USER MOD reduce.3.24.130724 H: found=0, std=0, add=853, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 850 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 62 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 63 MET CE :methyl 162:sc= -0.0211 (180deg=-0.257) USER MOD Set 2.1: A 5 HIS :FLIP no HD1:sc= -3.94 F(o=-8.4!,f=-3.8) USER MOD Set 2.2: A 7 TYR OH : rot 74:sc= 0.139 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -149:sc= 0.0349 (180deg=-0.431) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 65:sc= 0.308! USER MOD Single : A 11 SER OG : rot 41:sc= -5.94! USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot -78:sc= 1.02 USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.675 USER MOD Single : A 17 SER OG : rot 180:sc= 0.00266 USER MOD Single : A 21 SER OG : rot 23:sc= 0.307! USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 MET CE :methyl -106:sc= -3.94 (180deg=-12!) USER MOD Single : A 26 GLN : amide:sc= -0.157 K(o=-0.16,f=-0.98) USER MOD Single : A 29 LYS NZ :NH3+ 175:sc= -0.0773 (180deg=-0.143) USER MOD Single : A 30 TYR OH : rot 150:sc=-0.000988 USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0262 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 1.04 K(o=1,f=-0.047) USER MOD Single : A 50 ASN : amide:sc= -0.19 X(o=-0.19,f=-0.0041) USER MOD Single : A 59 GLN : amide:sc= -8.05! C(o=-8.1!,f=-8.5!) USER MOD Single : A 68 GLN : amide:sc= -0.36 X(o=-0.36,f=0) USER MOD Single : A 73 ASN : amide:sc= -2.34 K(o=-2.3,f=-7.6!) USER MOD Single : A 74 LYS NZ :NH3+ -178:sc= 1.13 (180deg=1.06) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= -5.96! USER MOD Single : A 86 LYS NZ :NH3+ -169:sc= -0.91 (180deg=-1.38) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 176:sc= -5.43! (180deg=-5.65!) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.115 14.501 2.491 1.00 0.00 N ATOM 2 CA MET A 1 7.134 14.100 3.514 1.00 0.00 C ATOM 3 C MET A 1 6.681 14.596 4.905 1.00 0.00 C ATOM 4 O MET A 1 5.485 14.786 5.180 1.00 0.00 O ATOM 5 CB MET A 1 8.502 14.741 3.146 1.00 0.00 C ATOM 6 CG MET A 1 8.879 14.428 1.697 1.00 0.00 C ATOM 7 SD MET A 1 10.660 14.056 1.417 1.00 0.00 S ATOM 8 CE MET A 1 11.286 15.712 1.110 1.00 0.00 C ATOM 0 H1 MET A 1 6.093 13.795 1.728 1.00 0.00 H new ATOM 0 H2 MET A 1 5.178 14.557 2.938 1.00 0.00 H new ATOM 0 H3 MET A 1 6.366 15.430 2.096 1.00 0.00 H new ATOM 0 HA MET A 1 7.235 13.015 3.534 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.452 15.821 3.288 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.276 14.367 3.816 1.00 0.00 H new ATOM 0 HG2 MET A 1 8.288 13.576 1.360 1.00 0.00 H new ATOM 0 HG3 MET A 1 8.599 15.277 1.073 1.00 0.00 H new ATOM 0 HE1 MET A 1 12.358 15.666 0.921 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.782 16.136 0.242 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.098 16.339 1.981 1.00 0.00 H new ATOM 18 N GLU A 2 7.667 14.711 5.814 1.00 0.00 N ATOM 19 CA GLU A 2 7.455 15.002 7.254 1.00 0.00 C ATOM 20 C GLU A 2 6.948 13.750 7.987 1.00 0.00 C ATOM 21 O GLU A 2 5.986 13.812 8.743 1.00 0.00 O ATOM 22 CB GLU A 2 6.432 16.157 7.414 1.00 0.00 C ATOM 23 CG GLU A 2 6.382 16.597 8.891 1.00 0.00 C ATOM 24 CD GLU A 2 4.965 16.682 9.488 1.00 0.00 C ATOM 25 OE1 GLU A 2 4.011 16.533 8.690 1.00 0.00 O ATOM 26 OE2 GLU A 2 4.870 16.862 10.734 1.00 0.00 O ATOM 0 H GLU A 2 8.651 14.603 5.570 1.00 0.00 H new ATOM 0 HA GLU A 2 8.407 15.301 7.693 1.00 0.00 H new ATOM 0 HB2 GLU A 2 6.715 16.999 6.782 1.00 0.00 H new ATOM 0 HB3 GLU A 2 5.445 15.831 7.087 1.00 0.00 H new ATOM 0 HG2 GLU A 2 6.971 15.898 9.485 1.00 0.00 H new ATOM 0 HG3 GLU A 2 6.859 17.573 8.982 1.00 0.00 H new ATOM 33 N LYS A 3 7.624 12.589 7.709 1.00 0.00 N ATOM 34 CA LYS A 3 7.144 11.281 8.353 1.00 0.00 C ATOM 35 C LYS A 3 5.681 11.010 7.884 1.00 0.00 C ATOM 36 O LYS A 3 4.775 11.764 8.126 1.00 0.00 O ATOM 37 CB LYS A 3 7.157 11.543 9.886 1.00 0.00 C ATOM 38 CG LYS A 3 8.357 11.016 10.601 1.00 0.00 C ATOM 39 CD LYS A 3 9.302 10.022 9.935 1.00 0.00 C ATOM 40 CE LYS A 3 10.658 10.013 10.719 1.00 0.00 C ATOM 41 NZ LYS A 3 11.553 8.985 10.187 1.00 0.00 N ATOM 0 H LYS A 3 8.437 12.510 7.098 1.00 0.00 H new ATOM 0 HA LYS A 3 7.766 10.427 8.085 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.092 12.617 10.057 1.00 0.00 H new ATOM 0 HB3 LYS A 3 6.265 11.096 10.324 1.00 0.00 H new ATOM 0 HG2 LYS A 3 8.957 11.878 10.893 1.00 0.00 H new ATOM 0 HG3 LYS A 3 8.000 10.549 11.519 1.00 0.00 H new ATOM 0 HD2 LYS A 3 8.861 9.025 9.932 1.00 0.00 H new ATOM 0 HD3 LYS A 3 9.469 10.299 8.894 1.00 0.00 H new ATOM 0 HE2 LYS A 3 11.134 10.991 10.645 1.00 0.00 H new ATOM 0 HE3 LYS A 3 10.472 9.829 11.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 12.447 8.994 10.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 11.104 8.052 10.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 11.746 9.178 9.183 1.00 0.00 H new ATOM 55 N LYS A 4 5.591 9.847 7.153 1.00 0.00 N ATOM 56 CA LYS A 4 4.336 9.629 6.333 1.00 0.00 C ATOM 57 C LYS A 4 4.161 8.217 5.863 1.00 0.00 C ATOM 58 O LYS A 4 5.051 7.488 5.412 1.00 0.00 O ATOM 59 CB LYS A 4 4.102 10.697 5.343 1.00 0.00 C ATOM 60 CG LYS A 4 3.815 10.186 3.922 1.00 0.00 C ATOM 61 CD LYS A 4 5.030 9.451 3.305 1.00 0.00 C ATOM 62 CE LYS A 4 5.927 10.474 2.621 1.00 0.00 C ATOM 63 NZ LYS A 4 6.128 10.170 1.203 1.00 0.00 N ATOM 0 H LYS A 4 6.294 9.110 7.109 1.00 0.00 H new ATOM 0 HA LYS A 4 3.490 9.743 7.011 1.00 0.00 H new ATOM 0 HB2 LYS A 4 3.262 11.307 5.675 1.00 0.00 H new ATOM 0 HB3 LYS A 4 4.976 11.348 5.314 1.00 0.00 H new ATOM 0 HG2 LYS A 4 2.959 9.511 3.947 1.00 0.00 H new ATOM 0 HG3 LYS A 4 3.540 11.026 3.285 1.00 0.00 H new ATOM 0 HD2 LYS A 4 5.584 8.922 4.080 1.00 0.00 H new ATOM 0 HD3 LYS A 4 4.694 8.704 2.586 1.00 0.00 H new ATOM 0 HE2 LYS A 4 5.486 11.466 2.720 1.00 0.00 H new ATOM 0 HE3 LYS A 4 6.893 10.503 3.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 6.744 10.891 0.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 6.573 9.235 1.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 5.210 10.167 0.715 1.00 0.00 H new ATOM 77 N HIS A 5 2.896 7.696 6.065 1.00 0.00 N ATOM 78 CA HIS A 5 2.472 6.352 5.796 1.00 0.00 C ATOM 79 C HIS A 5 2.363 5.994 4.282 1.00 0.00 C ATOM 80 O HIS A 5 1.937 6.765 3.447 1.00 0.00 O ATOM 81 CB HIS A 5 1.129 6.026 6.487 1.00 0.00 C ATOM 82 CG HIS A 5 0.852 6.857 7.737 1.00 0.00 C ATOM 83 ND1 HIS A 5 1.480 6.711 8.925 1.00 0.00 N flip ATOM 84 CD2 HIS A 5 0.044 7.944 7.833 1.00 0.00 C flip ATOM 85 CE1 HIS A 5 0.873 7.546 9.795 1.00 0.00 C flip ATOM 86 NE2 HIS A 5 0.202 8.465 9.091 1.00 0.00 N flip ATOM 0 H HIS A 5 2.140 8.268 6.440 1.00 0.00 H new ATOM 0 HA HIS A 5 3.270 5.737 6.213 1.00 0.00 H new ATOM 0 HB2 HIS A 5 0.319 6.181 5.774 1.00 0.00 H new ATOM 0 HB3 HIS A 5 1.119 4.970 6.756 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -0.605 8.328 7.060 1.00 0.00 H new ATOM 0 HE1 HIS A 5 0.921 7.483 10.872 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -0.126 9.372 9.424 1.00 0.00 H new ATOM 94 N ILE A 6 2.656 4.709 4.026 1.00 0.00 N ATOM 95 CA ILE A 6 1.964 3.838 3.007 1.00 0.00 C ATOM 96 C ILE A 6 1.339 2.679 3.841 1.00 0.00 C ATOM 97 O ILE A 6 1.851 2.352 4.937 1.00 0.00 O ATOM 98 CB ILE A 6 3.054 3.337 2.009 1.00 0.00 C ATOM 99 CG1 ILE A 6 3.672 4.486 1.206 1.00 0.00 C ATOM 100 CG2 ILE A 6 2.591 2.174 1.126 1.00 0.00 C ATOM 101 CD1 ILE A 6 4.829 4.140 0.261 1.00 0.00 C ATOM 0 H ILE A 6 3.397 4.215 4.524 1.00 0.00 H new ATOM 0 HA ILE A 6 1.190 4.336 2.423 1.00 0.00 H new ATOM 0 HB ILE A 6 3.851 2.921 2.624 1.00 0.00 H new ATOM 0 HG12 ILE A 6 2.881 4.949 0.616 1.00 0.00 H new ATOM 0 HG13 ILE A 6 4.026 5.238 1.911 1.00 0.00 H new ATOM 0 HG21 ILE A 6 3.401 1.879 0.458 1.00 0.00 H new ATOM 0 HG22 ILE A 6 2.313 1.328 1.755 1.00 0.00 H new ATOM 0 HG23 ILE A 6 1.729 2.486 0.536 1.00 0.00 H new ATOM 0 HD11 ILE A 6 5.170 5.044 -0.243 1.00 0.00 H new ATOM 0 HD12 ILE A 6 5.651 3.712 0.834 1.00 0.00 H new ATOM 0 HD13 ILE A 6 4.489 3.418 -0.481 1.00 0.00 H new ATOM 113 N TYR A 7 0.228 2.110 3.368 1.00 0.00 N ATOM 114 CA TYR A 7 -0.505 0.977 3.932 1.00 0.00 C ATOM 115 C TYR A 7 -0.962 0.014 2.840 1.00 0.00 C ATOM 116 O TYR A 7 -1.352 0.401 1.698 1.00 0.00 O ATOM 117 CB TYR A 7 -1.673 1.451 4.837 1.00 0.00 C ATOM 118 CG TYR A 7 -1.190 2.446 5.926 1.00 0.00 C ATOM 119 CD1 TYR A 7 -0.361 1.925 6.934 1.00 0.00 C ATOM 120 CD2 TYR A 7 -1.555 3.800 5.890 1.00 0.00 C ATOM 121 CE1 TYR A 7 -0.117 2.701 8.068 1.00 0.00 C ATOM 122 CE2 TYR A 7 -1.235 4.609 7.001 1.00 0.00 C ATOM 123 CZ TYR A 7 -0.569 4.056 8.079 1.00 0.00 C ATOM 124 OH TYR A 7 -0.340 4.797 9.192 1.00 0.00 O ATOM 0 H TYR A 7 -0.215 2.456 2.517 1.00 0.00 H new ATOM 0 HA TYR A 7 0.178 0.420 4.574 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.438 1.927 4.224 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -2.137 0.588 5.313 1.00 0.00 H new ATOM 0 HD1 TYR A 7 0.079 0.944 6.833 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -2.068 4.213 5.034 1.00 0.00 H new ATOM 0 HE1 TYR A 7 0.402 2.286 8.919 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -1.509 5.654 7.009 1.00 0.00 H new ATOM 0 HH TYR A 7 0.608 5.043 9.232 1.00 0.00 H new ATOM 134 N LEU A 8 -0.893 -1.302 3.152 1.00 0.00 N ATOM 135 CA LEU A 8 -1.400 -2.428 2.341 1.00 0.00 C ATOM 136 C LEU A 8 -2.637 -3.040 3.028 1.00 0.00 C ATOM 137 O LEU A 8 -2.716 -2.926 4.263 1.00 0.00 O ATOM 138 CB LEU A 8 -0.215 -3.485 2.399 1.00 0.00 C ATOM 139 CG LEU A 8 1.034 -3.159 1.611 1.00 0.00 C ATOM 140 CD1 LEU A 8 1.663 -4.409 0.930 1.00 0.00 C ATOM 141 CD2 LEU A 8 0.664 -2.100 0.462 1.00 0.00 C ATOM 0 H LEU A 8 -0.460 -1.620 4.019 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.681 -2.134 1.330 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.068 -3.620 3.443 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.598 -4.443 2.047 1.00 0.00 H new ATOM 0 HG LEU A 8 1.762 -2.758 2.316 1.00 0.00 H new ATOM 0 HD11 LEU A 8 2.556 -4.113 0.379 1.00 0.00 H new ATOM 0 HD12 LEU A 8 1.932 -5.141 1.691 1.00 0.00 H new ATOM 0 HD13 LEU A 8 0.942 -4.850 0.242 1.00 0.00 H new ATOM 0 HD21 LEU A 8 1.559 -1.858 -0.112 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.087 -2.530 -0.201 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.269 -1.192 0.918 1.00 0.00 H new ATOM 153 N PHE A 9 -3.557 -3.642 2.286 1.00 0.00 N ATOM 154 CA PHE A 9 -4.891 -4.143 2.731 1.00 0.00 C ATOM 155 C PHE A 9 -5.196 -5.495 2.153 1.00 0.00 C ATOM 156 O PHE A 9 -5.206 -5.667 0.924 1.00 0.00 O ATOM 157 CB PHE A 9 -5.877 -2.979 2.447 1.00 0.00 C ATOM 158 CG PHE A 9 -5.447 -1.655 3.167 1.00 0.00 C ATOM 159 CD1 PHE A 9 -5.043 -1.750 4.516 1.00 0.00 C ATOM 160 CD2 PHE A 9 -5.477 -0.435 2.504 1.00 0.00 C ATOM 161 CE1 PHE A 9 -4.799 -0.569 5.244 1.00 0.00 C ATOM 162 CE2 PHE A 9 -5.185 0.750 3.218 1.00 0.00 C ATOM 163 CZ PHE A 9 -4.655 0.630 4.530 1.00 0.00 C ATOM 0 H PHE A 9 -3.401 -3.814 1.293 1.00 0.00 H new ATOM 0 HA PHE A 9 -4.959 -4.371 3.795 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -5.933 -2.805 1.372 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -6.877 -3.262 2.776 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -4.922 -2.716 4.984 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.721 -0.392 1.453 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -4.725 -0.586 6.321 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -5.360 1.720 2.777 1.00 0.00 H new ATOM 0 HZ PHE A 9 -4.139 1.465 4.980 1.00 0.00 H new ATOM 173 N SER A 10 -5.218 -6.608 2.968 1.00 0.00 N ATOM 174 CA SER A 10 -4.979 -7.967 2.610 1.00 0.00 C ATOM 175 C SER A 10 -5.615 -8.532 1.361 1.00 0.00 C ATOM 176 O SER A 10 -6.448 -7.918 0.684 1.00 0.00 O ATOM 177 CB SER A 10 -5.229 -8.887 3.826 1.00 0.00 C ATOM 178 OG SER A 10 -4.873 -10.271 3.481 1.00 0.00 O ATOM 0 H SER A 10 -5.425 -6.518 3.963 1.00 0.00 H new ATOM 0 HA SER A 10 -3.930 -7.945 2.314 1.00 0.00 H new ATOM 0 HB2 SER A 10 -4.637 -8.550 4.677 1.00 0.00 H new ATOM 0 HB3 SER A 10 -6.276 -8.834 4.125 1.00 0.00 H new ATOM 0 HG SER A 10 -3.910 -10.327 3.307 1.00 0.00 H new ATOM 184 N SER A 11 -5.224 -9.807 1.052 1.00 0.00 N ATOM 185 CA SER A 11 -5.289 -10.401 -0.314 1.00 0.00 C ATOM 186 C SER A 11 -4.168 -11.438 -0.525 1.00 0.00 C ATOM 187 O SER A 11 -3.239 -11.260 -1.313 1.00 0.00 O ATOM 188 CB SER A 11 -5.204 -9.301 -1.368 1.00 0.00 C ATOM 189 OG SER A 11 -6.467 -9.214 -2.105 1.00 0.00 O ATOM 0 H SER A 11 -4.854 -10.451 1.751 1.00 0.00 H new ATOM 0 HA SER A 11 -6.244 -10.917 -0.416 1.00 0.00 H new ATOM 0 HB2 SER A 11 -4.985 -8.345 -0.891 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.385 -9.509 -2.057 1.00 0.00 H new ATOM 0 HG SER A 11 -7.217 -9.314 -1.482 1.00 0.00 H new ATOM 195 N ALA A 12 -4.276 -12.559 0.213 1.00 0.00 N ATOM 196 CA ALA A 12 -3.680 -13.861 -0.082 1.00 0.00 C ATOM 197 C ALA A 12 -3.102 -14.519 1.180 1.00 0.00 C ATOM 198 O ALA A 12 -2.098 -15.250 1.124 1.00 0.00 O ATOM 199 CB ALA A 12 -2.693 -13.835 -1.226 1.00 0.00 C ATOM 0 H ALA A 12 -4.814 -12.573 1.079 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.497 -14.491 -0.432 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.294 -14.837 -1.385 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -3.195 -13.497 -2.132 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -1.877 -13.153 -0.987 1.00 0.00 H new ATOM 205 N GLY A 13 -3.706 -14.252 2.339 1.00 0.00 N ATOM 206 CA GLY A 13 -3.159 -14.487 3.705 1.00 0.00 C ATOM 207 C GLY A 13 -1.659 -14.692 3.735 1.00 0.00 C ATOM 208 O GLY A 13 -1.145 -15.673 4.302 1.00 0.00 O ATOM 0 H GLY A 13 -4.640 -13.844 2.368 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -3.413 -13.638 4.339 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -3.645 -15.363 4.135 1.00 0.00 H new ATOM 212 N MET A 14 -0.910 -13.729 3.096 1.00 0.00 N ATOM 213 CA MET A 14 0.534 -13.448 3.420 1.00 0.00 C ATOM 214 C MET A 14 1.366 -13.528 2.123 1.00 0.00 C ATOM 215 O MET A 14 0.879 -13.904 1.059 1.00 0.00 O ATOM 216 CB MET A 14 1.011 -14.197 4.557 1.00 0.00 C ATOM 217 CG MET A 14 2.442 -14.702 4.586 1.00 0.00 C ATOM 218 SD MET A 14 2.754 -16.046 5.834 1.00 0.00 S ATOM 219 CE MET A 14 3.164 -15.028 7.261 1.00 0.00 C ATOM 0 H MET A 14 -1.284 -13.136 2.355 1.00 0.00 H new ATOM 0 HA MET A 14 0.654 -12.426 3.781 1.00 0.00 H new ATOM 0 HB2 MET A 14 0.870 -13.573 5.439 1.00 0.00 H new ATOM 0 HB3 MET A 14 0.359 -15.063 4.672 1.00 0.00 H new ATOM 0 HG2 MET A 14 2.704 -15.074 3.595 1.00 0.00 H new ATOM 0 HG3 MET A 14 3.106 -13.864 4.798 1.00 0.00 H new ATOM 0 HE1 MET A 14 3.383 -15.669 8.115 1.00 0.00 H new ATOM 0 HE2 MET A 14 4.037 -14.417 7.033 1.00 0.00 H new ATOM 0 HE3 MET A 14 2.320 -14.381 7.501 1.00 0.00 H new ATOM 229 N SER A 15 2.609 -13.025 2.249 1.00 0.00 N ATOM 230 CA SER A 15 3.371 -12.380 1.114 1.00 0.00 C ATOM 231 C SER A 15 3.192 -10.820 1.221 1.00 0.00 C ATOM 232 O SER A 15 3.861 -10.064 0.529 1.00 0.00 O ATOM 233 CB SER A 15 2.864 -12.850 -0.203 1.00 0.00 C ATOM 234 OG SER A 15 1.605 -12.199 -0.581 1.00 0.00 O ATOM 0 H SER A 15 3.128 -13.044 3.127 1.00 0.00 H new ATOM 0 HA SER A 15 4.424 -12.653 1.187 1.00 0.00 H new ATOM 0 HB2 SER A 15 3.615 -12.656 -0.969 1.00 0.00 H new ATOM 0 HB3 SER A 15 2.716 -13.929 -0.168 1.00 0.00 H new ATOM 0 HG SER A 15 0.863 -12.613 -0.093 1.00 0.00 H new ATOM 240 N THR A 16 2.277 -10.448 2.152 1.00 0.00 N ATOM 241 CA THR A 16 2.138 -9.069 2.753 1.00 0.00 C ATOM 242 C THR A 16 3.417 -8.739 3.552 1.00 0.00 C ATOM 243 O THR A 16 4.361 -8.156 3.067 1.00 0.00 O ATOM 244 CB THR A 16 0.930 -8.933 3.622 1.00 0.00 C ATOM 245 OG1 THR A 16 0.464 -10.192 4.187 1.00 0.00 O ATOM 246 CG2 THR A 16 -0.209 -8.070 3.058 1.00 0.00 C ATOM 0 H THR A 16 1.592 -11.105 2.524 1.00 0.00 H new ATOM 0 HA THR A 16 2.007 -8.360 1.935 1.00 0.00 H new ATOM 0 HB THR A 16 1.307 -8.345 4.459 1.00 0.00 H new ATOM 0 HG1 THR A 16 -0.325 -10.028 4.744 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.032 -8.042 3.772 1.00 0.00 H new ATOM 0 HG22 THR A 16 0.154 -7.057 2.883 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.558 -8.498 2.118 1.00 0.00 H new ATOM 254 N SER A 17 3.346 -9.119 4.856 1.00 0.00 N ATOM 255 CA SER A 17 4.171 -8.578 5.935 1.00 0.00 C ATOM 256 C SER A 17 5.538 -8.035 5.467 1.00 0.00 C ATOM 257 O SER A 17 5.878 -6.842 5.641 1.00 0.00 O ATOM 258 CB SER A 17 4.332 -9.559 7.064 1.00 0.00 C ATOM 259 OG SER A 17 4.096 -10.915 6.671 1.00 0.00 O ATOM 0 H SER A 17 2.691 -9.831 5.179 1.00 0.00 H new ATOM 0 HA SER A 17 3.620 -7.715 6.309 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.341 -9.475 7.469 1.00 0.00 H new ATOM 0 HB3 SER A 17 3.644 -9.295 7.867 1.00 0.00 H new ATOM 0 HG SER A 17 4.217 -11.505 7.444 1.00 0.00 H new ATOM 265 N LEU A 18 6.340 -8.928 4.812 1.00 0.00 N ATOM 266 CA LEU A 18 7.763 -8.752 4.503 1.00 0.00 C ATOM 267 C LEU A 18 7.940 -7.843 3.281 1.00 0.00 C ATOM 268 O LEU A 18 9.101 -7.506 2.952 1.00 0.00 O ATOM 269 CB LEU A 18 8.359 -10.141 4.240 1.00 0.00 C ATOM 270 CG LEU A 18 7.731 -11.381 4.905 1.00 0.00 C ATOM 271 CD1 LEU A 18 8.411 -12.718 4.583 1.00 0.00 C ATOM 272 CD2 LEU A 18 7.456 -11.179 6.422 1.00 0.00 C ATOM 0 H LEU A 18 5.981 -9.822 4.478 1.00 0.00 H new ATOM 0 HA LEU A 18 8.277 -8.275 5.338 1.00 0.00 H new ATOM 0 HB2 LEU A 18 8.340 -10.305 3.163 1.00 0.00 H new ATOM 0 HB3 LEU A 18 9.407 -10.107 4.538 1.00 0.00 H new ATOM 0 HG LEU A 18 6.758 -11.472 4.423 1.00 0.00 H new ATOM 0 HD11 LEU A 18 7.891 -13.524 5.101 1.00 0.00 H new ATOM 0 HD12 LEU A 18 8.376 -12.895 3.508 1.00 0.00 H new ATOM 0 HD13 LEU A 18 9.450 -12.686 4.911 1.00 0.00 H new ATOM 0 HD21 LEU A 18 7.014 -12.085 6.835 1.00 0.00 H new ATOM 0 HD22 LEU A 18 8.393 -10.965 6.936 1.00 0.00 H new ATOM 0 HD23 LEU A 18 6.768 -10.345 6.559 1.00 0.00 H new ATOM 284 N LEU A 19 6.842 -7.467 2.577 1.00 0.00 N ATOM 285 CA LEU A 19 6.846 -6.534 1.419 1.00 0.00 C ATOM 286 C LEU A 19 6.558 -5.107 1.922 1.00 0.00 C ATOM 287 O LEU A 19 7.075 -4.141 1.395 1.00 0.00 O ATOM 288 CB LEU A 19 5.792 -7.006 0.445 1.00 0.00 C ATOM 289 CG LEU A 19 4.523 -6.177 0.157 1.00 0.00 C ATOM 290 CD1 LEU A 19 4.811 -4.722 -0.310 1.00 0.00 C ATOM 291 CD2 LEU A 19 3.533 -6.920 -0.763 1.00 0.00 C ATOM 0 H LEU A 19 5.909 -7.811 2.803 1.00 0.00 H new ATOM 0 HA LEU A 19 7.813 -6.519 0.917 1.00 0.00 H new ATOM 0 HB2 LEU A 19 6.292 -7.160 -0.511 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.458 -7.984 0.791 1.00 0.00 H new ATOM 0 HG LEU A 19 4.027 -6.064 1.121 1.00 0.00 H new ATOM 0 HD11 LEU A 19 3.869 -4.205 -0.492 1.00 0.00 H new ATOM 0 HD12 LEU A 19 5.370 -4.196 0.463 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.396 -4.744 -1.229 1.00 0.00 H new ATOM 0 HD21 LEU A 19 2.657 -6.295 -0.935 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.016 -7.139 -1.716 1.00 0.00 H new ATOM 0 HD23 LEU A 19 3.226 -7.852 -0.289 1.00 0.00 H new ATOM 303 N VAL A 20 5.714 -5.001 2.975 1.00 0.00 N ATOM 304 CA VAL A 20 5.568 -3.797 3.818 1.00 0.00 C ATOM 305 C VAL A 20 6.980 -3.486 4.419 1.00 0.00 C ATOM 306 O VAL A 20 7.512 -2.393 4.216 1.00 0.00 O ATOM 307 CB VAL A 20 4.521 -4.040 4.914 1.00 0.00 C ATOM 308 CG1 VAL A 20 5.018 -4.117 6.336 1.00 0.00 C ATOM 309 CG2 VAL A 20 3.268 -3.163 4.764 1.00 0.00 C ATOM 0 H VAL A 20 5.105 -5.766 3.266 1.00 0.00 H new ATOM 0 HA VAL A 20 5.217 -2.944 3.238 1.00 0.00 H new ATOM 0 HB VAL A 20 4.223 -5.069 4.715 1.00 0.00 H new ATOM 0 HG11 VAL A 20 4.177 -4.291 7.007 1.00 0.00 H new ATOM 0 HG12 VAL A 20 5.731 -4.936 6.428 1.00 0.00 H new ATOM 0 HG13 VAL A 20 5.506 -3.179 6.602 1.00 0.00 H new ATOM 0 HG21 VAL A 20 2.569 -3.385 5.571 1.00 0.00 H new ATOM 0 HG22 VAL A 20 3.552 -2.112 4.810 1.00 0.00 H new ATOM 0 HG23 VAL A 20 2.792 -3.369 3.805 1.00 0.00 H new ATOM 319 N SER A 21 7.492 -4.457 5.196 1.00 0.00 N ATOM 320 CA SER A 21 8.740 -4.268 5.999 1.00 0.00 C ATOM 321 C SER A 21 10.007 -4.357 5.138 1.00 0.00 C ATOM 322 O SER A 21 11.124 -4.102 5.610 1.00 0.00 O ATOM 323 CB SER A 21 8.778 -5.316 7.111 1.00 0.00 C ATOM 324 OG SER A 21 10.100 -5.781 7.355 1.00 0.00 O ATOM 0 H SER A 21 7.072 -5.381 5.293 1.00 0.00 H new ATOM 0 HA SER A 21 8.721 -3.265 6.426 1.00 0.00 H new ATOM 0 HB2 SER A 21 8.368 -4.889 8.026 1.00 0.00 H new ATOM 0 HB3 SER A 21 8.141 -6.158 6.839 1.00 0.00 H new ATOM 0 HG SER A 21 10.745 -5.113 7.041 1.00 0.00 H new ATOM 330 N LYS A 22 9.805 -4.712 3.857 1.00 0.00 N ATOM 331 CA LYS A 22 10.777 -4.450 2.759 1.00 0.00 C ATOM 332 C LYS A 22 10.607 -2.941 2.294 1.00 0.00 C ATOM 333 O LYS A 22 11.518 -2.211 2.207 1.00 0.00 O ATOM 334 CB LYS A 22 10.392 -5.342 1.533 1.00 0.00 C ATOM 335 CG LYS A 22 11.451 -6.462 1.365 1.00 0.00 C ATOM 336 CD LYS A 22 10.962 -7.670 0.508 1.00 0.00 C ATOM 337 CE LYS A 22 11.451 -8.964 1.173 1.00 0.00 C ATOM 338 NZ LYS A 22 12.859 -9.205 0.904 1.00 0.00 N ATOM 0 H LYS A 22 8.961 -5.192 3.543 1.00 0.00 H new ATOM 0 HA LYS A 22 11.791 -4.656 3.101 1.00 0.00 H new ATOM 0 HB2 LYS A 22 9.404 -5.778 1.681 1.00 0.00 H new ATOM 0 HB3 LYS A 22 10.340 -4.736 0.629 1.00 0.00 H new ATOM 0 HG2 LYS A 22 12.343 -6.039 0.903 1.00 0.00 H new ATOM 0 HG3 LYS A 22 11.743 -6.823 2.351 1.00 0.00 H new ATOM 0 HD2 LYS A 22 9.874 -7.668 0.436 1.00 0.00 H new ATOM 0 HD3 LYS A 22 11.349 -7.596 -0.508 1.00 0.00 H new ATOM 0 HE2 LYS A 22 11.291 -8.904 2.249 1.00 0.00 H new ATOM 0 HE3 LYS A 22 10.861 -9.806 0.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 13.155 -10.087 1.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 13.007 -9.287 -0.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 13.423 -8.413 1.273 1.00 0.00 H new ATOM 352 N MET A 23 9.310 -2.663 1.963 1.00 0.00 N ATOM 353 CA MET A 23 8.835 -1.343 1.489 1.00 0.00 C ATOM 354 C MET A 23 9.302 -0.182 2.379 1.00 0.00 C ATOM 355 O MET A 23 9.813 0.825 1.915 1.00 0.00 O ATOM 356 CB MET A 23 7.316 -1.330 1.325 1.00 0.00 C ATOM 357 CG MET A 23 6.860 -1.745 -0.068 1.00 0.00 C ATOM 358 SD MET A 23 5.783 -0.470 -0.900 1.00 0.00 S ATOM 359 CE MET A 23 4.170 -1.132 -0.426 1.00 0.00 C ATOM 0 H MET A 23 8.567 -3.359 2.021 1.00 0.00 H new ATOM 0 HA MET A 23 9.291 -1.186 0.511 1.00 0.00 H new ATOM 0 HB2 MET A 23 6.872 -2.001 2.061 1.00 0.00 H new ATOM 0 HB3 MET A 23 6.942 -0.329 1.540 1.00 0.00 H new ATOM 0 HG2 MET A 23 7.736 -1.932 -0.689 1.00 0.00 H new ATOM 0 HG3 MET A 23 6.312 -2.685 0.001 1.00 0.00 H new ATOM 0 HE1 MET A 23 3.702 -1.603 -1.290 1.00 0.00 H new ATOM 0 HE2 MET A 23 4.298 -1.871 0.365 1.00 0.00 H new ATOM 0 HE3 MET A 23 3.536 -0.322 -0.066 1.00 0.00 H new ATOM 369 N ARG A 24 9.060 -0.332 3.707 1.00 0.00 N ATOM 370 CA ARG A 24 9.811 0.310 4.772 1.00 0.00 C ATOM 371 C ARG A 24 11.322 0.304 4.590 1.00 0.00 C ATOM 372 O ARG A 24 11.960 1.357 4.483 1.00 0.00 O ATOM 373 CB ARG A 24 9.374 -0.220 6.148 1.00 0.00 C ATOM 374 CG ARG A 24 7.883 0.175 6.423 1.00 0.00 C ATOM 375 CD ARG A 24 7.566 0.117 7.923 1.00 0.00 C ATOM 376 NE ARG A 24 6.389 -0.726 8.162 1.00 0.00 N ATOM 377 CZ ARG A 24 6.397 -2.036 8.500 1.00 0.00 C ATOM 378 NH1 ARG A 24 7.563 -2.727 8.682 1.00 0.00 N ATOM 379 NH2 ARG A 24 5.242 -2.716 8.688 1.00 0.00 N ATOM 0 H ARG A 24 8.309 -0.926 4.058 1.00 0.00 H new ATOM 0 HA ARG A 24 9.554 1.368 4.716 1.00 0.00 H new ATOM 0 HB2 ARG A 24 9.484 -1.304 6.182 1.00 0.00 H new ATOM 0 HB3 ARG A 24 10.017 0.190 6.926 1.00 0.00 H new ATOM 0 HG2 ARG A 24 7.694 1.180 6.046 1.00 0.00 H new ATOM 0 HG3 ARG A 24 7.219 -0.498 5.881 1.00 0.00 H new ATOM 0 HD2 ARG A 24 8.423 -0.280 8.468 1.00 0.00 H new ATOM 0 HD3 ARG A 24 7.385 1.123 8.303 1.00 0.00 H new ATOM 0 HE ARG A 24 5.476 -0.281 8.064 1.00 0.00 H new ATOM 0 HH11 ARG A 24 8.459 -2.255 8.563 1.00 0.00 H new ATOM 0 HH12 ARG A 24 7.536 -3.714 8.937 1.00 0.00 H new ATOM 0 HH21 ARG A 24 4.346 -2.241 8.575 1.00 0.00 H new ATOM 0 HH22 ARG A 24 5.267 -3.703 8.943 1.00 0.00 H new ATOM 393 N ALA A 25 11.934 -0.909 4.691 1.00 0.00 N ATOM 394 CA ALA A 25 13.349 -1.146 4.331 1.00 0.00 C ATOM 395 C ALA A 25 13.791 -0.186 3.200 1.00 0.00 C ATOM 396 O ALA A 25 14.655 0.660 3.384 1.00 0.00 O ATOM 397 CB ALA A 25 13.559 -2.604 3.933 1.00 0.00 C ATOM 0 H ALA A 25 11.455 -1.745 5.025 1.00 0.00 H new ATOM 0 HA ALA A 25 13.971 -0.942 5.203 1.00 0.00 H new ATOM 0 HB1 ALA A 25 14.605 -2.763 3.671 1.00 0.00 H new ATOM 0 HB2 ALA A 25 13.292 -3.251 4.768 1.00 0.00 H new ATOM 0 HB3 ALA A 25 12.930 -2.841 3.075 1.00 0.00 H new ATOM 403 N GLN A 26 13.216 -0.388 2.000 1.00 0.00 N ATOM 404 CA GLN A 26 13.206 0.572 0.871 1.00 0.00 C ATOM 405 C GLN A 26 13.281 2.042 1.412 1.00 0.00 C ATOM 406 O GLN A 26 14.143 2.806 1.025 1.00 0.00 O ATOM 407 CB GLN A 26 11.823 0.392 0.190 1.00 0.00 C ATOM 408 CG GLN A 26 11.783 -0.613 -0.956 1.00 0.00 C ATOM 409 CD GLN A 26 13.008 -1.446 -1.155 1.00 0.00 C ATOM 410 OE1 GLN A 26 13.894 -1.239 -2.023 1.00 0.00 O ATOM 411 NE2 GLN A 26 13.200 -2.534 -0.361 1.00 0.00 N ATOM 0 H GLN A 26 12.727 -1.255 1.778 1.00 0.00 H new ATOM 0 HA GLN A 26 14.047 0.397 0.200 1.00 0.00 H new ATOM 0 HB2 GLN A 26 11.102 0.083 0.947 1.00 0.00 H new ATOM 0 HB3 GLN A 26 11.494 1.360 -0.187 1.00 0.00 H new ATOM 0 HG2 GLN A 26 10.938 -1.282 -0.794 1.00 0.00 H new ATOM 0 HG3 GLN A 26 11.586 -0.069 -1.880 1.00 0.00 H new ATOM 0 HE21 GLN A 26 12.521 -2.762 0.365 1.00 0.00 H new ATOM 0 HE22 GLN A 26 14.023 -3.122 -0.491 1.00 0.00 H new ATOM 420 N ALA A 27 12.234 2.402 2.195 1.00 0.00 N ATOM 421 CA ALA A 27 11.978 3.770 2.671 1.00 0.00 C ATOM 422 C ALA A 27 12.936 4.189 3.782 1.00 0.00 C ATOM 423 O ALA A 27 13.005 5.363 4.188 1.00 0.00 O ATOM 424 CB ALA A 27 10.509 3.851 3.180 1.00 0.00 C ATOM 0 H ALA A 27 11.535 1.732 2.515 1.00 0.00 H new ATOM 0 HA ALA A 27 12.139 4.456 1.839 1.00 0.00 H new ATOM 0 HB1 ALA A 27 10.303 4.860 3.537 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.828 3.608 2.365 1.00 0.00 H new ATOM 0 HB3 ALA A 27 10.367 3.142 3.995 1.00 0.00 H new ATOM 430 N GLU A 28 13.639 3.192 4.370 1.00 0.00 N ATOM 431 CA GLU A 28 14.745 3.357 5.317 1.00 0.00 C ATOM 432 C GLU A 28 16.096 3.485 4.540 1.00 0.00 C ATOM 433 O GLU A 28 16.935 4.286 4.858 1.00 0.00 O ATOM 434 CB GLU A 28 14.793 2.255 6.342 1.00 0.00 C ATOM 435 CG GLU A 28 13.934 2.524 7.591 1.00 0.00 C ATOM 436 CD GLU A 28 14.690 2.346 8.933 1.00 0.00 C ATOM 437 OE1 GLU A 28 15.625 3.158 9.204 1.00 0.00 O ATOM 438 OE2 GLU A 28 14.307 1.394 9.659 1.00 0.00 O ATOM 0 H GLU A 28 13.434 2.211 4.182 1.00 0.00 H new ATOM 0 HA GLU A 28 14.575 4.278 5.875 1.00 0.00 H new ATOM 0 HB2 GLU A 28 14.460 1.326 5.878 1.00 0.00 H new ATOM 0 HB3 GLU A 28 15.828 2.105 6.651 1.00 0.00 H new ATOM 0 HG2 GLU A 28 13.545 3.541 7.538 1.00 0.00 H new ATOM 0 HG3 GLU A 28 13.075 1.853 7.579 1.00 0.00 H new ATOM 445 N LYS A 29 16.231 2.588 3.539 1.00 0.00 N ATOM 446 CA LYS A 29 17.197 2.815 2.397 1.00 0.00 C ATOM 447 C LYS A 29 17.281 4.297 1.988 1.00 0.00 C ATOM 448 O LYS A 29 18.346 4.919 1.987 1.00 0.00 O ATOM 449 CB LYS A 29 16.608 2.024 1.165 1.00 0.00 C ATOM 450 CG LYS A 29 17.747 1.259 0.477 1.00 0.00 C ATOM 451 CD LYS A 29 17.951 -0.184 1.004 1.00 0.00 C ATOM 452 CE LYS A 29 16.632 -0.969 0.710 1.00 0.00 C ATOM 453 NZ LYS A 29 16.290 -1.801 1.891 1.00 0.00 N ATOM 0 H LYS A 29 15.706 1.715 3.481 1.00 0.00 H new ATOM 0 HA LYS A 29 18.193 2.491 2.700 1.00 0.00 H new ATOM 0 HB2 LYS A 29 15.834 1.331 1.496 1.00 0.00 H new ATOM 0 HB3 LYS A 29 16.139 2.714 0.463 1.00 0.00 H new ATOM 0 HG2 LYS A 29 17.547 1.218 -0.594 1.00 0.00 H new ATOM 0 HG3 LYS A 29 18.675 1.816 0.607 1.00 0.00 H new ATOM 0 HD2 LYS A 29 18.800 -0.658 0.511 1.00 0.00 H new ATOM 0 HD3 LYS A 29 18.166 -0.177 2.073 1.00 0.00 H new ATOM 0 HE2 LYS A 29 15.821 -0.274 0.492 1.00 0.00 H new ATOM 0 HE3 LYS A 29 16.757 -1.599 -0.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 15.370 -2.261 1.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 17.022 -2.527 2.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 16.238 -1.198 2.737 1.00 0.00 H new ATOM 467 N TYR A 30 16.107 4.827 1.547 1.00 0.00 N ATOM 468 CA TYR A 30 15.948 6.001 0.674 1.00 0.00 C ATOM 469 C TYR A 30 15.584 7.240 1.495 1.00 0.00 C ATOM 470 O TYR A 30 15.680 8.393 1.027 1.00 0.00 O ATOM 471 CB TYR A 30 14.808 5.677 -0.383 1.00 0.00 C ATOM 472 CG TYR A 30 15.225 4.601 -1.394 1.00 0.00 C ATOM 473 CD1 TYR A 30 16.412 4.739 -2.135 1.00 0.00 C ATOM 474 CD2 TYR A 30 14.383 3.503 -1.528 1.00 0.00 C ATOM 475 CE1 TYR A 30 16.682 3.829 -3.167 1.00 0.00 C ATOM 476 CE2 TYR A 30 14.724 2.505 -2.469 1.00 0.00 C ATOM 477 CZ TYR A 30 15.827 2.719 -3.323 1.00 0.00 C ATOM 478 OH TYR A 30 16.080 1.832 -4.321 1.00 0.00 O ATOM 0 H TYR A 30 15.209 4.420 1.809 1.00 0.00 H new ATOM 0 HA TYR A 30 16.886 6.214 0.161 1.00 0.00 H new ATOM 0 HB2 TYR A 30 13.913 5.347 0.144 1.00 0.00 H new ATOM 0 HB3 TYR A 30 14.544 6.589 -0.918 1.00 0.00 H new ATOM 0 HD1 TYR A 30 17.107 5.535 -1.912 1.00 0.00 H new ATOM 0 HD2 TYR A 30 13.490 3.415 -0.927 1.00 0.00 H new ATOM 0 HE1 TYR A 30 17.525 3.975 -3.827 1.00 0.00 H new ATOM 0 HE2 TYR A 30 14.149 1.593 -2.533 1.00 0.00 H new ATOM 0 HH TYR A 30 15.773 0.941 -4.052 1.00 0.00 H new ATOM 488 N GLU A 31 15.095 6.983 2.710 1.00 0.00 N ATOM 489 CA GLU A 31 14.757 8.001 3.735 1.00 0.00 C ATOM 490 C GLU A 31 13.305 8.494 3.478 1.00 0.00 C ATOM 491 O GLU A 31 12.998 9.667 3.661 1.00 0.00 O ATOM 492 CB GLU A 31 15.744 9.192 3.614 1.00 0.00 C ATOM 493 CG GLU A 31 15.545 10.221 4.751 1.00 0.00 C ATOM 494 CD GLU A 31 15.801 9.681 6.149 1.00 0.00 C ATOM 495 OE1 GLU A 31 16.732 8.800 6.281 1.00 0.00 O ATOM 496 OE2 GLU A 31 15.094 10.079 7.116 1.00 0.00 O ATOM 0 H GLU A 31 14.913 6.031 3.029 1.00 0.00 H new ATOM 0 HA GLU A 31 14.832 7.574 4.735 1.00 0.00 H new ATOM 0 HB2 GLU A 31 16.768 8.819 3.636 1.00 0.00 H new ATOM 0 HB3 GLU A 31 15.605 9.683 2.651 1.00 0.00 H new ATOM 0 HG2 GLU A 31 16.209 11.068 4.576 1.00 0.00 H new ATOM 0 HG3 GLU A 31 14.524 10.601 4.704 1.00 0.00 H new ATOM 503 N VAL A 32 12.463 7.561 2.980 1.00 0.00 N ATOM 504 CA VAL A 32 11.037 7.757 2.668 1.00 0.00 C ATOM 505 C VAL A 32 10.187 7.620 3.940 1.00 0.00 C ATOM 506 O VAL A 32 9.911 6.528 4.434 1.00 0.00 O ATOM 507 CB VAL A 32 10.592 6.900 1.494 1.00 0.00 C ATOM 508 CG1 VAL A 32 9.124 7.187 1.021 1.00 0.00 C ATOM 509 CG2 VAL A 32 11.550 7.051 0.272 1.00 0.00 C ATOM 0 H VAL A 32 12.776 6.612 2.777 1.00 0.00 H new ATOM 0 HA VAL A 32 10.878 8.778 2.320 1.00 0.00 H new ATOM 0 HB VAL A 32 10.627 5.878 1.872 1.00 0.00 H new ATOM 0 HG11 VAL A 32 8.879 6.538 0.181 1.00 0.00 H new ATOM 0 HG12 VAL A 32 8.433 6.995 1.842 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.039 8.229 0.711 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.198 6.423 -0.546 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.567 8.092 -0.051 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.556 6.744 0.558 1.00 0.00 H new ATOM 519 N PRO A 33 9.856 8.788 4.538 1.00 0.00 N ATOM 520 CA PRO A 33 9.309 8.937 5.909 1.00 0.00 C ATOM 521 C PRO A 33 8.137 7.972 6.306 1.00 0.00 C ATOM 522 O PRO A 33 7.439 7.406 5.518 1.00 0.00 O ATOM 523 CB PRO A 33 8.974 10.378 6.087 1.00 0.00 C ATOM 524 CG PRO A 33 9.555 11.143 4.928 1.00 0.00 C ATOM 525 CD PRO A 33 10.226 10.122 4.020 1.00 0.00 C ATOM 0 HA PRO A 33 10.078 8.616 6.612 1.00 0.00 H new ATOM 0 HB2 PRO A 33 7.893 10.515 6.129 1.00 0.00 H new ATOM 0 HB3 PRO A 33 9.379 10.749 7.029 1.00 0.00 H new ATOM 0 HG2 PRO A 33 8.775 11.684 4.392 1.00 0.00 H new ATOM 0 HG3 PRO A 33 10.275 11.884 5.276 1.00 0.00 H new ATOM 0 HD2 PRO A 33 9.894 10.243 2.989 1.00 0.00 H new ATOM 0 HD3 PRO A 33 11.308 10.252 4.024 1.00 0.00 H new ATOM 533 N VAL A 34 7.841 8.008 7.645 1.00 0.00 N ATOM 534 CA VAL A 34 7.068 7.084 8.397 1.00 0.00 C ATOM 535 C VAL A 34 7.198 5.618 7.938 1.00 0.00 C ATOM 536 O VAL A 34 8.262 5.013 7.989 1.00 0.00 O ATOM 537 CB VAL A 34 5.600 7.563 8.697 1.00 0.00 C ATOM 538 CG1 VAL A 34 4.844 6.431 9.542 1.00 0.00 C ATOM 539 CG2 VAL A 34 5.662 8.833 9.623 1.00 0.00 C ATOM 0 H VAL A 34 8.188 8.766 8.233 1.00 0.00 H new ATOM 0 HA VAL A 34 7.538 7.077 9.380 1.00 0.00 H new ATOM 0 HB VAL A 34 5.091 7.770 7.756 1.00 0.00 H new ATOM 0 HG11 VAL A 34 3.825 6.755 9.754 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.818 5.505 8.968 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.374 6.262 10.479 1.00 0.00 H new ATOM 0 HG21 VAL A 34 4.650 9.176 9.839 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.166 8.579 10.556 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.213 9.626 9.117 1.00 0.00 H new ATOM 549 N ILE A 35 6.050 5.030 7.583 1.00 0.00 N ATOM 550 CA ILE A 35 5.745 3.598 7.564 1.00 0.00 C ATOM 551 C ILE A 35 5.330 3.101 6.169 1.00 0.00 C ATOM 552 O ILE A 35 5.061 3.823 5.237 1.00 0.00 O ATOM 553 CB ILE A 35 4.646 3.297 8.640 1.00 0.00 C ATOM 554 CG1 ILE A 35 5.133 3.415 10.070 1.00 0.00 C ATOM 555 CG2 ILE A 35 3.751 2.103 8.287 1.00 0.00 C ATOM 556 CD1 ILE A 35 5.305 2.160 10.909 1.00 0.00 C ATOM 0 H ILE A 35 5.251 5.586 7.279 1.00 0.00 H new ATOM 0 HA ILE A 35 6.653 3.047 7.811 1.00 0.00 H new ATOM 0 HB ILE A 35 3.934 4.122 8.596 1.00 0.00 H new ATOM 0 HG12 ILE A 35 6.096 3.926 10.046 1.00 0.00 H new ATOM 0 HG13 ILE A 35 4.439 4.068 10.598 1.00 0.00 H new ATOM 0 HG21 ILE A 35 3.015 1.954 9.077 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.239 2.298 7.345 1.00 0.00 H new ATOM 0 HG23 ILE A 35 4.363 1.206 8.188 1.00 0.00 H new ATOM 0 HD11 ILE A 35 5.660 2.433 11.903 1.00 0.00 H new ATOM 0 HD12 ILE A 35 4.348 1.645 10.994 1.00 0.00 H new ATOM 0 HD13 ILE A 35 6.031 1.501 10.433 1.00 0.00 H new ATOM 568 N ILE A 36 5.248 1.745 6.076 1.00 0.00 N ATOM 569 CA ILE A 36 4.356 0.980 5.186 1.00 0.00 C ATOM 570 C ILE A 36 3.862 -0.292 5.923 1.00 0.00 C ATOM 571 O ILE A 36 4.590 -1.275 6.022 1.00 0.00 O ATOM 572 CB ILE A 36 5.157 0.618 3.873 1.00 0.00 C ATOM 573 CG1 ILE A 36 5.810 1.830 3.242 1.00 0.00 C ATOM 574 CG2 ILE A 36 4.379 -0.289 2.918 1.00 0.00 C ATOM 575 CD1 ILE A 36 7.297 1.996 3.323 1.00 0.00 C ATOM 0 H ILE A 36 5.832 1.136 6.649 1.00 0.00 H new ATOM 0 HA ILE A 36 3.479 1.566 4.912 1.00 0.00 H new ATOM 0 HB ILE A 36 5.996 -0.009 4.175 1.00 0.00 H new ATOM 0 HG12 ILE A 36 5.538 1.834 2.186 1.00 0.00 H new ATOM 0 HG13 ILE A 36 5.358 2.715 3.691 1.00 0.00 H new ATOM 0 HG21 ILE A 36 4.987 -0.498 2.038 1.00 0.00 H new ATOM 0 HG22 ILE A 36 4.136 -1.225 3.422 1.00 0.00 H new ATOM 0 HG23 ILE A 36 3.458 0.208 2.613 1.00 0.00 H new ATOM 0 HD11 ILE A 36 7.588 2.917 2.819 1.00 0.00 H new ATOM 0 HD12 ILE A 36 7.601 2.043 4.369 1.00 0.00 H new ATOM 0 HD13 ILE A 36 7.784 1.149 2.841 1.00 0.00 H new ATOM 587 N GLU A 37 2.621 -0.201 6.432 1.00 0.00 N ATOM 588 CA GLU A 37 1.941 -1.213 7.231 1.00 0.00 C ATOM 589 C GLU A 37 0.772 -1.858 6.412 1.00 0.00 C ATOM 590 O GLU A 37 0.117 -1.199 5.654 1.00 0.00 O ATOM 591 CB GLU A 37 1.431 -0.688 8.553 1.00 0.00 C ATOM 592 CG GLU A 37 2.534 -0.387 9.572 1.00 0.00 C ATOM 593 CD GLU A 37 2.544 -1.377 10.757 1.00 0.00 C ATOM 594 OE1 GLU A 37 2.269 -2.597 10.480 1.00 0.00 O ATOM 595 OE2 GLU A 37 2.774 -0.897 11.869 1.00 0.00 O ATOM 0 H GLU A 37 2.043 0.626 6.285 1.00 0.00 H new ATOM 0 HA GLU A 37 2.686 -1.973 7.468 1.00 0.00 H new ATOM 0 HB2 GLU A 37 0.858 0.222 8.374 1.00 0.00 H new ATOM 0 HB3 GLU A 37 0.744 -1.418 8.981 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.502 -0.417 9.072 1.00 0.00 H new ATOM 0 HG3 GLU A 37 2.403 0.626 9.953 1.00 0.00 H new ATOM 602 N ALA A 38 0.663 -3.200 6.596 1.00 0.00 N ATOM 603 CA ALA A 38 -0.383 -4.030 6.014 1.00 0.00 C ATOM 604 C ALA A 38 -1.500 -4.408 7.006 1.00 0.00 C ATOM 605 O ALA A 38 -1.273 -4.689 8.183 1.00 0.00 O ATOM 606 CB ALA A 38 0.215 -5.310 5.407 1.00 0.00 C ATOM 0 H ALA A 38 1.321 -3.730 7.167 1.00 0.00 H new ATOM 0 HA ALA A 38 -0.842 -3.420 5.236 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -0.583 -5.916 4.978 1.00 0.00 H new ATOM 0 HB2 ALA A 38 0.929 -5.044 4.627 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.724 -5.879 6.185 1.00 0.00 H new ATOM 612 N PHE A 39 -2.749 -4.356 6.483 1.00 0.00 N ATOM 613 CA PHE A 39 -4.021 -4.461 7.190 1.00 0.00 C ATOM 614 C PHE A 39 -5.100 -5.128 6.394 1.00 0.00 C ATOM 615 O PHE A 39 -4.904 -5.369 5.172 1.00 0.00 O ATOM 616 CB PHE A 39 -4.399 -3.036 7.721 1.00 0.00 C ATOM 617 CG PHE A 39 -3.241 -2.349 8.487 1.00 0.00 C ATOM 618 CD1 PHE A 39 -2.712 -3.023 9.621 1.00 0.00 C ATOM 619 CD2 PHE A 39 -2.734 -1.112 8.083 1.00 0.00 C ATOM 620 CE1 PHE A 39 -1.610 -2.457 10.259 1.00 0.00 C ATOM 621 CE2 PHE A 39 -1.819 -0.434 8.919 1.00 0.00 C ATOM 622 CZ PHE A 39 -1.295 -1.095 10.050 1.00 0.00 C ATOM 0 H PHE A 39 -2.889 -4.230 5.481 1.00 0.00 H new ATOM 0 HA PHE A 39 -3.908 -5.134 8.040 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -4.695 -2.408 6.881 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -5.265 -3.117 8.378 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -3.150 -3.944 9.977 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -3.038 -0.678 7.142 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -0.997 -3.059 10.913 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -1.524 0.580 8.695 1.00 0.00 H new ATOM 0 HZ PHE A 39 -0.661 -0.567 10.747 1.00 0.00 H new ATOM 632 N PRO A 40 -6.188 -5.625 6.981 1.00 0.00 N ATOM 633 CA PRO A 40 -7.311 -6.347 6.331 1.00 0.00 C ATOM 634 C PRO A 40 -8.544 -5.561 5.839 1.00 0.00 C ATOM 635 O PRO A 40 -9.685 -5.783 6.245 1.00 0.00 O ATOM 636 CB PRO A 40 -7.656 -7.480 7.291 1.00 0.00 C ATOM 637 CG PRO A 40 -7.422 -6.842 8.668 1.00 0.00 C ATOM 638 CD PRO A 40 -6.402 -5.728 8.448 1.00 0.00 C ATOM 0 HA PRO A 40 -6.959 -6.677 5.353 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -8.687 -7.813 7.170 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -7.019 -8.351 7.135 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -8.351 -6.445 9.077 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -7.049 -7.578 9.380 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -6.767 -4.784 8.853 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -5.467 -5.954 8.960 1.00 0.00 H new ATOM 646 N GLU A 41 -8.281 -4.735 4.832 1.00 0.00 N ATOM 647 CA GLU A 41 -9.106 -3.716 4.268 1.00 0.00 C ATOM 648 C GLU A 41 -9.878 -2.807 5.218 1.00 0.00 C ATOM 649 O GLU A 41 -9.850 -1.550 5.081 1.00 0.00 O ATOM 650 CB GLU A 41 -10.071 -4.279 3.174 1.00 0.00 C ATOM 651 CG GLU A 41 -11.060 -5.278 3.759 1.00 0.00 C ATOM 652 CD GLU A 41 -12.460 -4.694 4.094 1.00 0.00 C ATOM 653 OE1 GLU A 41 -12.570 -3.456 4.009 1.00 0.00 O ATOM 654 OE2 GLU A 41 -13.369 -5.505 4.421 1.00 0.00 O ATOM 0 H GLU A 41 -7.383 -4.783 4.351 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.355 -3.058 3.830 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -10.615 -3.456 2.710 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -9.489 -4.760 2.388 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -11.185 -6.099 3.053 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -10.632 -5.701 4.668 1.00 0.00 H new ATOM 661 N THR A 42 -10.689 -3.384 6.135 1.00 0.00 N ATOM 662 CA THR A 42 -11.271 -2.785 7.333 1.00 0.00 C ATOM 663 C THR A 42 -10.580 -1.502 7.801 1.00 0.00 C ATOM 664 O THR A 42 -11.222 -0.523 8.192 1.00 0.00 O ATOM 665 CB THR A 42 -11.460 -3.707 8.535 1.00 0.00 C ATOM 666 OG1 THR A 42 -10.455 -3.377 9.563 1.00 0.00 O ATOM 667 CG2 THR A 42 -11.381 -5.214 8.142 1.00 0.00 C ATOM 0 H THR A 42 -10.969 -4.360 6.037 1.00 0.00 H new ATOM 0 HA THR A 42 -12.266 -2.544 6.959 1.00 0.00 H new ATOM 0 HB THR A 42 -12.461 -3.545 8.935 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.574 -3.966 10.337 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.521 -5.830 9.031 1.00 0.00 H new ATOM 0 HG22 THR A 42 -12.161 -5.442 7.416 1.00 0.00 H new ATOM 0 HG23 THR A 42 -10.405 -5.425 7.705 1.00 0.00 H new ATOM 675 N LEU A 43 -9.236 -1.529 7.806 1.00 0.00 N ATOM 676 CA LEU A 43 -8.317 -0.671 8.575 1.00 0.00 C ATOM 677 C LEU A 43 -7.720 0.421 7.659 1.00 0.00 C ATOM 678 O LEU A 43 -6.843 1.163 8.030 1.00 0.00 O ATOM 679 CB LEU A 43 -7.149 -1.633 8.987 1.00 0.00 C ATOM 680 CG LEU A 43 -7.119 -2.056 10.465 1.00 0.00 C ATOM 681 CD1 LEU A 43 -6.437 -3.320 10.876 1.00 0.00 C ATOM 682 CD2 LEU A 43 -6.827 -0.864 11.406 1.00 0.00 C ATOM 0 H LEU A 43 -8.726 -2.200 7.231 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.817 -0.189 9.415 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -7.210 -2.531 8.373 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.203 -1.148 8.748 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.150 -2.385 10.593 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.523 -3.445 11.955 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -6.906 -4.166 10.374 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.384 -3.272 10.599 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.816 -1.211 12.439 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -5.857 -0.433 11.157 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.602 -0.107 11.286 1.00 0.00 H new ATOM 694 N ALA A 44 -8.183 0.437 6.374 1.00 0.00 N ATOM 695 CA ALA A 44 -7.690 1.395 5.347 1.00 0.00 C ATOM 696 C ALA A 44 -8.276 2.804 5.696 1.00 0.00 C ATOM 697 O ALA A 44 -7.606 3.785 5.665 1.00 0.00 O ATOM 698 CB ALA A 44 -8.094 0.996 3.950 1.00 0.00 C ATOM 0 H ALA A 44 -8.897 -0.204 6.029 1.00 0.00 H new ATOM 0 HA ALA A 44 -6.600 1.404 5.362 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -7.710 1.726 3.238 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -7.683 0.013 3.719 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -9.181 0.959 3.882 1.00 0.00 H new ATOM 704 N GLY A 45 -9.597 2.739 5.988 1.00 0.00 N ATOM 705 CA GLY A 45 -10.377 3.959 6.405 1.00 0.00 C ATOM 706 C GLY A 45 -9.420 4.918 7.189 1.00 0.00 C ATOM 707 O GLY A 45 -9.451 6.112 6.987 1.00 0.00 O ATOM 0 H GLY A 45 -10.147 1.881 5.948 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.786 4.464 5.530 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.222 3.672 7.031 1.00 0.00 H new ATOM 711 N GLU A 46 -8.615 4.289 8.072 1.00 0.00 N ATOM 712 CA GLU A 46 -7.862 4.923 9.132 1.00 0.00 C ATOM 713 C GLU A 46 -6.383 5.120 8.769 1.00 0.00 C ATOM 714 O GLU A 46 -5.779 6.152 9.094 1.00 0.00 O ATOM 715 CB GLU A 46 -7.970 4.084 10.450 1.00 0.00 C ATOM 716 CG GLU A 46 -8.125 4.995 11.681 1.00 0.00 C ATOM 717 CD GLU A 46 -9.588 5.452 11.955 1.00 0.00 C ATOM 718 OE1 GLU A 46 -10.278 5.876 11.027 1.00 0.00 O ATOM 719 OE2 GLU A 46 -9.943 5.404 13.183 1.00 0.00 O ATOM 0 H GLU A 46 -8.478 3.278 8.049 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.298 5.911 9.281 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.823 3.409 10.385 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -7.081 3.464 10.563 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -7.750 4.468 12.559 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -7.499 5.877 11.547 1.00 0.00 H new ATOM 726 N LYS A 47 -5.791 4.044 8.150 1.00 0.00 N ATOM 727 CA LYS A 47 -4.363 4.110 7.716 1.00 0.00 C ATOM 728 C LYS A 47 -4.262 4.830 6.346 1.00 0.00 C ATOM 729 O LYS A 47 -3.614 5.833 6.186 1.00 0.00 O ATOM 730 CB LYS A 47 -3.759 2.701 7.632 1.00 0.00 C ATOM 731 CG LYS A 47 -4.188 1.927 8.959 1.00 0.00 C ATOM 732 CD LYS A 47 -3.986 2.857 10.197 1.00 0.00 C ATOM 733 CE LYS A 47 -4.129 1.971 11.454 1.00 0.00 C ATOM 734 NZ LYS A 47 -4.630 2.779 12.594 1.00 0.00 N ATOM 0 H LYS A 47 -6.261 3.161 7.950 1.00 0.00 H new ATOM 0 HA LYS A 47 -3.796 4.677 8.454 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -4.122 2.178 6.747 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.673 2.752 7.549 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -5.231 1.618 8.890 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.593 1.021 9.072 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -3.004 3.330 10.168 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -4.726 3.658 10.203 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -4.815 1.148 11.252 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -3.166 1.528 11.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -4.723 2.174 13.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -3.961 3.549 12.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -5.558 3.181 12.353 1.00 0.00 H new ATOM 748 N GLY A 48 -4.952 4.216 5.337 1.00 0.00 N ATOM 749 CA GLY A 48 -5.492 4.927 4.170 1.00 0.00 C ATOM 750 C GLY A 48 -5.675 6.417 4.336 1.00 0.00 C ATOM 751 O GLY A 48 -4.801 7.218 3.923 1.00 0.00 O ATOM 0 H GLY A 48 -5.141 3.214 5.325 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -4.828 4.753 3.323 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -6.456 4.488 3.914 1.00 0.00 H new ATOM 755 N GLN A 49 -6.810 6.820 4.971 1.00 0.00 N ATOM 756 CA GLN A 49 -7.127 8.233 5.293 1.00 0.00 C ATOM 757 C GLN A 49 -5.886 8.959 5.861 1.00 0.00 C ATOM 758 O GLN A 49 -5.483 10.028 5.380 1.00 0.00 O ATOM 759 CB GLN A 49 -8.322 8.292 6.192 1.00 0.00 C ATOM 760 CG GLN A 49 -8.157 9.031 7.523 1.00 0.00 C ATOM 761 CD GLN A 49 -9.469 9.302 8.239 1.00 0.00 C ATOM 762 OE1 GLN A 49 -9.686 10.301 8.958 1.00 0.00 O ATOM 763 NE2 GLN A 49 -10.481 8.393 8.086 1.00 0.00 N ATOM 0 H GLN A 49 -7.532 6.167 5.274 1.00 0.00 H new ATOM 0 HA GLN A 49 -7.391 8.771 4.382 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -9.136 8.763 5.642 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -8.633 7.270 6.409 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -7.511 8.444 8.176 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -7.650 9.979 7.342 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -10.340 7.566 7.506 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -11.376 8.543 8.551 1.00 0.00 H new ATOM 772 N ASN A 50 -5.328 8.397 6.961 1.00 0.00 N ATOM 773 CA ASN A 50 -4.138 8.973 7.686 1.00 0.00 C ATOM 774 C ASN A 50 -2.950 9.069 6.677 1.00 0.00 C ATOM 775 O ASN A 50 -2.038 9.909 6.843 1.00 0.00 O ATOM 776 CB ASN A 50 -3.765 8.088 8.866 1.00 0.00 C ATOM 777 CG ASN A 50 -4.012 8.747 10.258 1.00 0.00 C ATOM 778 OD1 ASN A 50 -3.228 8.648 11.215 1.00 0.00 O ATOM 779 ND2 ASN A 50 -5.156 9.425 10.386 1.00 0.00 N ATOM 0 H ASN A 50 -5.678 7.535 7.380 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.376 9.964 8.072 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -4.337 7.162 8.807 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -2.712 7.818 8.785 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -5.391 9.866 11.275 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -5.795 9.502 9.594 1.00 0.00 H new ATOM 786 N ALA A 51 -2.962 8.174 5.686 1.00 0.00 N ATOM 787 CA ALA A 51 -1.803 7.836 4.822 1.00 0.00 C ATOM 788 C ALA A 51 -1.417 9.072 3.965 1.00 0.00 C ATOM 789 O ALA A 51 -2.052 10.100 4.018 1.00 0.00 O ATOM 790 CB ALA A 51 -2.190 6.671 3.878 1.00 0.00 C ATOM 0 H ALA A 51 -3.799 7.642 5.447 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.959 7.543 5.447 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.341 6.420 3.242 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.469 5.800 4.471 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -3.033 6.972 3.256 1.00 0.00 H new ATOM 796 N ASP A 52 -0.267 8.938 3.270 1.00 0.00 N ATOM 797 CA ASP A 52 0.148 9.645 2.056 1.00 0.00 C ATOM 798 C ASP A 52 0.060 8.805 0.794 1.00 0.00 C ATOM 799 O ASP A 52 0.013 9.357 -0.340 1.00 0.00 O ATOM 800 CB ASP A 52 1.572 10.221 2.245 1.00 0.00 C ATOM 801 CG ASP A 52 1.974 11.337 1.272 1.00 0.00 C ATOM 802 OD1 ASP A 52 1.249 11.479 0.240 1.00 0.00 O ATOM 803 OD2 ASP A 52 3.018 11.978 1.567 1.00 0.00 O ATOM 0 H ASP A 52 0.448 8.277 3.575 1.00 0.00 H new ATOM 0 HA ASP A 52 -0.562 10.459 1.909 1.00 0.00 H new ATOM 0 HB2 ASP A 52 1.657 10.603 3.262 1.00 0.00 H new ATOM 0 HB3 ASP A 52 2.289 9.406 2.150 1.00 0.00 H new ATOM 808 N VAL A 53 0.240 7.470 0.907 1.00 0.00 N ATOM 809 CA VAL A 53 -0.079 6.447 -0.108 1.00 0.00 C ATOM 810 C VAL A 53 -0.584 5.163 0.566 1.00 0.00 C ATOM 811 O VAL A 53 -0.306 4.955 1.758 1.00 0.00 O ATOM 812 CB VAL A 53 1.100 6.262 -1.082 1.00 0.00 C ATOM 813 CG1 VAL A 53 1.117 4.879 -1.775 1.00 0.00 C ATOM 814 CG2 VAL A 53 1.235 7.403 -2.114 1.00 0.00 C ATOM 0 H VAL A 53 0.632 7.058 1.754 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.906 6.781 -0.735 1.00 0.00 H new ATOM 0 HB VAL A 53 1.981 6.308 -0.442 1.00 0.00 H new ATOM 0 HG11 VAL A 53 1.974 4.819 -2.446 1.00 0.00 H new ATOM 0 HG12 VAL A 53 1.191 4.095 -1.021 1.00 0.00 H new ATOM 0 HG13 VAL A 53 0.198 4.747 -2.347 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.086 7.205 -2.766 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.326 7.462 -2.712 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.389 8.348 -1.593 1.00 0.00 H new ATOM 824 N VAL A 54 -1.378 4.387 -0.154 1.00 0.00 N ATOM 825 CA VAL A 54 -1.922 3.055 0.288 1.00 0.00 C ATOM 826 C VAL A 54 -2.070 2.157 -0.941 1.00 0.00 C ATOM 827 O VAL A 54 -2.315 2.611 -2.070 1.00 0.00 O ATOM 828 CB VAL A 54 -3.321 3.350 0.956 1.00 0.00 C ATOM 829 CG1 VAL A 54 -4.534 2.731 0.263 1.00 0.00 C ATOM 830 CG2 VAL A 54 -3.253 2.951 2.455 1.00 0.00 C ATOM 0 H VAL A 54 -1.687 4.647 -1.091 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.269 2.546 0.996 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.493 4.421 0.844 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.440 2.999 0.807 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -4.600 3.106 -0.758 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.429 1.646 0.245 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.214 3.150 2.928 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -3.020 1.889 2.539 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -2.477 3.533 2.952 1.00 0.00 H new ATOM 840 N LEU A 55 -1.845 0.813 -0.745 1.00 0.00 N ATOM 841 CA LEU A 55 -2.143 -0.258 -1.678 1.00 0.00 C ATOM 842 C LEU A 55 -3.000 -1.380 -1.191 1.00 0.00 C ATOM 843 O LEU A 55 -2.965 -1.784 0.000 1.00 0.00 O ATOM 844 CB LEU A 55 -0.735 -0.756 -2.201 1.00 0.00 C ATOM 845 CG LEU A 55 0.341 0.457 -2.287 1.00 0.00 C ATOM 846 CD1 LEU A 55 1.641 0.072 -1.601 1.00 0.00 C ATOM 847 CD2 LEU A 55 0.437 0.925 -3.715 1.00 0.00 C ATOM 0 H LEU A 55 -1.430 0.464 0.119 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.784 0.145 -2.462 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -0.355 -1.532 -1.537 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -0.852 -1.208 -3.186 1.00 0.00 H new ATOM 0 HG LEU A 55 0.015 1.332 -1.724 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.348 0.899 -1.670 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.446 -0.152 -0.552 1.00 0.00 H new ATOM 0 HD13 LEU A 55 2.063 -0.807 -2.088 1.00 0.00 H new ATOM 0 HD21 LEU A 55 1.158 1.740 -3.783 1.00 0.00 H new ATOM 0 HD22 LEU A 55 0.762 0.099 -4.347 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -0.540 1.275 -4.050 1.00 0.00 H new ATOM 859 N LEU A 56 -3.958 -1.896 -2.042 1.00 0.00 N ATOM 860 CA LEU A 56 -4.784 -3.056 -1.864 1.00 0.00 C ATOM 861 C LEU A 56 -4.223 -4.212 -2.722 1.00 0.00 C ATOM 862 O LEU A 56 -3.762 -3.945 -3.836 1.00 0.00 O ATOM 863 CB LEU A 56 -6.216 -2.733 -2.302 1.00 0.00 C ATOM 864 CG LEU A 56 -7.278 -2.665 -1.089 1.00 0.00 C ATOM 865 CD1 LEU A 56 -7.037 -1.338 -0.329 1.00 0.00 C ATOM 866 CD2 LEU A 56 -8.665 -2.938 -1.548 1.00 0.00 C ATOM 0 H LEU A 56 -4.154 -1.440 -2.933 1.00 0.00 H new ATOM 0 HA LEU A 56 -4.788 -3.351 -0.815 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.217 -1.777 -2.825 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.545 -3.488 -3.016 1.00 0.00 H new ATOM 0 HG LEU A 56 -7.126 -3.466 -0.366 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -7.741 -1.260 0.500 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.018 -1.320 0.057 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -7.182 -0.498 -1.008 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -9.347 -2.882 -0.699 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -8.953 -2.198 -2.295 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -8.713 -3.934 -1.987 1.00 0.00 H new ATOM 878 N GLY A 57 -4.201 -5.427 -2.159 1.00 0.00 N ATOM 879 CA GLY A 57 -3.880 -6.664 -3.009 1.00 0.00 C ATOM 880 C GLY A 57 -4.804 -6.697 -4.246 1.00 0.00 C ATOM 881 O GLY A 57 -6.031 -6.704 -4.097 1.00 0.00 O ATOM 0 H GLY A 57 -4.386 -5.614 -1.174 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -2.836 -6.641 -3.323 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -4.015 -7.569 -2.417 1.00 0.00 H new ATOM 885 N PRO A 58 -4.167 -6.729 -5.408 1.00 0.00 N ATOM 886 CA PRO A 58 -4.863 -6.928 -6.742 1.00 0.00 C ATOM 887 C PRO A 58 -6.180 -7.759 -6.685 1.00 0.00 C ATOM 888 O PRO A 58 -7.200 -7.440 -7.240 1.00 0.00 O ATOM 889 CB PRO A 58 -3.765 -7.590 -7.585 1.00 0.00 C ATOM 890 CG PRO A 58 -2.493 -6.894 -7.132 1.00 0.00 C ATOM 891 CD PRO A 58 -2.772 -6.407 -5.674 1.00 0.00 C ATOM 0 HA PRO A 58 -5.233 -5.989 -7.154 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -3.718 -8.665 -7.408 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -3.940 -7.450 -8.652 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -1.643 -7.575 -7.161 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -2.252 -6.055 -7.785 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -2.113 -6.905 -4.963 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -2.593 -5.336 -5.578 1.00 0.00 H new ATOM 899 N GLN A 59 -6.064 -8.785 -5.786 1.00 0.00 N ATOM 900 CA GLN A 59 -7.020 -9.873 -5.592 1.00 0.00 C ATOM 901 C GLN A 59 -7.900 -9.620 -4.332 1.00 0.00 C ATOM 902 O GLN A 59 -8.422 -10.540 -3.699 1.00 0.00 O ATOM 903 CB GLN A 59 -6.145 -11.143 -5.268 1.00 0.00 C ATOM 904 CG GLN A 59 -5.483 -11.019 -3.854 1.00 0.00 C ATOM 905 CD GLN A 59 -4.089 -11.560 -3.777 1.00 0.00 C ATOM 906 OE1 GLN A 59 -3.754 -12.778 -3.785 1.00 0.00 O ATOM 907 NE2 GLN A 59 -3.042 -10.649 -3.745 1.00 0.00 N ATOM 0 H GLN A 59 -5.261 -8.860 -5.161 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.660 -9.973 -6.468 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -6.767 -12.037 -5.306 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -5.372 -11.260 -6.027 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -5.469 -9.969 -3.563 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -6.104 -11.543 -3.128 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -3.237 -9.648 -3.737 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -2.078 -10.981 -3.730 1.00 0.00 H new ATOM 916 N ILE A 60 -8.040 -8.341 -3.950 1.00 0.00 N ATOM 917 CA ILE A 60 -9.297 -7.756 -3.363 1.00 0.00 C ATOM 918 C ILE A 60 -10.043 -7.027 -4.522 1.00 0.00 C ATOM 919 O ILE A 60 -11.158 -7.421 -4.874 1.00 0.00 O ATOM 920 CB ILE A 60 -8.979 -6.914 -2.143 1.00 0.00 C ATOM 921 CG1 ILE A 60 -10.202 -6.127 -1.583 1.00 0.00 C ATOM 922 CG2 ILE A 60 -7.705 -6.105 -2.156 1.00 0.00 C ATOM 923 CD1 ILE A 60 -10.320 -6.083 -0.053 1.00 0.00 C ATOM 0 H ILE A 60 -7.285 -7.660 -4.033 1.00 0.00 H new ATOM 0 HA ILE A 60 -9.974 -8.515 -2.970 1.00 0.00 H new ATOM 0 HB ILE A 60 -8.739 -7.691 -1.417 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -10.154 -5.104 -1.955 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -11.112 -6.570 -1.987 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -7.613 -5.556 -1.219 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.851 -6.773 -2.270 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.729 -5.401 -2.988 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -11.205 -5.511 0.227 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -10.406 -7.098 0.335 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -9.433 -5.609 0.367 1.00 0.00 H new ATOM 935 N ALA A 61 -9.372 -6.076 -5.144 1.00 0.00 N ATOM 936 CA ALA A 61 -9.842 -5.195 -6.208 1.00 0.00 C ATOM 937 C ALA A 61 -11.213 -4.559 -5.976 1.00 0.00 C ATOM 938 O ALA A 61 -11.353 -3.344 -5.923 1.00 0.00 O ATOM 939 CB ALA A 61 -9.889 -5.995 -7.546 1.00 0.00 C ATOM 0 H ALA A 61 -8.401 -5.880 -4.900 1.00 0.00 H new ATOM 0 HA ALA A 61 -9.130 -4.370 -6.235 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.239 -5.344 -8.347 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -8.891 -6.361 -7.786 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.570 -6.840 -7.441 1.00 0.00 H new ATOM 945 N TYR A 62 -12.232 -5.419 -5.916 1.00 0.00 N ATOM 946 CA TYR A 62 -13.657 -5.081 -6.120 1.00 0.00 C ATOM 947 C TYR A 62 -14.054 -4.078 -5.006 1.00 0.00 C ATOM 948 O TYR A 62 -15.082 -3.369 -5.107 1.00 0.00 O ATOM 949 CB TYR A 62 -14.490 -6.443 -5.877 1.00 0.00 C ATOM 950 CG TYR A 62 -14.503 -6.779 -4.384 1.00 0.00 C ATOM 951 CD1 TYR A 62 -13.483 -7.481 -3.757 1.00 0.00 C ATOM 952 CD2 TYR A 62 -15.585 -6.278 -3.635 1.00 0.00 C ATOM 953 CE1 TYR A 62 -13.601 -7.848 -2.418 1.00 0.00 C ATOM 954 CE2 TYR A 62 -15.853 -6.902 -2.387 1.00 0.00 C ATOM 955 CZ TYR A 62 -14.842 -7.715 -1.813 1.00 0.00 C ATOM 956 OH TYR A 62 -15.101 -8.347 -0.656 1.00 0.00 O ATOM 0 H TYR A 62 -12.090 -6.409 -5.717 1.00 0.00 H new ATOM 0 HA TYR A 62 -13.845 -4.663 -7.109 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -15.510 -6.327 -6.243 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -14.041 -7.261 -6.440 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -12.593 -7.744 -4.310 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -16.185 -5.455 -3.994 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -12.752 -8.225 -1.868 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -16.801 -6.761 -1.889 1.00 0.00 H new ATOM 0 HH TYR A 62 -16.016 -8.145 -0.370 1.00 0.00 H new ATOM 966 N MET A 63 -13.212 -4.009 -3.966 1.00 0.00 N ATOM 967 CA MET A 63 -13.352 -3.131 -2.793 1.00 0.00 C ATOM 968 C MET A 63 -12.615 -1.788 -2.976 1.00 0.00 C ATOM 969 O MET A 63 -12.900 -0.803 -2.292 1.00 0.00 O ATOM 970 CB MET A 63 -12.724 -3.853 -1.540 1.00 0.00 C ATOM 971 CG MET A 63 -13.731 -4.923 -1.026 1.00 0.00 C ATOM 972 SD MET A 63 -15.159 -4.272 -0.116 1.00 0.00 S ATOM 973 CE MET A 63 -14.980 -5.137 1.437 1.00 0.00 C ATOM 0 H MET A 63 -12.375 -4.590 -3.916 1.00 0.00 H new ATOM 0 HA MET A 63 -14.415 -2.930 -2.661 1.00 0.00 H new ATOM 0 HB2 MET A 63 -11.778 -4.323 -1.809 1.00 0.00 H new ATOM 0 HB3 MET A 63 -12.508 -3.128 -0.755 1.00 0.00 H new ATOM 0 HG2 MET A 63 -14.095 -5.495 -1.880 1.00 0.00 H new ATOM 0 HG3 MET A 63 -13.197 -5.620 -0.380 1.00 0.00 H new ATOM 0 HE1 MET A 63 -15.565 -4.631 2.205 1.00 0.00 H new ATOM 0 HE2 MET A 63 -15.336 -6.161 1.326 1.00 0.00 H new ATOM 0 HE3 MET A 63 -13.930 -5.147 1.729 1.00 0.00 H new ATOM 983 N LEU A 64 -11.629 -1.794 -3.908 1.00 0.00 N ATOM 984 CA LEU A 64 -10.831 -0.635 -4.366 1.00 0.00 C ATOM 985 C LEU A 64 -11.750 0.523 -4.753 1.00 0.00 C ATOM 986 O LEU A 64 -11.333 1.694 -4.693 1.00 0.00 O ATOM 987 CB LEU A 64 -10.004 -1.139 -5.559 1.00 0.00 C ATOM 988 CG LEU A 64 -9.313 -0.152 -6.508 1.00 0.00 C ATOM 989 CD1 LEU A 64 -10.198 0.425 -7.620 1.00 0.00 C ATOM 990 CD2 LEU A 64 -8.500 0.934 -5.768 1.00 0.00 C ATOM 0 H LEU A 64 -11.357 -2.654 -4.384 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.176 -0.251 -3.584 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -9.230 -1.794 -5.158 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -10.663 -1.759 -6.166 1.00 0.00 H new ATOM 0 HG LEU A 64 -8.595 -0.775 -7.041 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -9.612 1.110 -8.233 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -10.575 -0.386 -8.242 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -11.036 0.962 -7.176 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -8.036 1.600 -6.495 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -9.164 1.508 -5.122 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -7.726 0.461 -5.164 1.00 0.00 H new ATOM 1002 N PRO A 65 -12.989 0.228 -5.181 1.00 0.00 N ATOM 1003 CA PRO A 65 -14.141 1.128 -5.257 1.00 0.00 C ATOM 1004 C PRO A 65 -14.652 1.732 -3.888 1.00 0.00 C ATOM 1005 O PRO A 65 -14.723 2.925 -3.700 1.00 0.00 O ATOM 1006 CB PRO A 65 -15.255 0.337 -5.938 1.00 0.00 C ATOM 1007 CG PRO A 65 -14.462 -0.634 -6.849 1.00 0.00 C ATOM 1008 CD PRO A 65 -13.314 -1.058 -5.860 1.00 0.00 C ATOM 0 HA PRO A 65 -13.828 2.012 -5.812 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -15.874 -0.196 -5.217 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -15.919 0.983 -6.513 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -15.063 -1.482 -7.178 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -14.081 -0.146 -7.746 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -13.646 -1.818 -5.153 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -12.453 -1.468 -6.388 1.00 0.00 H new ATOM 1016 N GLU A 66 -14.766 0.772 -2.960 1.00 0.00 N ATOM 1017 CA GLU A 66 -15.258 0.977 -1.580 1.00 0.00 C ATOM 1018 C GLU A 66 -14.179 1.504 -0.642 1.00 0.00 C ATOM 1019 O GLU A 66 -14.483 1.989 0.454 1.00 0.00 O ATOM 1020 CB GLU A 66 -15.831 -0.357 -1.017 1.00 0.00 C ATOM 1021 CG GLU A 66 -17.102 -0.761 -1.743 1.00 0.00 C ATOM 1022 CD GLU A 66 -17.708 -2.120 -1.322 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -18.405 -2.196 -0.290 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -17.374 -3.096 -2.079 1.00 0.00 O ATOM 0 H GLU A 66 -14.513 -0.198 -3.148 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.041 1.733 -1.632 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -15.086 -1.146 -1.117 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -16.037 -0.246 0.048 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -17.851 0.015 -1.586 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -16.894 -0.792 -2.813 1.00 0.00 H new ATOM 1031 N ILE A 67 -12.895 1.328 -1.033 1.00 0.00 N ATOM 1032 CA ILE A 67 -11.698 2.008 -0.502 1.00 0.00 C ATOM 1033 C ILE A 67 -11.786 3.518 -0.913 1.00 0.00 C ATOM 1034 O ILE A 67 -11.632 4.408 -0.083 1.00 0.00 O ATOM 1035 CB ILE A 67 -10.400 1.347 -1.074 1.00 0.00 C ATOM 1036 CG1 ILE A 67 -10.293 -0.146 -0.871 1.00 0.00 C ATOM 1037 CG2 ILE A 67 -9.123 2.113 -0.638 1.00 0.00 C ATOM 1038 CD1 ILE A 67 -10.800 -0.787 0.416 1.00 0.00 C ATOM 0 H ILE A 67 -12.657 0.667 -1.772 1.00 0.00 H new ATOM 0 HA ILE A 67 -11.656 1.920 0.584 1.00 0.00 H new ATOM 0 HB ILE A 67 -10.489 1.447 -2.156 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -10.820 -0.622 -1.698 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -9.240 -0.410 -0.970 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -8.244 1.622 -1.056 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -9.173 3.139 -1.001 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -9.054 2.116 0.450 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -10.637 -1.864 0.375 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -10.261 -0.370 1.267 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -11.865 -0.586 0.527 1.00 0.00 H new ATOM 1050 N GLN A 68 -12.009 3.735 -2.216 1.00 0.00 N ATOM 1051 CA GLN A 68 -11.863 4.967 -2.953 1.00 0.00 C ATOM 1052 C GLN A 68 -13.137 5.828 -2.995 1.00 0.00 C ATOM 1053 O GLN A 68 -13.113 6.905 -3.648 1.00 0.00 O ATOM 1054 CB GLN A 68 -11.437 4.654 -4.398 1.00 0.00 C ATOM 1055 CG GLN A 68 -9.928 4.422 -4.586 1.00 0.00 C ATOM 1056 CD GLN A 68 -9.181 5.787 -4.702 1.00 0.00 C ATOM 1057 OE1 GLN A 68 -8.846 6.276 -5.795 1.00 0.00 O ATOM 1058 NE2 GLN A 68 -8.929 6.437 -3.556 1.00 0.00 N ATOM 0 H GLN A 68 -12.323 2.977 -2.821 1.00 0.00 H new ATOM 0 HA GLN A 68 -11.105 5.545 -2.424 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -11.972 3.767 -4.736 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -11.747 5.478 -5.041 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -9.533 3.854 -3.744 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -9.753 3.827 -5.482 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.208 6.027 -2.665 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -8.458 7.342 -3.576 1.00 0.00 H new ATOM 1067 N ARG A 69 -14.246 5.354 -2.430 1.00 0.00 N ATOM 1068 CA ARG A 69 -15.532 6.076 -2.291 1.00 0.00 C ATOM 1069 C ARG A 69 -15.956 6.206 -0.833 1.00 0.00 C ATOM 1070 O ARG A 69 -16.757 7.084 -0.468 1.00 0.00 O ATOM 1071 CB ARG A 69 -16.625 5.424 -3.148 1.00 0.00 C ATOM 1072 CG ARG A 69 -16.972 3.998 -2.710 1.00 0.00 C ATOM 1073 CD ARG A 69 -18.066 3.977 -1.621 1.00 0.00 C ATOM 1074 NE ARG A 69 -19.144 3.055 -2.034 1.00 0.00 N ATOM 1075 CZ ARG A 69 -20.160 3.337 -2.890 1.00 0.00 C ATOM 1076 NH1 ARG A 69 -20.250 4.532 -3.521 1.00 0.00 N ATOM 1077 NH2 ARG A 69 -21.133 2.428 -3.135 1.00 0.00 N ATOM 0 H ARG A 69 -14.286 4.414 -2.035 1.00 0.00 H new ATOM 0 HA ARG A 69 -15.382 7.089 -2.664 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -17.524 6.038 -3.105 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -16.299 5.408 -4.188 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -17.310 3.426 -3.574 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -16.075 3.506 -2.333 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -17.642 3.657 -0.669 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -18.466 4.980 -1.471 1.00 0.00 H new ATOM 0 HE ARG A 69 -19.123 2.115 -1.638 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -19.543 5.249 -3.359 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -21.025 4.715 -4.159 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -21.109 1.518 -2.674 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -21.890 2.653 -3.780 1.00 0.00 H new ATOM 1091 N LEU A 70 -15.496 5.269 0.025 1.00 0.00 N ATOM 1092 CA LEU A 70 -15.349 5.435 1.475 1.00 0.00 C ATOM 1093 C LEU A 70 -14.368 6.581 1.788 1.00 0.00 C ATOM 1094 O LEU A 70 -14.763 7.554 2.463 1.00 0.00 O ATOM 1095 CB LEU A 70 -14.695 4.079 1.972 1.00 0.00 C ATOM 1096 CG LEU A 70 -15.002 3.599 3.370 1.00 0.00 C ATOM 1097 CD1 LEU A 70 -16.126 2.557 3.524 1.00 0.00 C ATOM 1098 CD2 LEU A 70 -13.688 3.091 4.104 1.00 0.00 C ATOM 0 H LEU A 70 -15.208 4.344 -0.293 1.00 0.00 H new ATOM 0 HA LEU A 70 -16.304 5.661 1.950 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -14.995 3.293 1.279 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -13.613 4.183 1.888 1.00 0.00 H new ATOM 0 HG LEU A 70 -15.399 4.494 3.850 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -16.242 2.300 4.577 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -17.061 2.972 3.147 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -15.872 1.661 2.958 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -13.940 2.752 5.109 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -13.253 2.266 3.541 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -12.968 3.907 4.167 1.00 0.00 H new ATOM 1110 N LEU A 71 -13.101 6.457 1.360 1.00 0.00 N ATOM 1111 CA LEU A 71 -11.936 7.306 1.708 1.00 0.00 C ATOM 1112 C LEU A 71 -11.303 7.798 0.368 1.00 0.00 C ATOM 1113 O LEU A 71 -10.333 7.212 -0.091 1.00 0.00 O ATOM 1114 CB LEU A 71 -11.010 6.542 2.578 1.00 0.00 C ATOM 1115 CG LEU A 71 -9.590 6.125 2.140 1.00 0.00 C ATOM 1116 CD1 LEU A 71 -8.602 7.318 1.957 1.00 0.00 C ATOM 1117 CD2 LEU A 71 -9.024 4.991 3.005 1.00 0.00 C ATOM 0 H LEU A 71 -12.839 5.710 0.716 1.00 0.00 H new ATOM 0 HA LEU A 71 -12.215 8.188 2.285 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.892 7.126 3.491 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.530 5.624 2.852 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.703 5.718 1.135 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.627 6.939 1.649 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.986 7.995 1.194 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.501 7.855 2.900 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -8.023 4.733 2.658 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.975 5.316 4.044 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -9.671 4.117 2.928 1.00 0.00 H new ATOM 1129 N PRO A 72 -11.918 8.821 -0.252 1.00 0.00 N ATOM 1130 CA PRO A 72 -11.520 9.434 -1.543 1.00 0.00 C ATOM 1131 C PRO A 72 -10.912 10.867 -1.522 1.00 0.00 C ATOM 1132 O PRO A 72 -11.340 11.742 -2.287 1.00 0.00 O ATOM 1133 CB PRO A 72 -12.834 9.394 -2.352 1.00 0.00 C ATOM 1134 CG PRO A 72 -13.859 9.813 -1.285 1.00 0.00 C ATOM 1135 CD PRO A 72 -13.289 9.307 0.062 1.00 0.00 C ATOM 0 HA PRO A 72 -10.679 8.879 -1.958 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -12.817 10.081 -3.198 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -13.040 8.401 -2.752 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -13.992 10.895 -1.273 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -14.836 9.374 -1.487 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -13.263 10.106 0.803 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -13.905 8.508 0.475 1.00 0.00 H new ATOM 1143 N ASN A 73 -9.818 10.984 -0.740 1.00 0.00 N ATOM 1144 CA ASN A 73 -8.935 12.181 -0.714 1.00 0.00 C ATOM 1145 C ASN A 73 -7.448 11.794 -0.596 1.00 0.00 C ATOM 1146 O ASN A 73 -6.657 12.560 -0.033 1.00 0.00 O ATOM 1147 CB ASN A 73 -9.362 13.106 0.435 1.00 0.00 C ATOM 1148 CG ASN A 73 -10.716 13.791 0.214 1.00 0.00 C ATOM 1149 OD1 ASN A 73 -11.660 13.256 -0.412 1.00 0.00 O ATOM 1150 ND2 ASN A 73 -10.879 15.040 0.701 1.00 0.00 N ATOM 0 H ASN A 73 -9.516 10.248 -0.102 1.00 0.00 H new ATOM 0 HA ASN A 73 -9.044 12.712 -1.660 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -9.406 12.526 1.357 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -8.598 13.871 0.575 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -11.760 15.533 0.557 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -10.121 15.491 1.213 1.00 0.00 H new ATOM 1157 N LYS A 74 -7.105 10.563 -1.048 1.00 0.00 N ATOM 1158 CA LYS A 74 -5.748 10.022 -0.989 1.00 0.00 C ATOM 1159 C LYS A 74 -5.303 9.319 -2.265 1.00 0.00 C ATOM 1160 O LYS A 74 -6.081 8.960 -3.122 1.00 0.00 O ATOM 1161 CB LYS A 74 -5.556 9.124 0.237 1.00 0.00 C ATOM 1162 CG LYS A 74 -6.431 9.542 1.412 1.00 0.00 C ATOM 1163 CD LYS A 74 -5.930 10.831 2.129 1.00 0.00 C ATOM 1164 CE LYS A 74 -4.606 10.540 2.829 1.00 0.00 C ATOM 1165 NZ LYS A 74 -3.663 11.665 2.721 1.00 0.00 N ATOM 0 H LYS A 74 -7.778 9.921 -1.466 1.00 0.00 H new ATOM 0 HA LYS A 74 -5.095 10.889 -0.890 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -5.785 8.093 -0.033 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -4.510 9.149 0.541 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -7.449 9.705 1.058 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -6.471 8.726 2.134 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -5.802 11.636 1.406 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -6.671 11.168 2.854 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -4.793 10.324 3.881 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -4.156 9.647 2.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -2.765 11.411 3.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -3.490 11.878 1.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -4.066 12.502 3.188 1.00 0.00 H new ATOM 1179 N PRO A 75 -3.949 9.205 -2.399 1.00 0.00 N ATOM 1180 CA PRO A 75 -3.242 8.345 -3.392 1.00 0.00 C ATOM 1181 C PRO A 75 -3.164 6.826 -3.153 1.00 0.00 C ATOM 1182 O PRO A 75 -2.088 6.237 -3.061 1.00 0.00 O ATOM 1183 CB PRO A 75 -1.929 9.013 -3.651 1.00 0.00 C ATOM 1184 CG PRO A 75 -1.593 9.702 -2.355 1.00 0.00 C ATOM 1185 CD PRO A 75 -2.981 10.097 -1.745 1.00 0.00 C ATOM 0 HA PRO A 75 -3.867 8.295 -4.283 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -1.162 8.288 -3.925 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -2.002 9.726 -4.472 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.040 9.042 -1.687 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -0.970 10.580 -2.523 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -2.989 9.964 -0.663 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.214 11.144 -1.939 1.00 0.00 H new ATOM 1193 N VAL A 76 -4.356 6.193 -3.267 1.00 0.00 N ATOM 1194 CA VAL A 76 -4.593 4.752 -3.208 1.00 0.00 C ATOM 1195 C VAL A 76 -4.178 4.053 -4.512 1.00 0.00 C ATOM 1196 O VAL A 76 -4.114 4.641 -5.602 1.00 0.00 O ATOM 1197 CB VAL A 76 -6.034 4.482 -2.752 1.00 0.00 C ATOM 1198 CG1 VAL A 76 -6.284 3.000 -2.339 1.00 0.00 C ATOM 1199 CG2 VAL A 76 -6.469 5.445 -1.624 1.00 0.00 C ATOM 0 H VAL A 76 -5.220 6.715 -3.411 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.948 4.300 -2.454 1.00 0.00 H new ATOM 0 HB VAL A 76 -6.656 4.672 -3.626 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.322 2.879 -2.028 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.081 2.347 -3.188 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -5.624 2.736 -1.512 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -7.494 5.221 -1.330 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -5.810 5.321 -0.765 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -6.410 6.473 -1.981 1.00 0.00 H new ATOM 1209 N GLU A 77 -3.821 2.745 -4.402 1.00 0.00 N ATOM 1210 CA GLU A 77 -3.559 1.830 -5.486 1.00 0.00 C ATOM 1211 C GLU A 77 -3.637 0.350 -5.056 1.00 0.00 C ATOM 1212 O GLU A 77 -3.379 -0.004 -3.927 1.00 0.00 O ATOM 1213 CB GLU A 77 -2.218 2.106 -6.180 1.00 0.00 C ATOM 1214 CG GLU A 77 -2.355 2.918 -7.465 1.00 0.00 C ATOM 1215 CD GLU A 77 -1.140 2.829 -8.405 1.00 0.00 C ATOM 1216 OE1 GLU A 77 -0.407 1.810 -8.233 1.00 0.00 O ATOM 1217 OE2 GLU A 77 -0.975 3.758 -9.252 1.00 0.00 O ATOM 0 H GLU A 77 -3.709 2.300 -3.491 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.358 2.010 -6.206 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -1.564 2.639 -5.490 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -1.734 1.157 -6.409 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -3.241 2.579 -8.002 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -2.522 3.963 -7.204 1.00 0.00 H new ATOM 1224 N VAL A 78 -4.118 -0.487 -6.001 1.00 0.00 N ATOM 1225 CA VAL A 78 -3.805 -1.923 -6.095 1.00 0.00 C ATOM 1226 C VAL A 78 -2.337 -2.149 -6.426 1.00 0.00 C ATOM 1227 O VAL A 78 -1.768 -1.529 -7.354 1.00 0.00 O ATOM 1228 CB VAL A 78 -4.809 -2.579 -7.054 1.00 0.00 C ATOM 1229 CG1 VAL A 78 -4.257 -3.230 -8.303 1.00 0.00 C ATOM 1230 CG2 VAL A 78 -5.852 -3.440 -6.314 1.00 0.00 C ATOM 0 H VAL A 78 -4.750 -0.171 -6.736 1.00 0.00 H new ATOM 0 HA VAL A 78 -3.927 -2.418 -5.131 1.00 0.00 H new ATOM 0 HB VAL A 78 -5.331 -1.722 -7.480 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -5.076 -3.652 -8.886 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -3.733 -2.484 -8.901 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -3.564 -4.024 -8.024 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.538 -3.881 -7.037 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.345 -4.233 -5.764 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -6.411 -2.815 -5.617 1.00 0.00 H new ATOM 1240 N ILE A 79 -1.658 -3.004 -5.620 1.00 0.00 N ATOM 1241 CA ILE A 79 -0.304 -3.575 -5.879 1.00 0.00 C ATOM 1242 C ILE A 79 -0.309 -4.320 -7.187 1.00 0.00 C ATOM 1243 O ILE A 79 -1.354 -4.333 -7.933 1.00 0.00 O ATOM 1244 CB ILE A 79 0.146 -4.362 -4.605 1.00 0.00 C ATOM 1245 CG1 ILE A 79 0.920 -3.450 -3.645 1.00 0.00 C ATOM 1246 CG2 ILE A 79 0.829 -5.692 -4.947 1.00 0.00 C ATOM 1247 CD1 ILE A 79 1.588 -4.053 -2.418 1.00 0.00 C ATOM 0 H ILE A 79 -2.051 -3.330 -4.737 1.00 0.00 H new ATOM 0 HA ILE A 79 0.464 -2.816 -6.026 1.00 0.00 H new ATOM 0 HB ILE A 79 -0.742 -4.671 -4.053 1.00 0.00 H new ATOM 0 HG12 ILE A 79 1.694 -2.946 -4.225 1.00 0.00 H new ATOM 0 HG13 ILE A 79 0.231 -2.681 -3.297 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.121 -6.198 -4.027 1.00 0.00 H new ATOM 0 HG22 ILE A 79 0.137 -6.324 -5.504 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.714 -5.501 -5.553 1.00 0.00 H new ATOM 0 HD11 ILE A 79 2.089 -3.267 -1.853 1.00 0.00 H new ATOM 0 HD12 ILE A 79 0.834 -4.527 -1.790 1.00 0.00 H new ATOM 0 HD13 ILE A 79 2.320 -4.797 -2.731 1.00 0.00 H new ATOM 1259 N ASP A 80 0.809 -4.870 -7.603 1.00 0.00 N ATOM 1260 CA ASP A 80 1.039 -5.973 -8.564 1.00 0.00 C ATOM 1261 C ASP A 80 1.230 -7.315 -7.785 1.00 0.00 C ATOM 1262 O ASP A 80 1.779 -7.387 -6.743 1.00 0.00 O ATOM 1263 CB ASP A 80 2.293 -5.709 -9.392 1.00 0.00 C ATOM 1264 CG ASP A 80 2.147 -5.302 -10.822 1.00 0.00 C ATOM 1265 OD1 ASP A 80 1.003 -5.537 -11.389 1.00 0.00 O ATOM 1266 OD2 ASP A 80 3.078 -4.731 -11.416 1.00 0.00 O ATOM 0 H ASP A 80 1.699 -4.526 -7.243 1.00 0.00 H new ATOM 0 HA ASP A 80 0.175 -6.038 -9.226 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.863 -4.930 -8.885 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.899 -6.615 -9.368 1.00 0.00 H new ATOM 1271 N SER A 81 0.516 -8.339 -8.343 1.00 0.00 N ATOM 1272 CA SER A 81 0.131 -9.605 -7.666 1.00 0.00 C ATOM 1273 C SER A 81 1.224 -10.632 -7.631 1.00 0.00 C ATOM 1274 O SER A 81 1.221 -11.591 -6.801 1.00 0.00 O ATOM 1275 CB SER A 81 -1.089 -10.136 -8.478 1.00 0.00 C ATOM 1276 OG SER A 81 -1.613 -11.286 -7.917 1.00 0.00 O ATOM 0 H SER A 81 0.185 -8.299 -9.307 1.00 0.00 H new ATOM 0 HA SER A 81 -0.095 -9.414 -6.617 1.00 0.00 H new ATOM 0 HB2 SER A 81 -1.861 -9.367 -8.521 1.00 0.00 H new ATOM 0 HB3 SER A 81 -0.783 -10.338 -9.505 1.00 0.00 H new ATOM 0 HG SER A 81 -2.377 -11.591 -8.450 1.00 0.00 H new ATOM 1282 N LEU A 82 2.262 -10.464 -8.478 1.00 0.00 N ATOM 1283 CA LEU A 82 3.502 -11.268 -8.576 1.00 0.00 C ATOM 1284 C LEU A 82 4.614 -10.570 -7.808 1.00 0.00 C ATOM 1285 O LEU A 82 5.386 -11.212 -7.062 1.00 0.00 O ATOM 1286 CB LEU A 82 3.794 -11.338 -10.085 1.00 0.00 C ATOM 1287 CG LEU A 82 5.163 -11.529 -10.660 1.00 0.00 C ATOM 1288 CD1 LEU A 82 6.336 -11.898 -9.775 1.00 0.00 C ATOM 1289 CD2 LEU A 82 5.055 -12.582 -11.875 1.00 0.00 C ATOM 0 H LEU A 82 2.256 -9.707 -9.162 1.00 0.00 H new ATOM 0 HA LEU A 82 3.415 -12.267 -8.148 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.182 -12.150 -10.477 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.409 -10.413 -10.514 1.00 0.00 H new ATOM 0 HG LEU A 82 5.437 -10.513 -10.943 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.236 -11.989 -10.383 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.483 -11.122 -9.023 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.134 -12.848 -9.281 1.00 0.00 H new ATOM 0 HD21 LEU A 82 6.042 -12.737 -12.311 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.670 -13.531 -11.501 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.380 -12.191 -12.636 1.00 0.00 H new ATOM 1301 N LEU A 83 4.763 -9.228 -8.014 1.00 0.00 N ATOM 1302 CA LEU A 83 5.710 -8.359 -7.229 1.00 0.00 C ATOM 1303 C LEU A 83 5.300 -8.488 -5.746 1.00 0.00 C ATOM 1304 O LEU A 83 6.104 -8.817 -4.884 1.00 0.00 O ATOM 1305 CB LEU A 83 5.505 -6.948 -7.777 1.00 0.00 C ATOM 1306 CG LEU A 83 6.311 -6.526 -9.043 1.00 0.00 C ATOM 1307 CD1 LEU A 83 7.784 -6.194 -8.752 1.00 0.00 C ATOM 1308 CD2 LEU A 83 6.125 -7.522 -10.187 1.00 0.00 C ATOM 0 H LEU A 83 4.237 -8.716 -8.722 1.00 0.00 H new ATOM 0 HA LEU A 83 6.763 -8.628 -7.311 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.445 -6.829 -8.002 1.00 0.00 H new ATOM 0 HB3 LEU A 83 5.743 -6.243 -6.980 1.00 0.00 H new ATOM 0 HG LEU A 83 5.884 -5.582 -9.381 1.00 0.00 H new ATOM 0 HD11 LEU A 83 8.283 -5.909 -9.678 1.00 0.00 H new ATOM 0 HD12 LEU A 83 7.838 -5.369 -8.042 1.00 0.00 H new ATOM 0 HD13 LEU A 83 8.277 -7.069 -8.329 1.00 0.00 H new ATOM 0 HD21 LEU A 83 6.702 -7.194 -11.052 1.00 0.00 H new ATOM 0 HD22 LEU A 83 6.471 -8.507 -9.872 1.00 0.00 H new ATOM 0 HD23 LEU A 83 5.070 -7.576 -10.454 1.00 0.00 H new ATOM 1320 N TYR A 84 3.962 -8.260 -5.466 1.00 0.00 N ATOM 1321 CA TYR A 84 3.295 -8.626 -4.241 1.00 0.00 C ATOM 1322 C TYR A 84 3.804 -9.990 -3.705 1.00 0.00 C ATOM 1323 O TYR A 84 4.602 -10.063 -2.799 1.00 0.00 O ATOM 1324 CB TYR A 84 1.755 -8.641 -4.373 1.00 0.00 C ATOM 1325 CG TYR A 84 1.040 -8.453 -3.011 1.00 0.00 C ATOM 1326 CD1 TYR A 84 1.713 -8.764 -1.824 1.00 0.00 C ATOM 1327 CD2 TYR A 84 -0.297 -8.048 -3.021 1.00 0.00 C ATOM 1328 CE1 TYR A 84 0.988 -8.837 -0.626 1.00 0.00 C ATOM 1329 CE2 TYR A 84 -0.982 -7.966 -1.808 1.00 0.00 C ATOM 1330 CZ TYR A 84 -0.337 -8.318 -0.616 1.00 0.00 C ATOM 1331 OH TYR A 84 -0.980 -8.176 0.549 1.00 0.00 O ATOM 0 H TYR A 84 3.339 -7.802 -6.132 1.00 0.00 H new ATOM 0 HA TYR A 84 3.547 -7.849 -3.520 1.00 0.00 H new ATOM 0 HB2 TYR A 84 1.444 -7.849 -5.055 1.00 0.00 H new ATOM 0 HB3 TYR A 84 1.441 -9.586 -4.817 1.00 0.00 H new ATOM 0 HD1 TYR A 84 2.778 -8.946 -1.831 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.791 -7.803 -3.950 1.00 0.00 H new ATOM 0 HE1 TYR A 84 1.422 -9.274 0.262 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -2.009 -7.631 -1.789 1.00 0.00 H new ATOM 0 HH TYR A 84 -1.874 -7.809 0.387 1.00 0.00 H new ATOM 1341 N GLY A 85 3.203 -11.052 -4.345 1.00 0.00 N ATOM 1342 CA GLY A 85 3.252 -12.436 -3.800 1.00 0.00 C ATOM 1343 C GLY A 85 4.679 -12.999 -3.736 1.00 0.00 C ATOM 1344 O GLY A 85 4.963 -13.964 -3.036 1.00 0.00 O ATOM 0 H GLY A 85 2.690 -10.967 -5.223 1.00 0.00 H new ATOM 0 HA2 GLY A 85 2.818 -12.444 -2.800 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.636 -13.088 -4.420 1.00 0.00 H new ATOM 1348 N LYS A 86 5.571 -12.392 -4.560 1.00 0.00 N ATOM 1349 CA LYS A 86 7.035 -12.631 -4.464 1.00 0.00 C ATOM 1350 C LYS A 86 7.735 -11.720 -3.489 1.00 0.00 C ATOM 1351 O LYS A 86 8.974 -11.706 -3.354 1.00 0.00 O ATOM 1352 CB LYS A 86 7.677 -12.673 -5.841 1.00 0.00 C ATOM 1353 CG LYS A 86 7.373 -14.028 -6.551 1.00 0.00 C ATOM 1354 CD LYS A 86 8.508 -14.533 -7.446 1.00 0.00 C ATOM 1355 CE LYS A 86 8.494 -16.050 -7.596 1.00 0.00 C ATOM 1356 NZ LYS A 86 7.770 -16.692 -6.475 1.00 0.00 N ATOM 0 H LYS A 86 5.304 -11.737 -5.295 1.00 0.00 H new ATOM 0 HA LYS A 86 7.167 -13.622 -4.029 1.00 0.00 H new ATOM 0 HB2 LYS A 86 7.303 -11.848 -6.447 1.00 0.00 H new ATOM 0 HB3 LYS A 86 8.755 -12.539 -5.749 1.00 0.00 H new ATOM 0 HG2 LYS A 86 7.158 -14.782 -5.794 1.00 0.00 H new ATOM 0 HG3 LYS A 86 6.472 -13.916 -7.154 1.00 0.00 H new ATOM 0 HD2 LYS A 86 8.425 -14.072 -8.430 1.00 0.00 H new ATOM 0 HD3 LYS A 86 9.465 -14.220 -7.028 1.00 0.00 H new ATOM 0 HE2 LYS A 86 8.021 -16.320 -8.540 1.00 0.00 H new ATOM 0 HE3 LYS A 86 9.517 -16.424 -7.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 7.933 -17.719 -6.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 8.116 -16.308 -5.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 6.752 -16.501 -6.565 1.00 0.00 H new ATOM 1370 N VAL A 87 6.957 -10.857 -2.763 1.00 0.00 N ATOM 1371 CA VAL A 87 7.310 -10.092 -1.602 1.00 0.00 C ATOM 1372 C VAL A 87 8.586 -9.259 -1.842 1.00 0.00 C ATOM 1373 O VAL A 87 9.611 -9.428 -1.185 1.00 0.00 O ATOM 1374 CB VAL A 87 7.229 -10.857 -0.306 1.00 0.00 C ATOM 1375 CG1 VAL A 87 7.579 -9.972 0.961 1.00 0.00 C ATOM 1376 CG2 VAL A 87 5.926 -11.612 -0.065 1.00 0.00 C ATOM 0 H VAL A 87 5.987 -10.690 -3.030 1.00 0.00 H new ATOM 0 HA VAL A 87 6.528 -9.349 -1.446 1.00 0.00 H new ATOM 0 HB VAL A 87 8.000 -11.616 -0.436 1.00 0.00 H new ATOM 0 HG11 VAL A 87 7.503 -10.580 1.862 1.00 0.00 H new ATOM 0 HG12 VAL A 87 8.595 -9.588 0.867 1.00 0.00 H new ATOM 0 HG13 VAL A 87 6.881 -9.138 1.026 1.00 0.00 H new ATOM 0 HG21 VAL A 87 5.976 -12.126 0.895 1.00 0.00 H new ATOM 0 HG22 VAL A 87 5.094 -10.908 -0.057 1.00 0.00 H new ATOM 0 HG23 VAL A 87 5.776 -12.342 -0.860 1.00 0.00 H new ATOM 1386 N ASP A 88 8.498 -8.346 -2.842 1.00 0.00 N ATOM 1387 CA ASP A 88 9.373 -7.226 -3.143 1.00 0.00 C ATOM 1388 C ASP A 88 8.770 -5.834 -2.915 1.00 0.00 C ATOM 1389 O ASP A 88 7.719 -5.520 -3.467 1.00 0.00 O ATOM 1390 CB ASP A 88 10.006 -7.322 -4.538 1.00 0.00 C ATOM 1391 CG ASP A 88 11.247 -6.366 -4.699 1.00 0.00 C ATOM 1392 OD1 ASP A 88 11.384 -5.471 -3.785 1.00 0.00 O ATOM 1393 OD2 ASP A 88 11.989 -6.605 -5.654 1.00 0.00 O ATOM 0 H ASP A 88 7.731 -8.397 -3.513 1.00 0.00 H new ATOM 0 HA ASP A 88 10.160 -7.326 -2.396 1.00 0.00 H new ATOM 0 HB2 ASP A 88 10.316 -8.350 -4.724 1.00 0.00 H new ATOM 0 HB3 ASP A 88 9.259 -7.073 -5.291 1.00 0.00 H new ATOM 1398 N GLY A 89 9.359 -5.083 -1.963 1.00 0.00 N ATOM 1399 CA GLY A 89 9.177 -3.615 -1.819 1.00 0.00 C ATOM 1400 C GLY A 89 9.452 -2.815 -3.092 1.00 0.00 C ATOM 1401 O GLY A 89 8.605 -2.139 -3.648 1.00 0.00 O ATOM 0 H GLY A 89 9.984 -5.479 -1.261 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.155 -3.418 -1.495 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.837 -3.255 -1.029 1.00 0.00 H new ATOM 1405 N LEU A 90 10.765 -2.807 -3.487 1.00 0.00 N ATOM 1406 CA LEU A 90 11.425 -1.796 -4.310 1.00 0.00 C ATOM 1407 C LEU A 90 10.523 -1.424 -5.508 1.00 0.00 C ATOM 1408 O LEU A 90 10.499 -0.263 -5.944 1.00 0.00 O ATOM 1409 CB LEU A 90 12.746 -2.378 -4.788 1.00 0.00 C ATOM 1410 CG LEU A 90 13.901 -1.430 -5.211 1.00 0.00 C ATOM 1411 CD1 LEU A 90 14.789 -1.970 -6.329 1.00 0.00 C ATOM 1412 CD2 LEU A 90 13.446 0.017 -5.396 1.00 0.00 C ATOM 0 H LEU A 90 11.405 -3.553 -3.214 1.00 0.00 H new ATOM 0 HA LEU A 90 11.607 -0.887 -3.736 1.00 0.00 H new ATOM 0 HB2 LEU A 90 13.126 -3.018 -3.992 1.00 0.00 H new ATOM 0 HB3 LEU A 90 12.528 -3.024 -5.639 1.00 0.00 H new ATOM 0 HG LEU A 90 14.577 -1.405 -4.356 1.00 0.00 H new ATOM 0 HD11 LEU A 90 15.567 -1.243 -6.559 1.00 0.00 H new ATOM 0 HD12 LEU A 90 15.249 -2.905 -6.009 1.00 0.00 H new ATOM 0 HD13 LEU A 90 14.185 -2.149 -7.219 1.00 0.00 H new ATOM 0 HD21 LEU A 90 14.297 0.631 -5.691 1.00 0.00 H new ATOM 0 HD22 LEU A 90 12.680 0.061 -6.170 1.00 0.00 H new ATOM 0 HD23 LEU A 90 13.036 0.392 -4.458 1.00 0.00 H new ATOM 1424 N GLY A 91 9.809 -2.423 -6.091 1.00 0.00 N ATOM 1425 CA GLY A 91 8.748 -2.177 -7.102 1.00 0.00 C ATOM 1426 C GLY A 91 7.562 -1.416 -6.546 1.00 0.00 C ATOM 1427 O GLY A 91 7.175 -0.333 -7.081 1.00 0.00 O ATOM 0 H GLY A 91 9.951 -3.410 -5.876 1.00 0.00 H new ATOM 0 HA2 GLY A 91 9.172 -1.618 -7.936 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.405 -3.132 -7.500 1.00 0.00 H new ATOM 1431 N VAL A 92 6.897 -1.979 -5.517 1.00 0.00 N ATOM 1432 CA VAL A 92 5.687 -1.471 -4.849 1.00 0.00 C ATOM 1433 C VAL A 92 5.926 -0.193 -4.085 1.00 0.00 C ATOM 1434 O VAL A 92 4.974 0.519 -3.696 1.00 0.00 O ATOM 1435 CB VAL A 92 5.122 -2.658 -3.968 1.00 0.00 C ATOM 1436 CG1 VAL A 92 5.005 -3.984 -4.854 1.00 0.00 C ATOM 1437 CG2 VAL A 92 6.143 -2.972 -2.825 1.00 0.00 C ATOM 0 H VAL A 92 7.213 -2.857 -5.106 1.00 0.00 H new ATOM 0 HA VAL A 92 4.938 -1.173 -5.582 1.00 0.00 H new ATOM 0 HB VAL A 92 4.149 -2.367 -3.573 1.00 0.00 H new ATOM 0 HG11 VAL A 92 4.616 -4.797 -4.242 1.00 0.00 H new ATOM 0 HG12 VAL A 92 4.330 -3.804 -5.691 1.00 0.00 H new ATOM 0 HG13 VAL A 92 5.990 -4.256 -5.234 1.00 0.00 H new ATOM 0 HG21 VAL A 92 5.763 -3.789 -2.212 1.00 0.00 H new ATOM 0 HG22 VAL A 92 7.100 -3.260 -3.261 1.00 0.00 H new ATOM 0 HG23 VAL A 92 6.279 -2.086 -2.205 1.00 0.00 H new ATOM 1447 N LEU A 93 7.224 0.127 -3.800 1.00 0.00 N ATOM 1448 CA LEU A 93 7.678 1.470 -3.366 1.00 0.00 C ATOM 1449 C LEU A 93 7.632 2.426 -4.567 1.00 0.00 C ATOM 1450 O LEU A 93 7.274 3.584 -4.443 1.00 0.00 O ATOM 1451 CB LEU A 93 9.149 1.255 -2.918 1.00 0.00 C ATOM 1452 CG LEU A 93 9.994 2.475 -2.496 1.00 0.00 C ATOM 1453 CD1 LEU A 93 10.406 3.401 -3.598 1.00 0.00 C ATOM 1454 CD2 LEU A 93 9.352 3.188 -1.269 1.00 0.00 C ATOM 0 H LEU A 93 7.984 -0.550 -3.868 1.00 0.00 H new ATOM 0 HA LEU A 93 7.062 1.895 -2.574 1.00 0.00 H new ATOM 0 HB2 LEU A 93 9.138 0.558 -2.080 1.00 0.00 H new ATOM 0 HB3 LEU A 93 9.672 0.761 -3.737 1.00 0.00 H new ATOM 0 HG LEU A 93 10.958 2.073 -2.184 1.00 0.00 H new ATOM 0 HD11 LEU A 93 10.994 4.220 -3.184 1.00 0.00 H new ATOM 0 HD12 LEU A 93 11.006 2.855 -4.327 1.00 0.00 H new ATOM 0 HD13 LEU A 93 9.518 3.803 -4.087 1.00 0.00 H new ATOM 0 HD21 LEU A 93 9.962 4.046 -0.986 1.00 0.00 H new ATOM 0 HD22 LEU A 93 8.349 3.526 -1.529 1.00 0.00 H new ATOM 0 HD23 LEU A 93 9.295 2.492 -0.432 1.00 0.00 H new ATOM 1466 N LYS A 94 8.058 1.912 -5.760 1.00 0.00 N ATOM 1467 CA LYS A 94 7.844 2.617 -7.049 1.00 0.00 C ATOM 1468 C LYS A 94 6.361 2.931 -7.299 1.00 0.00 C ATOM 1469 O LYS A 94 5.919 4.079 -7.211 1.00 0.00 O ATOM 1470 CB LYS A 94 8.471 1.883 -8.211 1.00 0.00 C ATOM 1471 CG LYS A 94 8.203 2.620 -9.547 1.00 0.00 C ATOM 1472 CD LYS A 94 8.577 1.850 -10.803 1.00 0.00 C ATOM 1473 CE LYS A 94 10.091 1.980 -11.097 1.00 0.00 C ATOM 1474 NZ LYS A 94 10.389 1.527 -12.471 1.00 0.00 N ATOM 0 H LYS A 94 8.546 1.021 -5.849 1.00 0.00 H new ATOM 0 HA LYS A 94 8.358 3.575 -6.968 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.545 1.793 -8.051 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.071 0.871 -8.264 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.144 2.871 -9.597 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.754 3.561 -9.540 1.00 0.00 H new ATOM 0 HD2 LYS A 94 8.314 0.799 -10.682 1.00 0.00 H new ATOM 0 HD3 LYS A 94 8.004 2.227 -11.650 1.00 0.00 H new ATOM 0 HE2 LYS A 94 10.404 3.017 -10.973 1.00 0.00 H new ATOM 0 HE3 LYS A 94 10.659 1.387 -10.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 11.409 1.620 -12.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 10.108 0.531 -12.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.861 2.110 -13.151 1.00 0.00 H new ATOM 1488 N ALA A 95 5.616 1.843 -7.667 1.00 0.00 N ATOM 1489 CA ALA A 95 4.186 1.913 -8.004 1.00 0.00 C ATOM 1490 C ALA A 95 3.434 2.904 -7.102 1.00 0.00 C ATOM 1491 O ALA A 95 2.561 3.647 -7.559 1.00 0.00 O ATOM 1492 CB ALA A 95 3.537 0.525 -7.929 1.00 0.00 C ATOM 0 H ALA A 95 6.004 0.902 -7.733 1.00 0.00 H new ATOM 0 HA ALA A 95 4.115 2.277 -9.029 1.00 0.00 H new ATOM 0 HB1 ALA A 95 2.480 0.604 -8.182 1.00 0.00 H new ATOM 0 HB2 ALA A 95 4.030 -0.146 -8.633 1.00 0.00 H new ATOM 0 HB3 ALA A 95 3.639 0.130 -6.918 1.00 0.00 H new ATOM 1498 N ALA A 96 3.752 2.892 -5.789 1.00 0.00 N ATOM 1499 CA ALA A 96 3.295 3.857 -4.778 1.00 0.00 C ATOM 1500 C ALA A 96 3.496 5.300 -5.266 1.00 0.00 C ATOM 1501 O ALA A 96 2.575 6.108 -5.293 1.00 0.00 O ATOM 1502 CB ALA A 96 4.096 3.634 -3.463 1.00 0.00 C ATOM 0 H ALA A 96 4.361 2.176 -5.393 1.00 0.00 H new ATOM 0 HA ALA A 96 2.231 3.702 -4.600 1.00 0.00 H new ATOM 0 HB1 ALA A 96 3.762 4.346 -2.708 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.929 2.619 -3.103 1.00 0.00 H new ATOM 0 HB3 ALA A 96 5.159 3.780 -3.655 1.00 0.00 H new ATOM 1508 N VAL A 97 4.784 5.632 -5.589 1.00 0.00 N ATOM 1509 CA VAL A 97 5.175 6.854 -6.313 1.00 0.00 C ATOM 1510 C VAL A 97 4.134 7.174 -7.415 1.00 0.00 C ATOM 1511 O VAL A 97 3.561 8.261 -7.451 1.00 0.00 O ATOM 1512 CB VAL A 97 6.619 6.691 -6.831 1.00 0.00 C ATOM 1513 CG1 VAL A 97 6.931 7.523 -8.107 1.00 0.00 C ATOM 1514 CG2 VAL A 97 7.686 6.979 -5.741 1.00 0.00 C ATOM 0 H VAL A 97 5.579 5.042 -5.344 1.00 0.00 H new ATOM 0 HA VAL A 97 5.177 7.721 -5.652 1.00 0.00 H new ATOM 0 HB VAL A 97 6.680 5.639 -7.108 1.00 0.00 H new ATOM 0 HG11 VAL A 97 7.965 7.354 -8.408 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.264 7.217 -8.913 1.00 0.00 H new ATOM 0 HG13 VAL A 97 6.783 8.582 -7.896 1.00 0.00 H new ATOM 0 HG21 VAL A 97 8.682 6.848 -6.164 1.00 0.00 H new ATOM 0 HG22 VAL A 97 7.574 8.003 -5.384 1.00 0.00 H new ATOM 0 HG23 VAL A 97 7.552 6.288 -4.909 1.00 0.00 H new ATOM 1524 N ALA A 98 3.967 6.197 -8.344 1.00 0.00 N ATOM 1525 CA ALA A 98 3.090 6.316 -9.513 1.00 0.00 C ATOM 1526 C ALA A 98 1.723 6.972 -9.133 1.00 0.00 C ATOM 1527 O ALA A 98 1.205 7.802 -9.852 1.00 0.00 O ATOM 1528 CB ALA A 98 2.828 4.954 -10.151 1.00 0.00 C ATOM 0 H ALA A 98 4.448 5.299 -8.291 1.00 0.00 H new ATOM 0 HA ALA A 98 3.606 6.954 -10.230 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.175 5.076 -11.015 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.773 4.514 -10.470 1.00 0.00 H new ATOM 0 HB3 ALA A 98 2.349 4.298 -9.424 1.00 0.00 H new ATOM 1534 N ALA A 99 1.172 6.492 -7.993 1.00 0.00 N ATOM 1535 CA ALA A 99 -0.091 6.973 -7.397 1.00 0.00 C ATOM 1536 C ALA A 99 -0.033 8.489 -7.141 1.00 0.00 C ATOM 1537 O ALA A 99 -0.722 9.282 -7.749 1.00 0.00 O ATOM 1538 CB ALA A 99 -0.390 6.237 -6.098 1.00 0.00 C ATOM 0 H ALA A 99 1.605 5.743 -7.452 1.00 0.00 H new ATOM 0 HA ALA A 99 -0.893 6.770 -8.107 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -1.325 6.607 -5.677 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -0.480 5.169 -6.297 1.00 0.00 H new ATOM 0 HB3 ALA A 99 0.420 6.407 -5.389 1.00 0.00 H new ATOM 1544 N ILE A 100 0.844 8.871 -6.176 1.00 0.00 N ATOM 1545 CA ILE A 100 0.998 10.264 -5.662 1.00 0.00 C ATOM 1546 C ILE A 100 1.030 11.223 -6.888 1.00 0.00 C ATOM 1547 O ILE A 100 0.251 12.125 -7.044 1.00 0.00 O ATOM 1548 CB ILE A 100 2.237 10.388 -4.741 1.00 0.00 C ATOM 1549 CG1 ILE A 100 1.854 10.773 -3.297 1.00 0.00 C ATOM 1550 CG2 ILE A 100 3.379 11.216 -5.321 1.00 0.00 C ATOM 1551 CD1 ILE A 100 1.384 12.216 -3.080 1.00 0.00 C ATOM 0 H ILE A 100 1.476 8.211 -5.724 1.00 0.00 H new ATOM 0 HA ILE A 100 0.155 10.543 -5.030 1.00 0.00 H new ATOM 0 HB ILE A 100 2.659 9.384 -4.686 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.063 10.102 -2.962 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.717 10.594 -2.655 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.203 11.249 -4.608 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.721 10.763 -6.251 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.030 12.229 -5.518 1.00 0.00 H new ATOM 0 HD11 ILE A 100 1.144 12.366 -2.027 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.176 12.905 -3.373 1.00 0.00 H new ATOM 0 HD13 ILE A 100 0.497 12.405 -3.685 1.00 0.00 H new ATOM 1563 N LYS A 101 2.042 10.943 -7.770 1.00 0.00 N ATOM 1564 CA LYS A 101 2.449 11.808 -8.867 1.00 0.00 C ATOM 1565 C LYS A 101 1.403 11.959 -9.984 1.00 0.00 C ATOM 1566 O LYS A 101 1.459 12.889 -10.809 1.00 0.00 O ATOM 1567 CB LYS A 101 3.823 11.487 -9.419 1.00 0.00 C ATOM 1568 CG LYS A 101 3.770 10.448 -10.562 1.00 0.00 C ATOM 1569 CD LYS A 101 3.784 11.029 -11.965 1.00 0.00 C ATOM 1570 CE LYS A 101 2.593 10.686 -12.813 1.00 0.00 C ATOM 1571 NZ LYS A 101 1.771 9.618 -12.210 1.00 0.00 N ATOM 0 H LYS A 101 2.592 10.086 -7.715 1.00 0.00 H new ATOM 0 HA LYS A 101 2.523 12.790 -8.400 1.00 0.00 H new ATOM 0 HB2 LYS A 101 4.288 12.403 -9.785 1.00 0.00 H new ATOM 0 HB3 LYS A 101 4.455 11.108 -8.616 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.619 9.773 -10.457 1.00 0.00 H new ATOM 0 HG3 LYS A 101 2.868 9.847 -10.444 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.856 12.114 -11.891 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.684 10.684 -12.475 1.00 0.00 H new ATOM 0 HE2 LYS A 101 1.981 11.577 -12.955 1.00 0.00 H new ATOM 0 HE3 LYS A 101 2.930 10.370 -13.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 0.925 9.460 -12.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 2.326 8.740 -12.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 1.483 9.901 -11.252 1.00 0.00 H new ATOM 1585 N LYS A 102 0.485 10.969 -10.043 1.00 0.00 N ATOM 1586 CA LYS A 102 -0.742 11.072 -10.867 1.00 0.00 C ATOM 1587 C LYS A 102 -1.739 12.102 -10.330 1.00 0.00 C ATOM 1588 O LYS A 102 -2.498 12.721 -11.090 1.00 0.00 O ATOM 1589 CB LYS A 102 -1.397 9.691 -11.057 1.00 0.00 C ATOM 1590 CG LYS A 102 -2.778 9.845 -11.749 1.00 0.00 C ATOM 1591 CD LYS A 102 -3.103 8.766 -12.797 1.00 0.00 C ATOM 1592 CE LYS A 102 -3.980 9.377 -13.908 1.00 0.00 C ATOM 1593 NZ LYS A 102 -5.105 8.479 -14.239 1.00 0.00 N ATOM 0 H LYS A 102 0.569 10.091 -9.531 1.00 0.00 H new ATOM 0 HA LYS A 102 -0.432 11.438 -11.846 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.750 9.053 -11.658 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -1.519 9.202 -10.091 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -3.554 9.833 -10.984 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -2.820 10.822 -12.230 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -2.182 8.369 -13.223 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -3.623 7.931 -12.326 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -4.364 10.345 -13.584 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -3.376 9.555 -14.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -5.683 8.909 -14.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -4.734 7.565 -14.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -5.691 8.330 -13.393 1.00 0.00 H new ATOM 1607 N ALA A 103 -1.760 12.261 -8.987 1.00 0.00 N ATOM 1608 CA ALA A 103 -2.508 13.258 -8.243 1.00 0.00 C ATOM 1609 C ALA A 103 -1.811 14.650 -8.296 1.00 0.00 C ATOM 1610 O ALA A 103 -2.312 15.615 -7.753 1.00 0.00 O ATOM 1611 CB ALA A 103 -2.723 12.866 -6.778 1.00 0.00 C ATOM 0 H ALA A 103 -1.218 11.653 -8.373 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.482 13.316 -8.729 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -3.288 13.648 -6.271 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -3.278 11.929 -6.730 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.757 12.741 -6.289 1.00 0.00 H new ATOM 1617 N ALA A 104 -0.636 14.667 -8.954 1.00 0.00 N ATOM 1618 CA ALA A 104 0.304 15.777 -8.982 1.00 0.00 C ATOM 1619 C ALA A 104 -0.405 17.123 -8.735 1.00 0.00 C ATOM 1620 O ALA A 104 -0.540 17.591 -7.608 1.00 0.00 O ATOM 1621 CB ALA A 104 1.089 15.833 -10.301 1.00 0.00 C ATOM 0 H ALA A 104 -0.313 13.868 -9.500 1.00 0.00 H new ATOM 0 HA ALA A 104 1.013 15.602 -8.173 1.00 0.00 H new ATOM 0 HB1 ALA A 104 1.779 16.677 -10.278 1.00 0.00 H new ATOM 0 HB2 ALA A 104 1.651 14.908 -10.429 1.00 0.00 H new ATOM 0 HB3 ALA A 104 0.395 15.954 -11.133 1.00 0.00 H new ATOM 1627 N ALA A 105 -0.809 17.781 -9.852 1.00 0.00 N ATOM 1628 CA ALA A 105 -1.303 19.150 -9.913 1.00 0.00 C ATOM 1629 C ALA A 105 -1.764 19.562 -11.308 1.00 0.00 C ATOM 1630 O ALA A 105 -1.784 18.771 -12.261 1.00 0.00 O ATOM 1631 CB ALA A 105 -0.233 20.151 -9.396 1.00 0.00 C ATOM 0 H ALA A 105 -0.792 17.336 -10.770 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.177 19.181 -9.263 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -0.627 21.166 -9.452 1.00 0.00 H new ATOM 0 HB2 ALA A 105 0.016 19.915 -8.361 1.00 0.00 H new ATOM 0 HB3 ALA A 105 0.664 20.075 -10.011 1.00 0.00 H new ATOM 1637 N ASN A 106 -2.199 20.861 -11.429 1.00 0.00 N ATOM 1638 CA ASN A 106 -2.783 21.429 -12.675 1.00 0.00 C ATOM 1639 C ASN A 106 -4.252 21.011 -12.823 1.00 0.00 C ATOM 1640 O ASN A 106 -4.697 20.048 -12.159 1.00 0.00 O ATOM 1641 CB ASN A 106 -1.942 21.013 -13.896 1.00 0.00 C ATOM 1642 CG ASN A 106 -2.214 21.852 -15.150 1.00 0.00 C ATOM 1643 OD1 ASN A 106 -2.403 23.077 -15.138 1.00 0.00 O ATOM 1644 ND2 ASN A 106 -2.236 21.184 -16.330 1.00 0.00 N ATOM 0 H ASN A 106 -2.151 21.533 -10.663 1.00 0.00 H new ATOM 0 HA ASN A 106 -2.761 22.517 -12.613 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -0.885 21.090 -13.641 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -2.140 19.965 -14.122 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -2.407 21.690 -17.199 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -2.081 20.176 -16.348 1.00 0.00 H new TER 1651 ASN A 106