USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 779 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 26 THR OG1 : rot 51:sc= 1.07 USER MOD Set 1.2: A 32 THR OG1 : rot 57:sc= 0.612 USER MOD Single : A 1 MET CE :methyl 167:sc= 0 (180deg=-0.184) USER MOD Single : A 1 MET N :NH3+ -136:sc= -0.0473 (180deg=-0.346) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0.115 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 68:sc= 0.317 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 TYR OH : rot 165:sc= -0.409 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+ -171:sc= 0 (180deg=-0.0378) USER MOD Single : A 44 SER OG : rot 180:sc= -0.0146 USER MOD Single : A 50 MET CE :methyl -128:sc= -2.82! (180deg=-7.01!) USER MOD Single : A 51 HIS : no HD1:sc= 0.00261 K(o=0.0026,f=-6!) USER MOD Single : A 52 ASN : amide:sc= -5.29! C(o=-5.3!,f=-6.9!) USER MOD Single : A 57 ASN : amide:sc= -0.854 K(o=-0.85,f=-2.8!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.542 K(o=-0.54,f=-2.4e-05) USER MOD Single : A 67 ASN : amide:sc= -0.193 X(o=-0.19,f=-0.026) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -0.19 X(o=-0.19,f=-0.023) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0.00883 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc=-0.00673 K(o=-0.0067,f=-0.69) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.365 0.049 0.248 1.00 0.00 N ATOM 2 CA MET A 1 3.000 0.034 -1.065 1.00 0.00 C ATOM 3 C MET A 1 1.957 0.123 -2.174 1.00 0.00 C ATOM 4 O MET A 1 0.818 -0.309 -2.003 1.00 0.00 O ATOM 5 CB MET A 1 3.837 -1.235 -1.236 1.00 0.00 C ATOM 6 CG MET A 1 4.888 -1.421 -0.154 1.00 0.00 C ATOM 7 SD MET A 1 6.075 -0.065 -0.097 1.00 0.00 S ATOM 8 CE MET A 1 5.805 0.552 1.563 1.00 0.00 C ATOM 0 H1 MET A 1 2.891 0.685 0.881 1.00 0.00 H new ATOM 0 H2 MET A 1 1.385 0.385 0.156 1.00 0.00 H new ATOM 0 H3 MET A 1 2.366 -0.912 0.645 1.00 0.00 H new ATOM 0 HA MET A 1 3.654 0.903 -1.135 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.174 -2.100 -1.239 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.329 -1.207 -2.208 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.395 -1.508 0.814 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.420 -2.357 -0.326 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.612 1.233 1.834 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.854 1.082 1.604 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.785 -0.283 2.263 1.00 0.00 H new ATOM 18 N GLU A 2 2.355 0.687 -3.311 1.00 0.00 N ATOM 19 CA GLU A 2 1.453 0.833 -4.447 1.00 0.00 C ATOM 20 C GLU A 2 1.747 -0.218 -5.514 1.00 0.00 C ATOM 21 O GLU A 2 2.678 -1.013 -5.378 1.00 0.00 O ATOM 22 CB GLU A 2 1.576 2.235 -5.048 1.00 0.00 C ATOM 23 CG GLU A 2 1.688 3.335 -4.007 1.00 0.00 C ATOM 24 CD GLU A 2 0.446 3.453 -3.145 1.00 0.00 C ATOM 25 OE1 GLU A 2 -0.630 3.000 -3.590 1.00 0.00 O ATOM 26 OE2 GLU A 2 0.550 3.997 -2.026 1.00 0.00 O ATOM 0 H GLU A 2 3.295 1.050 -3.469 1.00 0.00 H new ATOM 0 HA GLU A 2 0.434 0.687 -4.090 1.00 0.00 H new ATOM 0 HB2 GLU A 2 2.452 2.268 -5.695 1.00 0.00 H new ATOM 0 HB3 GLU A 2 0.707 2.429 -5.677 1.00 0.00 H new ATOM 0 HG2 GLU A 2 2.551 3.140 -3.370 1.00 0.00 H new ATOM 0 HG3 GLU A 2 1.870 4.286 -4.507 1.00 0.00 H new ATOM 33 N LEU A 3 0.948 -0.214 -6.575 1.00 0.00 N ATOM 34 CA LEU A 3 1.122 -1.167 -7.667 1.00 0.00 C ATOM 35 C LEU A 3 1.657 -0.473 -8.915 1.00 0.00 C ATOM 36 O LEU A 3 1.023 0.435 -9.452 1.00 0.00 O ATOM 37 CB LEU A 3 -0.206 -1.858 -7.983 1.00 0.00 C ATOM 38 CG LEU A 3 -0.252 -3.366 -7.736 1.00 0.00 C ATOM 39 CD1 LEU A 3 0.753 -4.084 -8.623 1.00 0.00 C ATOM 40 CD2 LEU A 3 0.011 -3.675 -6.269 1.00 0.00 C ATOM 0 H LEU A 3 0.174 0.438 -6.703 1.00 0.00 H new ATOM 0 HA LEU A 3 1.848 -1.916 -7.351 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -0.988 -1.388 -7.387 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -0.449 -1.674 -9.030 1.00 0.00 H new ATOM 0 HG LEU A 3 -1.250 -3.725 -7.989 1.00 0.00 H new ATOM 0 HD11 LEU A 3 0.705 -5.156 -8.433 1.00 0.00 H new ATOM 0 HD12 LEU A 3 0.518 -3.890 -9.670 1.00 0.00 H new ATOM 0 HD13 LEU A 3 1.757 -3.721 -8.403 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -0.026 -4.753 -6.112 1.00 0.00 H new ATOM 0 HD22 LEU A 3 0.996 -3.301 -5.989 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -0.749 -3.193 -5.654 1.00 0.00 H new ATOM 52 N ALA A 4 2.826 -0.908 -9.373 1.00 0.00 N ATOM 53 CA ALA A 4 3.444 -0.331 -10.560 1.00 0.00 C ATOM 54 C ALA A 4 3.788 -1.412 -11.580 1.00 0.00 C ATOM 55 O ALA A 4 4.568 -2.321 -11.297 1.00 0.00 O ATOM 56 CB ALA A 4 4.691 0.453 -10.179 1.00 0.00 C ATOM 0 H ALA A 4 3.364 -1.658 -8.940 1.00 0.00 H new ATOM 0 HA ALA A 4 2.726 0.350 -11.018 1.00 0.00 H new ATOM 0 HB1 ALA A 4 5.142 0.878 -11.076 1.00 0.00 H new ATOM 0 HB2 ALA A 4 4.421 1.256 -9.493 1.00 0.00 H new ATOM 0 HB3 ALA A 4 5.405 -0.213 -9.695 1.00 0.00 H new ATOM 62 N VAL A 5 3.199 -1.307 -12.767 1.00 0.00 N ATOM 63 CA VAL A 5 3.443 -2.276 -13.830 1.00 0.00 C ATOM 64 C VAL A 5 3.736 -1.578 -15.153 1.00 0.00 C ATOM 65 O VAL A 5 3.167 -0.527 -15.451 1.00 0.00 O ATOM 66 CB VAL A 5 2.241 -3.220 -14.015 1.00 0.00 C ATOM 67 CG1 VAL A 5 2.651 -4.461 -14.794 1.00 0.00 C ATOM 68 CG2 VAL A 5 1.649 -3.600 -12.666 1.00 0.00 C ATOM 0 H VAL A 5 2.550 -0.561 -13.017 1.00 0.00 H new ATOM 0 HA VAL A 5 4.313 -2.862 -13.531 1.00 0.00 H new ATOM 0 HB VAL A 5 1.476 -2.696 -14.588 1.00 0.00 H new ATOM 0 HG11 VAL A 5 1.788 -5.116 -14.915 1.00 0.00 H new ATOM 0 HG12 VAL A 5 3.024 -4.168 -15.775 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.435 -4.989 -14.251 1.00 0.00 H new ATOM 0 HG21 VAL A 5 0.800 -4.268 -12.816 1.00 0.00 H new ATOM 0 HG22 VAL A 5 2.406 -4.105 -12.066 1.00 0.00 H new ATOM 0 HG23 VAL A 5 1.316 -2.700 -12.148 1.00 0.00 H new ATOM 78 N ILE A 6 4.625 -2.169 -15.944 1.00 0.00 N ATOM 79 CA ILE A 6 4.992 -1.604 -17.236 1.00 0.00 C ATOM 80 C ILE A 6 4.956 -2.667 -18.330 1.00 0.00 C ATOM 81 O ILE A 6 5.852 -3.505 -18.425 1.00 0.00 O ATOM 82 CB ILE A 6 6.395 -0.971 -17.197 1.00 0.00 C ATOM 83 CG1 ILE A 6 6.654 -0.336 -15.829 1.00 0.00 C ATOM 84 CG2 ILE A 6 6.541 0.063 -18.303 1.00 0.00 C ATOM 85 CD1 ILE A 6 7.316 -1.273 -14.843 1.00 0.00 C ATOM 0 H ILE A 6 5.104 -3.039 -15.713 1.00 0.00 H new ATOM 0 HA ILE A 6 4.260 -0.828 -17.461 1.00 0.00 H new ATOM 0 HB ILE A 6 7.135 -1.754 -17.359 1.00 0.00 H new ATOM 0 HG12 ILE A 6 7.283 0.545 -15.960 1.00 0.00 H new ATOM 0 HG13 ILE A 6 5.707 0.008 -15.412 1.00 0.00 H new ATOM 0 HG21 ILE A 6 7.538 0.501 -18.262 1.00 0.00 H new ATOM 0 HG22 ILE A 6 6.395 -0.416 -19.271 1.00 0.00 H new ATOM 0 HG23 ILE A 6 5.795 0.846 -18.170 1.00 0.00 H new ATOM 0 HD11 ILE A 6 7.469 -0.756 -13.896 1.00 0.00 H new ATOM 0 HD12 ILE A 6 6.678 -2.142 -14.683 1.00 0.00 H new ATOM 0 HD13 ILE A 6 8.278 -1.597 -15.239 1.00 0.00 H new ATOM 97 N GLY A 7 3.914 -2.624 -19.155 1.00 0.00 N ATOM 98 CA GLY A 7 3.782 -3.587 -20.233 1.00 0.00 C ATOM 99 C GLY A 7 3.243 -2.963 -21.505 1.00 0.00 C ATOM 100 O GLY A 7 3.743 -1.935 -21.962 1.00 0.00 O ATOM 0 H GLY A 7 3.160 -1.940 -19.096 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.754 -4.036 -20.436 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.119 -4.392 -19.918 1.00 0.00 H new ATOM 104 N LYS A 8 2.221 -3.587 -22.081 1.00 0.00 N ATOM 105 CA LYS A 8 1.613 -3.088 -23.309 1.00 0.00 C ATOM 106 C LYS A 8 0.187 -2.609 -23.055 1.00 0.00 C ATOM 107 O LYS A 8 -0.264 -2.554 -21.911 1.00 0.00 O ATOM 108 CB LYS A 8 1.613 -4.179 -24.382 1.00 0.00 C ATOM 109 CG LYS A 8 0.871 -5.438 -23.969 1.00 0.00 C ATOM 110 CD LYS A 8 0.711 -6.399 -25.136 1.00 0.00 C ATOM 111 CE LYS A 8 2.052 -6.961 -25.582 1.00 0.00 C ATOM 112 NZ LYS A 8 2.320 -6.681 -27.020 1.00 0.00 N ATOM 0 H LYS A 8 1.796 -4.440 -21.717 1.00 0.00 H new ATOM 0 HA LYS A 8 2.204 -2.242 -23.660 1.00 0.00 H new ATOM 0 HB2 LYS A 8 1.161 -3.783 -25.291 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.644 -4.438 -24.625 1.00 0.00 H new ATOM 0 HG2 LYS A 8 1.412 -5.932 -23.161 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -0.111 -5.171 -23.579 1.00 0.00 H new ATOM 0 HD2 LYS A 8 0.050 -7.217 -24.848 1.00 0.00 H new ATOM 0 HD3 LYS A 8 0.235 -5.884 -25.971 1.00 0.00 H new ATOM 0 HE2 LYS A 8 2.847 -6.530 -24.974 1.00 0.00 H new ATOM 0 HE3 LYS A 8 2.069 -8.038 -25.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 3.243 -7.080 -27.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 1.575 -7.114 -27.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 2.329 -5.653 -27.178 1.00 0.00 H new ATOM 126 N SER A 9 -0.517 -2.267 -24.128 1.00 0.00 N ATOM 127 CA SER A 9 -1.892 -1.792 -24.021 1.00 0.00 C ATOM 128 C SER A 9 -2.827 -2.923 -23.607 1.00 0.00 C ATOM 129 O SER A 9 -3.863 -2.690 -22.984 1.00 0.00 O ATOM 130 CB SER A 9 -2.353 -1.195 -25.352 1.00 0.00 C ATOM 131 OG SER A 9 -1.393 -1.418 -26.371 1.00 0.00 O ATOM 0 H SER A 9 -0.159 -2.310 -25.082 1.00 0.00 H new ATOM 0 HA SER A 9 -1.924 -1.019 -23.254 1.00 0.00 H new ATOM 0 HB2 SER A 9 -3.306 -1.638 -25.642 1.00 0.00 H new ATOM 0 HB3 SER A 9 -2.522 -0.125 -25.235 1.00 0.00 H new ATOM 0 HG SER A 9 -1.712 -1.029 -27.212 1.00 0.00 H new ATOM 137 N GLU A 10 -2.453 -4.150 -23.957 1.00 0.00 N ATOM 138 CA GLU A 10 -3.259 -5.318 -23.623 1.00 0.00 C ATOM 139 C GLU A 10 -3.179 -5.625 -22.130 1.00 0.00 C ATOM 140 O GLU A 10 -4.144 -6.098 -21.529 1.00 0.00 O ATOM 141 CB GLU A 10 -2.797 -6.533 -24.430 1.00 0.00 C ATOM 142 CG GLU A 10 -2.815 -6.308 -25.933 1.00 0.00 C ATOM 143 CD GLU A 10 -3.947 -7.048 -26.619 1.00 0.00 C ATOM 144 OE1 GLU A 10 -4.092 -8.265 -26.380 1.00 0.00 O ATOM 145 OE2 GLU A 10 -4.687 -6.409 -27.396 1.00 0.00 O ATOM 0 H GLU A 10 -1.598 -4.360 -24.471 1.00 0.00 H new ATOM 0 HA GLU A 10 -4.296 -5.096 -23.876 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -1.786 -6.799 -24.123 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -3.437 -7.382 -24.191 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -2.907 -5.241 -26.136 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -1.864 -6.632 -26.357 1.00 0.00 H new ATOM 152 N PHE A 11 -2.021 -5.354 -21.538 1.00 0.00 N ATOM 153 CA PHE A 11 -1.812 -5.603 -20.116 1.00 0.00 C ATOM 154 C PHE A 11 -2.570 -4.585 -19.269 1.00 0.00 C ATOM 155 O PHE A 11 -3.348 -4.949 -18.387 1.00 0.00 O ATOM 156 CB PHE A 11 -0.320 -5.553 -19.781 1.00 0.00 C ATOM 157 CG PHE A 11 0.094 -6.550 -18.737 1.00 0.00 C ATOM 158 CD1 PHE A 11 0.082 -7.907 -19.014 1.00 0.00 C ATOM 159 CD2 PHE A 11 0.494 -6.130 -17.479 1.00 0.00 C ATOM 160 CE1 PHE A 11 0.463 -8.828 -18.056 1.00 0.00 C ATOM 161 CE2 PHE A 11 0.876 -7.045 -16.517 1.00 0.00 C ATOM 162 CZ PHE A 11 0.859 -8.396 -16.805 1.00 0.00 C ATOM 0 H PHE A 11 -1.212 -4.962 -22.021 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.195 -6.597 -19.887 1.00 0.00 H new ATOM 0 HB2 PHE A 11 0.254 -5.731 -20.690 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -0.067 -4.551 -19.435 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -0.229 -8.250 -19.990 1.00 0.00 H new ATOM 0 HD2 PHE A 11 0.507 -5.075 -17.248 1.00 0.00 H new ATOM 0 HE1 PHE A 11 0.451 -9.883 -18.285 1.00 0.00 H new ATOM 0 HE2 PHE A 11 1.188 -6.704 -15.541 1.00 0.00 H new ATOM 0 HZ PHE A 11 1.155 -9.113 -16.054 1.00 0.00 H new ATOM 172 N VAL A 12 -2.336 -3.305 -19.543 1.00 0.00 N ATOM 173 CA VAL A 12 -2.996 -2.233 -18.808 1.00 0.00 C ATOM 174 C VAL A 12 -4.504 -2.450 -18.754 1.00 0.00 C ATOM 175 O VAL A 12 -5.131 -2.282 -17.707 1.00 0.00 O ATOM 176 CB VAL A 12 -2.709 -0.858 -19.442 1.00 0.00 C ATOM 177 CG1 VAL A 12 -1.264 -0.451 -19.201 1.00 0.00 C ATOM 178 CG2 VAL A 12 -3.024 -0.882 -20.930 1.00 0.00 C ATOM 0 H VAL A 12 -1.694 -2.986 -20.269 1.00 0.00 H new ATOM 0 HA VAL A 12 -2.593 -2.250 -17.795 1.00 0.00 H new ATOM 0 HB VAL A 12 -3.354 -0.117 -18.969 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -1.079 0.522 -19.656 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -1.077 -0.392 -18.129 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -0.599 -1.191 -19.645 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -2.816 0.097 -21.362 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -2.406 -1.634 -21.421 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -4.076 -1.126 -21.075 1.00 0.00 H new ATOM 188 N THR A 13 -5.083 -2.826 -19.890 1.00 0.00 N ATOM 189 CA THR A 13 -6.518 -3.067 -19.974 1.00 0.00 C ATOM 190 C THR A 13 -6.984 -4.003 -18.865 1.00 0.00 C ATOM 191 O THR A 13 -8.123 -3.920 -18.406 1.00 0.00 O ATOM 192 CB THR A 13 -6.909 -3.669 -21.337 1.00 0.00 C ATOM 193 OG1 THR A 13 -8.143 -3.100 -21.788 1.00 0.00 O ATOM 194 CG2 THR A 13 -7.048 -5.181 -21.240 1.00 0.00 C ATOM 0 H THR A 13 -4.580 -2.970 -20.765 1.00 0.00 H new ATOM 0 HA THR A 13 -7.008 -2.100 -19.859 1.00 0.00 H new ATOM 0 HB THR A 13 -6.120 -3.437 -22.052 1.00 0.00 H new ATOM 0 HG1 THR A 13 -8.384 -3.487 -22.656 1.00 0.00 H new ATOM 0 HG21 THR A 13 -7.325 -5.584 -22.214 1.00 0.00 H new ATOM 0 HG22 THR A 13 -6.099 -5.614 -20.924 1.00 0.00 H new ATOM 0 HG23 THR A 13 -7.820 -5.429 -20.512 1.00 0.00 H new ATOM 202 N GLY A 14 -6.096 -4.894 -18.436 1.00 0.00 N ATOM 203 CA GLY A 14 -6.435 -5.833 -17.383 1.00 0.00 C ATOM 204 C GLY A 14 -6.703 -5.147 -16.059 1.00 0.00 C ATOM 205 O GLY A 14 -7.685 -5.452 -15.381 1.00 0.00 O ATOM 0 H GLY A 14 -5.147 -4.982 -18.799 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -7.316 -6.403 -17.678 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -5.620 -6.547 -17.261 1.00 0.00 H new ATOM 209 N PHE A 15 -5.828 -4.219 -15.687 1.00 0.00 N ATOM 210 CA PHE A 15 -5.974 -3.489 -14.433 1.00 0.00 C ATOM 211 C PHE A 15 -7.113 -2.478 -14.521 1.00 0.00 C ATOM 212 O PHE A 15 -7.915 -2.348 -13.596 1.00 0.00 O ATOM 213 CB PHE A 15 -4.668 -2.774 -14.080 1.00 0.00 C ATOM 214 CG PHE A 15 -4.672 -1.312 -14.427 1.00 0.00 C ATOM 215 CD1 PHE A 15 -5.380 -0.405 -13.655 1.00 0.00 C ATOM 216 CD2 PHE A 15 -3.969 -0.846 -15.527 1.00 0.00 C ATOM 217 CE1 PHE A 15 -5.386 0.940 -13.972 1.00 0.00 C ATOM 218 CE2 PHE A 15 -3.971 0.498 -15.848 1.00 0.00 C ATOM 219 CZ PHE A 15 -4.681 1.392 -15.070 1.00 0.00 C ATOM 0 H PHE A 15 -5.010 -3.954 -16.236 1.00 0.00 H new ATOM 0 HA PHE A 15 -6.210 -4.208 -13.648 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -4.479 -2.885 -13.012 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -3.844 -3.261 -14.602 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -5.934 -0.753 -12.796 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -3.414 -1.541 -16.140 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -5.941 1.637 -13.362 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -3.418 0.849 -16.707 1.00 0.00 H new ATOM 0 HZ PHE A 15 -4.685 2.443 -15.320 1.00 0.00 H new ATOM 229 N ARG A 16 -7.177 -1.764 -15.640 1.00 0.00 N ATOM 230 CA ARG A 16 -8.216 -0.763 -15.849 1.00 0.00 C ATOM 231 C ARG A 16 -9.571 -1.278 -15.374 1.00 0.00 C ATOM 232 O ARG A 16 -10.420 -0.505 -14.928 1.00 0.00 O ATOM 233 CB ARG A 16 -8.295 -0.380 -17.328 1.00 0.00 C ATOM 234 CG ARG A 16 -8.423 1.116 -17.564 1.00 0.00 C ATOM 235 CD ARG A 16 -9.104 1.415 -18.890 1.00 0.00 C ATOM 236 NE ARG A 16 -9.086 2.841 -19.206 1.00 0.00 N ATOM 237 CZ ARG A 16 -9.812 3.388 -20.175 1.00 0.00 C ATOM 238 NH1 ARG A 16 -10.608 2.633 -20.918 1.00 0.00 N ATOM 239 NH2 ARG A 16 -9.741 4.694 -20.401 1.00 0.00 N ATOM 0 H ARG A 16 -6.522 -1.860 -16.416 1.00 0.00 H new ATOM 0 HA ARG A 16 -7.957 0.120 -15.265 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -7.403 -0.744 -17.837 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -9.149 -0.885 -17.780 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -8.993 1.566 -16.751 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -7.434 1.573 -17.551 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -8.606 0.861 -19.686 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -10.136 1.065 -18.855 1.00 0.00 H new ATOM 0 HE ARG A 16 -8.483 3.450 -18.653 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -10.665 1.629 -20.747 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -11.164 3.056 -21.661 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -9.129 5.278 -19.831 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -10.298 5.114 -21.145 1.00 0.00 H new ATOM 253 N LEU A 17 -9.767 -2.589 -15.472 1.00 0.00 N ATOM 254 CA LEU A 17 -11.020 -3.208 -15.052 1.00 0.00 C ATOM 255 C LEU A 17 -11.279 -2.963 -13.569 1.00 0.00 C ATOM 256 O LEU A 17 -12.361 -2.524 -13.182 1.00 0.00 O ATOM 257 CB LEU A 17 -10.987 -4.711 -15.334 1.00 0.00 C ATOM 258 CG LEU A 17 -12.113 -5.254 -16.215 1.00 0.00 C ATOM 259 CD1 LEU A 17 -11.547 -5.866 -17.487 1.00 0.00 C ATOM 260 CD2 LEU A 17 -12.942 -6.276 -15.452 1.00 0.00 C ATOM 0 H LEU A 17 -9.075 -3.243 -15.838 1.00 0.00 H new ATOM 0 HA LEU A 17 -11.830 -2.754 -15.623 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -10.035 -4.951 -15.807 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -11.011 -5.240 -14.381 1.00 0.00 H new ATOM 0 HG LEU A 17 -12.763 -4.424 -16.493 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -12.363 -6.247 -18.102 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -10.998 -5.106 -18.043 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -10.874 -6.684 -17.229 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -13.738 -6.651 -16.095 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -12.304 -7.104 -15.143 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -13.378 -5.806 -14.571 1.00 0.00 H new ATOM 272 N ALA A 18 -10.276 -3.246 -12.744 1.00 0.00 N ATOM 273 CA ALA A 18 -10.394 -3.052 -11.304 1.00 0.00 C ATOM 274 C ALA A 18 -9.971 -1.643 -10.904 1.00 0.00 C ATOM 275 O ALA A 18 -10.344 -1.151 -9.840 1.00 0.00 O ATOM 276 CB ALA A 18 -9.561 -4.087 -10.562 1.00 0.00 C ATOM 0 H ALA A 18 -9.373 -3.610 -13.048 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.441 -3.180 -11.029 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -9.658 -3.930 -9.488 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -9.912 -5.087 -10.816 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -8.515 -3.986 -10.850 1.00 0.00 H new ATOM 282 N GLY A 19 -9.188 -0.998 -11.763 1.00 0.00 N ATOM 283 CA GLY A 19 -8.726 0.348 -11.480 1.00 0.00 C ATOM 284 C GLY A 19 -7.779 0.399 -10.298 1.00 0.00 C ATOM 285 O GLY A 19 -7.420 1.480 -9.829 1.00 0.00 O ATOM 0 H GLY A 19 -8.865 -1.384 -12.650 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -8.225 0.750 -12.361 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -9.585 0.989 -11.282 1.00 0.00 H new ATOM 289 N ILE A 20 -7.375 -0.770 -9.814 1.00 0.00 N ATOM 290 CA ILE A 20 -6.464 -0.854 -8.679 1.00 0.00 C ATOM 291 C ILE A 20 -5.110 -1.414 -9.100 1.00 0.00 C ATOM 292 O ILE A 20 -4.754 -2.537 -8.744 1.00 0.00 O ATOM 293 CB ILE A 20 -7.044 -1.733 -7.556 1.00 0.00 C ATOM 294 CG1 ILE A 20 -8.508 -1.368 -7.297 1.00 0.00 C ATOM 295 CG2 ILE A 20 -6.222 -1.580 -6.285 1.00 0.00 C ATOM 296 CD1 ILE A 20 -9.043 -1.910 -5.990 1.00 0.00 C ATOM 0 H ILE A 20 -7.664 -1.673 -10.190 1.00 0.00 H new ATOM 0 HA ILE A 20 -6.333 0.161 -8.304 1.00 0.00 H new ATOM 0 HB ILE A 20 -6.999 -2.775 -7.871 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -8.610 -0.283 -7.300 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -9.119 -1.748 -8.116 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -6.645 -2.208 -5.501 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -5.193 -1.884 -6.478 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -6.238 -0.538 -5.964 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -10.085 -1.613 -5.872 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -8.974 -2.998 -5.992 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -8.456 -1.510 -5.163 1.00 0.00 H new ATOM 308 N SER A 21 -4.358 -0.623 -9.859 1.00 0.00 N ATOM 309 CA SER A 21 -3.043 -1.041 -10.331 1.00 0.00 C ATOM 310 C SER A 21 -2.519 -0.083 -11.396 1.00 0.00 C ATOM 311 O SER A 21 -3.077 0.016 -12.489 1.00 0.00 O ATOM 312 CB SER A 21 -3.108 -2.462 -10.894 1.00 0.00 C ATOM 313 OG SER A 21 -2.518 -3.392 -10.002 1.00 0.00 O ATOM 0 H SER A 21 -4.637 0.311 -10.160 1.00 0.00 H new ATOM 0 HA SER A 21 -2.358 -1.025 -9.484 1.00 0.00 H new ATOM 0 HB2 SER A 21 -4.147 -2.737 -11.076 1.00 0.00 H new ATOM 0 HB3 SER A 21 -2.595 -2.499 -11.855 1.00 0.00 H new ATOM 0 HG SER A 21 -3.069 -3.465 -9.195 1.00 0.00 H new ATOM 319 N LYS A 22 -1.441 0.622 -11.069 1.00 0.00 N ATOM 320 CA LYS A 22 -0.838 1.572 -11.996 1.00 0.00 C ATOM 321 C LYS A 22 0.002 0.850 -13.045 1.00 0.00 C ATOM 322 O LYS A 22 1.168 0.532 -12.811 1.00 0.00 O ATOM 323 CB LYS A 22 0.031 2.577 -11.236 1.00 0.00 C ATOM 324 CG LYS A 22 -0.596 3.064 -9.941 1.00 0.00 C ATOM 325 CD LYS A 22 -1.914 3.776 -10.193 1.00 0.00 C ATOM 326 CE LYS A 22 -1.862 5.226 -9.737 1.00 0.00 C ATOM 327 NZ LYS A 22 -0.938 6.038 -10.576 1.00 0.00 N ATOM 0 H LYS A 22 -0.967 0.553 -10.168 1.00 0.00 H new ATOM 0 HA LYS A 22 -1.642 2.106 -12.503 1.00 0.00 H new ATOM 0 HB2 LYS A 22 0.994 2.117 -11.014 1.00 0.00 H new ATOM 0 HB3 LYS A 22 0.228 3.434 -11.880 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -0.760 2.217 -9.274 1.00 0.00 H new ATOM 0 HG3 LYS A 22 0.093 3.740 -9.434 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -2.152 3.736 -11.256 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -2.715 3.257 -9.667 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -2.863 5.656 -9.778 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -1.540 5.268 -8.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -0.930 7.020 -10.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 0.022 5.643 -10.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -1.260 6.019 -11.565 1.00 0.00 H new ATOM 341 N VAL A 23 -0.598 0.596 -14.204 1.00 0.00 N ATOM 342 CA VAL A 23 0.096 -0.086 -15.290 1.00 0.00 C ATOM 343 C VAL A 23 0.332 0.854 -16.467 1.00 0.00 C ATOM 344 O VAL A 23 -0.513 1.692 -16.785 1.00 0.00 O ATOM 345 CB VAL A 23 -0.696 -1.314 -15.779 1.00 0.00 C ATOM 346 CG1 VAL A 23 0.163 -2.174 -16.693 1.00 0.00 C ATOM 347 CG2 VAL A 23 -1.206 -2.123 -14.596 1.00 0.00 C ATOM 0 H VAL A 23 -1.563 0.852 -14.415 1.00 0.00 H new ATOM 0 HA VAL A 23 1.056 -0.416 -14.894 1.00 0.00 H new ATOM 0 HB VAL A 23 -1.556 -0.966 -16.351 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -0.413 -3.036 -17.028 1.00 0.00 H new ATOM 0 HG12 VAL A 23 0.475 -1.588 -17.557 1.00 0.00 H new ATOM 0 HG13 VAL A 23 1.044 -2.515 -16.149 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -1.763 -2.987 -14.959 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -0.362 -2.462 -13.996 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -1.859 -1.501 -13.984 1.00 0.00 H new ATOM 357 N TYR A 24 1.484 0.709 -17.111 1.00 0.00 N ATOM 358 CA TYR A 24 1.833 1.546 -18.253 1.00 0.00 C ATOM 359 C TYR A 24 1.832 0.735 -19.544 1.00 0.00 C ATOM 360 O TYR A 24 1.707 -0.489 -19.521 1.00 0.00 O ATOM 361 CB TYR A 24 3.206 2.187 -18.041 1.00 0.00 C ATOM 362 CG TYR A 24 3.273 3.089 -16.830 1.00 0.00 C ATOM 363 CD1 TYR A 24 2.239 3.970 -16.536 1.00 0.00 C ATOM 364 CD2 TYR A 24 4.370 3.060 -15.978 1.00 0.00 C ATOM 365 CE1 TYR A 24 2.296 4.796 -15.431 1.00 0.00 C ATOM 366 CE2 TYR A 24 4.435 3.882 -14.869 1.00 0.00 C ATOM 367 CZ TYR A 24 3.396 4.749 -14.600 1.00 0.00 C ATOM 368 OH TYR A 24 3.457 5.569 -13.497 1.00 0.00 O ATOM 0 H TYR A 24 2.193 0.019 -16.862 1.00 0.00 H new ATOM 0 HA TYR A 24 1.082 2.331 -18.339 1.00 0.00 H new ATOM 0 HB2 TYR A 24 3.953 1.400 -17.939 1.00 0.00 H new ATOM 0 HB3 TYR A 24 3.469 2.763 -18.928 1.00 0.00 H new ATOM 0 HD1 TYR A 24 1.375 4.009 -17.183 1.00 0.00 H new ATOM 0 HD2 TYR A 24 5.186 2.384 -16.186 1.00 0.00 H new ATOM 0 HE1 TYR A 24 1.484 5.475 -15.218 1.00 0.00 H new ATOM 0 HE2 TYR A 24 5.295 3.846 -14.216 1.00 0.00 H new ATOM 0 HH TYR A 24 4.162 5.254 -12.894 1.00 0.00 H new ATOM 378 N GLU A 25 1.972 1.427 -20.671 1.00 0.00 N ATOM 379 CA GLU A 25 1.987 0.771 -21.973 1.00 0.00 C ATOM 380 C GLU A 25 3.094 1.339 -22.856 1.00 0.00 C ATOM 381 O GLU A 25 2.996 2.464 -23.348 1.00 0.00 O ATOM 382 CB GLU A 25 0.632 0.934 -22.666 1.00 0.00 C ATOM 383 CG GLU A 25 0.674 0.650 -24.158 1.00 0.00 C ATOM 384 CD GLU A 25 0.806 1.912 -24.989 1.00 0.00 C ATOM 385 OE1 GLU A 25 0.706 3.015 -24.413 1.00 0.00 O ATOM 386 OE2 GLU A 25 1.009 1.795 -26.216 1.00 0.00 O ATOM 0 H GLU A 25 2.077 2.441 -20.708 1.00 0.00 H new ATOM 0 HA GLU A 25 2.181 -0.290 -21.815 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -0.089 0.265 -22.197 1.00 0.00 H new ATOM 0 HB3 GLU A 25 0.272 1.951 -22.508 1.00 0.00 H new ATOM 0 HG2 GLU A 25 1.512 -0.012 -24.374 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -0.234 0.121 -24.449 1.00 0.00 H new ATOM 393 N THR A 26 4.148 0.553 -23.052 1.00 0.00 N ATOM 394 CA THR A 26 5.275 0.977 -23.873 1.00 0.00 C ATOM 395 C THR A 26 5.618 -0.075 -24.921 1.00 0.00 C ATOM 396 O THR A 26 6.541 -0.874 -24.755 1.00 0.00 O ATOM 397 CB THR A 26 6.523 1.256 -23.014 1.00 0.00 C ATOM 398 OG1 THR A 26 6.953 0.052 -22.370 1.00 0.00 O ATOM 399 CG2 THR A 26 6.232 2.321 -21.968 1.00 0.00 C ATOM 0 H THR A 26 4.244 -0.381 -22.653 1.00 0.00 H new ATOM 0 HA THR A 26 4.974 1.898 -24.372 1.00 0.00 H new ATOM 0 HB THR A 26 7.315 1.620 -23.669 1.00 0.00 H new ATOM 0 HG1 THR A 26 7.038 -0.662 -23.035 1.00 0.00 H new ATOM 0 HG21 THR A 26 7.128 2.501 -21.373 1.00 0.00 H new ATOM 0 HG22 THR A 26 5.933 3.245 -22.463 1.00 0.00 H new ATOM 0 HG23 THR A 26 5.427 1.981 -21.317 1.00 0.00 H new ATOM 407 N PRO A 27 4.861 -0.079 -26.028 1.00 0.00 N ATOM 408 CA PRO A 27 5.067 -1.028 -27.126 1.00 0.00 C ATOM 409 C PRO A 27 6.358 -0.757 -27.892 1.00 0.00 C ATOM 410 O PRO A 27 7.019 -1.683 -28.360 1.00 0.00 O ATOM 411 CB PRO A 27 3.852 -0.798 -28.027 1.00 0.00 C ATOM 412 CG PRO A 27 3.430 0.602 -27.744 1.00 0.00 C ATOM 413 CD PRO A 27 3.744 0.844 -26.293 1.00 0.00 C ATOM 0 HA PRO A 27 5.160 -2.053 -26.767 1.00 0.00 H new ATOM 0 HB2 PRO A 27 4.108 -0.929 -29.078 1.00 0.00 H new ATOM 0 HB3 PRO A 27 3.053 -1.505 -27.803 1.00 0.00 H new ATOM 0 HG2 PRO A 27 3.964 1.307 -28.382 1.00 0.00 H new ATOM 0 HG3 PRO A 27 2.366 0.736 -27.941 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.027 1.881 -26.110 1.00 0.00 H new ATOM 0 HD3 PRO A 27 2.886 0.631 -25.655 1.00 0.00 H new ATOM 421 N ASP A 28 6.710 0.518 -28.014 1.00 0.00 N ATOM 422 CA ASP A 28 7.923 0.911 -28.722 1.00 0.00 C ATOM 423 C ASP A 28 9.080 1.113 -27.748 1.00 0.00 C ATOM 424 O ASP A 28 8.869 1.422 -26.575 1.00 0.00 O ATOM 425 CB ASP A 28 7.681 2.194 -29.519 1.00 0.00 C ATOM 426 CG ASP A 28 6.287 2.253 -30.113 1.00 0.00 C ATOM 427 OD1 ASP A 28 5.899 1.293 -30.811 1.00 0.00 O ATOM 428 OD2 ASP A 28 5.584 3.259 -29.880 1.00 0.00 O ATOM 0 H ASP A 28 6.173 1.297 -27.632 1.00 0.00 H new ATOM 0 HA ASP A 28 8.188 0.109 -29.411 1.00 0.00 H new ATOM 0 HB2 ASP A 28 7.833 3.056 -28.869 1.00 0.00 H new ATOM 0 HB3 ASP A 28 8.417 2.265 -30.320 1.00 0.00 H new ATOM 433 N ILE A 29 10.300 0.936 -28.243 1.00 0.00 N ATOM 434 CA ILE A 29 11.490 1.099 -27.416 1.00 0.00 C ATOM 435 C ILE A 29 11.692 2.559 -27.026 1.00 0.00 C ATOM 436 O ILE A 29 12.023 2.883 -25.885 1.00 0.00 O ATOM 437 CB ILE A 29 12.752 0.593 -28.139 1.00 0.00 C ATOM 438 CG1 ILE A 29 13.808 1.698 -28.202 1.00 0.00 C ATOM 439 CG2 ILE A 29 12.402 0.107 -29.537 1.00 0.00 C ATOM 440 CD1 ILE A 29 15.130 1.238 -28.775 1.00 0.00 C ATOM 0 H ILE A 29 10.491 0.680 -29.212 1.00 0.00 H new ATOM 0 HA ILE A 29 11.333 0.503 -26.517 1.00 0.00 H new ATOM 0 HB ILE A 29 13.164 -0.245 -27.577 1.00 0.00 H new ATOM 0 HG12 ILE A 29 13.426 2.521 -28.806 1.00 0.00 H new ATOM 0 HG13 ILE A 29 13.973 2.090 -27.198 1.00 0.00 H new ATOM 0 HG21 ILE A 29 13.304 -0.247 -30.035 1.00 0.00 H new ATOM 0 HG22 ILE A 29 11.681 -0.708 -29.469 1.00 0.00 H new ATOM 0 HG23 ILE A 29 11.970 0.927 -30.110 1.00 0.00 H new ATOM 0 HD11 ILE A 29 15.831 2.073 -28.789 1.00 0.00 H new ATOM 0 HD12 ILE A 29 15.534 0.436 -28.158 1.00 0.00 H new ATOM 0 HD13 ILE A 29 14.979 0.873 -29.791 1.00 0.00 H new ATOM 452 N PRO A 30 11.488 3.464 -27.995 1.00 0.00 N ATOM 453 CA PRO A 30 11.640 4.906 -27.776 1.00 0.00 C ATOM 454 C PRO A 30 10.546 5.475 -26.879 1.00 0.00 C ATOM 455 O PRO A 30 10.802 6.346 -26.048 1.00 0.00 O ATOM 456 CB PRO A 30 11.533 5.492 -29.186 1.00 0.00 C ATOM 457 CG PRO A 30 10.735 4.493 -29.952 1.00 0.00 C ATOM 458 CD PRO A 30 11.092 3.150 -29.378 1.00 0.00 C ATOM 0 HA PRO A 30 12.575 5.145 -27.270 1.00 0.00 H new ATOM 0 HB2 PRO A 30 11.042 6.465 -29.174 1.00 0.00 H new ATOM 0 HB3 PRO A 30 12.518 5.637 -29.630 1.00 0.00 H new ATOM 0 HG2 PRO A 30 9.667 4.688 -29.853 1.00 0.00 H new ATOM 0 HG3 PRO A 30 10.970 4.538 -31.015 1.00 0.00 H new ATOM 0 HD2 PRO A 30 10.246 2.463 -29.408 1.00 0.00 H new ATOM 0 HD3 PRO A 30 11.905 2.680 -29.932 1.00 0.00 H new ATOM 466 N ALA A 31 9.326 4.976 -27.052 1.00 0.00 N ATOM 467 CA ALA A 31 8.194 5.433 -26.256 1.00 0.00 C ATOM 468 C ALA A 31 8.369 5.061 -24.787 1.00 0.00 C ATOM 469 O ALA A 31 7.769 5.674 -23.904 1.00 0.00 O ATOM 470 CB ALA A 31 6.897 4.849 -26.799 1.00 0.00 C ATOM 0 H ALA A 31 9.097 4.255 -27.736 1.00 0.00 H new ATOM 0 HA ALA A 31 8.148 6.520 -26.325 1.00 0.00 H new ATOM 0 HB1 ALA A 31 6.060 5.199 -26.195 1.00 0.00 H new ATOM 0 HB2 ALA A 31 6.758 5.169 -27.832 1.00 0.00 H new ATOM 0 HB3 ALA A 31 6.943 3.761 -26.760 1.00 0.00 H new ATOM 476 N THR A 32 9.196 4.052 -24.532 1.00 0.00 N ATOM 477 CA THR A 32 9.450 3.597 -23.171 1.00 0.00 C ATOM 478 C THR A 32 10.015 4.723 -22.311 1.00 0.00 C ATOM 479 O THR A 32 9.749 4.793 -21.112 1.00 0.00 O ATOM 480 CB THR A 32 10.429 2.408 -23.148 1.00 0.00 C ATOM 481 OG1 THR A 32 9.915 1.336 -23.946 1.00 0.00 O ATOM 482 CG2 THR A 32 10.659 1.924 -21.725 1.00 0.00 C ATOM 0 H THR A 32 9.702 3.534 -25.251 1.00 0.00 H new ATOM 0 HA THR A 32 8.492 3.276 -22.762 1.00 0.00 H new ATOM 0 HB THR A 32 11.382 2.741 -23.559 1.00 0.00 H new ATOM 0 HG1 THR A 32 9.759 1.654 -24.860 1.00 0.00 H new ATOM 0 HG21 THR A 32 11.354 1.084 -21.734 1.00 0.00 H new ATOM 0 HG22 THR A 32 11.077 2.734 -21.128 1.00 0.00 H new ATOM 0 HG23 THR A 32 9.711 1.606 -21.291 1.00 0.00 H new ATOM 490 N GLU A 33 10.795 5.601 -22.933 1.00 0.00 N ATOM 491 CA GLU A 33 11.397 6.723 -22.223 1.00 0.00 C ATOM 492 C GLU A 33 10.328 7.575 -21.545 1.00 0.00 C ATOM 493 O GLU A 33 10.563 8.159 -20.487 1.00 0.00 O ATOM 494 CB GLU A 33 12.216 7.585 -23.187 1.00 0.00 C ATOM 495 CG GLU A 33 11.366 8.435 -24.116 1.00 0.00 C ATOM 496 CD GLU A 33 10.976 9.763 -23.497 1.00 0.00 C ATOM 497 OE1 GLU A 33 11.843 10.398 -22.860 1.00 0.00 O ATOM 498 OE2 GLU A 33 9.804 10.168 -23.649 1.00 0.00 O ATOM 0 H GLU A 33 11.025 5.557 -23.926 1.00 0.00 H new ATOM 0 HA GLU A 33 12.058 6.321 -21.455 1.00 0.00 H new ATOM 0 HB2 GLU A 33 12.872 8.237 -22.610 1.00 0.00 H new ATOM 0 HB3 GLU A 33 12.857 6.937 -23.785 1.00 0.00 H new ATOM 0 HG2 GLU A 33 11.915 8.616 -25.040 1.00 0.00 H new ATOM 0 HG3 GLU A 33 10.464 7.884 -24.383 1.00 0.00 H new ATOM 505 N SER A 34 9.153 7.641 -22.162 1.00 0.00 N ATOM 506 CA SER A 34 8.048 8.425 -21.622 1.00 0.00 C ATOM 507 C SER A 34 7.570 7.845 -20.294 1.00 0.00 C ATOM 508 O SER A 34 7.424 8.565 -19.307 1.00 0.00 O ATOM 509 CB SER A 34 6.890 8.468 -22.620 1.00 0.00 C ATOM 510 OG SER A 34 5.960 9.482 -22.278 1.00 0.00 O ATOM 0 H SER A 34 8.941 7.161 -23.037 1.00 0.00 H new ATOM 0 HA SER A 34 8.405 9.440 -21.448 1.00 0.00 H new ATOM 0 HB2 SER A 34 7.277 8.648 -23.623 1.00 0.00 H new ATOM 0 HB3 SER A 34 6.387 7.501 -22.641 1.00 0.00 H new ATOM 0 HG SER A 34 5.230 9.490 -22.932 1.00 0.00 H new ATOM 516 N ALA A 35 7.327 6.539 -20.280 1.00 0.00 N ATOM 517 CA ALA A 35 6.867 5.861 -19.074 1.00 0.00 C ATOM 518 C ALA A 35 7.950 5.854 -18.000 1.00 0.00 C ATOM 519 O ALA A 35 7.654 5.793 -16.807 1.00 0.00 O ATOM 520 CB ALA A 35 6.436 4.438 -19.400 1.00 0.00 C ATOM 0 H ALA A 35 7.441 5.929 -21.090 1.00 0.00 H new ATOM 0 HA ALA A 35 6.009 6.409 -18.684 1.00 0.00 H new ATOM 0 HB1 ALA A 35 6.095 3.944 -18.490 1.00 0.00 H new ATOM 0 HB2 ALA A 35 5.624 4.461 -20.127 1.00 0.00 H new ATOM 0 HB3 ALA A 35 7.280 3.889 -19.817 1.00 0.00 H new ATOM 526 N VAL A 36 9.205 5.917 -18.432 1.00 0.00 N ATOM 527 CA VAL A 36 10.333 5.919 -17.508 1.00 0.00 C ATOM 528 C VAL A 36 10.250 7.096 -16.542 1.00 0.00 C ATOM 529 O VAL A 36 10.708 7.011 -15.402 1.00 0.00 O ATOM 530 CB VAL A 36 11.675 5.980 -18.260 1.00 0.00 C ATOM 531 CG1 VAL A 36 12.813 6.290 -17.298 1.00 0.00 C ATOM 532 CG2 VAL A 36 11.932 4.675 -18.998 1.00 0.00 C ATOM 0 H VAL A 36 9.467 5.967 -19.417 1.00 0.00 H new ATOM 0 HA VAL A 36 10.283 4.987 -16.946 1.00 0.00 H new ATOM 0 HB VAL A 36 11.623 6.783 -18.995 1.00 0.00 H new ATOM 0 HG11 VAL A 36 13.754 6.329 -17.848 1.00 0.00 H new ATOM 0 HG12 VAL A 36 12.632 7.252 -16.819 1.00 0.00 H new ATOM 0 HG13 VAL A 36 12.869 5.511 -16.538 1.00 0.00 H new ATOM 0 HG21 VAL A 36 12.885 4.736 -19.524 1.00 0.00 H new ATOM 0 HG22 VAL A 36 11.964 3.853 -18.283 1.00 0.00 H new ATOM 0 HG23 VAL A 36 11.131 4.500 -19.717 1.00 0.00 H new ATOM 542 N ARG A 37 9.662 8.194 -17.006 1.00 0.00 N ATOM 543 CA ARG A 37 9.519 9.389 -16.183 1.00 0.00 C ATOM 544 C ARG A 37 8.844 9.058 -14.855 1.00 0.00 C ATOM 545 O ARG A 37 9.189 9.618 -13.815 1.00 0.00 O ATOM 546 CB ARG A 37 8.709 10.453 -16.928 1.00 0.00 C ATOM 547 CG ARG A 37 7.209 10.208 -16.897 1.00 0.00 C ATOM 548 CD ARG A 37 6.480 11.098 -17.892 1.00 0.00 C ATOM 549 NE ARG A 37 7.059 12.437 -17.957 1.00 0.00 N ATOM 550 CZ ARG A 37 6.970 13.324 -16.973 1.00 0.00 C ATOM 551 NH1 ARG A 37 6.328 13.016 -15.854 1.00 0.00 N ATOM 552 NH2 ARG A 37 7.523 14.523 -17.106 1.00 0.00 N ATOM 0 H ARG A 37 9.277 8.281 -17.947 1.00 0.00 H new ATOM 0 HA ARG A 37 10.516 9.779 -15.977 1.00 0.00 H new ATOM 0 HB2 ARG A 37 8.918 11.429 -16.491 1.00 0.00 H new ATOM 0 HB3 ARG A 37 9.041 10.490 -17.965 1.00 0.00 H new ATOM 0 HG2 ARG A 37 7.005 9.162 -17.125 1.00 0.00 H new ATOM 0 HG3 ARG A 37 6.829 10.395 -15.893 1.00 0.00 H new ATOM 0 HD2 ARG A 37 6.514 10.640 -18.881 1.00 0.00 H new ATOM 0 HD3 ARG A 37 5.429 11.171 -17.611 1.00 0.00 H new ATOM 0 HE ARG A 37 7.559 12.706 -18.804 1.00 0.00 H new ATOM 0 HH11 ARG A 37 5.901 12.096 -15.748 1.00 0.00 H new ATOM 0 HH12 ARG A 37 6.261 13.699 -15.100 1.00 0.00 H new ATOM 0 HH21 ARG A 37 8.017 14.764 -17.965 1.00 0.00 H new ATOM 0 HH22 ARG A 37 7.454 15.203 -16.349 1.00 0.00 H new ATOM 566 N SER A 38 7.879 8.145 -14.899 1.00 0.00 N ATOM 567 CA SER A 38 7.152 7.742 -13.701 1.00 0.00 C ATOM 568 C SER A 38 7.854 6.580 -13.005 1.00 0.00 C ATOM 569 O SER A 38 7.895 6.510 -11.776 1.00 0.00 O ATOM 570 CB SER A 38 5.718 7.347 -14.057 1.00 0.00 C ATOM 571 OG SER A 38 5.182 8.209 -15.046 1.00 0.00 O ATOM 0 H SER A 38 7.582 7.670 -15.752 1.00 0.00 H new ATOM 0 HA SER A 38 7.128 8.591 -13.018 1.00 0.00 H new ATOM 0 HB2 SER A 38 5.700 6.319 -14.418 1.00 0.00 H new ATOM 0 HB3 SER A 38 5.095 7.382 -13.163 1.00 0.00 H new ATOM 0 HG SER A 38 4.265 7.934 -15.257 1.00 0.00 H new ATOM 577 N VAL A 39 8.406 5.668 -13.800 1.00 0.00 N ATOM 578 CA VAL A 39 9.108 4.509 -13.262 1.00 0.00 C ATOM 579 C VAL A 39 10.302 4.934 -12.414 1.00 0.00 C ATOM 580 O VAL A 39 10.536 4.390 -11.334 1.00 0.00 O ATOM 581 CB VAL A 39 9.596 3.577 -14.386 1.00 0.00 C ATOM 582 CG1 VAL A 39 10.387 2.413 -13.809 1.00 0.00 C ATOM 583 CG2 VAL A 39 8.420 3.076 -15.211 1.00 0.00 C ATOM 0 H VAL A 39 8.380 5.710 -14.819 1.00 0.00 H new ATOM 0 HA VAL A 39 8.396 3.970 -12.637 1.00 0.00 H new ATOM 0 HB VAL A 39 10.256 4.144 -15.043 1.00 0.00 H new ATOM 0 HG11 VAL A 39 10.724 1.765 -14.618 1.00 0.00 H new ATOM 0 HG12 VAL A 39 11.252 2.794 -13.266 1.00 0.00 H new ATOM 0 HG13 VAL A 39 9.753 1.844 -13.129 1.00 0.00 H new ATOM 0 HG21 VAL A 39 8.783 2.419 -16.001 1.00 0.00 H new ATOM 0 HG22 VAL A 39 7.733 2.526 -14.568 1.00 0.00 H new ATOM 0 HG23 VAL A 39 7.900 3.924 -15.656 1.00 0.00 H new ATOM 593 N LEU A 40 11.055 5.909 -12.910 1.00 0.00 N ATOM 594 CA LEU A 40 12.226 6.409 -12.199 1.00 0.00 C ATOM 595 C LEU A 40 11.891 6.708 -10.741 1.00 0.00 C ATOM 596 O LEU A 40 12.741 6.578 -9.860 1.00 0.00 O ATOM 597 CB LEU A 40 12.762 7.670 -12.880 1.00 0.00 C ATOM 598 CG LEU A 40 11.923 8.936 -12.703 1.00 0.00 C ATOM 599 CD1 LEU A 40 12.322 9.666 -11.430 1.00 0.00 C ATOM 600 CD2 LEU A 40 12.073 9.848 -13.912 1.00 0.00 C ATOM 0 H LEU A 40 10.875 6.369 -13.802 1.00 0.00 H new ATOM 0 HA LEU A 40 12.994 5.636 -12.225 1.00 0.00 H new ATOM 0 HB2 LEU A 40 13.764 7.866 -12.499 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.860 7.469 -13.947 1.00 0.00 H new ATOM 0 HG LEU A 40 10.876 8.647 -12.619 1.00 0.00 H new ATOM 0 HD11 LEU A 40 11.715 10.564 -11.320 1.00 0.00 H new ATOM 0 HD12 LEU A 40 12.163 9.014 -10.571 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.375 9.944 -11.485 1.00 0.00 H new ATOM 0 HD21 LEU A 40 11.469 10.744 -13.769 1.00 0.00 H new ATOM 0 HD22 LEU A 40 13.119 10.130 -14.027 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.738 9.324 -14.807 1.00 0.00 H new ATOM 612 N GLU A 41 10.647 7.107 -10.495 1.00 0.00 N ATOM 613 CA GLU A 41 10.201 7.423 -9.143 1.00 0.00 C ATOM 614 C GLU A 41 9.337 6.299 -8.579 1.00 0.00 C ATOM 615 O GLU A 41 9.136 6.204 -7.368 1.00 0.00 O ATOM 616 CB GLU A 41 9.416 8.737 -9.135 1.00 0.00 C ATOM 617 CG GLU A 41 8.086 8.655 -9.866 1.00 0.00 C ATOM 618 CD GLU A 41 7.193 9.849 -9.587 1.00 0.00 C ATOM 619 OE1 GLU A 41 6.554 9.872 -8.514 1.00 0.00 O ATOM 620 OE2 GLU A 41 7.134 10.759 -10.440 1.00 0.00 O ATOM 0 H GLU A 41 9.931 7.219 -11.213 1.00 0.00 H new ATOM 0 HA GLU A 41 11.084 7.531 -8.513 1.00 0.00 H new ATOM 0 HB2 GLU A 41 9.236 9.037 -8.103 1.00 0.00 H new ATOM 0 HB3 GLU A 41 10.025 9.517 -9.592 1.00 0.00 H new ATOM 0 HG2 GLU A 41 8.269 8.585 -10.938 1.00 0.00 H new ATOM 0 HG3 GLU A 41 7.569 7.742 -9.571 1.00 0.00 H new ATOM 627 N ASP A 42 8.830 5.449 -9.465 1.00 0.00 N ATOM 628 CA ASP A 42 7.988 4.330 -9.057 1.00 0.00 C ATOM 629 C ASP A 42 8.811 3.265 -8.338 1.00 0.00 C ATOM 630 O ASP A 42 8.262 2.339 -7.741 1.00 0.00 O ATOM 631 CB ASP A 42 7.290 3.719 -10.272 1.00 0.00 C ATOM 632 CG ASP A 42 5.857 3.322 -9.978 1.00 0.00 C ATOM 633 OD1 ASP A 42 5.531 3.112 -8.791 1.00 0.00 O ATOM 634 OD2 ASP A 42 5.061 3.222 -10.935 1.00 0.00 O ATOM 0 H ASP A 42 8.987 5.513 -10.471 1.00 0.00 H new ATOM 0 HA ASP A 42 7.233 4.708 -8.367 1.00 0.00 H new ATOM 0 HB2 ASP A 42 7.304 4.435 -11.094 1.00 0.00 H new ATOM 0 HB3 ASP A 42 7.846 2.842 -10.604 1.00 0.00 H new ATOM 639 N LYS A 43 10.131 3.403 -8.400 1.00 0.00 N ATOM 640 CA LYS A 43 11.031 2.454 -7.756 1.00 0.00 C ATOM 641 C LYS A 43 10.963 2.584 -6.238 1.00 0.00 C ATOM 642 O LYS A 43 11.080 1.595 -5.514 1.00 0.00 O ATOM 643 CB LYS A 43 12.467 2.677 -8.234 1.00 0.00 C ATOM 644 CG LYS A 43 12.972 4.091 -8.005 1.00 0.00 C ATOM 645 CD LYS A 43 14.046 4.133 -6.930 1.00 0.00 C ATOM 646 CE LYS A 43 14.754 5.479 -6.902 1.00 0.00 C ATOM 647 NZ LYS A 43 15.704 5.630 -8.039 1.00 0.00 N ATOM 0 H LYS A 43 10.602 4.164 -8.890 1.00 0.00 H new ATOM 0 HA LYS A 43 10.715 1.448 -8.031 1.00 0.00 H new ATOM 0 HB2 LYS A 43 13.125 1.977 -7.719 1.00 0.00 H new ATOM 0 HB3 LYS A 43 12.527 2.447 -9.298 1.00 0.00 H new ATOM 0 HG2 LYS A 43 13.373 4.490 -8.937 1.00 0.00 H new ATOM 0 HG3 LYS A 43 12.140 4.733 -7.715 1.00 0.00 H new ATOM 0 HD2 LYS A 43 13.596 3.937 -5.957 1.00 0.00 H new ATOM 0 HD3 LYS A 43 14.774 3.342 -7.110 1.00 0.00 H new ATOM 0 HE2 LYS A 43 14.015 6.279 -6.938 1.00 0.00 H new ATOM 0 HE3 LYS A 43 15.294 5.586 -5.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 16.275 6.488 -7.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 16.330 4.801 -8.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 15.171 5.707 -8.929 1.00 0.00 H new ATOM 661 N SER A 44 10.772 3.811 -5.761 1.00 0.00 N ATOM 662 CA SER A 44 10.690 4.070 -4.329 1.00 0.00 C ATOM 663 C SER A 44 9.238 4.219 -3.885 1.00 0.00 C ATOM 664 O SER A 44 8.942 4.914 -2.913 1.00 0.00 O ATOM 665 CB SER A 44 11.477 5.333 -3.973 1.00 0.00 C ATOM 666 OG SER A 44 12.855 5.048 -3.811 1.00 0.00 O ATOM 0 H SER A 44 10.671 4.640 -6.346 1.00 0.00 H new ATOM 0 HA SER A 44 11.125 3.219 -3.805 1.00 0.00 H new ATOM 0 HB2 SER A 44 11.347 6.079 -4.757 1.00 0.00 H new ATOM 0 HB3 SER A 44 11.081 5.764 -3.053 1.00 0.00 H new ATOM 0 HG SER A 44 13.335 5.872 -3.586 1.00 0.00 H new ATOM 672 N VAL A 45 8.336 3.561 -4.605 1.00 0.00 N ATOM 673 CA VAL A 45 6.914 3.618 -4.287 1.00 0.00 C ATOM 674 C VAL A 45 6.445 2.324 -3.631 1.00 0.00 C ATOM 675 O VAL A 45 6.224 2.273 -2.422 1.00 0.00 O ATOM 676 CB VAL A 45 6.067 3.879 -5.546 1.00 0.00 C ATOM 677 CG1 VAL A 45 4.591 3.656 -5.253 1.00 0.00 C ATOM 678 CG2 VAL A 45 6.308 5.287 -6.068 1.00 0.00 C ATOM 0 H VAL A 45 8.564 2.982 -5.413 1.00 0.00 H new ATOM 0 HA VAL A 45 6.779 4.445 -3.590 1.00 0.00 H new ATOM 0 HB VAL A 45 6.370 3.173 -6.319 1.00 0.00 H new ATOM 0 HG11 VAL A 45 4.008 3.845 -6.155 1.00 0.00 H new ATOM 0 HG12 VAL A 45 4.436 2.627 -4.930 1.00 0.00 H new ATOM 0 HG13 VAL A 45 4.270 4.336 -4.464 1.00 0.00 H new ATOM 0 HG21 VAL A 45 5.701 5.454 -6.958 1.00 0.00 H new ATOM 0 HG22 VAL A 45 6.034 6.011 -5.301 1.00 0.00 H new ATOM 0 HG23 VAL A 45 7.362 5.406 -6.320 1.00 0.00 H new ATOM 688 N GLY A 46 6.296 1.278 -4.439 1.00 0.00 N ATOM 689 CA GLY A 46 5.855 -0.003 -3.919 1.00 0.00 C ATOM 690 C GLY A 46 6.413 -1.172 -4.707 1.00 0.00 C ATOM 691 O GLY A 46 7.627 -1.291 -4.878 1.00 0.00 O ATOM 0 H GLY A 46 6.473 1.295 -5.443 1.00 0.00 H new ATOM 0 HA2 GLY A 46 6.160 -0.093 -2.876 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.766 -0.043 -3.937 1.00 0.00 H new ATOM 695 N ILE A 47 5.526 -2.037 -5.187 1.00 0.00 N ATOM 696 CA ILE A 47 5.937 -3.202 -5.961 1.00 0.00 C ATOM 697 C ILE A 47 5.938 -2.897 -7.455 1.00 0.00 C ATOM 698 O ILE A 47 4.949 -2.404 -8.000 1.00 0.00 O ATOM 699 CB ILE A 47 5.017 -4.408 -5.695 1.00 0.00 C ATOM 700 CG1 ILE A 47 5.461 -5.610 -6.531 1.00 0.00 C ATOM 701 CG2 ILE A 47 3.571 -4.048 -6.000 1.00 0.00 C ATOM 702 CD1 ILE A 47 5.121 -6.942 -5.901 1.00 0.00 C ATOM 0 H ILE A 47 4.518 -1.953 -5.054 1.00 0.00 H new ATOM 0 HA ILE A 47 6.949 -3.451 -5.643 1.00 0.00 H new ATOM 0 HB ILE A 47 5.089 -4.676 -4.641 1.00 0.00 H new ATOM 0 HG12 ILE A 47 4.993 -5.552 -7.514 1.00 0.00 H new ATOM 0 HG13 ILE A 47 6.538 -5.556 -6.687 1.00 0.00 H new ATOM 0 HG21 ILE A 47 2.933 -4.910 -5.807 1.00 0.00 H new ATOM 0 HG22 ILE A 47 3.261 -3.218 -5.365 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.481 -3.757 -7.047 1.00 0.00 H new ATOM 0 HD11 ILE A 47 5.465 -7.749 -6.548 1.00 0.00 H new ATOM 0 HD12 ILE A 47 5.611 -7.021 -4.931 1.00 0.00 H new ATOM 0 HD13 ILE A 47 4.042 -7.017 -5.770 1.00 0.00 H new ATOM 714 N LEU A 48 7.052 -3.195 -8.114 1.00 0.00 N ATOM 715 CA LEU A 48 7.182 -2.955 -9.547 1.00 0.00 C ATOM 716 C LEU A 48 7.151 -4.268 -10.323 1.00 0.00 C ATOM 717 O LEU A 48 7.594 -5.304 -9.829 1.00 0.00 O ATOM 718 CB LEU A 48 8.481 -2.204 -9.843 1.00 0.00 C ATOM 719 CG LEU A 48 8.763 -0.981 -8.969 1.00 0.00 C ATOM 720 CD1 LEU A 48 10.169 -1.050 -8.393 1.00 0.00 C ATOM 721 CD2 LEU A 48 8.575 0.300 -9.768 1.00 0.00 C ATOM 0 H LEU A 48 7.879 -3.604 -7.679 1.00 0.00 H new ATOM 0 HA LEU A 48 6.337 -2.345 -9.867 1.00 0.00 H new ATOM 0 HB2 LEU A 48 9.312 -2.901 -9.737 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.463 -1.885 -10.885 1.00 0.00 H new ATOM 0 HG LEU A 48 8.053 -0.978 -8.142 1.00 0.00 H new ATOM 0 HD11 LEU A 48 10.352 -0.172 -7.774 1.00 0.00 H new ATOM 0 HD12 LEU A 48 10.270 -1.949 -7.786 1.00 0.00 H new ATOM 0 HD13 LEU A 48 10.894 -1.078 -9.206 1.00 0.00 H new ATOM 0 HD21 LEU A 48 8.780 1.160 -9.130 1.00 0.00 H new ATOM 0 HD22 LEU A 48 9.261 0.305 -10.615 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.549 0.354 -10.132 1.00 0.00 H new ATOM 733 N VAL A 49 6.628 -4.215 -11.544 1.00 0.00 N ATOM 734 CA VAL A 49 6.543 -5.399 -12.391 1.00 0.00 C ATOM 735 C VAL A 49 6.447 -5.015 -13.863 1.00 0.00 C ATOM 736 O VAL A 49 5.432 -4.483 -14.312 1.00 0.00 O ATOM 737 CB VAL A 49 5.328 -6.269 -12.019 1.00 0.00 C ATOM 738 CG1 VAL A 49 4.097 -5.403 -11.801 1.00 0.00 C ATOM 739 CG2 VAL A 49 5.072 -7.314 -13.095 1.00 0.00 C ATOM 0 H VAL A 49 6.257 -3.365 -11.969 1.00 0.00 H new ATOM 0 HA VAL A 49 7.455 -5.972 -12.226 1.00 0.00 H new ATOM 0 HB VAL A 49 5.547 -6.788 -11.086 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.249 -6.036 -11.539 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.287 -4.698 -10.992 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.872 -4.854 -12.715 1.00 0.00 H new ATOM 0 HG21 VAL A 49 4.210 -7.920 -12.816 1.00 0.00 H new ATOM 0 HG22 VAL A 49 4.874 -6.817 -14.045 1.00 0.00 H new ATOM 0 HG23 VAL A 49 5.948 -7.954 -13.196 1.00 0.00 H new ATOM 749 N MET A 50 7.511 -5.290 -14.611 1.00 0.00 N ATOM 750 CA MET A 50 7.546 -4.975 -16.035 1.00 0.00 C ATOM 751 C MET A 50 7.772 -6.235 -16.865 1.00 0.00 C ATOM 752 O MET A 50 8.040 -7.308 -16.323 1.00 0.00 O ATOM 753 CB MET A 50 8.648 -3.954 -16.326 1.00 0.00 C ATOM 754 CG MET A 50 9.627 -3.772 -15.177 1.00 0.00 C ATOM 755 SD MET A 50 10.793 -5.140 -15.036 1.00 0.00 S ATOM 756 CE MET A 50 12.273 -4.396 -15.716 1.00 0.00 C ATOM 0 H MET A 50 8.360 -5.730 -14.255 1.00 0.00 H new ATOM 0 HA MET A 50 6.582 -4.547 -16.311 1.00 0.00 H new ATOM 0 HB2 MET A 50 9.197 -4.267 -17.214 1.00 0.00 H new ATOM 0 HB3 MET A 50 8.189 -2.993 -16.557 1.00 0.00 H new ATOM 0 HG2 MET A 50 10.179 -2.843 -15.318 1.00 0.00 H new ATOM 0 HG3 MET A 50 9.072 -3.675 -14.244 1.00 0.00 H new ATOM 0 HE1 MET A 50 12.679 -5.040 -16.496 1.00 0.00 H new ATOM 0 HE2 MET A 50 12.029 -3.422 -16.140 1.00 0.00 H new ATOM 0 HE3 MET A 50 13.014 -4.272 -14.926 1.00 0.00 H new ATOM 766 N HIS A 51 7.662 -6.098 -18.182 1.00 0.00 N ATOM 767 CA HIS A 51 7.854 -7.226 -19.087 1.00 0.00 C ATOM 768 C HIS A 51 9.126 -7.050 -19.911 1.00 0.00 C ATOM 769 O HIS A 51 9.255 -6.094 -20.674 1.00 0.00 O ATOM 770 CB HIS A 51 6.648 -7.374 -20.014 1.00 0.00 C ATOM 771 CG HIS A 51 5.350 -7.548 -19.286 1.00 0.00 C ATOM 772 ND1 HIS A 51 4.787 -8.782 -19.037 1.00 0.00 N ATOM 773 CD2 HIS A 51 4.506 -6.635 -18.752 1.00 0.00 C ATOM 774 CE1 HIS A 51 3.651 -8.620 -18.382 1.00 0.00 C ATOM 775 NE2 HIS A 51 3.458 -7.327 -18.196 1.00 0.00 N ATOM 0 H HIS A 51 7.441 -5.217 -18.647 1.00 0.00 H new ATOM 0 HA HIS A 51 7.953 -8.130 -18.486 1.00 0.00 H new ATOM 0 HB2 HIS A 51 6.581 -6.494 -20.653 1.00 0.00 H new ATOM 0 HB3 HIS A 51 6.806 -8.232 -20.668 1.00 0.00 H new ATOM 0 HD2 HIS A 51 4.633 -5.563 -18.761 1.00 0.00 H new ATOM 0 HE1 HIS A 51 2.992 -9.411 -18.054 1.00 0.00 H new ATOM 0 HE2 HIS A 51 2.660 -6.910 -17.717 1.00 0.00 H new ATOM 783 N ASN A 52 10.063 -7.979 -19.751 1.00 0.00 N ATOM 784 CA ASN A 52 11.325 -7.926 -20.479 1.00 0.00 C ATOM 785 C ASN A 52 11.082 -7.785 -21.979 1.00 0.00 C ATOM 786 O ASN A 52 11.968 -7.367 -22.725 1.00 0.00 O ATOM 787 CB ASN A 52 12.152 -9.183 -20.201 1.00 0.00 C ATOM 788 CG ASN A 52 12.645 -9.245 -18.768 1.00 0.00 C ATOM 789 OD1 ASN A 52 13.294 -8.318 -18.282 1.00 0.00 O ATOM 790 ND2 ASN A 52 12.339 -10.341 -18.084 1.00 0.00 N ATOM 0 H ASN A 52 9.972 -8.778 -19.123 1.00 0.00 H new ATOM 0 HA ASN A 52 11.878 -7.052 -20.134 1.00 0.00 H new ATOM 0 HB2 ASN A 52 11.549 -10.066 -20.413 1.00 0.00 H new ATOM 0 HB3 ASN A 52 13.006 -9.210 -20.878 1.00 0.00 H new ATOM 0 HD21 ASN A 52 12.644 -10.440 -17.116 1.00 0.00 H new ATOM 0 HD22 ASN A 52 11.799 -11.084 -18.527 1.00 0.00 H new ATOM 797 N ASP A 53 9.877 -8.136 -22.413 1.00 0.00 N ATOM 798 CA ASP A 53 9.516 -8.048 -23.823 1.00 0.00 C ATOM 799 C ASP A 53 9.571 -6.602 -24.308 1.00 0.00 C ATOM 800 O ASP A 53 9.460 -6.334 -25.504 1.00 0.00 O ATOM 801 CB ASP A 53 8.117 -8.622 -24.050 1.00 0.00 C ATOM 802 CG ASP A 53 7.999 -10.061 -23.586 1.00 0.00 C ATOM 803 OD1 ASP A 53 8.732 -10.919 -24.121 1.00 0.00 O ATOM 804 OD2 ASP A 53 7.175 -10.327 -22.686 1.00 0.00 O ATOM 0 H ASP A 53 9.133 -8.484 -21.808 1.00 0.00 H new ATOM 0 HA ASP A 53 10.237 -8.632 -24.395 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.386 -8.011 -23.520 1.00 0.00 H new ATOM 0 HB3 ASP A 53 7.871 -8.564 -25.110 1.00 0.00 H new ATOM 809 N ASP A 54 9.741 -5.675 -23.371 1.00 0.00 N ATOM 810 CA ASP A 54 9.810 -4.257 -23.703 1.00 0.00 C ATOM 811 C ASP A 54 11.002 -3.596 -23.018 1.00 0.00 C ATOM 812 O ASP A 54 11.622 -2.686 -23.570 1.00 0.00 O ATOM 813 CB ASP A 54 8.516 -3.552 -23.295 1.00 0.00 C ATOM 814 CG ASP A 54 7.441 -3.653 -24.359 1.00 0.00 C ATOM 815 OD1 ASP A 54 7.771 -3.498 -25.553 1.00 0.00 O ATOM 816 OD2 ASP A 54 6.269 -3.888 -23.997 1.00 0.00 O ATOM 0 H ASP A 54 9.833 -5.880 -22.376 1.00 0.00 H new ATOM 0 HA ASP A 54 9.938 -4.168 -24.782 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.146 -3.987 -22.367 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.726 -2.502 -23.093 1.00 0.00 H new ATOM 821 N ILE A 55 11.317 -4.059 -21.813 1.00 0.00 N ATOM 822 CA ILE A 55 12.434 -3.513 -21.053 1.00 0.00 C ATOM 823 C ILE A 55 13.769 -3.932 -21.659 1.00 0.00 C ATOM 824 O ILE A 55 14.718 -3.151 -21.697 1.00 0.00 O ATOM 825 CB ILE A 55 12.387 -3.964 -19.581 1.00 0.00 C ATOM 826 CG1 ILE A 55 10.979 -3.778 -19.012 1.00 0.00 C ATOM 827 CG2 ILE A 55 13.404 -3.188 -18.757 1.00 0.00 C ATOM 828 CD1 ILE A 55 10.433 -2.380 -19.196 1.00 0.00 C ATOM 0 H ILE A 55 10.814 -4.811 -21.342 1.00 0.00 H new ATOM 0 HA ILE A 55 12.344 -2.428 -21.095 1.00 0.00 H new ATOM 0 HB ILE A 55 12.641 -5.023 -19.533 1.00 0.00 H new ATOM 0 HG12 ILE A 55 10.305 -4.488 -19.491 1.00 0.00 H new ATOM 0 HG13 ILE A 55 10.991 -4.018 -17.949 1.00 0.00 H new ATOM 0 HG21 ILE A 55 13.359 -3.518 -17.719 1.00 0.00 H new ATOM 0 HG22 ILE A 55 14.404 -3.367 -19.151 1.00 0.00 H new ATOM 0 HG23 ILE A 55 13.178 -2.123 -18.809 1.00 0.00 H new ATOM 0 HD11 ILE A 55 9.432 -2.321 -18.769 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.085 -1.666 -18.693 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.388 -2.144 -20.259 1.00 0.00 H new ATOM 840 N GLY A 56 13.833 -5.172 -22.136 1.00 0.00 N ATOM 841 CA GLY A 56 15.055 -5.674 -22.736 1.00 0.00 C ATOM 842 C GLY A 56 15.598 -4.747 -23.806 1.00 0.00 C ATOM 843 O GLY A 56 16.802 -4.714 -24.054 1.00 0.00 O ATOM 0 H GLY A 56 13.060 -5.837 -22.117 1.00 0.00 H new ATOM 0 HA2 GLY A 56 15.808 -5.809 -21.960 1.00 0.00 H new ATOM 0 HA3 GLY A 56 14.866 -6.655 -23.171 1.00 0.00 H new ATOM 847 N ASN A 57 14.707 -3.994 -24.443 1.00 0.00 N ATOM 848 CA ASN A 57 15.103 -3.064 -25.494 1.00 0.00 C ATOM 849 C ASN A 57 16.123 -2.057 -24.972 1.00 0.00 C ATOM 850 O ASN A 57 16.888 -1.475 -25.743 1.00 0.00 O ATOM 851 CB ASN A 57 13.879 -2.330 -26.043 1.00 0.00 C ATOM 852 CG ASN A 57 13.393 -2.915 -27.355 1.00 0.00 C ATOM 853 OD1 ASN A 57 14.125 -3.636 -28.034 1.00 0.00 O ATOM 854 ND2 ASN A 57 12.153 -2.607 -27.717 1.00 0.00 N ATOM 0 H ASN A 57 13.706 -4.010 -24.249 1.00 0.00 H new ATOM 0 HA ASN A 57 15.564 -3.638 -26.298 1.00 0.00 H new ATOM 0 HB2 ASN A 57 13.074 -2.373 -25.309 1.00 0.00 H new ATOM 0 HB3 ASN A 57 14.124 -1.278 -26.186 1.00 0.00 H new ATOM 0 HD21 ASN A 57 11.771 -2.972 -28.590 1.00 0.00 H new ATOM 0 HD22 ASN A 57 11.583 -2.006 -27.122 1.00 0.00 H new ATOM 861 N LEU A 58 16.129 -1.855 -23.659 1.00 0.00 N ATOM 862 CA LEU A 58 17.056 -0.918 -23.034 1.00 0.00 C ATOM 863 C LEU A 58 17.998 -1.641 -22.077 1.00 0.00 C ATOM 864 O LEU A 58 17.873 -1.548 -20.855 1.00 0.00 O ATOM 865 CB LEU A 58 16.284 0.169 -22.283 1.00 0.00 C ATOM 866 CG LEU A 58 15.278 0.970 -23.111 1.00 0.00 C ATOM 867 CD1 LEU A 58 15.846 1.281 -24.487 1.00 0.00 C ATOM 868 CD2 LEU A 58 13.964 0.212 -23.233 1.00 0.00 C ATOM 0 H LEU A 58 15.503 -2.327 -23.007 1.00 0.00 H new ATOM 0 HA LEU A 58 17.652 -0.455 -23.821 1.00 0.00 H new ATOM 0 HB2 LEU A 58 15.752 -0.298 -21.454 1.00 0.00 H new ATOM 0 HB3 LEU A 58 17.003 0.864 -21.850 1.00 0.00 H new ATOM 0 HG LEU A 58 15.084 1.913 -22.599 1.00 0.00 H new ATOM 0 HD11 LEU A 58 15.116 1.851 -25.062 1.00 0.00 H new ATOM 0 HD12 LEU A 58 16.760 1.865 -24.380 1.00 0.00 H new ATOM 0 HD13 LEU A 58 16.070 0.350 -25.007 1.00 0.00 H new ATOM 0 HD21 LEU A 58 13.260 0.797 -23.825 1.00 0.00 H new ATOM 0 HD22 LEU A 58 14.141 -0.746 -23.721 1.00 0.00 H new ATOM 0 HD23 LEU A 58 13.549 0.042 -22.240 1.00 0.00 H new ATOM 880 N PRO A 59 18.966 -2.378 -22.642 1.00 0.00 N ATOM 881 CA PRO A 59 19.950 -3.129 -21.857 1.00 0.00 C ATOM 882 C PRO A 59 20.933 -2.215 -21.133 1.00 0.00 C ATOM 883 O PRO A 59 20.783 -1.948 -19.942 1.00 0.00 O ATOM 884 CB PRO A 59 20.677 -3.969 -22.910 1.00 0.00 C ATOM 885 CG PRO A 59 20.515 -3.207 -24.180 1.00 0.00 C ATOM 886 CD PRO A 59 19.174 -2.534 -24.092 1.00 0.00 C ATOM 0 HA PRO A 59 19.480 -3.720 -21.071 1.00 0.00 H new ATOM 0 HB2 PRO A 59 21.729 -4.097 -22.657 1.00 0.00 H new ATOM 0 HB3 PRO A 59 20.244 -4.966 -22.989 1.00 0.00 H new ATOM 0 HG2 PRO A 59 21.312 -2.474 -24.299 1.00 0.00 H new ATOM 0 HG3 PRO A 59 20.562 -3.872 -25.042 1.00 0.00 H new ATOM 0 HD2 PRO A 59 19.173 -1.572 -24.604 1.00 0.00 H new ATOM 0 HD3 PRO A 59 18.390 -3.139 -24.548 1.00 0.00 H new ATOM 894 N GLU A 60 21.939 -1.740 -21.862 1.00 0.00 N ATOM 895 CA GLU A 60 22.946 -0.856 -21.287 1.00 0.00 C ATOM 896 C GLU A 60 22.328 0.475 -20.869 1.00 0.00 C ATOM 897 O GLU A 60 22.968 1.286 -20.201 1.00 0.00 O ATOM 898 CB GLU A 60 24.076 -0.614 -22.291 1.00 0.00 C ATOM 899 CG GLU A 60 23.608 0.012 -23.594 1.00 0.00 C ATOM 900 CD GLU A 60 24.646 0.933 -24.205 1.00 0.00 C ATOM 901 OE1 GLU A 60 25.502 0.439 -24.969 1.00 0.00 O ATOM 902 OE2 GLU A 60 24.602 2.148 -23.919 1.00 0.00 O ATOM 0 H GLU A 60 22.078 -1.952 -22.850 1.00 0.00 H new ATOM 0 HA GLU A 60 23.354 -1.341 -20.400 1.00 0.00 H new ATOM 0 HB2 GLU A 60 24.824 0.034 -21.834 1.00 0.00 H new ATOM 0 HB3 GLU A 60 24.567 -1.563 -22.509 1.00 0.00 H new ATOM 0 HG2 GLU A 60 23.365 -0.777 -24.305 1.00 0.00 H new ATOM 0 HG3 GLU A 60 22.691 0.573 -23.414 1.00 0.00 H new ATOM 909 N VAL A 61 21.079 0.691 -21.267 1.00 0.00 N ATOM 910 CA VAL A 61 20.373 1.923 -20.934 1.00 0.00 C ATOM 911 C VAL A 61 19.612 1.782 -19.620 1.00 0.00 C ATOM 912 O VAL A 61 19.855 2.523 -18.667 1.00 0.00 O ATOM 913 CB VAL A 61 19.384 2.322 -22.046 1.00 0.00 C ATOM 914 CG1 VAL A 61 18.442 3.411 -21.558 1.00 0.00 C ATOM 915 CG2 VAL A 61 20.136 2.773 -23.289 1.00 0.00 C ATOM 0 H VAL A 61 20.535 0.029 -21.820 1.00 0.00 H new ATOM 0 HA VAL A 61 21.128 2.703 -20.832 1.00 0.00 H new ATOM 0 HB VAL A 61 18.786 1.449 -22.307 1.00 0.00 H new ATOM 0 HG11 VAL A 61 17.751 3.679 -22.357 1.00 0.00 H new ATOM 0 HG12 VAL A 61 17.879 3.047 -20.699 1.00 0.00 H new ATOM 0 HG13 VAL A 61 19.020 4.289 -21.268 1.00 0.00 H new ATOM 0 HG21 VAL A 61 19.423 3.051 -24.065 1.00 0.00 H new ATOM 0 HG22 VAL A 61 20.760 3.633 -23.045 1.00 0.00 H new ATOM 0 HG23 VAL A 61 20.765 1.959 -23.649 1.00 0.00 H new ATOM 925 N LEU A 62 18.691 0.825 -19.576 1.00 0.00 N ATOM 926 CA LEU A 62 17.894 0.586 -18.378 1.00 0.00 C ATOM 927 C LEU A 62 18.461 -0.578 -17.570 1.00 0.00 C ATOM 928 O LEU A 62 18.914 -0.399 -16.440 1.00 0.00 O ATOM 929 CB LEU A 62 16.441 0.298 -18.757 1.00 0.00 C ATOM 930 CG LEU A 62 15.375 0.989 -17.906 1.00 0.00 C ATOM 931 CD1 LEU A 62 15.631 0.744 -16.427 1.00 0.00 C ATOM 932 CD2 LEU A 62 15.341 2.481 -18.203 1.00 0.00 C ATOM 0 H LEU A 62 18.478 0.203 -20.356 1.00 0.00 H new ATOM 0 HA LEU A 62 17.931 1.484 -17.762 1.00 0.00 H new ATOM 0 HB2 LEU A 62 16.293 0.590 -19.797 1.00 0.00 H new ATOM 0 HB3 LEU A 62 16.279 -0.779 -18.703 1.00 0.00 H new ATOM 0 HG LEU A 62 14.403 0.565 -18.160 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.862 1.243 -15.837 1.00 0.00 H new ATOM 0 HD12 LEU A 62 15.604 -0.327 -16.226 1.00 0.00 H new ATOM 0 HD13 LEU A 62 16.610 1.140 -16.157 1.00 0.00 H new ATOM 0 HD21 LEU A 62 14.577 2.957 -17.589 1.00 0.00 H new ATOM 0 HD22 LEU A 62 16.313 2.919 -17.977 1.00 0.00 H new ATOM 0 HD23 LEU A 62 15.109 2.637 -19.256 1.00 0.00 H new ATOM 944 N ARG A 63 18.435 -1.769 -18.160 1.00 0.00 N ATOM 945 CA ARG A 63 18.947 -2.961 -17.496 1.00 0.00 C ATOM 946 C ARG A 63 20.261 -2.663 -16.779 1.00 0.00 C ATOM 947 O ARG A 63 20.550 -3.232 -15.726 1.00 0.00 O ATOM 948 CB ARG A 63 19.151 -4.088 -18.510 1.00 0.00 C ATOM 949 CG ARG A 63 17.890 -4.456 -19.274 1.00 0.00 C ATOM 950 CD ARG A 63 16.754 -4.820 -18.331 1.00 0.00 C ATOM 951 NE ARG A 63 16.166 -6.117 -18.658 1.00 0.00 N ATOM 952 CZ ARG A 63 16.706 -7.278 -18.307 1.00 0.00 C ATOM 953 NH1 ARG A 63 17.840 -7.305 -17.621 1.00 0.00 N ATOM 954 NH2 ARG A 63 16.111 -8.416 -18.642 1.00 0.00 N ATOM 0 H ARG A 63 18.065 -1.933 -19.096 1.00 0.00 H new ATOM 0 HA ARG A 63 18.213 -3.277 -16.755 1.00 0.00 H new ATOM 0 HB2 ARG A 63 19.922 -3.791 -19.221 1.00 0.00 H new ATOM 0 HB3 ARG A 63 19.521 -4.971 -17.989 1.00 0.00 H new ATOM 0 HG2 ARG A 63 17.588 -3.619 -19.904 1.00 0.00 H new ATOM 0 HG3 ARG A 63 18.097 -5.296 -19.937 1.00 0.00 H new ATOM 0 HD2 ARG A 63 17.125 -4.838 -17.306 1.00 0.00 H new ATOM 0 HD3 ARG A 63 15.983 -4.050 -18.377 1.00 0.00 H new ATOM 0 HE ARG A 63 15.293 -6.131 -19.185 1.00 0.00 H new ATOM 0 HH11 ARG A 63 18.300 -6.432 -17.361 1.00 0.00 H new ATOM 0 HH12 ARG A 63 18.253 -8.198 -17.353 1.00 0.00 H new ATOM 0 HH21 ARG A 63 15.238 -8.399 -19.170 1.00 0.00 H new ATOM 0 HH22 ARG A 63 16.527 -9.308 -18.372 1.00 0.00 H new ATOM 968 N LYS A 64 21.053 -1.767 -17.357 1.00 0.00 N ATOM 969 CA LYS A 64 22.336 -1.391 -16.775 1.00 0.00 C ATOM 970 C LYS A 64 22.139 -0.496 -15.555 1.00 0.00 C ATOM 971 O LYS A 64 22.706 -0.747 -14.493 1.00 0.00 O ATOM 972 CB LYS A 64 23.200 -0.671 -17.814 1.00 0.00 C ATOM 973 CG LYS A 64 24.338 0.131 -17.208 1.00 0.00 C ATOM 974 CD LYS A 64 25.401 0.459 -18.242 1.00 0.00 C ATOM 975 CE LYS A 64 25.669 1.955 -18.312 1.00 0.00 C ATOM 976 NZ LYS A 64 26.555 2.411 -17.205 1.00 0.00 N ATOM 0 H LYS A 64 20.829 -1.287 -18.229 1.00 0.00 H new ATOM 0 HA LYS A 64 22.843 -2.302 -16.458 1.00 0.00 H new ATOM 0 HB2 LYS A 64 23.613 -1.407 -18.504 1.00 0.00 H new ATOM 0 HB3 LYS A 64 22.568 -0.004 -18.400 1.00 0.00 H new ATOM 0 HG2 LYS A 64 23.947 1.055 -16.782 1.00 0.00 H new ATOM 0 HG3 LYS A 64 24.786 -0.433 -16.390 1.00 0.00 H new ATOM 0 HD2 LYS A 64 26.324 -0.066 -17.995 1.00 0.00 H new ATOM 0 HD3 LYS A 64 25.082 0.099 -19.220 1.00 0.00 H new ATOM 0 HE2 LYS A 64 26.130 2.197 -19.270 1.00 0.00 H new ATOM 0 HE3 LYS A 64 24.724 2.496 -18.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 26.714 3.435 -17.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 26.104 2.203 -16.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 27.466 1.913 -17.262 1.00 0.00 H new ATOM 990 N ASN A 65 21.330 0.546 -15.716 1.00 0.00 N ATOM 991 CA ASN A 65 21.058 1.477 -14.627 1.00 0.00 C ATOM 992 C ASN A 65 20.409 0.759 -13.447 1.00 0.00 C ATOM 993 O ASN A 65 20.777 0.980 -12.293 1.00 0.00 O ATOM 994 CB ASN A 65 20.151 2.610 -15.111 1.00 0.00 C ATOM 995 CG ASN A 65 20.930 3.739 -15.757 1.00 0.00 C ATOM 996 OD1 ASN A 65 20.838 4.892 -15.335 1.00 0.00 O ATOM 997 ND2 ASN A 65 21.703 3.411 -16.786 1.00 0.00 N ATOM 0 H ASN A 65 20.852 0.767 -16.589 1.00 0.00 H new ATOM 0 HA ASN A 65 22.008 1.898 -14.296 1.00 0.00 H new ATOM 0 HB2 ASN A 65 19.430 2.214 -15.826 1.00 0.00 H new ATOM 0 HB3 ASN A 65 19.582 3.001 -14.268 1.00 0.00 H new ATOM 0 HD21 ASN A 65 22.252 4.128 -17.261 1.00 0.00 H new ATOM 0 HD22 ASN A 65 21.748 2.442 -17.101 1.00 0.00 H new ATOM 1004 N LEU A 66 19.441 -0.101 -13.745 1.00 0.00 N ATOM 1005 CA LEU A 66 18.740 -0.853 -12.710 1.00 0.00 C ATOM 1006 C LEU A 66 19.611 -1.986 -12.176 1.00 0.00 C ATOM 1007 O LEU A 66 19.450 -2.421 -11.037 1.00 0.00 O ATOM 1008 CB LEU A 66 17.430 -1.418 -13.262 1.00 0.00 C ATOM 1009 CG LEU A 66 17.561 -2.415 -14.414 1.00 0.00 C ATOM 1010 CD1 LEU A 66 17.823 -3.815 -13.881 1.00 0.00 C ATOM 1011 CD2 LEU A 66 16.310 -2.397 -15.280 1.00 0.00 C ATOM 0 H LEU A 66 19.124 -0.295 -14.695 1.00 0.00 H new ATOM 0 HA LEU A 66 18.517 -0.172 -11.888 1.00 0.00 H new ATOM 0 HB2 LEU A 66 16.895 -1.904 -12.446 1.00 0.00 H new ATOM 0 HB3 LEU A 66 16.811 -0.586 -13.597 1.00 0.00 H new ATOM 0 HG LEU A 66 18.409 -2.119 -15.031 1.00 0.00 H new ATOM 0 HD11 LEU A 66 17.913 -4.511 -14.715 1.00 0.00 H new ATOM 0 HD12 LEU A 66 18.748 -3.818 -13.304 1.00 0.00 H new ATOM 0 HD13 LEU A 66 16.996 -4.121 -13.241 1.00 0.00 H new ATOM 0 HD21 LEU A 66 16.421 -3.113 -16.095 1.00 0.00 H new ATOM 0 HD22 LEU A 66 15.445 -2.668 -14.675 1.00 0.00 H new ATOM 0 HD23 LEU A 66 16.167 -1.398 -15.692 1.00 0.00 H new ATOM 1023 N ASN A 67 20.536 -2.457 -13.007 1.00 0.00 N ATOM 1024 CA ASN A 67 21.433 -3.538 -12.617 1.00 0.00 C ATOM 1025 C ASN A 67 22.027 -3.281 -11.235 1.00 0.00 C ATOM 1026 O ASN A 67 22.272 -4.214 -10.471 1.00 0.00 O ATOM 1027 CB ASN A 67 22.555 -3.693 -13.646 1.00 0.00 C ATOM 1028 CG ASN A 67 22.607 -5.088 -14.240 1.00 0.00 C ATOM 1029 OD1 ASN A 67 22.755 -6.076 -13.520 1.00 0.00 O ATOM 1030 ND2 ASN A 67 22.484 -5.174 -15.559 1.00 0.00 N ATOM 0 H ASN A 67 20.683 -2.107 -13.954 1.00 0.00 H new ATOM 0 HA ASN A 67 20.854 -4.461 -12.578 1.00 0.00 H new ATOM 0 HB2 ASN A 67 22.414 -2.966 -14.446 1.00 0.00 H new ATOM 0 HB3 ASN A 67 23.511 -3.466 -13.174 1.00 0.00 H new ATOM 0 HD21 ASN A 67 22.510 -6.086 -16.015 1.00 0.00 H new ATOM 0 HD22 ASN A 67 22.363 -4.328 -16.116 1.00 0.00 H new ATOM 1037 N GLU A 68 22.256 -2.009 -10.923 1.00 0.00 N ATOM 1038 CA GLU A 68 22.821 -1.630 -9.633 1.00 0.00 C ATOM 1039 C GLU A 68 21.779 -0.926 -8.768 1.00 0.00 C ATOM 1040 O GLU A 68 21.882 -0.912 -7.542 1.00 0.00 O ATOM 1041 CB GLU A 68 24.035 -0.720 -9.831 1.00 0.00 C ATOM 1042 CG GLU A 68 23.804 0.391 -10.842 1.00 0.00 C ATOM 1043 CD GLU A 68 24.615 1.635 -10.537 1.00 0.00 C ATOM 1044 OE1 GLU A 68 25.840 1.618 -10.781 1.00 0.00 O ATOM 1045 OE2 GLU A 68 24.026 2.625 -10.055 1.00 0.00 O ATOM 0 H GLU A 68 22.059 -1.225 -11.545 1.00 0.00 H new ATOM 0 HA GLU A 68 23.137 -2.539 -9.122 1.00 0.00 H new ATOM 0 HB2 GLU A 68 24.307 -0.277 -8.873 1.00 0.00 H new ATOM 0 HB3 GLU A 68 24.883 -1.324 -10.155 1.00 0.00 H new ATOM 0 HG2 GLU A 68 24.060 0.030 -11.838 1.00 0.00 H new ATOM 0 HG3 GLU A 68 22.745 0.647 -10.859 1.00 0.00 H new ATOM 1052 N SER A 69 20.777 -0.342 -9.417 1.00 0.00 N ATOM 1053 CA SER A 69 19.718 0.368 -8.709 1.00 0.00 C ATOM 1054 C SER A 69 18.516 -0.541 -8.476 1.00 0.00 C ATOM 1055 O SER A 69 17.403 -0.071 -8.240 1.00 0.00 O ATOM 1056 CB SER A 69 19.289 1.607 -9.499 1.00 0.00 C ATOM 1057 OG SER A 69 19.070 2.710 -8.637 1.00 0.00 O ATOM 0 H SER A 69 20.676 -0.346 -10.432 1.00 0.00 H new ATOM 0 HA SER A 69 20.109 0.680 -7.740 1.00 0.00 H new ATOM 0 HB2 SER A 69 20.057 1.860 -10.230 1.00 0.00 H new ATOM 0 HB3 SER A 69 18.377 1.390 -10.056 1.00 0.00 H new ATOM 0 HG SER A 69 18.798 3.489 -9.166 1.00 0.00 H new ATOM 1063 N VAL A 70 18.749 -1.848 -8.543 1.00 0.00 N ATOM 1064 CA VAL A 70 17.687 -2.826 -8.338 1.00 0.00 C ATOM 1065 C VAL A 70 17.364 -2.984 -6.856 1.00 0.00 C ATOM 1066 O VAL A 70 17.448 -4.082 -6.307 1.00 0.00 O ATOM 1067 CB VAL A 70 18.069 -4.200 -8.918 1.00 0.00 C ATOM 1068 CG1 VAL A 70 19.319 -4.739 -8.237 1.00 0.00 C ATOM 1069 CG2 VAL A 70 16.912 -5.178 -8.777 1.00 0.00 C ATOM 0 H VAL A 70 19.664 -2.254 -8.738 1.00 0.00 H new ATOM 0 HA VAL A 70 16.807 -2.452 -8.861 1.00 0.00 H new ATOM 0 HB VAL A 70 18.286 -4.079 -9.979 1.00 0.00 H new ATOM 0 HG11 VAL A 70 19.574 -5.711 -8.660 1.00 0.00 H new ATOM 0 HG12 VAL A 70 20.146 -4.047 -8.394 1.00 0.00 H new ATOM 0 HG13 VAL A 70 19.134 -4.846 -7.168 1.00 0.00 H new ATOM 0 HG21 VAL A 70 17.199 -6.144 -9.192 1.00 0.00 H new ATOM 0 HG22 VAL A 70 16.662 -5.296 -7.723 1.00 0.00 H new ATOM 0 HG23 VAL A 70 16.045 -4.796 -9.315 1.00 0.00 H new ATOM 1079 N GLN A 71 16.993 -1.880 -6.216 1.00 0.00 N ATOM 1080 CA GLN A 71 16.657 -1.896 -4.797 1.00 0.00 C ATOM 1081 C GLN A 71 15.301 -2.555 -4.567 1.00 0.00 C ATOM 1082 O GLN A 71 15.188 -3.578 -3.891 1.00 0.00 O ATOM 1083 CB GLN A 71 16.647 -0.472 -4.237 1.00 0.00 C ATOM 1084 CG GLN A 71 17.847 -0.155 -3.360 1.00 0.00 C ATOM 1085 CD GLN A 71 19.166 -0.391 -4.069 1.00 0.00 C ATOM 1086 OE1 GLN A 71 20.046 -1.082 -3.553 1.00 0.00 O ATOM 1087 NE2 GLN A 71 19.311 0.183 -5.257 1.00 0.00 N ATOM 0 H GLN A 71 16.917 -0.963 -6.657 1.00 0.00 H new ATOM 0 HA GLN A 71 17.417 -2.478 -4.276 1.00 0.00 H new ATOM 0 HB2 GLN A 71 16.616 0.235 -5.066 1.00 0.00 H new ATOM 0 HB3 GLN A 71 15.735 -0.325 -3.658 1.00 0.00 H new ATOM 0 HG2 GLN A 71 17.793 0.885 -3.038 1.00 0.00 H new ATOM 0 HG3 GLN A 71 17.807 -0.769 -2.460 1.00 0.00 H new ATOM 0 HE21 GLN A 71 18.556 0.747 -5.646 1.00 0.00 H new ATOM 0 HE22 GLN A 71 20.178 0.060 -5.781 1.00 0.00 H new ATOM 1096 N PRO A 72 14.246 -1.957 -5.140 1.00 0.00 N ATOM 1097 CA PRO A 72 12.879 -2.469 -5.011 1.00 0.00 C ATOM 1098 C PRO A 72 12.675 -3.775 -5.771 1.00 0.00 C ATOM 1099 O PRO A 72 13.638 -4.425 -6.180 1.00 0.00 O ATOM 1100 CB PRO A 72 12.024 -1.356 -5.621 1.00 0.00 C ATOM 1101 CG PRO A 72 12.935 -0.655 -6.568 1.00 0.00 C ATOM 1102 CD PRO A 72 14.307 -0.735 -5.958 1.00 0.00 C ATOM 0 HA PRO A 72 12.627 -2.700 -3.976 1.00 0.00 H new ATOM 0 HB2 PRO A 72 11.154 -1.763 -6.136 1.00 0.00 H new ATOM 0 HB3 PRO A 72 11.652 -0.677 -4.854 1.00 0.00 H new ATOM 0 HG2 PRO A 72 12.916 -1.128 -7.550 1.00 0.00 H new ATOM 0 HG3 PRO A 72 12.630 0.382 -6.708 1.00 0.00 H new ATOM 0 HD2 PRO A 72 15.083 -0.801 -6.721 1.00 0.00 H new ATOM 0 HD3 PRO A 72 14.529 0.143 -5.352 1.00 0.00 H new ATOM 1110 N THR A 73 11.415 -4.156 -5.957 1.00 0.00 N ATOM 1111 CA THR A 73 11.085 -5.385 -6.667 1.00 0.00 C ATOM 1112 C THR A 73 10.661 -5.094 -8.102 1.00 0.00 C ATOM 1113 O THR A 73 9.528 -4.684 -8.354 1.00 0.00 O ATOM 1114 CB THR A 73 9.957 -6.159 -5.957 1.00 0.00 C ATOM 1115 OG1 THR A 73 10.094 -6.031 -4.538 1.00 0.00 O ATOM 1116 CG2 THR A 73 9.984 -7.629 -6.345 1.00 0.00 C ATOM 0 H THR A 73 10.606 -3.630 -5.625 1.00 0.00 H new ATOM 0 HA THR A 73 11.987 -5.997 -6.674 1.00 0.00 H new ATOM 0 HB THR A 73 9.002 -5.735 -6.268 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.373 -6.524 -4.094 1.00 0.00 H new ATOM 0 HG21 THR A 73 9.179 -8.156 -5.832 1.00 0.00 H new ATOM 0 HG22 THR A 73 9.850 -7.723 -7.423 1.00 0.00 H new ATOM 0 HG23 THR A 73 10.942 -8.063 -6.059 1.00 0.00 H new ATOM 1124 N VAL A 74 11.577 -5.309 -9.040 1.00 0.00 N ATOM 1125 CA VAL A 74 11.297 -5.071 -10.451 1.00 0.00 C ATOM 1126 C VAL A 74 11.005 -6.378 -11.181 1.00 0.00 C ATOM 1127 O VAL A 74 11.842 -6.885 -11.928 1.00 0.00 O ATOM 1128 CB VAL A 74 12.474 -4.360 -11.145 1.00 0.00 C ATOM 1129 CG1 VAL A 74 11.986 -3.571 -12.350 1.00 0.00 C ATOM 1130 CG2 VAL A 74 13.202 -3.455 -10.163 1.00 0.00 C ATOM 0 H VAL A 74 12.520 -5.648 -8.849 1.00 0.00 H new ATOM 0 HA VAL A 74 10.418 -4.429 -10.495 1.00 0.00 H new ATOM 0 HB VAL A 74 13.176 -5.116 -11.497 1.00 0.00 H new ATOM 0 HG11 VAL A 74 12.832 -3.076 -12.827 1.00 0.00 H new ATOM 0 HG12 VAL A 74 11.514 -4.248 -13.061 1.00 0.00 H new ATOM 0 HG13 VAL A 74 11.263 -2.823 -12.026 1.00 0.00 H new ATOM 0 HG21 VAL A 74 14.031 -2.960 -10.670 1.00 0.00 H new ATOM 0 HG22 VAL A 74 12.511 -2.704 -9.779 1.00 0.00 H new ATOM 0 HG23 VAL A 74 13.587 -4.051 -9.335 1.00 0.00 H new ATOM 1140 N VAL A 75 9.811 -6.918 -10.962 1.00 0.00 N ATOM 1141 CA VAL A 75 9.406 -8.165 -11.600 1.00 0.00 C ATOM 1142 C VAL A 75 9.456 -8.046 -13.119 1.00 0.00 C ATOM 1143 O VAL A 75 8.551 -7.489 -13.739 1.00 0.00 O ATOM 1144 CB VAL A 75 7.984 -8.577 -11.175 1.00 0.00 C ATOM 1145 CG1 VAL A 75 7.565 -9.856 -11.884 1.00 0.00 C ATOM 1146 CG2 VAL A 75 7.908 -8.745 -9.665 1.00 0.00 C ATOM 0 H VAL A 75 9.106 -6.511 -10.347 1.00 0.00 H new ATOM 0 HA VAL A 75 10.110 -8.931 -11.275 1.00 0.00 H new ATOM 0 HB VAL A 75 7.292 -7.786 -11.465 1.00 0.00 H new ATOM 0 HG11 VAL A 75 6.558 -10.132 -11.572 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.579 -9.696 -12.962 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.257 -10.658 -11.627 1.00 0.00 H new ATOM 0 HG21 VAL A 75 6.897 -9.036 -9.382 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.610 -9.517 -9.349 1.00 0.00 H new ATOM 0 HG23 VAL A 75 8.163 -7.802 -9.181 1.00 0.00 H new ATOM 1156 N ALA A 76 10.522 -8.574 -13.714 1.00 0.00 N ATOM 1157 CA ALA A 76 10.689 -8.529 -15.161 1.00 0.00 C ATOM 1158 C ALA A 76 10.260 -9.844 -15.804 1.00 0.00 C ATOM 1159 O ALA A 76 10.986 -10.837 -15.754 1.00 0.00 O ATOM 1160 CB ALA A 76 12.135 -8.214 -15.515 1.00 0.00 C ATOM 0 H ALA A 76 11.282 -9.037 -13.216 1.00 0.00 H new ATOM 0 HA ALA A 76 10.049 -7.738 -15.552 1.00 0.00 H new ATOM 0 HB1 ALA A 76 12.246 -8.183 -16.599 1.00 0.00 H new ATOM 0 HB2 ALA A 76 12.410 -7.247 -15.095 1.00 0.00 H new ATOM 0 HB3 ALA A 76 12.786 -8.986 -15.105 1.00 0.00 H new ATOM 1166 N LEU A 77 9.075 -9.843 -16.406 1.00 0.00 N ATOM 1167 CA LEU A 77 8.548 -11.036 -17.059 1.00 0.00 C ATOM 1168 C LEU A 77 9.421 -11.440 -18.243 1.00 0.00 C ATOM 1169 O LEU A 77 9.784 -10.606 -19.072 1.00 0.00 O ATOM 1170 CB LEU A 77 7.113 -10.793 -17.527 1.00 0.00 C ATOM 1171 CG LEU A 77 6.082 -11.840 -17.104 1.00 0.00 C ATOM 1172 CD1 LEU A 77 6.546 -13.235 -17.495 1.00 0.00 C ATOM 1173 CD2 LEU A 77 5.827 -11.762 -15.605 1.00 0.00 C ATOM 0 H LEU A 77 8.462 -9.030 -16.455 1.00 0.00 H new ATOM 0 HA LEU A 77 8.554 -11.850 -16.334 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.790 -9.822 -17.152 1.00 0.00 H new ATOM 0 HB3 LEU A 77 7.113 -10.731 -18.615 1.00 0.00 H new ATOM 0 HG LEU A 77 5.147 -11.631 -17.623 1.00 0.00 H new ATOM 0 HD11 LEU A 77 5.800 -13.967 -17.186 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.677 -13.285 -18.576 1.00 0.00 H new ATOM 0 HD13 LEU A 77 7.494 -13.454 -17.004 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.091 -12.514 -15.322 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.758 -11.945 -15.068 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.450 -10.771 -15.351 1.00 0.00 H new ATOM 1185 N GLY A 78 9.752 -12.725 -18.317 1.00 0.00 N ATOM 1186 CA GLY A 78 10.577 -13.217 -19.405 1.00 0.00 C ATOM 1187 C GLY A 78 12.017 -13.437 -18.986 1.00 0.00 C ATOM 1188 O GLY A 78 12.354 -13.316 -17.810 1.00 0.00 O ATOM 0 H GLY A 78 9.464 -13.434 -17.643 1.00 0.00 H new ATOM 0 HA2 GLY A 78 10.162 -14.154 -19.776 1.00 0.00 H new ATOM 0 HA3 GLY A 78 10.546 -12.506 -20.230 1.00 0.00 H new ATOM 1192 N GLY A 79 12.870 -13.764 -19.953 1.00 0.00 N ATOM 1193 CA GLY A 79 14.271 -13.999 -19.658 1.00 0.00 C ATOM 1194 C GLY A 79 14.528 -15.400 -19.141 1.00 0.00 C ATOM 1195 O GLY A 79 15.346 -16.133 -19.695 1.00 0.00 O ATOM 0 H GLY A 79 12.615 -13.870 -20.935 1.00 0.00 H new ATOM 0 HA2 GLY A 79 14.861 -13.834 -20.559 1.00 0.00 H new ATOM 0 HA3 GLY A 79 14.610 -13.274 -18.918 1.00 0.00 H new ATOM 1199 N SER A 80 13.828 -15.773 -18.073 1.00 0.00 N ATOM 1200 CA SER A 80 13.989 -17.094 -17.477 1.00 0.00 C ATOM 1201 C SER A 80 13.841 -18.187 -18.531 1.00 0.00 C ATOM 1202 O SER A 80 14.823 -18.797 -18.951 1.00 0.00 O ATOM 1203 CB SER A 80 12.962 -17.301 -16.363 1.00 0.00 C ATOM 1204 OG SER A 80 13.376 -16.670 -15.164 1.00 0.00 O ATOM 0 H SER A 80 13.145 -15.179 -17.604 1.00 0.00 H new ATOM 0 HA SER A 80 14.992 -17.156 -17.054 1.00 0.00 H new ATOM 0 HB2 SER A 80 11.997 -16.900 -16.674 1.00 0.00 H new ATOM 0 HB3 SER A 80 12.822 -18.368 -16.187 1.00 0.00 H new ATOM 0 HG SER A 80 12.702 -16.816 -14.468 1.00 0.00 H new ATOM 1210 N GLY A 81 12.604 -18.428 -18.955 1.00 0.00 N ATOM 1211 CA GLY A 81 12.348 -19.447 -19.956 1.00 0.00 C ATOM 1212 C GLY A 81 12.890 -20.805 -19.553 1.00 0.00 C ATOM 1213 O GLY A 81 12.280 -21.511 -18.750 1.00 0.00 O ATOM 0 H GLY A 81 11.775 -17.936 -18.623 1.00 0.00 H new ATOM 0 HA2 GLY A 81 11.274 -19.524 -20.126 1.00 0.00 H new ATOM 0 HA3 GLY A 81 12.799 -19.145 -20.901 1.00 0.00 H new ATOM 1217 N SER A 82 14.039 -21.171 -20.112 1.00 0.00 N ATOM 1218 CA SER A 82 14.660 -22.456 -19.811 1.00 0.00 C ATOM 1219 C SER A 82 16.008 -22.259 -19.124 1.00 0.00 C ATOM 1220 O SER A 82 16.170 -22.579 -17.947 1.00 0.00 O ATOM 1221 CB SER A 82 14.842 -23.271 -21.092 1.00 0.00 C ATOM 1222 OG SER A 82 15.196 -22.437 -22.182 1.00 0.00 O ATOM 0 H SER A 82 14.559 -20.596 -20.775 1.00 0.00 H new ATOM 0 HA SER A 82 14.002 -23.000 -19.134 1.00 0.00 H new ATOM 0 HB2 SER A 82 15.615 -24.024 -20.941 1.00 0.00 H new ATOM 0 HB3 SER A 82 13.919 -23.803 -21.322 1.00 0.00 H new ATOM 0 HG SER A 82 15.308 -22.983 -22.988 1.00 0.00 H new ATOM 1228 N GLY A 83 16.973 -21.729 -19.869 1.00 0.00 N ATOM 1229 CA GLY A 83 18.295 -21.498 -19.316 1.00 0.00 C ATOM 1230 C GLY A 83 19.349 -22.388 -19.944 1.00 0.00 C ATOM 1231 O GLY A 83 19.037 -23.240 -20.775 1.00 0.00 O ATOM 0 H GLY A 83 16.863 -21.455 -20.845 1.00 0.00 H new ATOM 0 HA2 GLY A 83 18.570 -20.454 -19.464 1.00 0.00 H new ATOM 0 HA3 GLY A 83 18.271 -21.672 -18.240 1.00 0.00 H new ATOM 1235 N SER A 84 20.602 -22.189 -19.547 1.00 0.00 N ATOM 1236 CA SER A 84 21.707 -22.977 -20.080 1.00 0.00 C ATOM 1237 C SER A 84 22.380 -23.787 -18.976 1.00 0.00 C ATOM 1238 O SER A 84 22.791 -23.241 -17.951 1.00 0.00 O ATOM 1239 CB SER A 84 22.733 -22.064 -20.755 1.00 0.00 C ATOM 1240 OG SER A 84 23.678 -22.818 -21.495 1.00 0.00 O ATOM 0 H SER A 84 20.877 -21.489 -18.858 1.00 0.00 H new ATOM 0 HA SER A 84 21.303 -23.669 -20.819 1.00 0.00 H new ATOM 0 HB2 SER A 84 22.222 -21.365 -21.417 1.00 0.00 H new ATOM 0 HB3 SER A 84 23.248 -21.470 -20.000 1.00 0.00 H new ATOM 0 HG SER A 84 24.321 -22.212 -21.918 1.00 0.00 H new ATOM 1246 N THR A 85 22.488 -25.094 -19.192 1.00 0.00 N ATOM 1247 CA THR A 85 23.109 -25.981 -18.216 1.00 0.00 C ATOM 1248 C THR A 85 24.495 -25.483 -17.824 1.00 0.00 C ATOM 1249 O THR A 85 24.691 -24.967 -16.724 1.00 0.00 O ATOM 1250 CB THR A 85 23.226 -27.418 -18.758 1.00 0.00 C ATOM 1251 OG1 THR A 85 21.925 -27.935 -19.060 1.00 0.00 O ATOM 1252 CG2 THR A 85 23.915 -28.323 -17.747 1.00 0.00 C ATOM 0 H THR A 85 22.153 -25.562 -20.034 1.00 0.00 H new ATOM 0 HA THR A 85 22.465 -25.984 -17.336 1.00 0.00 H new ATOM 0 HB THR A 85 23.826 -27.392 -19.667 1.00 0.00 H new ATOM 0 HG1 THR A 85 22.008 -28.848 -19.406 1.00 0.00 H new ATOM 0 HG21 THR A 85 23.986 -29.333 -18.152 1.00 0.00 H new ATOM 0 HG22 THR A 85 24.916 -27.943 -17.541 1.00 0.00 H new ATOM 0 HG23 THR A 85 23.337 -28.342 -16.823 1.00 0.00 H new ATOM 1260 N SER A 86 25.454 -25.641 -18.731 1.00 0.00 N ATOM 1261 CA SER A 86 26.824 -25.210 -18.478 1.00 0.00 C ATOM 1262 C SER A 86 27.712 -25.487 -19.687 1.00 0.00 C ATOM 1263 O SER A 86 27.226 -25.840 -20.762 1.00 0.00 O ATOM 1264 CB SER A 86 27.385 -25.920 -17.245 1.00 0.00 C ATOM 1265 OG SER A 86 28.065 -25.010 -16.398 1.00 0.00 O ATOM 0 H SER A 86 25.307 -26.064 -19.647 1.00 0.00 H new ATOM 0 HA SER A 86 26.813 -24.135 -18.296 1.00 0.00 H new ATOM 0 HB2 SER A 86 26.573 -26.396 -16.695 1.00 0.00 H new ATOM 0 HB3 SER A 86 28.067 -26.711 -17.556 1.00 0.00 H new ATOM 0 HG SER A 86 28.413 -25.488 -15.616 1.00 0.00 H new ATOM 1271 N LEU A 87 29.018 -25.324 -19.503 1.00 0.00 N ATOM 1272 CA LEU A 87 29.976 -25.556 -20.578 1.00 0.00 C ATOM 1273 C LEU A 87 30.888 -26.734 -20.249 1.00 0.00 C ATOM 1274 O LEU A 87 30.653 -27.464 -19.286 1.00 0.00 O ATOM 1275 CB LEU A 87 30.815 -24.299 -20.820 1.00 0.00 C ATOM 1276 CG LEU A 87 30.036 -22.993 -20.974 1.00 0.00 C ATOM 1277 CD1 LEU A 87 29.952 -22.261 -19.643 1.00 0.00 C ATOM 1278 CD2 LEU A 87 30.682 -22.108 -22.031 1.00 0.00 C ATOM 0 H LEU A 87 29.437 -25.032 -18.620 1.00 0.00 H new ATOM 0 HA LEU A 87 29.418 -25.793 -21.484 1.00 0.00 H new ATOM 0 HB2 LEU A 87 31.513 -24.187 -19.990 1.00 0.00 H new ATOM 0 HB3 LEU A 87 31.411 -24.452 -21.720 1.00 0.00 H new ATOM 0 HG LEU A 87 29.023 -23.233 -21.298 1.00 0.00 H new ATOM 0 HD11 LEU A 87 29.394 -21.334 -19.772 1.00 0.00 H new ATOM 0 HD12 LEU A 87 29.444 -22.891 -18.913 1.00 0.00 H new ATOM 0 HD13 LEU A 87 30.957 -22.033 -19.289 1.00 0.00 H new ATOM 0 HD21 LEU A 87 30.114 -21.183 -22.127 1.00 0.00 H new ATOM 0 HD22 LEU A 87 31.705 -21.877 -21.736 1.00 0.00 H new ATOM 0 HD23 LEU A 87 30.690 -22.630 -22.988 1.00 0.00 H new ATOM 1290 N ARG A 88 31.931 -26.911 -21.054 1.00 0.00 N ATOM 1291 CA ARG A 88 32.879 -27.999 -20.848 1.00 0.00 C ATOM 1292 C ARG A 88 34.299 -27.462 -20.698 1.00 0.00 C ATOM 1293 O ARG A 88 34.528 -26.256 -20.778 1.00 0.00 O ATOM 1294 CB ARG A 88 32.816 -28.986 -22.015 1.00 0.00 C ATOM 1295 CG ARG A 88 32.561 -30.422 -21.586 1.00 0.00 C ATOM 1296 CD ARG A 88 33.361 -31.405 -22.426 1.00 0.00 C ATOM 1297 NE ARG A 88 34.664 -31.696 -21.834 1.00 0.00 N ATOM 1298 CZ ARG A 88 35.380 -32.775 -22.128 1.00 0.00 C ATOM 1299 NH1 ARG A 88 34.922 -33.661 -23.002 1.00 0.00 N ATOM 1300 NH2 ARG A 88 36.558 -32.970 -21.548 1.00 0.00 N ATOM 0 H ARG A 88 32.141 -26.315 -21.855 1.00 0.00 H new ATOM 0 HA ARG A 88 32.606 -28.516 -19.928 1.00 0.00 H new ATOM 0 HB2 ARG A 88 32.027 -28.675 -22.700 1.00 0.00 H new ATOM 0 HB3 ARG A 88 33.754 -28.942 -22.568 1.00 0.00 H new ATOM 0 HG2 ARG A 88 32.825 -30.541 -20.535 1.00 0.00 H new ATOM 0 HG3 ARG A 88 31.498 -30.646 -21.675 1.00 0.00 H new ATOM 0 HD2 ARG A 88 32.797 -32.331 -22.535 1.00 0.00 H new ATOM 0 HD3 ARG A 88 33.500 -30.997 -23.427 1.00 0.00 H new ATOM 0 HE ARG A 88 35.045 -31.034 -21.158 1.00 0.00 H new ATOM 0 HH11 ARG A 88 34.018 -33.515 -23.450 1.00 0.00 H new ATOM 0 HH12 ARG A 88 35.474 -34.489 -23.226 1.00 0.00 H new ATOM 0 HH21 ARG A 88 36.914 -32.291 -20.876 1.00 0.00 H new ATOM 0 HH22 ARG A 88 37.107 -33.799 -21.775 1.00 0.00 H new ATOM 1314 N GLU A 89 35.248 -28.367 -20.479 1.00 0.00 N ATOM 1315 CA GLU A 89 36.645 -27.982 -20.316 1.00 0.00 C ATOM 1316 C GLU A 89 37.566 -29.184 -20.510 1.00 0.00 C ATOM 1317 O GLU A 89 37.131 -30.251 -20.943 1.00 0.00 O ATOM 1318 CB GLU A 89 36.871 -27.371 -18.931 1.00 0.00 C ATOM 1319 CG GLU A 89 36.829 -28.388 -17.803 1.00 0.00 C ATOM 1320 CD GLU A 89 36.175 -27.841 -16.549 1.00 0.00 C ATOM 1321 OE1 GLU A 89 34.965 -27.534 -16.597 1.00 0.00 O ATOM 1322 OE2 GLU A 89 36.872 -27.719 -15.520 1.00 0.00 O ATOM 0 H GLU A 89 35.075 -29.370 -20.410 1.00 0.00 H new ATOM 0 HA GLU A 89 36.881 -27.238 -21.076 1.00 0.00 H new ATOM 0 HB2 GLU A 89 37.837 -26.867 -18.919 1.00 0.00 H new ATOM 0 HB3 GLU A 89 36.112 -26.610 -18.751 1.00 0.00 H new ATOM 0 HG2 GLU A 89 36.285 -29.272 -18.136 1.00 0.00 H new ATOM 0 HG3 GLU A 89 37.844 -28.708 -17.569 1.00 0.00 H new ATOM 1329 N LYS A 90 38.842 -29.002 -20.187 1.00 0.00 N ATOM 1330 CA LYS A 90 39.826 -30.069 -20.325 1.00 0.00 C ATOM 1331 C LYS A 90 40.271 -30.579 -18.957 1.00 0.00 C ATOM 1332 O LYS A 90 39.683 -30.229 -17.934 1.00 0.00 O ATOM 1333 CB LYS A 90 41.040 -29.573 -21.115 1.00 0.00 C ATOM 1334 CG LYS A 90 41.526 -30.558 -22.164 1.00 0.00 C ATOM 1335 CD LYS A 90 42.368 -29.871 -23.226 1.00 0.00 C ATOM 1336 CE LYS A 90 43.575 -30.713 -23.611 1.00 0.00 C ATOM 1337 NZ LYS A 90 44.634 -29.897 -24.267 1.00 0.00 N ATOM 0 H LYS A 90 39.219 -28.125 -19.828 1.00 0.00 H new ATOM 0 HA LYS A 90 39.359 -30.892 -20.866 1.00 0.00 H new ATOM 0 HB2 LYS A 90 40.786 -28.632 -21.602 1.00 0.00 H new ATOM 0 HB3 LYS A 90 41.854 -29.363 -20.421 1.00 0.00 H new ATOM 0 HG2 LYS A 90 42.112 -31.342 -21.684 1.00 0.00 H new ATOM 0 HG3 LYS A 90 40.670 -31.042 -22.634 1.00 0.00 H new ATOM 0 HD2 LYS A 90 41.758 -29.682 -24.109 1.00 0.00 H new ATOM 0 HD3 LYS A 90 42.702 -28.902 -22.856 1.00 0.00 H new ATOM 0 HE2 LYS A 90 43.984 -31.190 -22.720 1.00 0.00 H new ATOM 0 HE3 LYS A 90 43.262 -31.511 -24.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 45.439 -30.507 -24.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 44.252 -29.462 -25.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 44.952 -29.152 -23.615 1.00 0.00 H new ATOM 1351 N ILE A 91 41.311 -31.405 -18.949 1.00 0.00 N ATOM 1352 CA ILE A 91 41.835 -31.959 -17.707 1.00 0.00 C ATOM 1353 C ILE A 91 42.677 -30.932 -16.958 1.00 0.00 C ATOM 1354 O ILE A 91 42.421 -30.635 -15.791 1.00 0.00 O ATOM 1355 CB ILE A 91 42.689 -33.215 -17.967 1.00 0.00 C ATOM 1356 CG1 ILE A 91 41.935 -34.193 -18.870 1.00 0.00 C ATOM 1357 CG2 ILE A 91 43.065 -33.881 -16.652 1.00 0.00 C ATOM 1358 CD1 ILE A 91 42.738 -35.422 -19.233 1.00 0.00 C ATOM 0 H ILE A 91 41.807 -31.705 -19.788 1.00 0.00 H new ATOM 0 HA ILE A 91 40.975 -32.234 -17.097 1.00 0.00 H new ATOM 0 HB ILE A 91 43.606 -32.915 -18.475 1.00 0.00 H new ATOM 0 HG12 ILE A 91 41.017 -34.503 -18.370 1.00 0.00 H new ATOM 0 HG13 ILE A 91 41.641 -33.678 -19.784 1.00 0.00 H new ATOM 0 HG21 ILE A 91 43.668 -34.767 -16.852 1.00 0.00 H new ATOM 0 HG22 ILE A 91 43.637 -33.183 -16.041 1.00 0.00 H new ATOM 0 HG23 ILE A 91 42.159 -34.171 -16.119 1.00 0.00 H new ATOM 0 HD11 ILE A 91 42.141 -36.070 -19.874 1.00 0.00 H new ATOM 0 HD12 ILE A 91 43.643 -35.122 -19.762 1.00 0.00 H new ATOM 0 HD13 ILE A 91 43.010 -35.960 -18.325 1.00 0.00 H new ATOM 1370 N LYS A 92 43.683 -30.391 -17.637 1.00 0.00 N ATOM 1371 CA LYS A 92 44.562 -29.393 -17.038 1.00 0.00 C ATOM 1372 C LYS A 92 45.516 -30.039 -16.039 1.00 0.00 C ATOM 1373 O LYS A 92 46.734 -29.999 -16.216 1.00 0.00 O ATOM 1374 CB LYS A 92 43.737 -28.308 -16.343 1.00 0.00 C ATOM 1375 CG LYS A 92 44.446 -26.968 -16.254 1.00 0.00 C ATOM 1376 CD LYS A 92 44.933 -26.687 -14.842 1.00 0.00 C ATOM 1377 CE LYS A 92 46.315 -27.275 -14.601 1.00 0.00 C ATOM 1378 NZ LYS A 92 47.323 -26.220 -14.305 1.00 0.00 N ATOM 0 H LYS A 92 43.910 -30.627 -18.603 1.00 0.00 H new ATOM 0 HA LYS A 92 45.151 -28.938 -17.835 1.00 0.00 H new ATOM 0 HB2 LYS A 92 42.798 -28.178 -16.880 1.00 0.00 H new ATOM 0 HB3 LYS A 92 43.485 -28.644 -15.337 1.00 0.00 H new ATOM 0 HG2 LYS A 92 45.292 -26.957 -16.941 1.00 0.00 H new ATOM 0 HG3 LYS A 92 43.768 -26.175 -16.571 1.00 0.00 H new ATOM 0 HD2 LYS A 92 44.960 -25.611 -14.673 1.00 0.00 H new ATOM 0 HD3 LYS A 92 44.228 -27.105 -14.123 1.00 0.00 H new ATOM 0 HE2 LYS A 92 46.270 -27.978 -13.769 1.00 0.00 H new ATOM 0 HE3 LYS A 92 46.628 -27.840 -15.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 48.251 -26.661 -14.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 47.384 -25.563 -15.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 47.038 -25.697 -13.452 1.00 0.00 H new ATOM 1392 N GLN A 93 44.956 -30.634 -14.991 1.00 0.00 N ATOM 1393 CA GLN A 93 45.759 -31.289 -13.965 1.00 0.00 C ATOM 1394 C GLN A 93 46.666 -32.350 -14.579 1.00 0.00 C ATOM 1395 O GLN A 93 47.713 -32.682 -14.024 1.00 0.00 O ATOM 1396 CB GLN A 93 44.854 -31.924 -12.908 1.00 0.00 C ATOM 1397 CG GLN A 93 45.583 -32.294 -11.626 1.00 0.00 C ATOM 1398 CD GLN A 93 45.797 -31.103 -10.713 1.00 0.00 C ATOM 1399 OE1 GLN A 93 46.648 -30.252 -10.972 1.00 0.00 O ATOM 1400 NE2 GLN A 93 45.024 -31.037 -9.635 1.00 0.00 N ATOM 0 H GLN A 93 43.950 -30.676 -14.830 1.00 0.00 H new ATOM 0 HA GLN A 93 46.385 -30.533 -13.491 1.00 0.00 H new ATOM 0 HB2 GLN A 93 44.046 -31.232 -12.670 1.00 0.00 H new ATOM 0 HB3 GLN A 93 44.394 -32.819 -13.326 1.00 0.00 H new ATOM 0 HG2 GLN A 93 45.013 -33.056 -11.095 1.00 0.00 H new ATOM 0 HG3 GLN A 93 46.548 -32.734 -11.875 1.00 0.00 H new ATOM 0 HE21 GLN A 93 44.331 -31.765 -9.459 1.00 0.00 H new ATOM 0 HE22 GLN A 93 45.123 -30.259 -8.983 1.00 0.00 H new ATOM 1409 N ALA A 94 46.257 -32.879 -15.728 1.00 0.00 N ATOM 1410 CA ALA A 94 47.034 -33.901 -16.418 1.00 0.00 C ATOM 1411 C ALA A 94 48.481 -33.458 -16.605 1.00 0.00 C ATOM 1412 O ALA A 94 49.397 -34.281 -16.608 1.00 0.00 O ATOM 1413 CB ALA A 94 46.401 -34.227 -17.763 1.00 0.00 C ATOM 0 H ALA A 94 45.392 -32.616 -16.200 1.00 0.00 H new ATOM 0 HA ALA A 94 47.034 -34.800 -15.802 1.00 0.00 H new ATOM 0 HB1 ALA A 94 46.992 -34.992 -18.267 1.00 0.00 H new ATOM 0 HB2 ALA A 94 45.387 -34.595 -17.608 1.00 0.00 H new ATOM 0 HB3 ALA A 94 46.370 -33.328 -18.378 1.00 0.00 H new ATOM 1419 N VAL A 95 48.680 -32.153 -16.761 1.00 0.00 N ATOM 1420 CA VAL A 95 50.016 -31.601 -16.948 1.00 0.00 C ATOM 1421 C VAL A 95 50.945 -32.012 -15.811 1.00 0.00 C ATOM 1422 O VAL A 95 52.162 -32.073 -15.981 1.00 0.00 O ATOM 1423 CB VAL A 95 49.981 -30.063 -17.036 1.00 0.00 C ATOM 1424 CG1 VAL A 95 49.563 -29.461 -15.703 1.00 0.00 C ATOM 1425 CG2 VAL A 95 51.334 -29.524 -17.473 1.00 0.00 C ATOM 0 H VAL A 95 47.933 -31.459 -16.762 1.00 0.00 H new ATOM 0 HA VAL A 95 50.395 -32.003 -17.887 1.00 0.00 H new ATOM 0 HB VAL A 95 49.242 -29.776 -17.784 1.00 0.00 H new ATOM 0 HG11 VAL A 95 49.544 -28.374 -15.785 1.00 0.00 H new ATOM 0 HG12 VAL A 95 48.570 -29.822 -15.436 1.00 0.00 H new ATOM 0 HG13 VAL A 95 50.275 -29.755 -14.932 1.00 0.00 H new ATOM 0 HG21 VAL A 95 51.291 -28.436 -17.530 1.00 0.00 H new ATOM 0 HG22 VAL A 95 52.094 -29.820 -16.750 1.00 0.00 H new ATOM 0 HG23 VAL A 95 51.588 -29.929 -18.453 1.00 0.00 H new ATOM 1435 N GLY A 96 50.362 -32.295 -14.650 1.00 0.00 N ATOM 1436 CA GLY A 96 51.152 -32.698 -13.502 1.00 0.00 C ATOM 1437 C GLY A 96 52.004 -33.920 -13.784 1.00 0.00 C ATOM 1438 O GLY A 96 53.016 -34.147 -13.120 1.00 0.00 O ATOM 0 H GLY A 96 49.356 -32.252 -14.484 1.00 0.00 H new ATOM 0 HA2 GLY A 96 51.796 -31.872 -13.200 1.00 0.00 H new ATOM 0 HA3 GLY A 96 50.488 -32.908 -12.663 1.00 0.00 H new ATOM 1442 N VAL A 97 51.595 -34.710 -14.772 1.00 0.00 N ATOM 1443 CA VAL A 97 52.327 -35.915 -15.140 1.00 0.00 C ATOM 1444 C VAL A 97 53.659 -35.570 -15.797 1.00 0.00 C ATOM 1445 O VAL A 97 54.615 -36.343 -15.730 1.00 0.00 O ATOM 1446 CB VAL A 97 51.508 -36.798 -16.100 1.00 0.00 C ATOM 1447 CG1 VAL A 97 52.211 -38.127 -16.334 1.00 0.00 C ATOM 1448 CG2 VAL A 97 50.105 -37.017 -15.555 1.00 0.00 C ATOM 0 H VAL A 97 50.760 -34.536 -15.332 1.00 0.00 H new ATOM 0 HA VAL A 97 52.512 -36.467 -14.218 1.00 0.00 H new ATOM 0 HB VAL A 97 51.425 -36.284 -17.058 1.00 0.00 H new ATOM 0 HG11 VAL A 97 51.618 -38.738 -17.015 1.00 0.00 H new ATOM 0 HG12 VAL A 97 53.193 -37.947 -16.771 1.00 0.00 H new ATOM 0 HG13 VAL A 97 52.326 -38.650 -15.385 1.00 0.00 H new ATOM 0 HG21 VAL A 97 49.540 -37.643 -16.246 1.00 0.00 H new ATOM 0 HG22 VAL A 97 50.164 -37.510 -14.585 1.00 0.00 H new ATOM 0 HG23 VAL A 97 49.604 -36.056 -15.444 1.00 0.00 H new ATOM 1458 N ASP A 98 53.715 -34.403 -16.430 1.00 0.00 N ATOM 1459 CA ASP A 98 54.931 -33.954 -17.098 1.00 0.00 C ATOM 1460 C ASP A 98 56.006 -33.587 -16.080 1.00 0.00 C ATOM 1461 O ASP A 98 57.193 -33.531 -16.407 1.00 0.00 O ATOM 1462 CB ASP A 98 54.630 -32.753 -17.996 1.00 0.00 C ATOM 1463 CG ASP A 98 55.696 -32.540 -19.054 1.00 0.00 C ATOM 1464 OD1 ASP A 98 56.677 -31.820 -18.771 1.00 0.00 O ATOM 1465 OD2 ASP A 98 55.549 -33.093 -20.163 1.00 0.00 O ATOM 0 H ASP A 98 52.933 -33.751 -16.494 1.00 0.00 H new ATOM 0 HA ASP A 98 55.303 -34.774 -17.713 1.00 0.00 H new ATOM 0 HB2 ASP A 98 53.665 -32.898 -18.481 1.00 0.00 H new ATOM 0 HB3 ASP A 98 54.547 -31.856 -17.382 1.00 0.00 H new ATOM 1470 N LEU A 99 55.584 -33.336 -14.846 1.00 0.00 N ATOM 1471 CA LEU A 99 56.511 -32.973 -13.779 1.00 0.00 C ATOM 1472 C LEU A 99 57.373 -34.166 -13.378 1.00 0.00 C ATOM 1473 O LEU A 99 58.599 -34.069 -13.327 1.00 0.00 O ATOM 1474 CB LEU A 99 55.742 -32.453 -12.564 1.00 0.00 C ATOM 1475 CG LEU A 99 54.576 -31.510 -12.861 1.00 0.00 C ATOM 1476 CD1 LEU A 99 53.877 -31.103 -11.573 1.00 0.00 C ATOM 1477 CD2 LEU A 99 55.063 -30.281 -13.616 1.00 0.00 C ATOM 0 H LEU A 99 54.606 -33.377 -14.559 1.00 0.00 H new ATOM 0 HA LEU A 99 57.165 -32.185 -14.151 1.00 0.00 H new ATOM 0 HB2 LEU A 99 55.359 -33.309 -12.008 1.00 0.00 H new ATOM 0 HB3 LEU A 99 56.443 -31.936 -11.909 1.00 0.00 H new ATOM 0 HG LEU A 99 53.858 -32.038 -13.489 1.00 0.00 H new ATOM 0 HD11 LEU A 99 53.050 -30.432 -11.804 1.00 0.00 H new ATOM 0 HD12 LEU A 99 53.494 -31.991 -11.071 1.00 0.00 H new ATOM 0 HD13 LEU A 99 54.586 -30.594 -10.920 1.00 0.00 H new ATOM 0 HD21 LEU A 99 54.220 -29.621 -13.819 1.00 0.00 H new ATOM 0 HD22 LEU A 99 55.801 -29.752 -13.013 1.00 0.00 H new ATOM 0 HD23 LEU A 99 55.518 -30.589 -14.558 1.00 0.00 H new ATOM 1489 N TRP A 100 56.724 -35.290 -13.096 1.00 0.00 N ATOM 1490 CA TRP A 100 57.432 -36.502 -12.701 1.00 0.00 C ATOM 1491 C TRP A 100 58.164 -37.117 -13.889 1.00 0.00 C ATOM 1492 O TRP A 100 59.174 -37.800 -13.723 1.00 0.00 O ATOM 1493 CB TRP A 100 56.454 -37.518 -12.108 1.00 0.00 C ATOM 1494 CG TRP A 100 55.940 -38.504 -13.113 1.00 0.00 C ATOM 1495 CD1 TRP A 100 54.759 -38.438 -13.796 1.00 0.00 C ATOM 1496 CD2 TRP A 100 56.589 -39.704 -13.547 1.00 0.00 C ATOM 1497 NE1 TRP A 100 54.635 -39.524 -14.627 1.00 0.00 N ATOM 1498 CE2 TRP A 100 55.745 -40.316 -14.494 1.00 0.00 C ATOM 1499 CE3 TRP A 100 57.802 -40.320 -13.228 1.00 0.00 C ATOM 1500 CZ2 TRP A 100 56.076 -41.513 -15.123 1.00 0.00 C ATOM 1501 CZ3 TRP A 100 58.130 -41.509 -13.853 1.00 0.00 C ATOM 1502 CH2 TRP A 100 57.270 -42.094 -14.792 1.00 0.00 C ATOM 0 H TRP A 100 55.709 -35.387 -13.134 1.00 0.00 H new ATOM 0 HA TRP A 100 58.169 -36.232 -11.944 1.00 0.00 H new ATOM 0 HB2 TRP A 100 56.948 -38.058 -11.300 1.00 0.00 H new ATOM 0 HB3 TRP A 100 55.611 -36.986 -11.668 1.00 0.00 H new ATOM 0 HD1 TRP A 100 54.030 -37.648 -13.697 1.00 0.00 H new ATOM 0 HE1 TRP A 100 53.844 -39.711 -15.244 1.00 0.00 H new ATOM 0 HE3 TRP A 100 58.471 -39.875 -12.506 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 55.414 -41.967 -15.846 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 59.064 -41.995 -13.614 1.00 0.00 H new ATOM 0 HH2 TRP A 100 57.555 -43.022 -15.264 1.00 0.00 H new ATOM 1513 N LYS A 101 57.649 -36.869 -15.089 1.00 0.00 N ATOM 1514 CA LYS A 101 58.254 -37.396 -16.306 1.00 0.00 C ATOM 1515 C LYS A 101 59.735 -37.038 -16.376 1.00 0.00 C ATOM 1516 O LYS A 101 60.123 -35.902 -16.103 1.00 0.00 O ATOM 1517 CB LYS A 101 57.528 -36.852 -17.538 1.00 0.00 C ATOM 1518 CG LYS A 101 57.871 -37.589 -18.821 1.00 0.00 C ATOM 1519 CD LYS A 101 56.792 -37.407 -19.875 1.00 0.00 C ATOM 1520 CE LYS A 101 57.359 -36.820 -21.158 1.00 0.00 C ATOM 1521 NZ LYS A 101 57.894 -37.876 -22.062 1.00 0.00 N ATOM 0 H LYS A 101 56.813 -36.306 -15.244 1.00 0.00 H new ATOM 0 HA LYS A 101 58.161 -38.482 -16.287 1.00 0.00 H new ATOM 0 HB2 LYS A 101 56.452 -36.911 -17.371 1.00 0.00 H new ATOM 0 HB3 LYS A 101 57.774 -35.797 -17.658 1.00 0.00 H new ATOM 0 HG2 LYS A 101 58.823 -37.225 -19.207 1.00 0.00 H new ATOM 0 HG3 LYS A 101 57.998 -38.651 -18.609 1.00 0.00 H new ATOM 0 HD2 LYS A 101 56.325 -38.368 -20.089 1.00 0.00 H new ATOM 0 HD3 LYS A 101 56.011 -36.752 -19.488 1.00 0.00 H new ATOM 0 HE2 LYS A 101 56.581 -36.259 -21.676 1.00 0.00 H new ATOM 0 HE3 LYS A 101 58.153 -36.114 -20.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 58.271 -37.436 -22.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 58.654 -38.395 -21.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 57.131 -38.536 -22.315 1.00 0.00 H new TER 1535 LYS A 101