USER MOD reduce.3.24.130724 H: found=0, std=0, add=679, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 680 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot -170:sc= -0.0562 USER MOD Single : A 21 SER OG : rot 57:sc= 0.966 USER MOD Single : A 22 LYS NZ :NH3+ 169:sc= -0.0134 (180deg=-0.152) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 49:sc= 1.01 USER MOD Single : A 32 THR OG1 : rot 47:sc= 0.234 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot -50:sc= 0.874 USER MOD Single : A 50 MET CE :methyl -139:sc= -2 (180deg=-2.18) USER MOD Single : A 51 HIS : no HD1:sc= -1.26 K(o=-1.3,f=-2.3) USER MOD Single : A 52 ASN : amide:sc= -4.22! C(o=-4.2!,f=-5.3!) USER MOD Single : A 57 ASN : amide:sc= -0.205 K(o=-0.21,f=-1.8!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.603 K(o=-0.6,f=-0.019) USER MOD Single : A 67 ASN : amide:sc= 0.177 X(o=0.18,f=-0.035) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -1 X(o=-1,f=-0.72) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 18 N GLU A 2 1.651 0.595 -3.553 1.00 0.00 N ATOM 19 CA GLU A 2 0.863 0.689 -4.775 1.00 0.00 C ATOM 20 C GLU A 2 1.295 -0.372 -5.784 1.00 0.00 C ATOM 21 O GLU A 2 2.315 -1.039 -5.603 1.00 0.00 O ATOM 22 CB GLU A 2 1.002 2.082 -5.392 1.00 0.00 C ATOM 23 CG GLU A 2 0.939 3.208 -4.374 1.00 0.00 C ATOM 24 CD GLU A 2 0.677 4.558 -5.012 1.00 0.00 C ATOM 25 OE1 GLU A 2 1.166 4.785 -6.139 1.00 0.00 O ATOM 26 OE2 GLU A 2 -0.015 5.387 -4.386 1.00 0.00 O ATOM 0 HA GLU A 2 -0.182 0.516 -4.517 1.00 0.00 H new ATOM 0 HB2 GLU A 2 1.950 2.140 -5.927 1.00 0.00 H new ATOM 0 HB3 GLU A 2 0.211 2.225 -6.128 1.00 0.00 H new ATOM 0 HG2 GLU A 2 0.153 2.994 -3.650 1.00 0.00 H new ATOM 0 HG3 GLU A 2 1.878 3.247 -3.823 1.00 0.00 H new ATOM 33 N LEU A 3 0.512 -0.523 -6.847 1.00 0.00 N ATOM 34 CA LEU A 3 0.812 -1.502 -7.886 1.00 0.00 C ATOM 35 C LEU A 3 1.218 -0.812 -9.184 1.00 0.00 C ATOM 36 O LEU A 3 0.377 -0.259 -9.893 1.00 0.00 O ATOM 37 CB LEU A 3 -0.399 -2.403 -8.130 1.00 0.00 C ATOM 38 CG LEU A 3 -0.285 -3.837 -7.612 1.00 0.00 C ATOM 39 CD1 LEU A 3 0.690 -4.636 -8.464 1.00 0.00 C ATOM 40 CD2 LEU A 3 0.149 -3.844 -6.154 1.00 0.00 C ATOM 0 H LEU A 3 -0.335 0.020 -7.012 1.00 0.00 H new ATOM 0 HA LEU A 3 1.648 -2.113 -7.545 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -1.270 -1.939 -7.668 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -0.589 -2.440 -9.203 1.00 0.00 H new ATOM 0 HG LEU A 3 -1.266 -4.307 -7.681 1.00 0.00 H new ATOM 0 HD11 LEU A 3 0.758 -5.654 -8.081 1.00 0.00 H new ATOM 0 HD12 LEU A 3 0.337 -4.659 -9.495 1.00 0.00 H new ATOM 0 HD13 LEU A 3 1.674 -4.168 -8.427 1.00 0.00 H new ATOM 0 HD21 LEU A 3 0.225 -4.873 -5.802 1.00 0.00 H new ATOM 0 HD22 LEU A 3 1.119 -3.356 -6.061 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -0.586 -3.308 -5.553 1.00 0.00 H new ATOM 52 N ALA A 4 2.510 -0.850 -9.490 1.00 0.00 N ATOM 53 CA ALA A 4 3.026 -0.233 -10.706 1.00 0.00 C ATOM 54 C ALA A 4 3.497 -1.288 -11.701 1.00 0.00 C ATOM 55 O ALA A 4 4.348 -2.119 -11.384 1.00 0.00 O ATOM 56 CB ALA A 4 4.161 0.723 -10.370 1.00 0.00 C ATOM 0 H ALA A 4 3.219 -1.302 -8.913 1.00 0.00 H new ATOM 0 HA ALA A 4 2.216 0.329 -11.171 1.00 0.00 H new ATOM 0 HB1 ALA A 4 4.538 1.177 -11.287 1.00 0.00 H new ATOM 0 HB2 ALA A 4 3.794 1.503 -9.703 1.00 0.00 H new ATOM 0 HB3 ALA A 4 4.965 0.175 -9.880 1.00 0.00 H new ATOM 62 N VAL A 5 2.937 -1.250 -12.906 1.00 0.00 N ATOM 63 CA VAL A 5 3.300 -2.203 -13.948 1.00 0.00 C ATOM 64 C VAL A 5 3.599 -1.492 -15.263 1.00 0.00 C ATOM 65 O VAL A 5 2.997 -0.465 -15.575 1.00 0.00 O ATOM 66 CB VAL A 5 2.181 -3.236 -14.178 1.00 0.00 C ATOM 67 CG1 VAL A 5 2.732 -4.476 -14.867 1.00 0.00 C ATOM 68 CG2 VAL A 5 1.514 -3.600 -12.860 1.00 0.00 C ATOM 0 H VAL A 5 2.230 -0.569 -13.185 1.00 0.00 H new ATOM 0 HA VAL A 5 4.197 -2.720 -13.606 1.00 0.00 H new ATOM 0 HB VAL A 5 1.428 -2.792 -14.830 1.00 0.00 H new ATOM 0 HG11 VAL A 5 1.927 -5.195 -15.021 1.00 0.00 H new ATOM 0 HG12 VAL A 5 3.159 -4.197 -15.830 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.505 -4.925 -14.244 1.00 0.00 H new ATOM 0 HG21 VAL A 5 0.726 -4.331 -13.041 1.00 0.00 H new ATOM 0 HG22 VAL A 5 2.255 -4.025 -12.183 1.00 0.00 H new ATOM 0 HG23 VAL A 5 1.083 -2.705 -12.411 1.00 0.00 H new ATOM 78 N ILE A 6 4.532 -2.046 -16.029 1.00 0.00 N ATOM 79 CA ILE A 6 4.910 -1.466 -17.312 1.00 0.00 C ATOM 80 C ILE A 6 4.945 -2.527 -18.407 1.00 0.00 C ATOM 81 O ILE A 6 5.891 -3.308 -18.498 1.00 0.00 O ATOM 82 CB ILE A 6 6.285 -0.777 -17.235 1.00 0.00 C ATOM 83 CG1 ILE A 6 6.252 0.366 -16.219 1.00 0.00 C ATOM 84 CG2 ILE A 6 6.697 -0.263 -18.607 1.00 0.00 C ATOM 85 CD1 ILE A 6 7.597 0.655 -15.590 1.00 0.00 C ATOM 0 H ILE A 6 5.040 -2.896 -15.784 1.00 0.00 H new ATOM 0 HA ILE A 6 4.153 -0.721 -17.557 1.00 0.00 H new ATOM 0 HB ILE A 6 7.023 -1.508 -16.906 1.00 0.00 H new ATOM 0 HG12 ILE A 6 5.889 1.268 -16.711 1.00 0.00 H new ATOM 0 HG13 ILE A 6 5.537 0.122 -15.433 1.00 0.00 H new ATOM 0 HG21 ILE A 6 7.671 0.222 -18.537 1.00 0.00 H new ATOM 0 HG22 ILE A 6 6.757 -1.098 -19.305 1.00 0.00 H new ATOM 0 HG23 ILE A 6 5.959 0.456 -18.963 1.00 0.00 H new ATOM 0 HD11 ILE A 6 7.498 1.477 -14.881 1.00 0.00 H new ATOM 0 HD12 ILE A 6 7.953 -0.234 -15.069 1.00 0.00 H new ATOM 0 HD13 ILE A 6 8.310 0.931 -16.367 1.00 0.00 H new ATOM 97 N GLY A 7 3.907 -2.547 -19.238 1.00 0.00 N ATOM 98 CA GLY A 7 3.840 -3.515 -20.317 1.00 0.00 C ATOM 99 C GLY A 7 3.175 -2.954 -21.558 1.00 0.00 C ATOM 100 O GLY A 7 3.615 -1.942 -22.104 1.00 0.00 O ATOM 0 H GLY A 7 3.112 -1.910 -19.183 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.848 -3.846 -20.567 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.290 -4.393 -19.979 1.00 0.00 H new ATOM 104 N LYS A 8 2.113 -3.613 -22.008 1.00 0.00 N ATOM 105 CA LYS A 8 1.386 -3.175 -23.194 1.00 0.00 C ATOM 106 C LYS A 8 0.075 -2.498 -22.808 1.00 0.00 C ATOM 107 O LYS A 8 -0.229 -2.339 -21.626 1.00 0.00 O ATOM 108 CB LYS A 8 1.106 -4.365 -24.114 1.00 0.00 C ATOM 109 CG LYS A 8 0.420 -5.526 -23.415 1.00 0.00 C ATOM 110 CD LYS A 8 0.016 -6.610 -24.401 1.00 0.00 C ATOM 111 CE LYS A 8 -0.001 -7.982 -23.744 1.00 0.00 C ATOM 112 NZ LYS A 8 -0.190 -9.072 -24.741 1.00 0.00 N ATOM 0 H LYS A 8 1.736 -4.453 -21.569 1.00 0.00 H new ATOM 0 HA LYS A 8 2.006 -2.452 -23.724 1.00 0.00 H new ATOM 0 HB2 LYS A 8 0.483 -4.033 -24.945 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.047 -4.713 -24.540 1.00 0.00 H new ATOM 0 HG2 LYS A 8 1.089 -5.947 -22.664 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -0.463 -5.164 -22.888 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -0.971 -6.386 -24.805 1.00 0.00 H new ATOM 0 HD3 LYS A 8 0.710 -6.616 -25.241 1.00 0.00 H new ATOM 0 HE2 LYS A 8 0.934 -8.139 -23.207 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -0.802 -8.022 -23.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -0.196 -9.991 -24.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -1.095 -8.937 -25.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 0.588 -9.051 -25.430 1.00 0.00 H new ATOM 126 N SER A 9 -0.699 -2.101 -23.814 1.00 0.00 N ATOM 127 CA SER A 9 -1.977 -1.439 -23.580 1.00 0.00 C ATOM 128 C SER A 9 -3.019 -2.432 -23.075 1.00 0.00 C ATOM 129 O SER A 9 -3.651 -2.213 -22.042 1.00 0.00 O ATOM 130 CB SER A 9 -2.472 -0.771 -24.864 1.00 0.00 C ATOM 131 OG SER A 9 -3.887 -0.689 -24.884 1.00 0.00 O ATOM 0 H SER A 9 -0.463 -2.226 -24.798 1.00 0.00 H new ATOM 0 HA SER A 9 -1.828 -0.676 -22.816 1.00 0.00 H new ATOM 0 HB2 SER A 9 -2.046 0.229 -24.945 1.00 0.00 H new ATOM 0 HB3 SER A 9 -2.125 -1.337 -25.729 1.00 0.00 H new ATOM 0 HG SER A 9 -4.178 -0.257 -25.714 1.00 0.00 H new ATOM 137 N GLU A 10 -3.193 -3.524 -23.812 1.00 0.00 N ATOM 138 CA GLU A 10 -4.159 -4.551 -23.440 1.00 0.00 C ATOM 139 C GLU A 10 -3.945 -5.002 -21.998 1.00 0.00 C ATOM 140 O GLU A 10 -4.861 -5.514 -21.354 1.00 0.00 O ATOM 141 CB GLU A 10 -4.050 -5.751 -24.383 1.00 0.00 C ATOM 142 CG GLU A 10 -4.236 -5.393 -25.848 1.00 0.00 C ATOM 143 CD GLU A 10 -5.687 -5.455 -26.284 1.00 0.00 C ATOM 144 OE1 GLU A 10 -6.140 -6.548 -26.682 1.00 0.00 O ATOM 145 OE2 GLU A 10 -6.368 -4.410 -26.228 1.00 0.00 O ATOM 0 H GLU A 10 -2.678 -3.720 -24.670 1.00 0.00 H new ATOM 0 HA GLU A 10 -5.157 -4.122 -23.524 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.073 -6.217 -24.253 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -4.797 -6.493 -24.101 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -3.850 -4.389 -26.025 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -3.647 -6.074 -26.462 1.00 0.00 H new ATOM 152 N PHE A 11 -2.729 -4.808 -21.498 1.00 0.00 N ATOM 153 CA PHE A 11 -2.393 -5.197 -20.133 1.00 0.00 C ATOM 154 C PHE A 11 -3.086 -4.287 -19.123 1.00 0.00 C ATOM 155 O PHE A 11 -3.640 -4.754 -18.127 1.00 0.00 O ATOM 156 CB PHE A 11 -0.878 -5.148 -19.925 1.00 0.00 C ATOM 157 CG PHE A 11 -0.331 -6.357 -19.221 1.00 0.00 C ATOM 158 CD1 PHE A 11 -0.121 -7.540 -19.910 1.00 0.00 C ATOM 159 CD2 PHE A 11 -0.027 -6.310 -17.870 1.00 0.00 C ATOM 160 CE1 PHE A 11 0.383 -8.654 -19.265 1.00 0.00 C ATOM 161 CE2 PHE A 11 0.477 -7.420 -17.220 1.00 0.00 C ATOM 162 CZ PHE A 11 0.681 -8.594 -17.918 1.00 0.00 C ATOM 0 H PHE A 11 -1.960 -4.384 -22.017 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.742 -6.218 -19.976 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -0.389 -5.049 -20.894 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -0.627 -4.257 -19.349 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -0.354 -7.593 -20.963 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -0.186 -5.395 -17.319 1.00 0.00 H new ATOM 0 HE1 PHE A 11 0.543 -9.570 -19.814 1.00 0.00 H new ATOM 0 HE2 PHE A 11 0.711 -7.370 -16.167 1.00 0.00 H new ATOM 0 HZ PHE A 11 1.073 -9.464 -17.411 1.00 0.00 H new ATOM 172 N VAL A 12 -3.050 -2.984 -19.386 1.00 0.00 N ATOM 173 CA VAL A 12 -3.675 -2.008 -18.502 1.00 0.00 C ATOM 174 C VAL A 12 -5.195 -2.104 -18.562 1.00 0.00 C ATOM 175 O VAL A 12 -5.886 -1.832 -17.580 1.00 0.00 O ATOM 176 CB VAL A 12 -3.248 -0.572 -18.860 1.00 0.00 C ATOM 177 CG1 VAL A 12 -1.804 -0.548 -19.338 1.00 0.00 C ATOM 178 CG2 VAL A 12 -4.177 0.012 -19.913 1.00 0.00 C ATOM 0 H VAL A 12 -2.594 -2.580 -20.204 1.00 0.00 H new ATOM 0 HA VAL A 12 -3.340 -2.238 -17.491 1.00 0.00 H new ATOM 0 HB VAL A 12 -3.319 0.044 -17.964 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -1.520 0.475 -19.586 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -1.153 -0.924 -18.549 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -1.703 -1.178 -20.222 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -3.861 1.027 -20.154 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -4.140 -0.603 -20.812 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -5.197 0.031 -19.528 1.00 0.00 H new ATOM 188 N THR A 13 -5.712 -2.495 -19.723 1.00 0.00 N ATOM 189 CA THR A 13 -7.151 -2.627 -19.914 1.00 0.00 C ATOM 190 C THR A 13 -7.728 -3.709 -19.008 1.00 0.00 C ATOM 191 O THR A 13 -8.866 -3.608 -18.551 1.00 0.00 O ATOM 192 CB THR A 13 -7.496 -2.961 -21.377 1.00 0.00 C ATOM 193 OG1 THR A 13 -6.468 -2.471 -22.247 1.00 0.00 O ATOM 194 CG2 THR A 13 -8.833 -2.351 -21.771 1.00 0.00 C ATOM 0 H THR A 13 -5.155 -2.726 -20.546 1.00 0.00 H new ATOM 0 HA THR A 13 -7.594 -1.665 -19.655 1.00 0.00 H new ATOM 0 HB THR A 13 -7.567 -4.045 -21.472 1.00 0.00 H new ATOM 0 HG1 THR A 13 -6.765 -2.544 -23.178 1.00 0.00 H new ATOM 0 HG21 THR A 13 -9.055 -2.601 -22.809 1.00 0.00 H new ATOM 0 HG22 THR A 13 -9.618 -2.747 -21.126 1.00 0.00 H new ATOM 0 HG23 THR A 13 -8.785 -1.268 -21.661 1.00 0.00 H new ATOM 202 N GLY A 14 -6.935 -4.745 -18.751 1.00 0.00 N ATOM 203 CA GLY A 14 -7.385 -5.831 -17.900 1.00 0.00 C ATOM 204 C GLY A 14 -7.450 -5.433 -16.439 1.00 0.00 C ATOM 205 O GLY A 14 -8.439 -5.704 -15.758 1.00 0.00 O ATOM 0 H GLY A 14 -5.989 -4.851 -19.117 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -8.371 -6.161 -18.228 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -6.711 -6.680 -18.013 1.00 0.00 H new ATOM 209 N PHE A 15 -6.392 -4.791 -15.955 1.00 0.00 N ATOM 210 CA PHE A 15 -6.332 -4.358 -14.564 1.00 0.00 C ATOM 211 C PHE A 15 -7.225 -3.142 -14.333 1.00 0.00 C ATOM 212 O PHE A 15 -7.855 -3.012 -13.284 1.00 0.00 O ATOM 213 CB PHE A 15 -4.890 -4.027 -14.173 1.00 0.00 C ATOM 214 CG PHE A 15 -4.015 -5.239 -14.029 1.00 0.00 C ATOM 215 CD1 PHE A 15 -4.216 -6.137 -12.994 1.00 0.00 C ATOM 216 CD2 PHE A 15 -2.990 -5.480 -14.930 1.00 0.00 C ATOM 217 CE1 PHE A 15 -3.412 -7.254 -12.859 1.00 0.00 C ATOM 218 CE2 PHE A 15 -2.183 -6.595 -14.801 1.00 0.00 C ATOM 219 CZ PHE A 15 -2.394 -7.482 -13.764 1.00 0.00 C ATOM 0 H PHE A 15 -5.565 -4.559 -16.505 1.00 0.00 H new ATOM 0 HA PHE A 15 -6.693 -5.175 -13.939 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -4.460 -3.366 -14.926 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -4.894 -3.478 -13.232 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -5.011 -5.963 -12.284 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -2.820 -4.789 -15.742 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -3.580 -7.947 -12.048 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -1.388 -6.772 -15.511 1.00 0.00 H new ATOM 0 HZ PHE A 15 -1.764 -8.353 -13.661 1.00 0.00 H new ATOM 229 N ARG A 16 -7.272 -2.254 -15.321 1.00 0.00 N ATOM 230 CA ARG A 16 -8.086 -1.048 -15.226 1.00 0.00 C ATOM 231 C ARG A 16 -9.514 -1.387 -14.811 1.00 0.00 C ATOM 232 O ARG A 16 -10.194 -0.583 -14.172 1.00 0.00 O ATOM 233 CB ARG A 16 -8.094 -0.306 -16.564 1.00 0.00 C ATOM 234 CG ARG A 16 -9.058 0.868 -16.603 1.00 0.00 C ATOM 235 CD ARG A 16 -8.731 1.893 -15.528 1.00 0.00 C ATOM 236 NE ARG A 16 -9.332 3.194 -15.810 1.00 0.00 N ATOM 237 CZ ARG A 16 -8.865 4.037 -16.724 1.00 0.00 C ATOM 238 NH1 ARG A 16 -7.796 3.717 -17.440 1.00 0.00 N ATOM 239 NH2 ARG A 16 -9.467 5.202 -16.923 1.00 0.00 N ATOM 0 H ARG A 16 -6.756 -2.347 -16.196 1.00 0.00 H new ATOM 0 HA ARG A 16 -7.648 -0.403 -14.464 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -7.087 0.054 -16.776 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -8.356 -1.007 -17.357 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -9.017 1.342 -17.584 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -10.078 0.508 -16.466 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -9.086 1.532 -14.563 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -7.649 2.003 -15.449 1.00 0.00 H new ATOM 0 HE ARG A 16 -10.156 3.470 -15.276 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -7.331 2.822 -17.289 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -7.439 4.366 -18.141 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -10.290 5.451 -16.374 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -9.107 5.849 -17.625 1.00 0.00 H new ATOM 253 N LEU A 17 -9.964 -2.582 -15.179 1.00 0.00 N ATOM 254 CA LEU A 17 -11.312 -3.028 -14.846 1.00 0.00 C ATOM 255 C LEU A 17 -11.522 -3.048 -13.335 1.00 0.00 C ATOM 256 O LEU A 17 -12.529 -2.552 -12.832 1.00 0.00 O ATOM 257 CB LEU A 17 -11.568 -4.421 -15.426 1.00 0.00 C ATOM 258 CG LEU A 17 -12.652 -4.512 -16.500 1.00 0.00 C ATOM 259 CD1 LEU A 17 -12.028 -4.557 -17.886 1.00 0.00 C ATOM 260 CD2 LEU A 17 -13.531 -5.732 -16.268 1.00 0.00 C ATOM 0 H LEU A 17 -9.415 -3.259 -15.708 1.00 0.00 H new ATOM 0 HA LEU A 17 -12.019 -2.323 -15.283 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -10.635 -4.794 -15.848 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -11.838 -5.089 -14.608 1.00 0.00 H new ATOM 0 HG LEU A 17 -13.277 -3.621 -16.435 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -12.815 -4.622 -18.637 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -11.442 -3.653 -18.051 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -11.379 -5.429 -17.965 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -14.297 -5.781 -17.042 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -12.919 -6.633 -16.305 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -14.007 -5.657 -15.290 1.00 0.00 H new ATOM 272 N ALA A 18 -10.562 -3.623 -12.617 1.00 0.00 N ATOM 273 CA ALA A 18 -10.639 -3.703 -11.164 1.00 0.00 C ATOM 274 C ALA A 18 -10.100 -2.433 -10.515 1.00 0.00 C ATOM 275 O ALA A 18 -10.393 -2.144 -9.355 1.00 0.00 O ATOM 276 CB ALA A 18 -9.876 -4.920 -10.661 1.00 0.00 C ATOM 0 H ALA A 18 -9.722 -4.040 -13.019 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.688 -3.805 -10.886 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -9.942 -4.967 -9.574 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -10.309 -5.824 -11.090 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -8.830 -4.842 -10.958 1.00 0.00 H new ATOM 282 N GLY A 19 -9.310 -1.677 -11.271 1.00 0.00 N ATOM 283 CA GLY A 19 -8.742 -0.446 -10.751 1.00 0.00 C ATOM 284 C GLY A 19 -7.758 -0.693 -9.624 1.00 0.00 C ATOM 285 O GLY A 19 -7.339 0.243 -8.942 1.00 0.00 O ATOM 0 H GLY A 19 -9.053 -1.894 -12.234 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -8.240 0.088 -11.558 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -9.545 0.199 -10.394 1.00 0.00 H new ATOM 289 N ILE A 20 -7.389 -1.954 -9.428 1.00 0.00 N ATOM 290 CA ILE A 20 -6.449 -2.320 -8.376 1.00 0.00 C ATOM 291 C ILE A 20 -5.105 -2.741 -8.961 1.00 0.00 C ATOM 292 O ILE A 20 -4.526 -3.746 -8.551 1.00 0.00 O ATOM 293 CB ILE A 20 -6.998 -3.465 -7.504 1.00 0.00 C ATOM 294 CG1 ILE A 20 -8.483 -3.244 -7.209 1.00 0.00 C ATOM 295 CG2 ILE A 20 -6.206 -3.571 -6.209 1.00 0.00 C ATOM 296 CD1 ILE A 20 -9.037 -4.182 -6.160 1.00 0.00 C ATOM 0 H ILE A 20 -7.727 -2.740 -9.984 1.00 0.00 H new ATOM 0 HA ILE A 20 -6.311 -1.435 -7.755 1.00 0.00 H new ATOM 0 HB ILE A 20 -6.891 -4.402 -8.051 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -8.630 -2.216 -6.879 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -9.051 -3.368 -8.131 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -6.606 -4.384 -5.604 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -5.159 -3.770 -6.438 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -6.285 -2.635 -5.656 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -10.094 -3.968 -6.002 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -8.922 -5.212 -6.496 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -8.495 -4.043 -5.225 1.00 0.00 H new ATOM 308 N SER A 21 -4.615 -1.964 -9.921 1.00 0.00 N ATOM 309 CA SER A 21 -3.339 -2.257 -10.565 1.00 0.00 C ATOM 310 C SER A 21 -3.036 -1.238 -11.659 1.00 0.00 C ATOM 311 O SER A 21 -3.674 -1.231 -12.712 1.00 0.00 O ATOM 312 CB SER A 21 -3.355 -3.668 -11.156 1.00 0.00 C ATOM 313 OG SER A 21 -2.693 -4.585 -10.303 1.00 0.00 O ATOM 0 H SER A 21 -5.081 -1.127 -10.270 1.00 0.00 H new ATOM 0 HA SER A 21 -2.556 -2.196 -9.809 1.00 0.00 H new ATOM 0 HB2 SER A 21 -4.385 -3.989 -11.311 1.00 0.00 H new ATOM 0 HB3 SER A 21 -2.872 -3.662 -12.133 1.00 0.00 H new ATOM 0 HG SER A 21 -3.112 -4.569 -9.417 1.00 0.00 H new ATOM 319 N LYS A 22 -2.058 -0.376 -11.402 1.00 0.00 N ATOM 320 CA LYS A 22 -1.667 0.648 -12.363 1.00 0.00 C ATOM 321 C LYS A 22 -0.636 0.104 -13.348 1.00 0.00 C ATOM 322 O LYS A 22 0.521 -0.116 -12.992 1.00 0.00 O ATOM 323 CB LYS A 22 -1.099 1.869 -11.637 1.00 0.00 C ATOM 324 CG LYS A 22 -1.967 3.109 -11.762 1.00 0.00 C ATOM 325 CD LYS A 22 -3.207 3.013 -10.890 1.00 0.00 C ATOM 326 CE LYS A 22 -4.048 4.278 -10.975 1.00 0.00 C ATOM 327 NZ LYS A 22 -4.553 4.517 -12.355 1.00 0.00 N ATOM 0 H LYS A 22 -1.521 -0.366 -10.535 1.00 0.00 H new ATOM 0 HA LYS A 22 -2.555 0.946 -12.920 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -0.974 1.628 -10.581 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -0.108 2.088 -12.033 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -1.389 3.989 -11.478 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -2.263 3.244 -12.802 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -3.805 2.156 -11.199 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -2.913 2.839 -9.855 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -4.891 4.200 -10.288 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -3.452 5.132 -10.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -5.266 5.273 -12.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -3.763 4.800 -12.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -4.983 3.644 -12.723 1.00 0.00 H new ATOM 341 N VAL A 23 -1.064 -0.109 -14.588 1.00 0.00 N ATOM 342 CA VAL A 23 -0.178 -0.624 -15.625 1.00 0.00 C ATOM 343 C VAL A 23 -0.005 0.387 -16.753 1.00 0.00 C ATOM 344 O VAL A 23 -0.935 1.119 -17.092 1.00 0.00 O ATOM 345 CB VAL A 23 -0.709 -1.945 -16.212 1.00 0.00 C ATOM 346 CG1 VAL A 23 0.341 -2.594 -17.101 1.00 0.00 C ATOM 347 CG2 VAL A 23 -1.134 -2.890 -15.098 1.00 0.00 C ATOM 0 H VAL A 23 -2.019 0.067 -14.899 1.00 0.00 H new ATOM 0 HA VAL A 23 0.788 -0.806 -15.153 1.00 0.00 H new ATOM 0 HB VAL A 23 -1.584 -1.725 -16.824 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -0.052 -3.526 -17.507 1.00 0.00 H new ATOM 0 HG12 VAL A 23 0.592 -1.919 -17.919 1.00 0.00 H new ATOM 0 HG13 VAL A 23 1.236 -2.802 -16.515 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -1.507 -3.818 -15.531 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -0.279 -3.106 -14.458 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -1.922 -2.424 -14.506 1.00 0.00 H new ATOM 357 N TYR A 24 1.191 0.423 -17.330 1.00 0.00 N ATOM 358 CA TYR A 24 1.487 1.346 -18.419 1.00 0.00 C ATOM 359 C TYR A 24 1.597 0.604 -19.747 1.00 0.00 C ATOM 360 O TYR A 24 1.506 -0.622 -19.795 1.00 0.00 O ATOM 361 CB TYR A 24 2.785 2.103 -18.135 1.00 0.00 C ATOM 362 CG TYR A 24 2.712 2.994 -16.915 1.00 0.00 C ATOM 363 CD1 TYR A 24 1.812 4.050 -16.854 1.00 0.00 C ATOM 364 CD2 TYR A 24 3.544 2.777 -15.823 1.00 0.00 C ATOM 365 CE1 TYR A 24 1.744 4.866 -15.742 1.00 0.00 C ATOM 366 CE2 TYR A 24 3.481 3.587 -14.706 1.00 0.00 C ATOM 367 CZ TYR A 24 2.579 4.631 -14.670 1.00 0.00 C ATOM 368 OH TYR A 24 2.513 5.441 -13.560 1.00 0.00 O ATOM 0 H TYR A 24 1.971 -0.177 -17.062 1.00 0.00 H new ATOM 0 HA TYR A 24 0.666 2.060 -18.490 1.00 0.00 H new ATOM 0 HB2 TYR A 24 3.593 1.384 -18.002 1.00 0.00 H new ATOM 0 HB3 TYR A 24 3.039 2.711 -19.004 1.00 0.00 H new ATOM 0 HD1 TYR A 24 1.154 4.236 -17.690 1.00 0.00 H new ATOM 0 HD2 TYR A 24 4.252 1.961 -15.848 1.00 0.00 H new ATOM 0 HE1 TYR A 24 1.040 5.685 -15.712 1.00 0.00 H new ATOM 0 HE2 TYR A 24 4.134 3.404 -13.865 1.00 0.00 H new ATOM 0 HH TYR A 24 3.167 5.139 -12.895 1.00 0.00 H new ATOM 378 N GLU A 25 1.795 1.358 -20.824 1.00 0.00 N ATOM 379 CA GLU A 25 1.918 0.772 -22.154 1.00 0.00 C ATOM 380 C GLU A 25 3.105 1.370 -22.904 1.00 0.00 C ATOM 381 O GLU A 25 3.070 2.528 -23.323 1.00 0.00 O ATOM 382 CB GLU A 25 0.632 0.991 -22.953 1.00 0.00 C ATOM 383 CG GLU A 25 0.781 0.702 -24.437 1.00 0.00 C ATOM 384 CD GLU A 25 0.692 1.955 -25.287 1.00 0.00 C ATOM 385 OE1 GLU A 25 0.984 3.050 -24.761 1.00 0.00 O ATOM 386 OE2 GLU A 25 0.331 1.842 -26.477 1.00 0.00 O ATOM 0 H GLU A 25 1.874 2.375 -20.802 1.00 0.00 H new ATOM 0 HA GLU A 25 2.086 -0.299 -22.038 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -0.153 0.354 -22.544 1.00 0.00 H new ATOM 0 HB3 GLU A 25 0.305 2.023 -22.823 1.00 0.00 H new ATOM 0 HG2 GLU A 25 1.740 0.215 -24.614 1.00 0.00 H new ATOM 0 HG3 GLU A 25 0.005 0.001 -24.747 1.00 0.00 H new ATOM 393 N THR A 26 4.155 0.573 -23.071 1.00 0.00 N ATOM 394 CA THR A 26 5.353 1.023 -23.769 1.00 0.00 C ATOM 395 C THR A 26 5.622 0.172 -25.004 1.00 0.00 C ATOM 396 O THR A 26 6.410 -0.774 -24.976 1.00 0.00 O ATOM 397 CB THR A 26 6.589 0.979 -22.850 1.00 0.00 C ATOM 398 OG1 THR A 26 6.843 -0.367 -22.436 1.00 0.00 O ATOM 399 CG2 THR A 26 6.385 1.861 -21.627 1.00 0.00 C ATOM 0 H THR A 26 4.200 -0.388 -22.732 1.00 0.00 H new ATOM 0 HA THR A 26 5.172 2.054 -24.074 1.00 0.00 H new ATOM 0 HB THR A 26 7.445 1.354 -23.410 1.00 0.00 H new ATOM 0 HG1 THR A 26 6.834 -0.957 -23.218 1.00 0.00 H new ATOM 0 HG21 THR A 26 7.270 1.814 -20.993 1.00 0.00 H new ATOM 0 HG22 THR A 26 6.220 2.891 -21.944 1.00 0.00 H new ATOM 0 HG23 THR A 26 5.518 1.511 -21.066 1.00 0.00 H new ATOM 407 N PRO A 27 4.955 0.513 -26.116 1.00 0.00 N ATOM 408 CA PRO A 27 5.107 -0.208 -27.384 1.00 0.00 C ATOM 409 C PRO A 27 6.475 0.018 -28.018 1.00 0.00 C ATOM 410 O PRO A 27 7.077 -0.907 -28.564 1.00 0.00 O ATOM 411 CB PRO A 27 4.004 0.386 -28.264 1.00 0.00 C ATOM 412 CG PRO A 27 3.762 1.745 -27.702 1.00 0.00 C ATOM 413 CD PRO A 27 4.000 1.629 -26.222 1.00 0.00 C ATOM 0 HA PRO A 27 5.030 -1.287 -27.252 1.00 0.00 H new ATOM 0 HB2 PRO A 27 4.315 0.439 -29.307 1.00 0.00 H new ATOM 0 HB3 PRO A 27 3.100 -0.223 -28.231 1.00 0.00 H new ATOM 0 HG2 PRO A 27 4.434 2.478 -28.149 1.00 0.00 H new ATOM 0 HG3 PRO A 27 2.745 2.077 -27.909 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.411 2.550 -25.808 1.00 0.00 H new ATOM 0 HD3 PRO A 27 3.077 1.420 -25.682 1.00 0.00 H new ATOM 421 N ASP A 28 6.960 1.252 -27.943 1.00 0.00 N ATOM 422 CA ASP A 28 8.259 1.599 -28.509 1.00 0.00 C ATOM 423 C ASP A 28 9.347 1.555 -27.440 1.00 0.00 C ATOM 424 O ASP A 28 9.089 1.828 -26.267 1.00 0.00 O ATOM 425 CB ASP A 28 8.207 2.989 -29.145 1.00 0.00 C ATOM 426 CG ASP A 28 6.873 3.274 -29.805 1.00 0.00 C ATOM 427 OD1 ASP A 28 6.661 2.802 -30.942 1.00 0.00 O ATOM 428 OD2 ASP A 28 6.040 3.970 -29.186 1.00 0.00 O ATOM 0 H ASP A 28 6.474 2.029 -27.496 1.00 0.00 H new ATOM 0 HA ASP A 28 8.501 0.865 -29.278 1.00 0.00 H new ATOM 0 HB2 ASP A 28 8.399 3.742 -28.381 1.00 0.00 H new ATOM 0 HB3 ASP A 28 9.002 3.076 -29.886 1.00 0.00 H new ATOM 433 N ILE A 29 10.561 1.210 -27.853 1.00 0.00 N ATOM 434 CA ILE A 29 11.687 1.131 -26.931 1.00 0.00 C ATOM 435 C ILE A 29 12.041 2.506 -26.376 1.00 0.00 C ATOM 436 O ILE A 29 12.308 2.672 -25.185 1.00 0.00 O ATOM 437 CB ILE A 29 12.931 0.529 -27.612 1.00 0.00 C ATOM 438 CG1 ILE A 29 14.122 1.480 -27.479 1.00 0.00 C ATOM 439 CG2 ILE A 29 12.643 0.235 -29.077 1.00 0.00 C ATOM 440 CD1 ILE A 29 15.419 0.901 -28.001 1.00 0.00 C ATOM 0 H ILE A 29 10.790 0.981 -28.820 1.00 0.00 H new ATOM 0 HA ILE A 29 11.379 0.480 -26.113 1.00 0.00 H new ATOM 0 HB ILE A 29 13.181 -0.409 -27.115 1.00 0.00 H new ATOM 0 HG12 ILE A 29 13.902 2.402 -28.017 1.00 0.00 H new ATOM 0 HG13 ILE A 29 14.249 1.746 -26.430 1.00 0.00 H new ATOM 0 HG21 ILE A 29 13.531 -0.190 -29.544 1.00 0.00 H new ATOM 0 HG22 ILE A 29 11.819 -0.475 -29.150 1.00 0.00 H new ATOM 0 HG23 ILE A 29 12.372 1.159 -29.587 1.00 0.00 H new ATOM 0 HD11 ILE A 29 16.220 1.630 -27.875 1.00 0.00 H new ATOM 0 HD12 ILE A 29 15.662 -0.005 -27.446 1.00 0.00 H new ATOM 0 HD13 ILE A 29 15.311 0.661 -29.059 1.00 0.00 H new ATOM 452 N PRO A 30 12.041 3.518 -27.256 1.00 0.00 N ATOM 453 CA PRO A 30 12.357 4.898 -26.876 1.00 0.00 C ATOM 454 C PRO A 30 11.271 5.524 -26.009 1.00 0.00 C ATOM 455 O PRO A 30 11.562 6.272 -25.076 1.00 0.00 O ATOM 456 CB PRO A 30 12.452 5.623 -28.221 1.00 0.00 C ATOM 457 CG PRO A 30 11.603 4.820 -29.145 1.00 0.00 C ATOM 458 CD PRO A 30 11.732 3.392 -28.690 1.00 0.00 C ATOM 0 HA PRO A 30 13.267 4.958 -26.278 1.00 0.00 H new ATOM 0 HB2 PRO A 30 12.092 6.649 -28.144 1.00 0.00 H new ATOM 0 HB3 PRO A 30 13.483 5.672 -28.572 1.00 0.00 H new ATOM 0 HG2 PRO A 30 10.565 5.150 -29.107 1.00 0.00 H new ATOM 0 HG3 PRO A 30 11.935 4.932 -30.177 1.00 0.00 H new ATOM 0 HD2 PRO A 30 10.811 2.833 -28.855 1.00 0.00 H new ATOM 0 HD3 PRO A 30 12.523 2.869 -29.227 1.00 0.00 H new ATOM 466 N ALA A 31 10.017 5.212 -26.322 1.00 0.00 N ATOM 467 CA ALA A 31 8.887 5.742 -25.569 1.00 0.00 C ATOM 468 C ALA A 31 8.903 5.241 -24.129 1.00 0.00 C ATOM 469 O ALA A 31 8.348 5.877 -23.232 1.00 0.00 O ATOM 470 CB ALA A 31 7.578 5.366 -26.246 1.00 0.00 C ATOM 0 H ALA A 31 9.759 4.595 -27.092 1.00 0.00 H new ATOM 0 HA ALA A 31 8.974 6.828 -25.549 1.00 0.00 H new ATOM 0 HB1 ALA A 31 6.743 5.769 -25.673 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.558 5.779 -27.254 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.493 4.280 -26.297 1.00 0.00 H new ATOM 476 N THR A 32 9.543 4.096 -23.913 1.00 0.00 N ATOM 477 CA THR A 32 9.630 3.508 -22.582 1.00 0.00 C ATOM 478 C THR A 32 10.148 4.520 -21.566 1.00 0.00 C ATOM 479 O THR A 32 9.717 4.532 -20.414 1.00 0.00 O ATOM 480 CB THR A 32 10.550 2.272 -22.572 1.00 0.00 C ATOM 481 OG1 THR A 32 10.049 1.282 -23.477 1.00 0.00 O ATOM 482 CG2 THR A 32 10.651 1.684 -21.173 1.00 0.00 C ATOM 0 H THR A 32 10.009 3.557 -24.643 1.00 0.00 H new ATOM 0 HA THR A 32 8.621 3.203 -22.306 1.00 0.00 H new ATOM 0 HB THR A 32 11.545 2.584 -22.890 1.00 0.00 H new ATOM 0 HG1 THR A 32 9.813 1.706 -24.328 1.00 0.00 H new ATOM 0 HG21 THR A 32 11.306 0.813 -21.191 1.00 0.00 H new ATOM 0 HG22 THR A 32 11.060 2.431 -20.493 1.00 0.00 H new ATOM 0 HG23 THR A 32 9.660 1.386 -20.831 1.00 0.00 H new ATOM 490 N GLU A 33 11.073 5.369 -22.003 1.00 0.00 N ATOM 491 CA GLU A 33 11.649 6.386 -21.130 1.00 0.00 C ATOM 492 C GLU A 33 10.557 7.262 -20.521 1.00 0.00 C ATOM 493 O GLU A 33 10.693 7.753 -19.401 1.00 0.00 O ATOM 494 CB GLU A 33 12.641 7.254 -21.906 1.00 0.00 C ATOM 495 CG GLU A 33 11.983 8.168 -22.925 1.00 0.00 C ATOM 496 CD GLU A 33 12.905 8.518 -24.077 1.00 0.00 C ATOM 497 OE1 GLU A 33 14.138 8.432 -23.898 1.00 0.00 O ATOM 498 OE2 GLU A 33 12.393 8.878 -25.157 1.00 0.00 O ATOM 0 H GLU A 33 11.439 5.373 -22.955 1.00 0.00 H new ATOM 0 HA GLU A 33 12.176 5.878 -20.322 1.00 0.00 H new ATOM 0 HB2 GLU A 33 13.210 7.860 -21.201 1.00 0.00 H new ATOM 0 HB3 GLU A 33 13.354 6.607 -22.418 1.00 0.00 H new ATOM 0 HG2 GLU A 33 11.087 7.685 -23.315 1.00 0.00 H new ATOM 0 HG3 GLU A 33 11.661 9.085 -22.431 1.00 0.00 H new ATOM 505 N SER A 34 9.475 7.454 -21.269 1.00 0.00 N ATOM 506 CA SER A 34 8.362 8.274 -20.807 1.00 0.00 C ATOM 507 C SER A 34 7.779 7.718 -19.511 1.00 0.00 C ATOM 508 O SER A 34 7.615 8.443 -18.530 1.00 0.00 O ATOM 509 CB SER A 34 7.274 8.346 -21.879 1.00 0.00 C ATOM 510 OG SER A 34 6.275 9.289 -21.530 1.00 0.00 O ATOM 0 H SER A 34 9.346 7.053 -22.198 1.00 0.00 H new ATOM 0 HA SER A 34 8.739 9.279 -20.614 1.00 0.00 H new ATOM 0 HB2 SER A 34 7.719 8.620 -22.835 1.00 0.00 H new ATOM 0 HB3 SER A 34 6.821 7.363 -22.008 1.00 0.00 H new ATOM 0 HG SER A 34 5.592 9.317 -22.232 1.00 0.00 H new ATOM 516 N ALA A 35 7.468 6.426 -19.516 1.00 0.00 N ATOM 517 CA ALA A 35 6.906 5.771 -18.342 1.00 0.00 C ATOM 518 C ALA A 35 7.928 5.695 -17.213 1.00 0.00 C ATOM 519 O ALA A 35 7.570 5.721 -16.035 1.00 0.00 O ATOM 520 CB ALA A 35 6.410 4.378 -18.702 1.00 0.00 C ATOM 0 H ALA A 35 7.596 5.812 -20.321 1.00 0.00 H new ATOM 0 HA ALA A 35 6.062 6.367 -17.993 1.00 0.00 H new ATOM 0 HB1 ALA A 35 5.993 3.900 -17.816 1.00 0.00 H new ATOM 0 HB2 ALA A 35 5.640 4.453 -19.470 1.00 0.00 H new ATOM 0 HB3 ALA A 35 7.241 3.782 -19.078 1.00 0.00 H new ATOM 526 N VAL A 36 9.202 5.600 -17.579 1.00 0.00 N ATOM 527 CA VAL A 36 10.276 5.521 -16.597 1.00 0.00 C ATOM 528 C VAL A 36 10.371 6.806 -15.781 1.00 0.00 C ATOM 529 O VAL A 36 10.807 6.792 -14.630 1.00 0.00 O ATOM 530 CB VAL A 36 11.635 5.253 -17.271 1.00 0.00 C ATOM 531 CG1 VAL A 36 12.525 6.484 -17.188 1.00 0.00 C ATOM 532 CG2 VAL A 36 12.315 4.049 -16.638 1.00 0.00 C ATOM 0 H VAL A 36 9.516 5.576 -18.549 1.00 0.00 H new ATOM 0 HA VAL A 36 10.037 4.689 -15.934 1.00 0.00 H new ATOM 0 HB VAL A 36 11.461 5.031 -18.324 1.00 0.00 H new ATOM 0 HG11 VAL A 36 13.480 6.275 -17.669 1.00 0.00 H new ATOM 0 HG12 VAL A 36 12.039 7.319 -17.693 1.00 0.00 H new ATOM 0 HG13 VAL A 36 12.694 6.741 -16.142 1.00 0.00 H new ATOM 0 HG21 VAL A 36 13.274 3.874 -17.126 1.00 0.00 H new ATOM 0 HG22 VAL A 36 12.478 4.239 -15.577 1.00 0.00 H new ATOM 0 HG23 VAL A 36 11.682 3.170 -16.756 1.00 0.00 H new ATOM 542 N ARG A 37 9.959 7.916 -16.386 1.00 0.00 N ATOM 543 CA ARG A 37 9.997 9.210 -15.716 1.00 0.00 C ATOM 544 C ARG A 37 9.022 9.244 -14.542 1.00 0.00 C ATOM 545 O ARG A 37 9.284 9.884 -13.524 1.00 0.00 O ATOM 546 CB ARG A 37 9.662 10.329 -16.703 1.00 0.00 C ATOM 547 CG ARG A 37 8.200 10.742 -16.683 1.00 0.00 C ATOM 548 CD ARG A 37 7.863 11.660 -17.848 1.00 0.00 C ATOM 549 NE ARG A 37 8.904 12.659 -18.076 1.00 0.00 N ATOM 550 CZ ARG A 37 9.141 13.674 -17.253 1.00 0.00 C ATOM 551 NH1 ARG A 37 8.416 13.823 -16.153 1.00 0.00 N ATOM 552 NH2 ARG A 37 10.106 14.542 -17.529 1.00 0.00 N ATOM 0 H ARG A 37 9.595 7.945 -17.339 1.00 0.00 H new ATOM 0 HA ARG A 37 11.006 9.363 -15.333 1.00 0.00 H new ATOM 0 HB2 ARG A 37 10.279 11.198 -16.477 1.00 0.00 H new ATOM 0 HB3 ARG A 37 9.925 10.005 -17.710 1.00 0.00 H new ATOM 0 HG2 ARG A 37 7.570 9.854 -16.724 1.00 0.00 H new ATOM 0 HG3 ARG A 37 7.977 11.248 -15.744 1.00 0.00 H new ATOM 0 HD2 ARG A 37 7.728 11.065 -18.751 1.00 0.00 H new ATOM 0 HD3 ARG A 37 6.916 12.162 -17.652 1.00 0.00 H new ATOM 0 HE ARG A 37 9.480 12.572 -18.913 1.00 0.00 H new ATOM 0 HH11 ARG A 37 7.674 13.157 -15.937 1.00 0.00 H new ATOM 0 HH12 ARG A 37 8.600 14.603 -15.523 1.00 0.00 H new ATOM 0 HH21 ARG A 37 10.666 14.430 -18.374 1.00 0.00 H new ATOM 0 HH22 ARG A 37 10.287 15.321 -16.896 1.00 0.00 H new ATOM 566 N SER A 38 7.898 8.551 -14.693 1.00 0.00 N ATOM 567 CA SER A 38 6.882 8.505 -13.648 1.00 0.00 C ATOM 568 C SER A 38 7.163 7.371 -12.667 1.00 0.00 C ATOM 569 O SER A 38 6.609 7.334 -11.568 1.00 0.00 O ATOM 570 CB SER A 38 5.493 8.329 -14.265 1.00 0.00 C ATOM 571 OG SER A 38 5.355 9.109 -15.440 1.00 0.00 O ATOM 0 H SER A 38 7.668 8.014 -15.529 1.00 0.00 H new ATOM 0 HA SER A 38 6.913 9.449 -13.104 1.00 0.00 H new ATOM 0 HB2 SER A 38 5.327 7.278 -14.501 1.00 0.00 H new ATOM 0 HB3 SER A 38 4.731 8.618 -13.541 1.00 0.00 H new ATOM 0 HG SER A 38 4.460 8.978 -15.816 1.00 0.00 H new ATOM 577 N VAL A 39 8.027 6.446 -13.072 1.00 0.00 N ATOM 578 CA VAL A 39 8.383 5.311 -12.230 1.00 0.00 C ATOM 579 C VAL A 39 9.536 5.660 -11.295 1.00 0.00 C ATOM 580 O VAL A 39 9.653 5.106 -10.202 1.00 0.00 O ATOM 581 CB VAL A 39 8.777 4.086 -13.077 1.00 0.00 C ATOM 582 CG1 VAL A 39 9.192 2.929 -12.181 1.00 0.00 C ATOM 583 CG2 VAL A 39 7.630 3.679 -13.990 1.00 0.00 C ATOM 0 H VAL A 39 8.494 6.461 -13.979 1.00 0.00 H new ATOM 0 HA VAL A 39 7.501 5.067 -11.639 1.00 0.00 H new ATOM 0 HB VAL A 39 9.630 4.356 -13.700 1.00 0.00 H new ATOM 0 HG11 VAL A 39 9.467 2.073 -12.797 1.00 0.00 H new ATOM 0 HG12 VAL A 39 10.046 3.228 -11.573 1.00 0.00 H new ATOM 0 HG13 VAL A 39 8.361 2.656 -11.530 1.00 0.00 H new ATOM 0 HG21 VAL A 39 7.925 2.812 -14.581 1.00 0.00 H new ATOM 0 HG22 VAL A 39 6.757 3.427 -13.388 1.00 0.00 H new ATOM 0 HG23 VAL A 39 7.384 4.506 -14.656 1.00 0.00 H new ATOM 593 N LEU A 40 10.386 6.583 -11.732 1.00 0.00 N ATOM 594 CA LEU A 40 11.530 7.008 -10.934 1.00 0.00 C ATOM 595 C LEU A 40 11.086 7.485 -9.555 1.00 0.00 C ATOM 596 O LEU A 40 11.860 7.456 -8.599 1.00 0.00 O ATOM 597 CB LEU A 40 12.291 8.125 -11.651 1.00 0.00 C ATOM 598 CG LEU A 40 11.613 9.495 -11.669 1.00 0.00 C ATOM 599 CD1 LEU A 40 11.925 10.262 -10.394 1.00 0.00 C ATOM 600 CD2 LEU A 40 12.048 10.290 -12.892 1.00 0.00 C ATOM 0 H LEU A 40 10.304 7.051 -12.635 1.00 0.00 H new ATOM 0 HA LEU A 40 12.190 6.150 -10.806 1.00 0.00 H new ATOM 0 HB2 LEU A 40 13.268 8.232 -11.180 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.466 7.815 -12.681 1.00 0.00 H new ATOM 0 HG LEU A 40 10.535 9.344 -11.723 1.00 0.00 H new ATOM 0 HD11 LEU A 40 11.434 11.235 -10.425 1.00 0.00 H new ATOM 0 HD12 LEU A 40 11.563 9.700 -9.533 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.003 10.402 -10.308 1.00 0.00 H new ATOM 0 HD21 LEU A 40 11.555 11.262 -12.888 1.00 0.00 H new ATOM 0 HD22 LEU A 40 13.129 10.431 -12.869 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.772 9.747 -13.796 1.00 0.00 H new ATOM 612 N GLU A 41 9.834 7.921 -9.460 1.00 0.00 N ATOM 613 CA GLU A 41 9.286 8.402 -8.197 1.00 0.00 C ATOM 614 C GLU A 41 8.278 7.409 -7.627 1.00 0.00 C ATOM 615 O GLU A 41 8.105 7.312 -6.412 1.00 0.00 O ATOM 616 CB GLU A 41 8.621 9.767 -8.391 1.00 0.00 C ATOM 617 CG GLU A 41 7.548 9.773 -9.467 1.00 0.00 C ATOM 618 CD GLU A 41 6.730 11.050 -9.468 1.00 0.00 C ATOM 619 OE1 GLU A 41 7.261 12.095 -9.899 1.00 0.00 O ATOM 620 OE2 GLU A 41 5.559 11.004 -9.037 1.00 0.00 O ATOM 0 H GLU A 41 9.180 7.951 -10.242 1.00 0.00 H new ATOM 0 HA GLU A 41 10.109 8.504 -7.489 1.00 0.00 H new ATOM 0 HB2 GLU A 41 8.179 10.084 -7.447 1.00 0.00 H new ATOM 0 HB3 GLU A 41 9.385 10.501 -8.647 1.00 0.00 H new ATOM 0 HG2 GLU A 41 8.017 9.645 -10.443 1.00 0.00 H new ATOM 0 HG3 GLU A 41 6.885 8.921 -9.318 1.00 0.00 H new ATOM 627 N ASP A 42 7.615 6.674 -8.513 1.00 0.00 N ATOM 628 CA ASP A 42 6.624 5.688 -8.100 1.00 0.00 C ATOM 629 C ASP A 42 7.275 4.328 -7.866 1.00 0.00 C ATOM 630 O ASP A 42 6.590 3.319 -7.701 1.00 0.00 O ATOM 631 CB ASP A 42 5.524 5.565 -9.156 1.00 0.00 C ATOM 632 CG ASP A 42 4.141 5.460 -8.542 1.00 0.00 C ATOM 633 OD1 ASP A 42 3.712 6.428 -7.879 1.00 0.00 O ATOM 634 OD2 ASP A 42 3.489 4.411 -8.723 1.00 0.00 O ATOM 0 H ASP A 42 7.746 6.743 -9.522 1.00 0.00 H new ATOM 0 HA ASP A 42 6.181 6.025 -7.163 1.00 0.00 H new ATOM 0 HB2 ASP A 42 5.560 6.431 -9.817 1.00 0.00 H new ATOM 0 HB3 ASP A 42 5.713 4.686 -9.772 1.00 0.00 H new ATOM 639 N LYS A 43 8.604 4.309 -7.854 1.00 0.00 N ATOM 640 CA LYS A 43 9.349 3.074 -7.640 1.00 0.00 C ATOM 641 C LYS A 43 9.463 2.758 -6.152 1.00 0.00 C ATOM 642 O LYS A 43 9.492 1.593 -5.756 1.00 0.00 O ATOM 643 CB LYS A 43 10.746 3.184 -8.257 1.00 0.00 C ATOM 644 CG LYS A 43 11.521 4.406 -7.795 1.00 0.00 C ATOM 645 CD LYS A 43 12.950 4.388 -8.311 1.00 0.00 C ATOM 646 CE LYS A 43 13.953 4.316 -7.170 1.00 0.00 C ATOM 647 NZ LYS A 43 15.342 4.584 -7.635 1.00 0.00 N ATOM 0 H LYS A 43 9.187 5.135 -7.990 1.00 0.00 H new ATOM 0 HA LYS A 43 8.806 2.263 -8.125 1.00 0.00 H new ATOM 0 HB2 LYS A 43 11.315 2.288 -8.009 1.00 0.00 H new ATOM 0 HB3 LYS A 43 10.653 3.212 -9.343 1.00 0.00 H new ATOM 0 HG2 LYS A 43 11.019 5.309 -8.142 1.00 0.00 H new ATOM 0 HG3 LYS A 43 11.527 4.444 -6.706 1.00 0.00 H new ATOM 0 HD2 LYS A 43 13.088 3.533 -8.973 1.00 0.00 H new ATOM 0 HD3 LYS A 43 13.135 5.284 -8.904 1.00 0.00 H new ATOM 0 HE2 LYS A 43 13.681 5.040 -6.401 1.00 0.00 H new ATOM 0 HE3 LYS A 43 13.908 3.329 -6.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 15.996 4.526 -6.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 15.611 3.878 -8.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 15.391 5.535 -8.052 1.00 0.00 H new ATOM 661 N SER A 44 9.526 3.803 -5.333 1.00 0.00 N ATOM 662 CA SER A 44 9.639 3.637 -3.889 1.00 0.00 C ATOM 663 C SER A 44 8.284 3.826 -3.212 1.00 0.00 C ATOM 664 O SER A 44 8.208 4.193 -2.040 1.00 0.00 O ATOM 665 CB SER A 44 10.650 4.632 -3.316 1.00 0.00 C ATOM 666 OG SER A 44 10.860 4.407 -1.933 1.00 0.00 O ATOM 0 H SER A 44 9.501 4.774 -5.645 1.00 0.00 H new ATOM 0 HA SER A 44 9.987 2.623 -3.692 1.00 0.00 H new ATOM 0 HB2 SER A 44 11.596 4.542 -3.850 1.00 0.00 H new ATOM 0 HB3 SER A 44 10.292 5.650 -3.472 1.00 0.00 H new ATOM 0 HG SER A 44 9.995 4.350 -1.476 1.00 0.00 H new ATOM 672 N VAL A 45 7.215 3.571 -3.961 1.00 0.00 N ATOM 673 CA VAL A 45 5.863 3.711 -3.435 1.00 0.00 C ATOM 674 C VAL A 45 5.244 2.349 -3.141 1.00 0.00 C ATOM 675 O VAL A 45 4.390 2.220 -2.264 1.00 0.00 O ATOM 676 CB VAL A 45 4.955 4.474 -4.418 1.00 0.00 C ATOM 677 CG1 VAL A 45 4.525 3.567 -5.561 1.00 0.00 C ATOM 678 CG2 VAL A 45 3.744 5.042 -3.693 1.00 0.00 C ATOM 0 H VAL A 45 7.260 3.267 -4.933 1.00 0.00 H new ATOM 0 HA VAL A 45 5.941 4.279 -2.508 1.00 0.00 H new ATOM 0 HB VAL A 45 5.521 5.305 -4.838 1.00 0.00 H new ATOM 0 HG11 VAL A 45 3.884 4.123 -6.245 1.00 0.00 H new ATOM 0 HG12 VAL A 45 5.406 3.213 -6.096 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.976 2.714 -5.162 1.00 0.00 H new ATOM 0 HG21 VAL A 45 3.113 5.578 -4.402 1.00 0.00 H new ATOM 0 HG22 VAL A 45 3.174 4.229 -3.244 1.00 0.00 H new ATOM 0 HG23 VAL A 45 4.075 5.727 -2.913 1.00 0.00 H new ATOM 688 N GLY A 46 5.680 1.334 -3.881 1.00 0.00 N ATOM 689 CA GLY A 46 5.158 -0.005 -3.684 1.00 0.00 C ATOM 690 C GLY A 46 5.929 -1.049 -4.467 1.00 0.00 C ATOM 691 O GLY A 46 7.161 -1.064 -4.449 1.00 0.00 O ATOM 0 H GLY A 46 6.385 1.416 -4.613 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.192 -0.252 -2.623 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.110 -0.031 -3.984 1.00 0.00 H new ATOM 695 N ILE A 47 5.205 -1.924 -5.157 1.00 0.00 N ATOM 696 CA ILE A 47 5.829 -2.976 -5.949 1.00 0.00 C ATOM 697 C ILE A 47 5.753 -2.660 -7.439 1.00 0.00 C ATOM 698 O ILE A 47 4.688 -2.328 -7.961 1.00 0.00 O ATOM 699 CB ILE A 47 5.168 -4.343 -5.691 1.00 0.00 C ATOM 700 CG1 ILE A 47 5.251 -4.701 -4.206 1.00 0.00 C ATOM 701 CG2 ILE A 47 5.829 -5.419 -6.539 1.00 0.00 C ATOM 702 CD1 ILE A 47 3.923 -4.608 -3.487 1.00 0.00 C ATOM 0 H ILE A 47 4.185 -1.925 -5.183 1.00 0.00 H new ATOM 0 HA ILE A 47 6.874 -3.024 -5.643 1.00 0.00 H new ATOM 0 HB ILE A 47 4.117 -4.281 -5.972 1.00 0.00 H new ATOM 0 HG12 ILE A 47 5.639 -5.715 -4.106 1.00 0.00 H new ATOM 0 HG13 ILE A 47 5.966 -4.037 -3.720 1.00 0.00 H new ATOM 0 HG21 ILE A 47 5.351 -6.379 -6.346 1.00 0.00 H new ATOM 0 HG22 ILE A 47 5.723 -5.167 -7.594 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.887 -5.483 -6.286 1.00 0.00 H new ATOM 0 HD11 ILE A 47 4.057 -4.875 -2.439 1.00 0.00 H new ATOM 0 HD12 ILE A 47 3.543 -3.589 -3.556 1.00 0.00 H new ATOM 0 HD13 ILE A 47 3.211 -5.293 -3.948 1.00 0.00 H new ATOM 714 N LEU A 48 6.889 -2.767 -8.120 1.00 0.00 N ATOM 715 CA LEU A 48 6.951 -2.495 -9.552 1.00 0.00 C ATOM 716 C LEU A 48 7.073 -3.791 -10.347 1.00 0.00 C ATOM 717 O LEU A 48 7.617 -4.782 -9.861 1.00 0.00 O ATOM 718 CB LEU A 48 8.134 -1.578 -9.865 1.00 0.00 C ATOM 719 CG LEU A 48 8.340 -0.399 -8.913 1.00 0.00 C ATOM 720 CD1 LEU A 48 7.018 0.299 -8.635 1.00 0.00 C ATOM 721 CD2 LEU A 48 8.982 -0.867 -7.616 1.00 0.00 C ATOM 0 H LEU A 48 7.779 -3.040 -7.704 1.00 0.00 H new ATOM 0 HA LEU A 48 6.026 -1.997 -9.844 1.00 0.00 H new ATOM 0 HB2 LEU A 48 9.043 -2.179 -9.868 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.007 -1.186 -10.874 1.00 0.00 H new ATOM 0 HG LEU A 48 9.011 0.316 -9.389 1.00 0.00 H new ATOM 0 HD11 LEU A 48 7.184 1.135 -7.956 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.598 0.669 -9.570 1.00 0.00 H new ATOM 0 HD13 LEU A 48 6.323 -0.406 -8.179 1.00 0.00 H new ATOM 0 HD21 LEU A 48 9.121 -0.015 -6.951 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.336 -1.602 -7.135 1.00 0.00 H new ATOM 0 HD23 LEU A 48 9.949 -1.320 -7.832 1.00 0.00 H new ATOM 733 N VAL A 49 6.563 -3.775 -11.575 1.00 0.00 N ATOM 734 CA VAL A 49 6.618 -4.948 -12.440 1.00 0.00 C ATOM 735 C VAL A 49 6.610 -4.546 -13.911 1.00 0.00 C ATOM 736 O VAL A 49 5.648 -3.952 -14.397 1.00 0.00 O ATOM 737 CB VAL A 49 5.436 -5.898 -12.173 1.00 0.00 C ATOM 738 CG1 VAL A 49 4.176 -5.107 -11.853 1.00 0.00 C ATOM 739 CG2 VAL A 49 5.210 -6.817 -13.364 1.00 0.00 C ATOM 0 H VAL A 49 6.108 -2.964 -11.993 1.00 0.00 H new ATOM 0 HA VAL A 49 7.550 -5.466 -12.212 1.00 0.00 H new ATOM 0 HB VAL A 49 5.678 -6.516 -11.308 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.352 -5.795 -11.667 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.345 -4.496 -10.966 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.927 -4.462 -12.696 1.00 0.00 H new ATOM 0 HG21 VAL A 49 4.371 -7.481 -13.157 1.00 0.00 H new ATOM 0 HG22 VAL A 49 4.990 -6.219 -14.248 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.107 -7.410 -13.541 1.00 0.00 H new ATOM 749 N MET A 50 7.688 -4.876 -14.614 1.00 0.00 N ATOM 750 CA MET A 50 7.805 -4.551 -16.031 1.00 0.00 C ATOM 751 C MET A 50 7.917 -5.819 -16.872 1.00 0.00 C ATOM 752 O MET A 50 8.055 -6.920 -16.338 1.00 0.00 O ATOM 753 CB MET A 50 9.021 -3.655 -16.273 1.00 0.00 C ATOM 754 CG MET A 50 9.136 -2.507 -15.284 1.00 0.00 C ATOM 755 SD MET A 50 10.681 -1.593 -15.457 1.00 0.00 S ATOM 756 CE MET A 50 10.503 -0.938 -17.114 1.00 0.00 C ATOM 0 H MET A 50 8.493 -5.368 -14.226 1.00 0.00 H new ATOM 0 HA MET A 50 6.904 -4.016 -16.331 1.00 0.00 H new ATOM 0 HB2 MET A 50 9.925 -4.261 -16.220 1.00 0.00 H new ATOM 0 HB3 MET A 50 8.968 -3.249 -17.283 1.00 0.00 H new ATOM 0 HG2 MET A 50 8.297 -1.825 -15.426 1.00 0.00 H new ATOM 0 HG3 MET A 50 9.061 -2.898 -14.269 1.00 0.00 H new ATOM 0 HE1 MET A 50 11.456 -1.010 -17.638 1.00 0.00 H new ATOM 0 HE2 MET A 50 9.748 -1.511 -17.653 1.00 0.00 H new ATOM 0 HE3 MET A 50 10.196 0.107 -17.061 1.00 0.00 H new ATOM 766 N HIS A 51 7.858 -5.657 -18.190 1.00 0.00 N ATOM 767 CA HIS A 51 7.953 -6.789 -19.105 1.00 0.00 C ATOM 768 C HIS A 51 9.251 -6.733 -19.905 1.00 0.00 C ATOM 769 O HIS A 51 9.490 -5.786 -20.652 1.00 0.00 O ATOM 770 CB HIS A 51 6.755 -6.807 -20.054 1.00 0.00 C ATOM 771 CG HIS A 51 5.458 -7.124 -19.376 1.00 0.00 C ATOM 772 ND1 HIS A 51 4.929 -8.397 -19.319 1.00 0.00 N ATOM 773 CD2 HIS A 51 4.583 -6.326 -18.722 1.00 0.00 C ATOM 774 CE1 HIS A 51 3.784 -8.367 -18.661 1.00 0.00 C ATOM 775 NE2 HIS A 51 3.551 -7.121 -18.287 1.00 0.00 N ATOM 0 H HIS A 51 7.745 -4.753 -18.648 1.00 0.00 H new ATOM 0 HA HIS A 51 7.951 -7.704 -18.513 1.00 0.00 H new ATOM 0 HB2 HIS A 51 6.673 -5.835 -20.541 1.00 0.00 H new ATOM 0 HB3 HIS A 51 6.935 -7.542 -20.838 1.00 0.00 H new ATOM 0 HD2 HIS A 51 4.678 -5.261 -18.570 1.00 0.00 H new ATOM 0 HE1 HIS A 51 3.147 -9.216 -18.462 1.00 0.00 H new ATOM 0 HE2 HIS A 51 2.737 -6.802 -17.761 1.00 0.00 H new ATOM 783 N ASN A 52 10.086 -7.754 -19.742 1.00 0.00 N ATOM 784 CA ASN A 52 11.360 -7.820 -20.449 1.00 0.00 C ATOM 785 C ASN A 52 11.146 -7.804 -21.959 1.00 0.00 C ATOM 786 O ASN A 52 12.086 -7.601 -22.727 1.00 0.00 O ATOM 787 CB ASN A 52 12.126 -9.081 -20.044 1.00 0.00 C ATOM 788 CG ASN A 52 12.665 -9.001 -18.629 1.00 0.00 C ATOM 789 OD1 ASN A 52 13.398 -8.074 -18.283 1.00 0.00 O ATOM 790 ND2 ASN A 52 12.304 -9.976 -17.803 1.00 0.00 N ATOM 0 H ASN A 52 9.903 -8.547 -19.127 1.00 0.00 H new ATOM 0 HA ASN A 52 11.946 -6.943 -20.174 1.00 0.00 H new ATOM 0 HB2 ASN A 52 11.468 -9.946 -20.131 1.00 0.00 H new ATOM 0 HB3 ASN A 52 12.953 -9.239 -20.736 1.00 0.00 H new ATOM 0 HD21 ASN A 52 12.636 -9.976 -16.839 1.00 0.00 H new ATOM 0 HD22 ASN A 52 11.695 -10.725 -18.133 1.00 0.00 H new ATOM 797 N ASP A 53 9.903 -8.018 -22.377 1.00 0.00 N ATOM 798 CA ASP A 53 9.565 -8.027 -23.796 1.00 0.00 C ATOM 799 C ASP A 53 9.818 -6.659 -24.423 1.00 0.00 C ATOM 800 O ASP A 53 9.754 -6.503 -25.642 1.00 0.00 O ATOM 801 CB ASP A 53 8.102 -8.428 -23.990 1.00 0.00 C ATOM 802 CG ASP A 53 7.903 -9.931 -23.951 1.00 0.00 C ATOM 803 OD1 ASP A 53 8.848 -10.664 -24.312 1.00 0.00 O ATOM 804 OD2 ASP A 53 6.804 -10.373 -23.558 1.00 0.00 O ATOM 0 H ASP A 53 9.113 -8.187 -21.754 1.00 0.00 H new ATOM 0 HA ASP A 53 10.203 -8.758 -24.293 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.495 -7.964 -23.213 1.00 0.00 H new ATOM 0 HB3 ASP A 53 7.746 -8.042 -24.945 1.00 0.00 H new ATOM 809 N ASP A 54 10.104 -5.672 -23.581 1.00 0.00 N ATOM 810 CA ASP A 54 10.366 -4.317 -24.053 1.00 0.00 C ATOM 811 C ASP A 54 11.640 -3.761 -23.425 1.00 0.00 C ATOM 812 O ASP A 54 12.341 -2.951 -24.033 1.00 0.00 O ATOM 813 CB ASP A 54 9.183 -3.404 -23.731 1.00 0.00 C ATOM 814 CG ASP A 54 8.431 -2.971 -24.974 1.00 0.00 C ATOM 815 OD1 ASP A 54 7.524 -3.712 -25.408 1.00 0.00 O ATOM 816 OD2 ASP A 54 8.748 -1.889 -25.512 1.00 0.00 O ATOM 0 H ASP A 54 10.160 -5.785 -22.569 1.00 0.00 H new ATOM 0 HA ASP A 54 10.501 -4.354 -25.134 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.500 -3.923 -23.059 1.00 0.00 H new ATOM 0 HB3 ASP A 54 9.542 -2.522 -23.201 1.00 0.00 H new ATOM 821 N ILE A 55 11.932 -4.199 -22.205 1.00 0.00 N ATOM 822 CA ILE A 55 13.121 -3.744 -21.495 1.00 0.00 C ATOM 823 C ILE A 55 14.385 -4.359 -22.088 1.00 0.00 C ATOM 824 O ILE A 55 15.410 -3.691 -22.220 1.00 0.00 O ATOM 825 CB ILE A 55 13.050 -4.092 -19.996 1.00 0.00 C ATOM 826 CG1 ILE A 55 11.750 -3.561 -19.389 1.00 0.00 C ATOM 827 CG2 ILE A 55 14.255 -3.523 -19.262 1.00 0.00 C ATOM 828 CD1 ILE A 55 11.023 -4.576 -18.535 1.00 0.00 C ATOM 0 H ILE A 55 11.362 -4.868 -21.688 1.00 0.00 H new ATOM 0 HA ILE A 55 13.159 -2.660 -21.607 1.00 0.00 H new ATOM 0 HB ILE A 55 13.063 -5.177 -19.889 1.00 0.00 H new ATOM 0 HG12 ILE A 55 11.973 -2.682 -18.784 1.00 0.00 H new ATOM 0 HG13 ILE A 55 11.090 -3.235 -20.193 1.00 0.00 H new ATOM 0 HG21 ILE A 55 14.190 -3.777 -18.204 1.00 0.00 H new ATOM 0 HG22 ILE A 55 15.169 -3.944 -19.681 1.00 0.00 H new ATOM 0 HG23 ILE A 55 14.271 -2.439 -19.374 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.111 -4.131 -18.138 1.00 0.00 H new ATOM 0 HD12 ILE A 55 10.768 -5.445 -19.141 1.00 0.00 H new ATOM 0 HD13 ILE A 55 11.665 -4.884 -17.710 1.00 0.00 H new ATOM 840 N GLY A 56 14.303 -5.637 -22.447 1.00 0.00 N ATOM 841 CA GLY A 56 15.445 -6.320 -23.024 1.00 0.00 C ATOM 842 C GLY A 56 16.070 -5.542 -24.166 1.00 0.00 C ATOM 843 O GLY A 56 17.263 -5.673 -24.434 1.00 0.00 O ATOM 0 H GLY A 56 13.466 -6.211 -22.348 1.00 0.00 H new ATOM 0 HA2 GLY A 56 16.194 -6.487 -22.250 1.00 0.00 H new ATOM 0 HA3 GLY A 56 15.134 -7.301 -23.384 1.00 0.00 H new ATOM 847 N ASN A 57 15.261 -4.733 -24.841 1.00 0.00 N ATOM 848 CA ASN A 57 15.741 -3.933 -25.962 1.00 0.00 C ATOM 849 C ASN A 57 16.938 -3.082 -25.549 1.00 0.00 C ATOM 850 O ASN A 57 17.781 -2.734 -26.378 1.00 0.00 O ATOM 851 CB ASN A 57 14.621 -3.035 -26.491 1.00 0.00 C ATOM 852 CG ASN A 57 14.093 -3.499 -27.835 1.00 0.00 C ATOM 853 OD1 ASN A 57 14.808 -4.138 -28.607 1.00 0.00 O ATOM 854 ND2 ASN A 57 12.837 -3.180 -28.120 1.00 0.00 N ATOM 0 H ASN A 57 14.270 -4.614 -24.632 1.00 0.00 H new ATOM 0 HA ASN A 57 16.057 -4.613 -26.753 1.00 0.00 H new ATOM 0 HB2 ASN A 57 13.804 -3.015 -25.770 1.00 0.00 H new ATOM 0 HB3 ASN A 57 14.990 -2.014 -26.582 1.00 0.00 H new ATOM 0 HD21 ASN A 57 12.427 -3.466 -29.009 1.00 0.00 H new ATOM 0 HD22 ASN A 57 12.281 -2.649 -27.450 1.00 0.00 H new ATOM 861 N LEU A 58 17.007 -2.751 -24.265 1.00 0.00 N ATOM 862 CA LEU A 58 18.102 -1.941 -23.741 1.00 0.00 C ATOM 863 C LEU A 58 18.924 -2.728 -22.725 1.00 0.00 C ATOM 864 O LEU A 58 18.816 -2.528 -21.515 1.00 0.00 O ATOM 865 CB LEU A 58 17.556 -0.666 -23.096 1.00 0.00 C ATOM 866 CG LEU A 58 16.664 0.205 -23.981 1.00 0.00 C ATOM 867 CD1 LEU A 58 17.209 0.258 -25.400 1.00 0.00 C ATOM 868 CD2 LEU A 58 15.234 -0.316 -23.975 1.00 0.00 C ATOM 0 H LEU A 58 16.318 -3.031 -23.567 1.00 0.00 H new ATOM 0 HA LEU A 58 18.751 -1.670 -24.573 1.00 0.00 H new ATOM 0 HB2 LEU A 58 16.990 -0.946 -22.208 1.00 0.00 H new ATOM 0 HB3 LEU A 58 18.399 -0.063 -22.760 1.00 0.00 H new ATOM 0 HG LEU A 58 16.661 1.217 -23.577 1.00 0.00 H new ATOM 0 HD11 LEU A 58 16.561 0.882 -26.015 1.00 0.00 H new ATOM 0 HD12 LEU A 58 18.214 0.679 -25.388 1.00 0.00 H new ATOM 0 HD13 LEU A 58 17.243 -0.749 -25.815 1.00 0.00 H new ATOM 0 HD21 LEU A 58 14.614 0.316 -24.610 1.00 0.00 H new ATOM 0 HD22 LEU A 58 15.218 -1.338 -24.354 1.00 0.00 H new ATOM 0 HD23 LEU A 58 14.845 -0.300 -22.957 1.00 0.00 H new ATOM 880 N PRO A 59 19.766 -3.643 -23.226 1.00 0.00 N ATOM 881 CA PRO A 59 20.625 -4.476 -22.379 1.00 0.00 C ATOM 882 C PRO A 59 21.737 -3.673 -21.714 1.00 0.00 C ATOM 883 O PRO A 59 21.637 -3.310 -20.542 1.00 0.00 O ATOM 884 CB PRO A 59 21.213 -5.492 -23.361 1.00 0.00 C ATOM 885 CG PRO A 59 21.169 -4.809 -24.685 1.00 0.00 C ATOM 886 CD PRO A 59 19.947 -3.934 -24.658 1.00 0.00 C ATOM 0 HA PRO A 59 20.071 -4.929 -21.557 1.00 0.00 H new ATOM 0 HB2 PRO A 59 22.233 -5.761 -23.088 1.00 0.00 H new ATOM 0 HB3 PRO A 59 20.632 -6.414 -23.372 1.00 0.00 H new ATOM 0 HG2 PRO A 59 22.069 -4.217 -24.849 1.00 0.00 H new ATOM 0 HG3 PRO A 59 21.112 -5.534 -25.497 1.00 0.00 H new ATOM 0 HD2 PRO A 59 20.093 -3.023 -25.238 1.00 0.00 H new ATOM 0 HD3 PRO A 59 19.079 -4.443 -25.077 1.00 0.00 H new ATOM 894 N GLU A 60 22.797 -3.399 -22.469 1.00 0.00 N ATOM 895 CA GLU A 60 23.928 -2.639 -21.950 1.00 0.00 C ATOM 896 C GLU A 60 23.521 -1.201 -21.641 1.00 0.00 C ATOM 897 O GLU A 60 24.280 -0.447 -21.032 1.00 0.00 O ATOM 898 CB GLU A 60 25.082 -2.649 -22.955 1.00 0.00 C ATOM 899 CG GLU A 60 24.720 -2.051 -24.303 1.00 0.00 C ATOM 900 CD GLU A 60 25.609 -2.556 -25.423 1.00 0.00 C ATOM 901 OE1 GLU A 60 26.782 -2.132 -25.488 1.00 0.00 O ATOM 902 OE2 GLU A 60 25.131 -3.375 -26.236 1.00 0.00 O ATOM 0 H GLU A 60 22.896 -3.692 -23.441 1.00 0.00 H new ATOM 0 HA GLU A 60 24.257 -3.112 -21.025 1.00 0.00 H new ATOM 0 HB2 GLU A 60 25.923 -2.096 -22.536 1.00 0.00 H new ATOM 0 HB3 GLU A 60 25.417 -3.676 -23.101 1.00 0.00 H new ATOM 0 HG2 GLU A 60 23.681 -2.287 -24.534 1.00 0.00 H new ATOM 0 HG3 GLU A 60 24.795 -0.965 -24.246 1.00 0.00 H new ATOM 909 N VAL A 61 22.318 -0.828 -22.066 1.00 0.00 N ATOM 910 CA VAL A 61 21.809 0.518 -21.835 1.00 0.00 C ATOM 911 C VAL A 61 20.980 0.581 -20.557 1.00 0.00 C ATOM 912 O VAL A 61 21.262 1.375 -19.659 1.00 0.00 O ATOM 913 CB VAL A 61 20.948 1.003 -23.017 1.00 0.00 C ATOM 914 CG1 VAL A 61 20.128 2.220 -22.616 1.00 0.00 C ATOM 915 CG2 VAL A 61 21.824 1.314 -24.221 1.00 0.00 C ATOM 0 H VAL A 61 21.678 -1.440 -22.572 1.00 0.00 H new ATOM 0 HA VAL A 61 22.676 1.171 -21.734 1.00 0.00 H new ATOM 0 HB VAL A 61 20.259 0.205 -23.294 1.00 0.00 H new ATOM 0 HG11 VAL A 61 19.526 2.549 -23.463 1.00 0.00 H new ATOM 0 HG12 VAL A 61 19.473 1.959 -21.785 1.00 0.00 H new ATOM 0 HG13 VAL A 61 20.797 3.025 -22.312 1.00 0.00 H new ATOM 0 HG21 VAL A 61 21.200 1.655 -25.047 1.00 0.00 H new ATOM 0 HG22 VAL A 61 22.538 2.095 -23.959 1.00 0.00 H new ATOM 0 HG23 VAL A 61 22.363 0.415 -24.521 1.00 0.00 H new ATOM 925 N LEU A 62 19.956 -0.262 -20.481 1.00 0.00 N ATOM 926 CA LEU A 62 19.084 -0.304 -19.312 1.00 0.00 C ATOM 927 C LEU A 62 19.485 -1.439 -18.374 1.00 0.00 C ATOM 928 O LEU A 62 19.932 -1.201 -17.252 1.00 0.00 O ATOM 929 CB LEU A 62 17.627 -0.476 -19.744 1.00 0.00 C ATOM 930 CG LEU A 62 16.570 -0.070 -18.716 1.00 0.00 C ATOM 931 CD1 LEU A 62 16.734 1.392 -18.331 1.00 0.00 C ATOM 932 CD2 LEU A 62 15.172 -0.326 -19.259 1.00 0.00 C ATOM 0 H LEU A 62 19.709 -0.926 -21.215 1.00 0.00 H new ATOM 0 HA LEU A 62 19.189 0.640 -18.777 1.00 0.00 H new ATOM 0 HB2 LEU A 62 17.466 0.108 -20.651 1.00 0.00 H new ATOM 0 HB3 LEU A 62 17.468 -1.522 -20.006 1.00 0.00 H new ATOM 0 HG LEU A 62 16.708 -0.678 -17.822 1.00 0.00 H new ATOM 0 HD11 LEU A 62 15.973 1.663 -17.599 1.00 0.00 H new ATOM 0 HD12 LEU A 62 17.723 1.546 -17.900 1.00 0.00 H new ATOM 0 HD13 LEU A 62 16.623 2.016 -19.218 1.00 0.00 H new ATOM 0 HD21 LEU A 62 14.433 -0.031 -18.514 1.00 0.00 H new ATOM 0 HD22 LEU A 62 15.023 0.256 -20.168 1.00 0.00 H new ATOM 0 HD23 LEU A 62 15.058 -1.386 -19.484 1.00 0.00 H new ATOM 944 N ARG A 63 19.325 -2.672 -18.843 1.00 0.00 N ATOM 945 CA ARG A 63 19.671 -3.843 -18.047 1.00 0.00 C ATOM 946 C ARG A 63 21.003 -3.638 -17.330 1.00 0.00 C ATOM 947 O ARG A 63 21.204 -4.130 -16.219 1.00 0.00 O ATOM 948 CB ARG A 63 19.743 -5.087 -18.934 1.00 0.00 C ATOM 949 CG ARG A 63 18.450 -5.381 -19.676 1.00 0.00 C ATOM 950 CD ARG A 63 17.267 -5.462 -18.723 1.00 0.00 C ATOM 951 NE ARG A 63 16.468 -6.664 -18.944 1.00 0.00 N ATOM 952 CZ ARG A 63 16.826 -7.873 -18.524 1.00 0.00 C ATOM 953 NH1 ARG A 63 17.965 -8.038 -17.865 1.00 0.00 N ATOM 954 NH2 ARG A 63 16.045 -8.918 -18.763 1.00 0.00 N ATOM 0 H ARG A 63 18.958 -2.886 -19.770 1.00 0.00 H new ATOM 0 HA ARG A 63 18.892 -3.985 -17.298 1.00 0.00 H new ATOM 0 HB2 ARG A 63 20.547 -4.960 -19.659 1.00 0.00 H new ATOM 0 HB3 ARG A 63 20.002 -5.948 -18.318 1.00 0.00 H new ATOM 0 HG2 ARG A 63 18.269 -4.602 -20.417 1.00 0.00 H new ATOM 0 HG3 ARG A 63 18.546 -6.321 -20.219 1.00 0.00 H new ATOM 0 HD2 ARG A 63 17.628 -5.451 -17.695 1.00 0.00 H new ATOM 0 HD3 ARG A 63 16.638 -4.580 -18.850 1.00 0.00 H new ATOM 0 HE ARG A 63 15.586 -6.571 -19.449 1.00 0.00 H new ATOM 0 HH11 ARG A 63 18.568 -7.236 -17.680 1.00 0.00 H new ATOM 0 HH12 ARG A 63 18.238 -8.967 -17.543 1.00 0.00 H new ATOM 0 HH21 ARG A 63 15.168 -8.794 -19.270 1.00 0.00 H new ATOM 0 HH22 ARG A 63 16.321 -9.845 -18.440 1.00 0.00 H new ATOM 968 N LYS A 64 21.909 -2.911 -17.973 1.00 0.00 N ATOM 969 CA LYS A 64 23.222 -2.640 -17.398 1.00 0.00 C ATOM 970 C LYS A 64 23.126 -1.595 -16.292 1.00 0.00 C ATOM 971 O LYS A 64 23.680 -1.773 -15.208 1.00 0.00 O ATOM 972 CB LYS A 64 24.188 -2.161 -18.484 1.00 0.00 C ATOM 973 CG LYS A 64 25.454 -1.526 -17.935 1.00 0.00 C ATOM 974 CD LYS A 64 26.518 -1.384 -19.010 1.00 0.00 C ATOM 975 CE LYS A 64 26.998 0.055 -19.133 1.00 0.00 C ATOM 976 NZ LYS A 64 27.917 0.429 -18.023 1.00 0.00 N ATOM 0 H LYS A 64 21.759 -2.498 -18.894 1.00 0.00 H new ATOM 0 HA LYS A 64 23.600 -3.567 -16.967 1.00 0.00 H new ATOM 0 HB2 LYS A 64 24.460 -3.007 -19.115 1.00 0.00 H new ATOM 0 HB3 LYS A 64 23.676 -1.439 -19.121 1.00 0.00 H new ATOM 0 HG2 LYS A 64 25.220 -0.545 -17.521 1.00 0.00 H new ATOM 0 HG3 LYS A 64 25.841 -2.133 -17.117 1.00 0.00 H new ATOM 0 HD2 LYS A 64 27.363 -2.032 -18.775 1.00 0.00 H new ATOM 0 HD3 LYS A 64 26.117 -1.718 -19.967 1.00 0.00 H new ATOM 0 HE2 LYS A 64 27.508 0.188 -20.087 1.00 0.00 H new ATOM 0 HE3 LYS A 64 26.139 0.726 -19.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 28.222 1.416 -18.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 27.423 0.327 -17.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 28.749 -0.194 -18.036 1.00 0.00 H new ATOM 990 N ASN A 65 22.418 -0.505 -16.572 1.00 0.00 N ATOM 991 CA ASN A 65 22.249 0.568 -15.599 1.00 0.00 C ATOM 992 C ASN A 65 21.464 0.082 -14.385 1.00 0.00 C ATOM 993 O ASN A 65 21.903 0.239 -13.245 1.00 0.00 O ATOM 994 CB ASN A 65 21.534 1.758 -16.241 1.00 0.00 C ATOM 995 CG ASN A 65 22.492 2.694 -16.953 1.00 0.00 C ATOM 996 OD1 ASN A 65 22.556 3.885 -16.647 1.00 0.00 O ATOM 997 ND2 ASN A 65 23.242 2.157 -17.908 1.00 0.00 N ATOM 0 H ASN A 65 21.952 -0.342 -17.465 1.00 0.00 H new ATOM 0 HA ASN A 65 23.238 0.884 -15.267 1.00 0.00 H new ATOM 0 HB2 ASN A 65 20.793 1.392 -16.951 1.00 0.00 H new ATOM 0 HB3 ASN A 65 20.994 2.311 -15.473 1.00 0.00 H new ATOM 0 HD21 ASN A 65 23.905 2.737 -18.422 1.00 0.00 H new ATOM 0 HD22 ASN A 65 23.155 1.165 -18.127 1.00 0.00 H new ATOM 1004 N LEU A 66 20.300 -0.507 -14.637 1.00 0.00 N ATOM 1005 CA LEU A 66 19.453 -1.017 -13.565 1.00 0.00 C ATOM 1006 C LEU A 66 20.155 -2.133 -12.799 1.00 0.00 C ATOM 1007 O LEU A 66 19.886 -2.355 -11.619 1.00 0.00 O ATOM 1008 CB LEU A 66 18.128 -1.529 -14.135 1.00 0.00 C ATOM 1009 CG LEU A 66 18.225 -2.710 -15.101 1.00 0.00 C ATOM 1010 CD1 LEU A 66 18.274 -4.023 -14.336 1.00 0.00 C ATOM 1011 CD2 LEU A 66 17.055 -2.700 -16.074 1.00 0.00 C ATOM 0 H LEU A 66 19.921 -0.643 -15.574 1.00 0.00 H new ATOM 0 HA LEU A 66 19.253 -0.198 -12.874 1.00 0.00 H new ATOM 0 HB2 LEU A 66 17.485 -1.817 -13.303 1.00 0.00 H new ATOM 0 HB3 LEU A 66 17.634 -0.705 -14.649 1.00 0.00 H new ATOM 0 HG LEU A 66 19.148 -2.612 -15.673 1.00 0.00 H new ATOM 0 HD11 LEU A 66 18.343 -4.852 -15.040 1.00 0.00 H new ATOM 0 HD12 LEU A 66 19.145 -4.030 -13.681 1.00 0.00 H new ATOM 0 HD13 LEU A 66 17.369 -4.129 -13.738 1.00 0.00 H new ATOM 0 HD21 LEU A 66 17.140 -3.547 -16.754 1.00 0.00 H new ATOM 0 HD22 LEU A 66 16.120 -2.773 -15.519 1.00 0.00 H new ATOM 0 HD23 LEU A 66 17.066 -1.773 -16.647 1.00 0.00 H new ATOM 1023 N ASN A 67 21.059 -2.832 -13.479 1.00 0.00 N ATOM 1024 CA ASN A 67 21.802 -3.925 -12.862 1.00 0.00 C ATOM 1025 C ASN A 67 22.364 -3.504 -11.507 1.00 0.00 C ATOM 1026 O ASN A 67 22.436 -4.307 -10.578 1.00 0.00 O ATOM 1027 CB ASN A 67 22.940 -4.378 -13.779 1.00 0.00 C ATOM 1028 CG ASN A 67 22.888 -5.864 -14.074 1.00 0.00 C ATOM 1029 OD1 ASN A 67 22.957 -6.691 -13.165 1.00 0.00 O ATOM 1030 ND2 ASN A 67 22.766 -6.211 -15.350 1.00 0.00 N ATOM 0 H ASN A 67 21.294 -2.661 -14.457 1.00 0.00 H new ATOM 0 HA ASN A 67 21.115 -4.757 -12.709 1.00 0.00 H new ATOM 0 HB2 ASN A 67 22.891 -3.823 -14.716 1.00 0.00 H new ATOM 0 HB3 ASN A 67 23.896 -4.136 -13.314 1.00 0.00 H new ATOM 0 HD21 ASN A 67 22.726 -7.197 -15.609 1.00 0.00 H new ATOM 0 HD22 ASN A 67 22.712 -5.492 -16.071 1.00 0.00 H new ATOM 1037 N GLU A 68 22.759 -2.239 -11.404 1.00 0.00 N ATOM 1038 CA GLU A 68 23.314 -1.712 -10.163 1.00 0.00 C ATOM 1039 C GLU A 68 22.348 -0.728 -9.509 1.00 0.00 C ATOM 1040 O GLU A 68 22.418 -0.478 -8.306 1.00 0.00 O ATOM 1041 CB GLU A 68 24.656 -1.026 -10.429 1.00 0.00 C ATOM 1042 CG GLU A 68 24.583 0.064 -11.485 1.00 0.00 C ATOM 1043 CD GLU A 68 25.913 0.760 -11.697 1.00 0.00 C ATOM 1044 OE1 GLU A 68 26.737 0.763 -10.759 1.00 0.00 O ATOM 1045 OE2 GLU A 68 26.130 1.302 -12.801 1.00 0.00 O ATOM 0 H GLU A 68 22.705 -1.561 -12.164 1.00 0.00 H new ATOM 0 HA GLU A 68 23.470 -2.548 -9.481 1.00 0.00 H new ATOM 0 HB2 GLU A 68 25.025 -0.595 -9.498 1.00 0.00 H new ATOM 0 HB3 GLU A 68 25.382 -1.776 -10.743 1.00 0.00 H new ATOM 0 HG2 GLU A 68 24.250 -0.370 -12.428 1.00 0.00 H new ATOM 0 HG3 GLU A 68 23.835 0.800 -11.191 1.00 0.00 H new ATOM 1052 N SER A 69 21.446 -0.171 -10.312 1.00 0.00 N ATOM 1053 CA SER A 69 20.468 0.789 -9.814 1.00 0.00 C ATOM 1054 C SER A 69 19.150 0.098 -9.479 1.00 0.00 C ATOM 1055 O SER A 69 18.103 0.740 -9.395 1.00 0.00 O ATOM 1056 CB SER A 69 20.231 1.891 -10.849 1.00 0.00 C ATOM 1057 OG SER A 69 20.608 3.158 -10.339 1.00 0.00 O ATOM 0 H SER A 69 21.373 -0.368 -11.310 1.00 0.00 H new ATOM 0 HA SER A 69 20.866 1.236 -8.903 1.00 0.00 H new ATOM 0 HB2 SER A 69 20.801 1.675 -11.752 1.00 0.00 H new ATOM 0 HB3 SER A 69 19.179 1.908 -11.133 1.00 0.00 H new ATOM 0 HG SER A 69 20.449 3.845 -11.019 1.00 0.00 H new ATOM 1063 N VAL A 70 19.210 -1.216 -9.289 1.00 0.00 N ATOM 1064 CA VAL A 70 18.022 -1.996 -8.962 1.00 0.00 C ATOM 1065 C VAL A 70 17.637 -1.823 -7.498 1.00 0.00 C ATOM 1066 O VAL A 70 17.572 -2.794 -6.744 1.00 0.00 O ATOM 1067 CB VAL A 70 18.237 -3.494 -9.252 1.00 0.00 C ATOM 1068 CG1 VAL A 70 19.386 -4.040 -8.418 1.00 0.00 C ATOM 1069 CG2 VAL A 70 16.958 -4.275 -8.990 1.00 0.00 C ATOM 0 H VAL A 70 20.068 -1.763 -9.356 1.00 0.00 H new ATOM 0 HA VAL A 70 17.215 -1.624 -9.593 1.00 0.00 H new ATOM 0 HB VAL A 70 18.497 -3.610 -10.304 1.00 0.00 H new ATOM 0 HG11 VAL A 70 19.523 -5.099 -8.636 1.00 0.00 H new ATOM 0 HG12 VAL A 70 20.301 -3.499 -8.660 1.00 0.00 H new ATOM 0 HG13 VAL A 70 19.159 -3.914 -7.359 1.00 0.00 H new ATOM 0 HG21 VAL A 70 17.127 -5.331 -9.200 1.00 0.00 H new ATOM 0 HG22 VAL A 70 16.665 -4.154 -7.947 1.00 0.00 H new ATOM 0 HG23 VAL A 70 16.164 -3.900 -9.635 1.00 0.00 H new ATOM 1079 N GLN A 71 17.381 -0.581 -7.102 1.00 0.00 N ATOM 1080 CA GLN A 71 17.002 -0.281 -5.726 1.00 0.00 C ATOM 1081 C GLN A 71 15.603 -0.807 -5.420 1.00 0.00 C ATOM 1082 O GLN A 71 15.405 -1.629 -4.525 1.00 0.00 O ATOM 1083 CB GLN A 71 17.058 1.228 -5.477 1.00 0.00 C ATOM 1084 CG GLN A 71 18.381 1.699 -4.895 1.00 0.00 C ATOM 1085 CD GLN A 71 18.812 0.886 -3.691 1.00 0.00 C ATOM 1086 OE1 GLN A 71 18.338 1.108 -2.576 1.00 0.00 O ATOM 1087 NE2 GLN A 71 19.716 -0.062 -3.908 1.00 0.00 N ATOM 0 H GLN A 71 17.429 0.234 -7.714 1.00 0.00 H new ATOM 0 HA GLN A 71 17.711 -0.778 -5.064 1.00 0.00 H new ATOM 0 HB2 GLN A 71 16.877 1.750 -6.417 1.00 0.00 H new ATOM 0 HB3 GLN A 71 16.252 1.506 -4.798 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.152 1.641 -5.663 1.00 0.00 H new ATOM 0 HG3 GLN A 71 18.295 2.747 -4.609 1.00 0.00 H new ATOM 0 HE21 GLN A 71 20.082 -0.212 -4.848 1.00 0.00 H new ATOM 0 HE22 GLN A 71 20.044 -0.640 -3.135 1.00 0.00 H new ATOM 1096 N PRO A 72 14.609 -0.323 -6.179 1.00 0.00 N ATOM 1097 CA PRO A 72 13.212 -0.731 -6.008 1.00 0.00 C ATOM 1098 C PRO A 72 12.972 -2.174 -6.440 1.00 0.00 C ATOM 1099 O PRO A 72 13.916 -2.920 -6.702 1.00 0.00 O ATOM 1100 CB PRO A 72 12.446 0.234 -6.916 1.00 0.00 C ATOM 1101 CG PRO A 72 13.435 0.645 -7.952 1.00 0.00 C ATOM 1102 CD PRO A 72 14.773 0.659 -7.264 1.00 0.00 C ATOM 0 HA PRO A 72 12.901 -0.692 -4.964 1.00 0.00 H new ATOM 0 HB2 PRO A 72 11.579 -0.250 -7.366 1.00 0.00 H new ATOM 0 HB3 PRO A 72 12.077 1.094 -6.358 1.00 0.00 H new ATOM 0 HG2 PRO A 72 13.434 -0.052 -8.790 1.00 0.00 H new ATOM 0 HG3 PRO A 72 13.193 1.629 -8.355 1.00 0.00 H new ATOM 0 HD2 PRO A 72 15.577 0.377 -7.943 1.00 0.00 H new ATOM 0 HD3 PRO A 72 15.016 1.649 -6.877 1.00 0.00 H new ATOM 1110 N THR A 73 11.702 -2.561 -6.514 1.00 0.00 N ATOM 1111 CA THR A 73 11.338 -3.914 -6.914 1.00 0.00 C ATOM 1112 C THR A 73 10.833 -3.945 -8.352 1.00 0.00 C ATOM 1113 O THR A 73 9.627 -3.918 -8.598 1.00 0.00 O ATOM 1114 CB THR A 73 10.256 -4.502 -5.989 1.00 0.00 C ATOM 1115 OG1 THR A 73 10.537 -4.160 -4.627 1.00 0.00 O ATOM 1116 CG2 THR A 73 10.184 -6.015 -6.132 1.00 0.00 C ATOM 0 H THR A 73 10.909 -1.956 -6.302 1.00 0.00 H new ATOM 0 HA THR A 73 12.241 -4.520 -6.835 1.00 0.00 H new ATOM 0 HB THR A 73 9.294 -4.080 -6.279 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.844 -4.536 -4.046 1.00 0.00 H new ATOM 0 HG21 THR A 73 9.413 -6.407 -5.469 1.00 0.00 H new ATOM 0 HG22 THR A 73 9.941 -6.272 -7.163 1.00 0.00 H new ATOM 0 HG23 THR A 73 11.147 -6.452 -5.867 1.00 0.00 H new ATOM 1124 N VAL A 74 11.763 -4.004 -9.300 1.00 0.00 N ATOM 1125 CA VAL A 74 11.411 -4.040 -10.715 1.00 0.00 C ATOM 1126 C VAL A 74 11.182 -5.471 -11.187 1.00 0.00 C ATOM 1127 O VAL A 74 12.083 -6.107 -11.736 1.00 0.00 O ATOM 1128 CB VAL A 74 12.507 -3.394 -11.582 1.00 0.00 C ATOM 1129 CG1 VAL A 74 12.150 -3.495 -13.057 1.00 0.00 C ATOM 1130 CG2 VAL A 74 12.722 -1.944 -11.175 1.00 0.00 C ATOM 0 H VAL A 74 12.766 -4.028 -9.114 1.00 0.00 H new ATOM 0 HA VAL A 74 10.488 -3.471 -10.827 1.00 0.00 H new ATOM 0 HB VAL A 74 13.440 -3.935 -11.421 1.00 0.00 H new ATOM 0 HG11 VAL A 74 12.936 -3.033 -13.654 1.00 0.00 H new ATOM 0 HG12 VAL A 74 12.051 -4.544 -13.336 1.00 0.00 H new ATOM 0 HG13 VAL A 74 11.207 -2.980 -13.239 1.00 0.00 H new ATOM 0 HG21 VAL A 74 13.500 -1.503 -11.798 1.00 0.00 H new ATOM 0 HG22 VAL A 74 11.794 -1.388 -11.306 1.00 0.00 H new ATOM 0 HG23 VAL A 74 13.027 -1.901 -10.129 1.00 0.00 H new ATOM 1140 N VAL A 75 9.971 -5.974 -10.971 1.00 0.00 N ATOM 1141 CA VAL A 75 9.622 -7.330 -11.376 1.00 0.00 C ATOM 1142 C VAL A 75 9.516 -7.440 -12.893 1.00 0.00 C ATOM 1143 O VAL A 75 8.473 -7.149 -13.476 1.00 0.00 O ATOM 1144 CB VAL A 75 8.290 -7.779 -10.746 1.00 0.00 C ATOM 1145 CG1 VAL A 75 7.895 -9.156 -11.258 1.00 0.00 C ATOM 1146 CG2 VAL A 75 8.391 -7.774 -9.228 1.00 0.00 C ATOM 0 H VAL A 75 9.214 -5.462 -10.517 1.00 0.00 H new ATOM 0 HA VAL A 75 10.421 -7.982 -11.022 1.00 0.00 H new ATOM 0 HB VAL A 75 7.513 -7.073 -11.038 1.00 0.00 H new ATOM 0 HG11 VAL A 75 6.952 -9.457 -10.802 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.780 -9.122 -12.341 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.670 -9.877 -10.998 1.00 0.00 H new ATOM 0 HG21 VAL A 75 7.441 -8.094 -8.799 1.00 0.00 H new ATOM 0 HG22 VAL A 75 9.180 -8.458 -8.914 1.00 0.00 H new ATOM 0 HG23 VAL A 75 8.625 -6.767 -8.882 1.00 0.00 H new ATOM 1156 N ALA A 76 10.605 -7.864 -13.527 1.00 0.00 N ATOM 1157 CA ALA A 76 10.634 -8.016 -14.977 1.00 0.00 C ATOM 1158 C ALA A 76 10.111 -9.386 -15.396 1.00 0.00 C ATOM 1159 O ALA A 76 10.521 -10.411 -14.851 1.00 0.00 O ATOM 1160 CB ALA A 76 12.047 -7.805 -15.501 1.00 0.00 C ATOM 0 H ALA A 76 11.478 -8.108 -13.060 1.00 0.00 H new ATOM 0 HA ALA A 76 9.981 -7.259 -15.410 1.00 0.00 H new ATOM 0 HB1 ALA A 76 12.054 -7.921 -16.585 1.00 0.00 H new ATOM 0 HB2 ALA A 76 12.385 -6.802 -15.241 1.00 0.00 H new ATOM 0 HB3 ALA A 76 12.715 -8.540 -15.053 1.00 0.00 H new ATOM 1166 N LEU A 77 9.204 -9.395 -16.366 1.00 0.00 N ATOM 1167 CA LEU A 77 8.624 -10.640 -16.859 1.00 0.00 C ATOM 1168 C LEU A 77 9.306 -11.087 -18.148 1.00 0.00 C ATOM 1169 O LEU A 77 9.485 -10.296 -19.073 1.00 0.00 O ATOM 1170 CB LEU A 77 7.123 -10.467 -17.096 1.00 0.00 C ATOM 1171 CG LEU A 77 6.289 -11.748 -17.081 1.00 0.00 C ATOM 1172 CD1 LEU A 77 5.457 -11.829 -15.811 1.00 0.00 C ATOM 1173 CD2 LEU A 77 5.395 -11.817 -18.311 1.00 0.00 C ATOM 0 H LEU A 77 8.854 -8.555 -16.827 1.00 0.00 H new ATOM 0 HA LEU A 77 8.780 -11.409 -16.103 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.731 -9.793 -16.335 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.982 -9.977 -18.059 1.00 0.00 H new ATOM 0 HG LEU A 77 6.968 -12.600 -17.101 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.870 -12.748 -15.818 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.117 -11.827 -14.943 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.787 -10.971 -15.760 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.809 -12.735 -18.284 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.724 -10.958 -18.322 1.00 0.00 H new ATOM 0 HD23 LEU A 77 6.011 -11.807 -19.210 1.00 0.00 H new ATOM 1185 N GLY A 78 9.683 -12.361 -18.201 1.00 0.00 N ATOM 1186 CA GLY A 78 10.340 -12.891 -19.382 1.00 0.00 C ATOM 1187 C GLY A 78 11.849 -12.913 -19.245 1.00 0.00 C ATOM 1188 O GLY A 78 12.378 -13.159 -18.162 1.00 0.00 O ATOM 0 H GLY A 78 9.545 -13.035 -17.448 1.00 0.00 H new ATOM 0 HA2 GLY A 78 9.981 -13.903 -19.571 1.00 0.00 H new ATOM 0 HA3 GLY A 78 10.066 -12.288 -20.248 1.00 0.00 H new ATOM 1370 N LYS A 92 45.281 -27.564 -22.206 1.00 0.00 N ATOM 1371 CA LYS A 92 46.196 -27.674 -21.076 1.00 0.00 C ATOM 1372 C LYS A 92 47.645 -27.721 -21.551 1.00 0.00 C ATOM 1373 O LYS A 92 48.453 -26.867 -21.190 1.00 0.00 O ATOM 1374 CB LYS A 92 45.876 -28.924 -20.254 1.00 0.00 C ATOM 1375 CG LYS A 92 46.093 -28.743 -18.762 1.00 0.00 C ATOM 1376 CD LYS A 92 47.113 -29.732 -18.222 1.00 0.00 C ATOM 1377 CE LYS A 92 46.589 -31.159 -18.277 1.00 0.00 C ATOM 1378 NZ LYS A 92 47.159 -32.001 -17.189 1.00 0.00 N ATOM 0 HA LYS A 92 46.067 -26.792 -20.449 1.00 0.00 H new ATOM 0 HB2 LYS A 92 44.839 -29.208 -20.430 1.00 0.00 H new ATOM 0 HB3 LYS A 92 46.496 -29.748 -20.605 1.00 0.00 H new ATOM 0 HG2 LYS A 92 46.431 -27.726 -18.563 1.00 0.00 H new ATOM 0 HG3 LYS A 92 45.146 -28.873 -18.237 1.00 0.00 H new ATOM 0 HD2 LYS A 92 48.034 -29.659 -18.801 1.00 0.00 H new ATOM 0 HD3 LYS A 92 47.362 -29.474 -17.193 1.00 0.00 H new ATOM 0 HE2 LYS A 92 45.502 -31.150 -18.198 1.00 0.00 H new ATOM 0 HE3 LYS A 92 46.835 -31.599 -19.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 46.778 -32.966 -17.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 48.195 -32.030 -17.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 46.903 -31.595 -16.266 1.00 0.00 H new ATOM 1392 N GLN A 93 47.964 -28.724 -22.363 1.00 0.00 N ATOM 1393 CA GLN A 93 49.315 -28.881 -22.888 1.00 0.00 C ATOM 1394 C GLN A 93 49.821 -27.574 -23.489 1.00 0.00 C ATOM 1395 O GLN A 93 51.022 -27.305 -23.492 1.00 0.00 O ATOM 1396 CB GLN A 93 49.350 -29.989 -23.942 1.00 0.00 C ATOM 1397 CG GLN A 93 50.730 -30.594 -24.143 1.00 0.00 C ATOM 1398 CD GLN A 93 50.708 -31.807 -25.052 1.00 0.00 C ATOM 1399 OE1 GLN A 93 50.261 -31.732 -26.197 1.00 0.00 O ATOM 1400 NE2 GLN A 93 51.194 -32.935 -24.546 1.00 0.00 N ATOM 0 H GLN A 93 47.306 -29.439 -22.671 1.00 0.00 H new ATOM 0 HA GLN A 93 49.969 -29.156 -22.061 1.00 0.00 H new ATOM 0 HB2 GLN A 93 48.656 -30.777 -23.652 1.00 0.00 H new ATOM 0 HB3 GLN A 93 48.997 -29.587 -24.892 1.00 0.00 H new ATOM 0 HG2 GLN A 93 51.395 -29.840 -24.565 1.00 0.00 H new ATOM 0 HG3 GLN A 93 51.143 -30.877 -23.175 1.00 0.00 H new ATOM 0 HE21 GLN A 93 51.555 -32.952 -23.592 1.00 0.00 H new ATOM 0 HE22 GLN A 93 51.207 -33.784 -25.111 1.00 0.00 H new ATOM 1409 N ALA A 94 48.897 -26.766 -23.998 1.00 0.00 N ATOM 1410 CA ALA A 94 49.249 -25.486 -24.601 1.00 0.00 C ATOM 1411 C ALA A 94 50.144 -24.671 -23.674 1.00 0.00 C ATOM 1412 O ALA A 94 50.982 -23.893 -24.130 1.00 0.00 O ATOM 1413 CB ALA A 94 47.992 -24.703 -24.948 1.00 0.00 C ATOM 0 H ALA A 94 47.899 -26.975 -24.005 1.00 0.00 H new ATOM 0 HA ALA A 94 49.804 -25.684 -25.518 1.00 0.00 H new ATOM 0 HB1 ALA A 94 48.270 -23.750 -25.397 1.00 0.00 H new ATOM 0 HB2 ALA A 94 47.390 -25.275 -25.654 1.00 0.00 H new ATOM 0 HB3 ALA A 94 47.414 -24.522 -24.042 1.00 0.00 H new ATOM 1419 N VAL A 95 49.961 -24.854 -22.370 1.00 0.00 N ATOM 1420 CA VAL A 95 50.753 -24.135 -21.379 1.00 0.00 C ATOM 1421 C VAL A 95 52.245 -24.308 -21.637 1.00 0.00 C ATOM 1422 O VAL A 95 53.050 -23.446 -21.288 1.00 0.00 O ATOM 1423 CB VAL A 95 50.431 -24.613 -19.950 1.00 0.00 C ATOM 1424 CG1 VAL A 95 48.953 -24.429 -19.645 1.00 0.00 C ATOM 1425 CG2 VAL A 95 50.845 -26.066 -19.769 1.00 0.00 C ATOM 0 H VAL A 95 49.271 -25.494 -21.975 1.00 0.00 H new ATOM 0 HA VAL A 95 50.492 -23.081 -21.469 1.00 0.00 H new ATOM 0 HB VAL A 95 51.000 -24.006 -19.246 1.00 0.00 H new ATOM 0 HG11 VAL A 95 48.745 -24.772 -18.632 1.00 0.00 H new ATOM 0 HG12 VAL A 95 48.692 -23.374 -19.732 1.00 0.00 H new ATOM 0 HG13 VAL A 95 48.360 -25.009 -20.353 1.00 0.00 H new ATOM 0 HG21 VAL A 95 50.610 -26.387 -18.754 1.00 0.00 H new ATOM 0 HG22 VAL A 95 50.305 -26.690 -20.481 1.00 0.00 H new ATOM 0 HG23 VAL A 95 51.917 -26.163 -19.942 1.00 0.00 H new ATOM 1435 N GLY A 96 52.608 -25.430 -22.252 1.00 0.00 N ATOM 1436 CA GLY A 96 54.004 -25.695 -22.547 1.00 0.00 C ATOM 1437 C GLY A 96 54.668 -24.551 -23.287 1.00 0.00 C ATOM 1438 O GLY A 96 55.878 -24.352 -23.179 1.00 0.00 O ATOM 0 H GLY A 96 51.961 -26.159 -22.551 1.00 0.00 H new ATOM 0 HA2 GLY A 96 54.540 -25.881 -21.616 1.00 0.00 H new ATOM 0 HA3 GLY A 96 54.080 -26.603 -23.145 1.00 0.00 H new ATOM 1442 N VAL A 97 53.876 -23.797 -24.042 1.00 0.00 N ATOM 1443 CA VAL A 97 54.394 -22.667 -24.803 1.00 0.00 C ATOM 1444 C VAL A 97 54.963 -21.596 -23.878 1.00 0.00 C ATOM 1445 O VAL A 97 55.892 -20.876 -24.244 1.00 0.00 O ATOM 1446 CB VAL A 97 53.302 -22.038 -25.688 1.00 0.00 C ATOM 1447 CG1 VAL A 97 52.686 -23.086 -26.602 1.00 0.00 C ATOM 1448 CG2 VAL A 97 52.236 -21.375 -24.828 1.00 0.00 C ATOM 0 H VAL A 97 52.872 -23.949 -24.143 1.00 0.00 H new ATOM 0 HA VAL A 97 55.190 -23.053 -25.440 1.00 0.00 H new ATOM 0 HB VAL A 97 53.761 -21.271 -26.312 1.00 0.00 H new ATOM 0 HG11 VAL A 97 51.917 -22.623 -27.220 1.00 0.00 H new ATOM 0 HG12 VAL A 97 53.459 -23.510 -27.243 1.00 0.00 H new ATOM 0 HG13 VAL A 97 52.240 -23.877 -26.000 1.00 0.00 H new ATOM 0 HG21 VAL A 97 51.472 -20.936 -25.470 1.00 0.00 H new ATOM 0 HG22 VAL A 97 51.778 -22.120 -24.177 1.00 0.00 H new ATOM 0 HG23 VAL A 97 52.693 -20.594 -24.220 1.00 0.00 H new ATOM 1458 N ASP A 98 54.399 -21.498 -22.679 1.00 0.00 N ATOM 1459 CA ASP A 98 54.851 -20.516 -21.701 1.00 0.00 C ATOM 1460 C ASP A 98 56.227 -20.886 -21.155 1.00 0.00 C ATOM 1461 O ASP A 98 56.937 -20.041 -20.607 1.00 0.00 O ATOM 1462 CB ASP A 98 53.846 -20.408 -20.553 1.00 0.00 C ATOM 1463 CG ASP A 98 53.738 -18.997 -20.008 1.00 0.00 C ATOM 1464 OD1 ASP A 98 54.550 -18.637 -19.130 1.00 0.00 O ATOM 1465 OD2 ASP A 98 52.843 -18.254 -20.460 1.00 0.00 O ATOM 0 H ASP A 98 53.629 -22.086 -22.361 1.00 0.00 H new ATOM 0 HA ASP A 98 54.926 -19.550 -22.201 1.00 0.00 H new ATOM 0 HB2 ASP A 98 52.866 -20.736 -20.900 1.00 0.00 H new ATOM 0 HB3 ASP A 98 54.142 -21.083 -19.750 1.00 0.00 H new ATOM 1470 N LEU A 99 56.597 -22.152 -21.307 1.00 0.00 N ATOM 1471 CA LEU A 99 57.888 -22.635 -20.829 1.00 0.00 C ATOM 1472 C LEU A 99 59.027 -22.069 -21.671 1.00 0.00 C ATOM 1473 O LEU A 99 59.988 -21.513 -21.139 1.00 0.00 O ATOM 1474 CB LEU A 99 57.926 -24.164 -20.860 1.00 0.00 C ATOM 1475 CG LEU A 99 59.194 -24.815 -20.306 1.00 0.00 C ATOM 1476 CD1 LEU A 99 59.173 -24.813 -18.785 1.00 0.00 C ATOM 1477 CD2 LEU A 99 59.341 -26.233 -20.837 1.00 0.00 C ATOM 0 H LEU A 99 56.021 -22.863 -21.758 1.00 0.00 H new ATOM 0 HA LEU A 99 58.017 -22.295 -19.801 1.00 0.00 H new ATOM 0 HB2 LEU A 99 57.072 -24.540 -20.296 1.00 0.00 H new ATOM 0 HB3 LEU A 99 57.795 -24.490 -21.892 1.00 0.00 H new ATOM 0 HG LEU A 99 60.054 -24.233 -20.638 1.00 0.00 H new ATOM 0 HD11 LEU A 99 60.083 -25.280 -18.408 1.00 0.00 H new ATOM 0 HD12 LEU A 99 59.115 -23.786 -18.423 1.00 0.00 H new ATOM 0 HD13 LEU A 99 58.306 -25.371 -18.432 1.00 0.00 H new ATOM 0 HD21 LEU A 99 60.249 -26.681 -20.432 1.00 0.00 H new ATOM 0 HD22 LEU A 99 58.478 -26.826 -20.535 1.00 0.00 H new ATOM 0 HD23 LEU A 99 59.402 -26.210 -21.925 1.00 0.00 H new ATOM 1489 N TRP A 100 58.911 -22.212 -22.986 1.00 0.00 N ATOM 1490 CA TRP A 100 59.930 -21.713 -23.901 1.00 0.00 C ATOM 1491 C TRP A 100 59.900 -20.190 -23.972 1.00 0.00 C ATOM 1492 O TRP A 100 60.918 -19.550 -24.234 1.00 0.00 O ATOM 1493 CB TRP A 100 59.726 -22.305 -25.297 1.00 0.00 C ATOM 1494 CG TRP A 100 58.918 -21.425 -26.203 1.00 0.00 C ATOM 1495 CD1 TRP A 100 57.579 -21.517 -26.455 1.00 0.00 C ATOM 1496 CD2 TRP A 100 59.400 -20.322 -26.978 1.00 0.00 C ATOM 1497 NE1 TRP A 100 57.199 -20.538 -27.340 1.00 0.00 N ATOM 1498 CE2 TRP A 100 58.297 -19.791 -27.675 1.00 0.00 C ATOM 1499 CE3 TRP A 100 60.654 -19.730 -27.150 1.00 0.00 C ATOM 1500 CZ2 TRP A 100 58.414 -18.698 -28.530 1.00 0.00 C ATOM 1501 CZ3 TRP A 100 60.768 -18.645 -27.998 1.00 0.00 C ATOM 1502 CH2 TRP A 100 59.653 -18.138 -28.679 1.00 0.00 C ATOM 0 H TRP A 100 58.122 -22.669 -23.442 1.00 0.00 H new ATOM 0 HA TRP A 100 60.904 -22.021 -23.522 1.00 0.00 H new ATOM 0 HB2 TRP A 100 60.699 -22.487 -25.752 1.00 0.00 H new ATOM 0 HB3 TRP A 100 59.231 -23.272 -25.205 1.00 0.00 H new ATOM 0 HD1 TRP A 100 56.916 -22.252 -26.022 1.00 0.00 H new ATOM 0 HE1 TRP A 100 56.253 -20.391 -27.691 1.00 0.00 H new ATOM 0 HE3 TRP A 100 61.519 -20.114 -26.629 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 57.557 -18.306 -29.057 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 61.733 -18.180 -28.138 1.00 0.00 H new ATOM 0 HH2 TRP A 100 59.774 -17.288 -29.334 1.00 0.00 H new ATOM 1513 N LYS A 101 58.725 -19.615 -23.738 1.00 0.00 N ATOM 1514 CA LYS A 101 58.562 -18.166 -23.774 1.00 0.00 C ATOM 1515 C LYS A 101 59.325 -17.504 -22.631 1.00 0.00 C ATOM 1516 O LYS A 101 59.383 -18.035 -21.521 1.00 0.00 O ATOM 1517 CB LYS A 101 57.079 -17.798 -23.692 1.00 0.00 C ATOM 1518 CG LYS A 101 56.740 -16.484 -24.374 1.00 0.00 C ATOM 1519 CD LYS A 101 55.248 -16.199 -24.327 1.00 0.00 C ATOM 1520 CE LYS A 101 54.838 -15.594 -22.993 1.00 0.00 C ATOM 1521 NZ LYS A 101 54.590 -14.130 -23.100 1.00 0.00 N ATOM 0 H LYS A 101 57.872 -20.130 -23.521 1.00 0.00 H new ATOM 0 HA LYS A 101 58.969 -17.802 -24.717 1.00 0.00 H new ATOM 0 HB2 LYS A 101 56.490 -18.595 -24.145 1.00 0.00 H new ATOM 0 HB3 LYS A 101 56.785 -17.740 -22.644 1.00 0.00 H new ATOM 0 HG2 LYS A 101 57.282 -15.672 -23.890 1.00 0.00 H new ATOM 0 HG3 LYS A 101 57.073 -16.515 -25.412 1.00 0.00 H new ATOM 0 HD2 LYS A 101 54.981 -15.517 -25.134 1.00 0.00 H new ATOM 0 HD3 LYS A 101 54.695 -17.123 -24.494 1.00 0.00 H new ATOM 0 HE2 LYS A 101 53.937 -16.089 -22.631 1.00 0.00 H new ATOM 0 HE3 LYS A 101 55.620 -15.777 -22.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 54.313 -13.756 -22.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 55.457 -13.654 -23.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 53.826 -13.956 -23.784 1.00 0.00 H new