.982 -3.739 -4.295 1.00 0.00 H new ATOM 0 HA CYS A 128 10.190 -1.379 -4.469 1.00 0.00 H new ATOM 0 HB2 CYS A 128 10.755 -3.388 -2.238 1.00 0.00 H new ATOM 0 HB3 CYS A 128 9.818 -1.925 -2.008 1.00 0.00 H new ATOM 1517 N VAL A 129 11.849 0.204 -3.567 1.00 0.00 N ATOM 1518 CA VAL A 129 12.856 1.149 -3.087 1.00 0.00 C ATOM 1519 C VAL A 129 12.224 2.225 -2.199 1.00 0.00 C ATOM 1520 O VAL A 129 11.025 2.483 -2.295 1.00 0.00 O ATOM 1521 CB VAL A 129 13.560 1.808 -4.274 1.00 0.00 C ATOM 1522 CG1 VAL A 129 14.554 0.817 -4.882 1.00 0.00 C ATOM 1523 CG2 VAL A 129 12.527 2.209 -5.336 1.00 0.00 C ATOM 0 H VAL A 129 11.070 0.627 -4.072 1.00 0.00 H new ATOM 0 HA VAL A 129 13.583 0.597 -2.492 1.00 0.00 H new ATOM 0 HB VAL A 129 14.087 2.699 -3.933 1.00 0.00 H new ATOM 0 HG11 VAL A 129 15.059 1.282 -5.729 1.00 0.00 H new ATOM 0 HG12 VAL A 129 15.291 0.534 -4.131 1.00 0.00 H new ATOM 0 HG13 VAL A 129 14.021 -0.072 -5.220 1.00 0.00 H new ATOM 0 HG21 VAL A 129 13.035 2.678 -6.179 1.00 0.00 H new ATOM 0 HG22 VAL A 129 11.996 1.322 -5.680 1.00 0.00 H new ATOM 0 HG23 VAL A 129 11.816 2.913 -4.904 1.00 0.00 H new ATOM 1533 N PRO A 130 12.999 2.862 -1.338 1.00 0.00 N ATOM 1534 CA PRO A 130 12.479 3.933 -0.428 1.00 0.00 C ATOM 1535 C PRO A 130 11.912 5.123 -1.198 1.00 0.00 C ATOM 1536 O PRO A 130 12.366 5.435 -2.300 1.00 0.00 O ATOM 1537 CB PRO A 130 13.700 4.359 0.397 1.00 0.00 C ATOM 1538 CG PRO A 130 14.695 3.258 0.243 1.00 0.00 C ATOM 1539 CD PRO A 130 14.441 2.639 -1.126 1.00 0.00 C ATOM 0 HA PRO A 130 11.655 3.567 0.185 1.00 0.00 H new ATOM 0 HB2 PRO A 130 14.104 5.305 0.038 1.00 0.00 H new ATOM 0 HB3 PRO A 130 13.434 4.503 1.444 1.00 0.00 H new ATOM 0 HG2 PRO A 130 15.713 3.641 0.313 1.00 0.00 H new ATOM 0 HG3 PRO A 130 14.579 2.516 1.033 1.00 0.00 H new ATOM 0 HD2 PRO A 130 15.040 3.117 -1.901 1.00 0.00 H new ATOM 0 HD3 PRO A 130 14.690 1.578 -1.140 1.00 0.00 H new ATOM 1547 N TYR A 131 10.923 5.785 -0.610 1.00 0.00 N ATOM 1548 CA TYR A 131 10.311 6.941 -1.253 1.00 0.00 C ATOM 1549 C TYR A 131 11.180 8.178 -1.075 1.00 0.00 C ATOM 1550 O TYR A 131 10.887 9.240 -1.625 1.00 0.00 O ATOM 1551 CB TYR A 131 8.923 7.209 -0.680 1.00 0.00 C ATOM 1552 CG TYR A 131 8.246 8.239 -1.545 1.00 0.00 C ATOM 1553 CD1 TYR A 131 7.879 7.908 -2.854 1.00 0.00 C ATOM 1554 CD2 TYR A 131 7.997 9.523 -1.050 1.00 0.00 C ATOM 1555 CE1 TYR A 131 7.260 8.861 -3.668 1.00 0.00 C ATOM 1556 CE2 TYR A 131 7.375 10.477 -1.865 1.00 0.00 C ATOM 1557 CZ TYR A 131 7.008 10.145 -3.175 1.00 0.00 C ATOM 1558 OH TYR A 131 6.396 11.087 -3.976 1.00 0.00 O ATOM 0 H TYR A 131 10.531 5.545 0.301 1.00 0.00 H new ATOM 0 HA TYR A 131 10.219 6.719 -2.316 1.00 0.00 H new ATOM 0 HB2 TYR A 131 8.338 6.290 -0.656 1.00 0.00 H new ATOM 0 HB3 TYR A 131 8.999 7.566 0.347 1.00 0.00 H new ATOM 0 HD1 TYR A 131 8.074 6.917 -3.235 1.00 0.00 H new ATOM 0 HD2 TYR A 131 8.284 9.779 -0.041 1.00 0.00 H new ATOM 0 HE1 TYR A 131 6.976 8.605 -4.678 1.00 0.00 H new ATOM 0 HE2 TYR A 131 7.178 11.468 -1.483 1.00 0.00 H new ATOM 0 HH TYR A 131 6.295 11.925 -3.477 1.00 0.00 H new ATOM 1568 N LYS A 132 12.249 8.033 -0.307 1.00 0.00 N ATOM 1569 CA LYS A 132 13.162 9.139 -0.058 1.00 0.00 C ATOM 1570 C LYS A 132 14.602 8.653 -0.173 1.00 0.00 C ATOM 1571 O LYS A 132 15.121 7.996 0.728 1.00 0.00 O ATOM 1572 CB LYS A 132 12.903 9.720 1.338 1.00 0.00 C ATOM 1573 CG LYS A 132 12.822 8.586 2.363 1.00 0.00 C ATOM 1574 CD LYS A 132 12.369 9.147 3.714 1.00 0.00 C ATOM 1575 CE LYS A 132 12.282 8.011 4.733 1.00 0.00 C ATOM 1576 NZ LYS A 132 11.277 7.008 4.277 1.00 0.00 N ATOM 0 H LYS A 132 12.506 7.161 0.155 1.00 0.00 H new ATOM 0 HA LYS A 132 12.996 9.921 -0.799 1.00 0.00 H new ATOM 0 HB2 LYS A 132 13.701 10.411 1.608 1.00 0.00 H new ATOM 0 HB3 LYS A 132 11.974 10.290 1.338 1.00 0.00 H new ATOM 0 HG2 LYS A 132 12.123 7.823 2.022 1.00 0.00 H new ATOM 0 HG3 LYS A 132 13.794 8.104 2.465 1.00 0.00 H new ATOM 0 HD2 LYS A 132 13.071 9.906 4.059 1.00 0.00 H new ATOM 0 HD3 LYS A 132 11.399 9.633 3.611 1.00 0.00 H new ATOM 0 HE2 LYS A 132 13.257 7.537 4.849 1.00 0.00 H new ATOM 0 HE3 LYS A 132 12.001 8.405 5.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 10.955 6.445 5.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 10.465 7.499 3.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 11.710 6.379 3.571 1.00 0.00 H new ATOM 1590 N VAL A 133 15.236 8.966 -1.300 1.00 0.00 N ATOM 1591 CA VAL A 133 16.611 8.539 -1.532 1.00 0.00 C ATOM 1592 C VAL A 133 17.599 9.584 -1.037 1.00 0.00 C ATOM 1593 O VAL A 133 17.466 10.772 -1.335 1.00 0.00 O ATOM 1594 CB VAL A 133 16.844 8.294 -3.027 1.00 0.00 C ATOM 1595 CG1 VAL A 133 18.264 7.767 -3.245 1.00 0.00 C ATOM 1596 CG2 VAL A 133 15.838 7.264 -3.545 1.00 0.00 C ATOM 0 H VAL A 133 14.824 9.508 -2.059 1.00 0.00 H new ATOM 0 HA VAL A 133 16.770 7.614 -0.978 1.00 0.00 H new ATOM 0 HB VAL A 133 16.714 9.232 -3.567 1.00 0.00 H new ATOM 0 HG11 VAL A 133 18.428 7.593 -4.308 1.00 0.00 H new ATOM 0 HG12 VAL A 133 18.984 8.500 -2.882 1.00 0.00 H new ATOM 0 HG13 VAL A 133 18.393 6.832 -2.700 1.00 0.00 H new ATOM 0 HG21 VAL A 133 16.007 7.093 -4.608 1.00 0.00 H new ATOM 0 HG22 VAL A 133 15.964 6.327 -3.002 1.00 0.00 H new ATOM 0 HG23 VAL A 133 14.825 7.637 -3.394 1.00 0.00 H new ATOM 1606 N GLU A 134 18.601 9.127 -0.296 1.00 0.00 N ATOM 1607 CA GLU A 134 19.623 10.022 0.226 1.00 0.00 C ATOM 1608 C GLU A 134 19.005 11.100 1.111 1.00 0.00 C ATOM 1609 O GLU A 134 17.803 11.284 1.034 1.00 0.00 O ATOM 1610 CB GLU A 134 20.375 10.670 -0.939 1.00 0.00 C ATOM 1611 CG GLU A 134 21.584 11.440 -0.408 1.00 0.00 C ATOM 1612 CD GLU A 134 22.554 10.478 0.271 1.00 0.00 C ATOM 1613 OE1 GLU A 134 22.429 9.286 0.045 1.00 0.00 O ATOM 1614 OE2 GLU A 134 23.402 10.947 1.014 1.00 0.00 O ATOM 1615 OXT GLU A 134 19.746 11.718 1.859 1.00 0.00 O ATOM 0 H GLU A 134 18.727 8.146 -0.045 1.00 0.00 H new ATOM 0 HA GLU A 134 20.317 9.442 0.834 1.00 0.00 H new ATOM 0 HB2 GLU A 134 20.700 9.905 -1.645 1.00 0.00 H new ATOM 0 HB3 GLU A 134 19.712 11.344 -1.482 1.00 0.00 H new ATOM 0 HG2 GLU A 134 22.084 11.958 -1.226 1.00 0.00 H new ATOM 0 HG3 GLU A 134 21.259 12.202 0.300 1.00 0.00 H new TER 1622 GLU A 134 HETATM 1623 C1 NAG A 135 9.324 8.270 -9.730 1.00 0.00 C HETATM 1624 C2 NAG A 135 9.203 8.834 -11.118 1.00 0.00 C HETATM 1625 C3 NAG A 135 10.568 9.213 -11.635 1.00 0.00 C HETATM 1626 C4 NAG A 135 11.209 10.207 -10.700 1.00 0.00 C HETATM 1627 C5 NAG A 135 11.234 9.639 -9.291 1.00 0.00 C HETATM 1628 C6 NAG A 135 11.730 10.663 -8.274 1.00 0.00 C HETATM 1629 C7 NAG A 135 7.303 7.967 -12.339 1.00 0.00 C HETATM 1630 C8 NAG A 135 6.713 6.925 -13.258 1.00 0.00 C HETATM 1631 N2 NAG A 135 8.585 7.840 -12.008 1.00 0.00 N HETATM 1632 O3 NAG A 135 10.445 9.775 -12.952 1.00 0.00 O HETATM 1633 O4 NAG A 135 12.550 10.489 -11.135 1.00 0.00 O HETATM 1634 O5 NAG A 135 9.910 9.225 -8.875 1.00 0.00 O HETATM 1635 O6 NAG A 135 10.644 11.195 -7.497 1.00 0.00 O HETATM 1636 O7 NAG A 135 6.598 8.889 -11.932 1.00 0.00 O HETATM 0 HO6 NAG A 135 9.829 10.684 -7.681 1.00 0.00 H new HETATM 0 HO4 NAG A 135 12.734 11.445 -11.028 1.00 0.00 H new HETATM 0 HO3 NAG A 135 11.332 10.022 -13.286 1.00 0.00 H new HETATM 0 HN2 NAG A 135 9.135 7.060 -12.368 1.00 0.00 H new HETATM 0 H83 NAG A 135 7.255 6.925 -14.204 1.00 0.00 H new HETATM 0 H82 NAG A 135 6.794 5.942 -12.793 1.00 0.00 H new HETATM 0 H81 NAG A 135 5.663 7.154 -13.442 1.00 0.00 H new HETATM 0 H62 NAG A 135 12.460 10.197 -7.612 1.00 0.00 H new HETATM 0 H61 NAG A 135 12.242 11.475 -8.792 1.00 0.00 H new HETATM 0 H5 NAG A 135 11.914 8.787 -9.321 1.00 0.00 H new HETATM 0 H4 NAG A 135 10.631 11.131 -10.705 1.00 0.00 H new HETATM 0 H3 NAG A 135 11.197 8.324 -11.687 1.00 0.00 H new HETATM 0 H2 NAG A 135 8.574 9.724 -11.091 1.00 0.00 H new HETATM 1651 C1 RAM A 136 -9.544 -14.441 -26.865 1.00 0.00 C HETATM 1652 C2 RAM A 136 -8.510 -13.304 -26.684 1.00 0.00 C HETATM 1653 C3 RAM A 136 -7.748 -13.558 -25.366 1.00 0.00 C HETATM 1654 C4 RAM A 136 -7.054 -14.932 -25.441 1.00 0.00 C HETATM 1655 C5 RAM A 136 -8.139 -16.011 -25.660 1.00 0.00 C HETATM 1656 C6 RAM A 136 -7.484 -17.391 -25.746 1.00 0.00 C HETATM 1657 O1 RAM A 136 -10.474 -14.417 -25.779 1.00 0.00 O HETATM 1658 O2 RAM A 136 -7.587 -13.321 -27.776 1.00 0.00 O HETATM 1659 O3 RAM A 136 -6.775 -12.527 -25.168 1.00 0.00 O HETATM 1660 O4 RAM A 136 -6.349 -15.191 -24.226 1.00 0.00 O HETATM 1661 O5 RAM A 136 -8.876 -15.744 -26.895 1.00 0.00 O HETATM 0 HO4 RAM A 136 -5.416 -15.410 -24.430 1.00 0.00 H new HETATM 0 HO3 RAM A 136 -6.829 -12.199 -24.246 1.00 0.00 H new HETATM 0 HO2 RAM A 136 -6.933 -12.600 -27.663 1.00 0.00 H new HETATM 0 HO1 RAM A 136 -11.130 -15.136 -25.894 1.00 0.00 H new HETATM 0 H63 RAM A 136 -6.783 -17.410 -26.580 1.00 0.00 H new HETATM 0 H62 RAM A 136 -6.950 -17.599 -24.819 1.00 0.00 H new HETATM 0 H61 RAM A 136 -8.252 -18.149 -25.900 1.00 0.00 H new HETATM 0 H5 RAM A 136 -8.833 -15.987 -24.819 1.00 0.00 H new HETATM 0 H4 RAM A 136 -6.339 -14.945 -26.264 1.00 0.00 H new HETATM 0 H3 RAM A 136 -8.445 -13.551 -24.528 1.00 0.00 H new HETATM 0 H2 RAM A 136 -9.010 -12.336 -26.656 1.00 0.00 H new HETATM 0 H1 RAM A 136 -10.067 -14.289 -27.809 1.00 0.00 H new