USER MOD reduce.3.24.130724 H: found=0, std=0, add=640, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 639 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 178:sc=-0.000416 (180deg=-0.00671) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= -0.136 K(o=-0.14,f=-1.1) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 0.435 X(o=0.43,f=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0.335 USER MOD Single : A 25 SER OG : rot 33:sc= 0.244 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 MET CE :methyl 179:sc= -1.3 (180deg=-1.31) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 72:sc= 1.34 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 48 CYS SG : rot -150:sc= -1.27 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HE2:sc= 0.243 K(o=0.24,f=-1.1) USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-2.3!) USER MOD Single : A 60 ASN : amide:sc=-0.00802 K(o=-0.008,f=-0.58) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -120:sc= 0 (180deg=-0.14) USER MOD Single : A 69 TYR OH : rot -145:sc= 0.574 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.136) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -1.300 7.914 -16.891 1.00 25.00 N ATOM 2 CA GLY A 1 -0.417 8.907 -16.130 1.00 25.00 C ATOM 3 C GLY A 1 1.026 8.481 -15.897 1.00 25.00 C ATOM 4 O GLY A 1 1.689 8.853 -14.982 1.00 25.00 O ATOM 0 H1 GLY A 1 -2.266 8.292 -16.962 1.00 25.00 H new ATOM 0 H2 GLY A 1 -0.915 7.768 -17.846 1.00 25.00 H new ATOM 0 H3 GLY A 1 -1.320 7.007 -16.383 1.00 25.00 H new ATOM 0 HA2 GLY A 1 -0.412 9.850 -16.677 1.00 25.00 H new ATOM 0 HA3 GLY A 1 -0.877 9.103 -15.161 1.00 25.00 H new ATOM 9 N SER A 2 1.589 7.737 -16.896 1.00 25.00 N ATOM 10 CA SER A 2 2.958 7.240 -16.956 1.00 25.00 C ATOM 11 C SER A 2 3.992 8.392 -16.947 1.00 25.00 C ATOM 12 O SER A 2 3.821 9.443 -17.609 1.00 25.00 O ATOM 13 CB SER A 2 3.153 6.467 -18.263 1.00 25.00 C ATOM 14 OG SER A 2 2.206 5.411 -18.336 1.00 25.00 O ATOM 0 H SER A 2 1.050 7.464 -17.718 1.00 25.00 H new ATOM 0 HA SER A 2 3.114 6.610 -16.080 1.00 25.00 H new ATOM 0 HB2 SER A 2 3.033 7.136 -19.115 1.00 25.00 H new ATOM 0 HB3 SER A 2 4.165 6.066 -18.313 1.00 25.00 H new ATOM 0 HG SER A 2 2.330 4.918 -19.174 1.00 25.00 H new ATOM 20 N MET A 3 5.098 8.163 -16.252 1.00 25.00 N ATOM 21 CA MET A 3 6.138 9.179 -16.162 1.00 25.00 C ATOM 22 C MET A 3 7.461 8.601 -16.646 1.00 25.00 C ATOM 23 O MET A 3 8.220 8.061 -15.901 1.00 25.00 O ATOM 24 CB MET A 3 6.277 9.645 -14.692 1.00 25.00 C ATOM 25 CG MET A 3 5.070 10.361 -14.178 1.00 25.00 C ATOM 26 SD MET A 3 5.278 11.025 -12.524 1.00 25.00 S ATOM 27 CE MET A 3 3.678 11.578 -12.226 1.00 25.00 C ATOM 0 H MET A 3 5.297 7.298 -15.750 1.00 25.00 H new ATOM 0 HA MET A 3 5.870 10.031 -16.787 1.00 25.00 H new ATOM 0 HB2 MET A 3 6.472 8.778 -14.061 1.00 25.00 H new ATOM 0 HB3 MET A 3 7.143 10.302 -14.607 1.00 25.00 H new ATOM 0 HG2 MET A 3 4.824 11.176 -14.859 1.00 25.00 H new ATOM 0 HG3 MET A 3 4.223 9.676 -14.181 1.00 25.00 H new ATOM 0 HE1 MET A 3 3.626 12.024 -11.233 1.00 25.00 H new ATOM 0 HE2 MET A 3 3.406 12.324 -12.973 1.00 25.00 H new ATOM 0 HE3 MET A 3 2.986 10.738 -12.283 1.00 25.00 H new ATOM 37 N LYS A 4 7.711 8.771 -17.946 1.00 25.00 N ATOM 38 CA LYS A 4 8.941 8.323 -18.590 1.00 25.00 C ATOM 39 C LYS A 4 9.208 6.828 -18.439 1.00 25.00 C ATOM 40 O LYS A 4 10.355 6.378 -18.316 1.00 25.00 O ATOM 41 CB LYS A 4 10.131 9.129 -18.095 1.00 25.00 C ATOM 42 CG LYS A 4 10.001 10.628 -18.198 1.00 25.00 C ATOM 43 CD LYS A 4 11.374 11.189 -17.734 1.00 25.00 C ATOM 44 CE LYS A 4 11.382 12.745 -17.604 1.00 25.00 C ATOM 45 NZ LYS A 4 10.692 13.162 -16.303 1.00 25.00 N ATOM 0 H LYS A 4 7.059 9.227 -18.584 1.00 25.00 H new ATOM 0 HA LYS A 4 8.800 8.498 -19.657 1.00 25.00 H new ATOM 0 HB2 LYS A 4 10.311 8.870 -17.052 1.00 25.00 H new ATOM 0 HB3 LYS A 4 11.013 8.821 -18.657 1.00 25.00 H new ATOM 0 HG2 LYS A 4 9.775 10.934 -19.219 1.00 25.00 H new ATOM 0 HG3 LYS A 4 9.192 10.997 -17.568 1.00 25.00 H new ATOM 0 HD2 LYS A 4 11.635 10.748 -16.772 1.00 25.00 H new ATOM 0 HD3 LYS A 4 12.144 10.885 -18.443 1.00 25.00 H new ATOM 0 HE2 LYS A 4 12.407 13.115 -17.617 1.00 25.00 H new ATOM 0 HE3 LYS A 4 10.871 13.193 -18.457 1.00 25.00 H new ATOM 0 HZ1 LYS A 4 10.701 14.199 -16.222 1.00 25.00 H new ATOM 0 HZ2 LYS A 4 9.709 12.823 -16.307 1.00 25.00 H new ATOM 0 HZ3 LYS A 4 11.197 12.748 -15.494 1.00 25.00 H new ATOM 59 N TYR A 5 8.112 6.066 -18.563 1.00 25.00 N ATOM 60 CA TYR A 5 8.213 4.605 -18.666 1.00 25.00 C ATOM 61 C TYR A 5 8.472 4.202 -20.128 1.00 25.00 C ATOM 62 O TYR A 5 8.223 5.009 -21.072 1.00 25.00 O ATOM 63 CB TYR A 5 6.899 3.980 -18.198 1.00 25.00 C ATOM 64 CG TYR A 5 7.070 3.243 -16.852 1.00 25.00 C ATOM 65 CD1 TYR A 5 6.764 1.857 -16.734 1.00 25.00 C ATOM 66 CD2 TYR A 5 7.569 3.927 -15.706 1.00 25.00 C ATOM 67 CE1 TYR A 5 6.993 1.152 -15.528 1.00 25.00 C ATOM 68 CE2 TYR A 5 7.732 3.227 -14.464 1.00 25.00 C ATOM 69 CZ TYR A 5 7.461 1.868 -14.384 1.00 25.00 C ATOM 70 OH TYR A 5 7.646 1.269 -13.156 1.00 25.00 O ATOM 0 H TYR A 5 7.160 6.431 -18.594 1.00 25.00 H new ATOM 0 HA TYR A 5 9.036 4.254 -18.044 1.00 25.00 H new ATOM 0 HB2 TYR A 5 6.142 4.757 -18.095 1.00 25.00 H new ATOM 0 HB3 TYR A 5 6.538 3.282 -18.953 1.00 25.00 H new ATOM 0 HD1 TYR A 5 6.349 1.333 -17.582 1.00 25.00 H new ATOM 0 HD2 TYR A 5 7.825 4.974 -15.772 1.00 25.00 H new ATOM 0 HE1 TYR A 5 6.816 0.088 -15.474 1.00 25.00 H new ATOM 0 HE2 TYR A 5 8.067 3.760 -13.587 1.00 25.00 H new ATOM 0 HH TYR A 5 7.971 1.934 -12.513 1.00 25.00 H new ATOM 80 N LEU A 6 8.856 2.931 -20.302 1.00 25.00 N ATOM 81 CA LEU A 6 9.227 2.441 -21.633 1.00 25.00 C ATOM 82 C LEU A 6 8.142 2.607 -22.685 1.00 25.00 C ATOM 83 O LEU A 6 8.418 3.014 -23.805 1.00 25.00 O ATOM 84 CB LEU A 6 9.556 0.945 -21.546 1.00 25.00 C ATOM 85 CG LEU A 6 10.971 0.452 -21.238 1.00 25.00 C ATOM 86 CD1 LEU A 6 11.867 0.889 -22.397 1.00 25.00 C ATOM 87 CD2 LEU A 6 11.559 0.953 -19.882 1.00 25.00 C ATOM 0 H LEU A 6 8.917 2.238 -19.556 1.00 25.00 H new ATOM 0 HA LEU A 6 10.081 3.044 -21.942 1.00 25.00 H new ATOM 0 HB2 LEU A 6 8.901 0.521 -20.785 1.00 25.00 H new ATOM 0 HB3 LEU A 6 9.267 0.502 -22.499 1.00 25.00 H new ATOM 0 HG LEU A 6 10.927 -0.632 -21.132 1.00 25.00 H new ATOM 0 HD11 LEU A 6 12.888 0.555 -22.214 1.00 25.00 H new ATOM 0 HD12 LEU A 6 11.502 0.449 -23.325 1.00 25.00 H new ATOM 0 HD13 LEU A 6 11.850 1.976 -22.480 1.00 25.00 H new ATOM 0 HD21 LEU A 6 12.564 0.552 -19.751 1.00 25.00 H new ATOM 0 HD22 LEU A 6 11.600 2.042 -19.883 1.00 25.00 H new ATOM 0 HD23 LEU A 6 10.924 0.615 -19.063 1.00 25.00 H new ATOM 99 N ASN A 7 6.926 2.204 -22.349 1.00 25.00 N ATOM 100 CA ASN A 7 5.772 2.257 -23.267 1.00 25.00 C ATOM 101 C ASN A 7 6.115 1.725 -24.661 1.00 25.00 C ATOM 102 O ASN A 7 5.699 2.312 -25.654 1.00 25.00 O ATOM 103 CB ASN A 7 5.193 3.681 -23.277 1.00 25.00 C ATOM 104 CG ASN A 7 3.813 3.741 -23.869 1.00 25.00 C ATOM 105 OD1 ASN A 7 3.008 2.841 -23.706 1.00 25.00 O ATOM 106 ND2 ASN A 7 3.534 4.838 -24.566 1.00 25.00 N ATOM 0 H ASN A 7 6.699 1.827 -21.429 1.00 25.00 H new ATOM 0 HA ASN A 7 4.994 1.586 -22.903 1.00 25.00 H new ATOM 0 HB2 ASN A 7 5.163 4.064 -22.257 1.00 25.00 H new ATOM 0 HB3 ASN A 7 5.856 4.335 -23.844 1.00 25.00 H new ATOM 0 HD21 ASN A 7 2.614 4.952 -24.991 1.00 25.00 H new ATOM 0 HD22 ASN A 7 4.240 5.566 -24.676 1.00 25.00 H new ATOM 113 N VAL A 8 6.764 0.574 -24.711 1.00 25.00 N ATOM 114 CA VAL A 8 6.876 -0.178 -25.939 1.00 25.00 C ATOM 115 C VAL A 8 6.008 -1.374 -25.761 1.00 25.00 C ATOM 116 O VAL A 8 5.550 -1.672 -24.640 1.00 25.00 O ATOM 117 CB VAL A 8 8.313 -0.557 -26.268 1.00 25.00 C ATOM 118 CG1 VAL A 8 9.083 0.675 -26.800 1.00 25.00 C ATOM 119 CG2 VAL A 8 9.051 -1.175 -25.074 1.00 25.00 C ATOM 0 H VAL A 8 7.222 0.142 -23.908 1.00 25.00 H new ATOM 0 HA VAL A 8 6.556 0.423 -26.790 1.00 25.00 H new ATOM 0 HB VAL A 8 8.272 -1.322 -27.043 1.00 25.00 H new ATOM 0 HG11 VAL A 8 10.109 0.390 -27.032 1.00 25.00 H new ATOM 0 HG12 VAL A 8 8.597 1.046 -27.702 1.00 25.00 H new ATOM 0 HG13 VAL A 8 9.086 1.458 -26.041 1.00 25.00 H new ATOM 0 HG21 VAL A 8 10.071 -1.426 -25.367 1.00 25.00 H new ATOM 0 HG22 VAL A 8 9.075 -0.460 -24.251 1.00 25.00 H new ATOM 0 HG23 VAL A 8 8.533 -2.079 -24.754 1.00 25.00 H new ATOM 129 N LEU A 9 5.723 -2.047 -26.875 1.00 25.00 N ATOM 130 CA LEU A 9 4.841 -3.205 -26.902 1.00 25.00 C ATOM 131 C LEU A 9 5.381 -4.235 -27.893 1.00 25.00 C ATOM 132 O LEU A 9 6.133 -3.859 -28.828 1.00 25.00 O ATOM 133 CB LEU A 9 3.391 -2.815 -27.261 1.00 25.00 C ATOM 134 CG LEU A 9 3.096 -1.891 -28.457 1.00 25.00 C ATOM 135 CD1 LEU A 9 1.770 -2.271 -29.108 1.00 25.00 C ATOM 136 CD2 LEU A 9 3.098 -0.425 -28.031 1.00 25.00 C ATOM 0 H LEU A 9 6.102 -1.799 -27.789 1.00 25.00 H new ATOM 0 HA LEU A 9 4.818 -3.638 -25.902 1.00 25.00 H new ATOM 0 HB2 LEU A 9 2.843 -3.742 -27.429 1.00 25.00 H new ATOM 0 HB3 LEU A 9 2.958 -2.344 -26.378 1.00 25.00 H new ATOM 0 HG LEU A 9 3.889 -2.021 -29.194 1.00 25.00 H new ATOM 0 HD11 LEU A 9 1.576 -1.609 -29.952 1.00 25.00 H new ATOM 0 HD12 LEU A 9 1.819 -3.302 -29.460 1.00 25.00 H new ATOM 0 HD13 LEU A 9 0.966 -2.175 -28.379 1.00 25.00 H new ATOM 0 HD21 LEU A 9 2.887 0.205 -28.895 1.00 25.00 H new ATOM 0 HD22 LEU A 9 2.333 -0.266 -27.271 1.00 25.00 H new ATOM 0 HD23 LEU A 9 4.075 -0.166 -27.623 1.00 25.00 H new ATOM 148 N ALA A 10 5.017 -5.497 -27.706 1.00 25.00 N ATOM 149 CA ALA A 10 5.522 -6.617 -28.498 1.00 25.00 C ATOM 150 C ALA A 10 4.402 -7.610 -28.815 1.00 25.00 C ATOM 151 O ALA A 10 3.403 -7.636 -28.132 1.00 25.00 O ATOM 152 CB ALA A 10 6.641 -7.363 -27.659 1.00 25.00 C ATOM 0 H ALA A 10 4.350 -5.779 -26.987 1.00 25.00 H new ATOM 0 HA ALA A 10 5.925 -6.234 -29.435 1.00 25.00 H new ATOM 0 HB1 ALA A 10 7.029 -8.203 -28.236 1.00 25.00 H new ATOM 0 HB2 ALA A 10 7.452 -6.670 -27.437 1.00 25.00 H new ATOM 0 HB3 ALA A 10 6.212 -7.731 -26.727 1.00 25.00 H new ATOM 158 N LYS A 11 4.651 -8.464 -29.819 1.00 25.00 N ATOM 159 CA LYS A 11 3.781 -9.565 -30.144 1.00 25.00 C ATOM 160 C LYS A 11 4.386 -10.848 -29.579 1.00 25.00 C ATOM 161 O LYS A 11 5.542 -11.097 -29.814 1.00 25.00 O ATOM 162 CB LYS A 11 3.697 -9.743 -31.662 1.00 25.00 C ATOM 163 CG LYS A 11 2.591 -10.752 -32.076 1.00 25.00 C ATOM 164 CD LYS A 11 2.967 -11.610 -33.284 1.00 25.00 C ATOM 165 CE LYS A 11 2.953 -10.849 -34.604 1.00 25.00 C ATOM 166 NZ LYS A 11 3.008 -11.768 -35.793 1.00 25.00 N ATOM 0 H LYS A 11 5.471 -8.395 -30.422 1.00 25.00 H new ATOM 0 HA LYS A 11 2.793 -9.364 -29.730 1.00 25.00 H new ATOM 0 HB2 LYS A 11 3.499 -8.778 -32.128 1.00 25.00 H new ATOM 0 HB3 LYS A 11 4.660 -10.087 -32.039 1.00 25.00 H new ATOM 0 HG2 LYS A 11 2.372 -11.405 -31.231 1.00 25.00 H new ATOM 0 HG3 LYS A 11 1.676 -10.204 -32.301 1.00 25.00 H new ATOM 0 HD2 LYS A 11 3.961 -12.028 -33.126 1.00 25.00 H new ATOM 0 HD3 LYS A 11 2.275 -12.450 -33.352 1.00 25.00 H new ATOM 0 HE2 LYS A 11 2.051 -10.240 -34.660 1.00 25.00 H new ATOM 0 HE3 LYS A 11 3.802 -10.166 -34.636 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 2.996 -11.205 -36.668 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 3.881 -12.332 -35.756 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 2.185 -12.403 -35.779 1.00 25.00 H new ATOM 180 N ALA A 12 3.581 -11.672 -28.915 1.00 25.00 N ATOM 181 CA ALA A 12 4.060 -12.970 -28.445 1.00 25.00 C ATOM 182 C ALA A 12 4.133 -13.860 -29.693 1.00 25.00 C ATOM 183 O ALA A 12 3.214 -13.951 -30.494 1.00 25.00 O ATOM 184 CB ALA A 12 3.116 -13.521 -27.414 1.00 25.00 C ATOM 0 H ALA A 12 2.607 -11.469 -28.692 1.00 25.00 H new ATOM 0 HA ALA A 12 5.036 -12.907 -27.963 1.00 25.00 H new ATOM 0 HB1 ALA A 12 3.479 -14.489 -27.068 1.00 25.00 H new ATOM 0 HB2 ALA A 12 3.057 -12.833 -26.571 1.00 25.00 H new ATOM 0 HB3 ALA A 12 2.126 -13.641 -27.854 1.00 25.00 H new ATOM 190 N LEU A 13 5.267 -14.517 -29.867 1.00 25.00 N ATOM 191 CA LEU A 13 5.487 -15.375 -31.019 1.00 25.00 C ATOM 192 C LEU A 13 5.159 -16.825 -30.674 1.00 25.00 C ATOM 193 O LEU A 13 4.999 -17.673 -31.597 1.00 25.00 O ATOM 194 CB LEU A 13 6.965 -15.293 -31.478 1.00 25.00 C ATOM 195 CG LEU A 13 7.515 -13.910 -31.917 1.00 25.00 C ATOM 196 CD1 LEU A 13 9.023 -14.092 -32.192 1.00 25.00 C ATOM 197 CD2 LEU A 13 6.826 -13.342 -33.187 1.00 25.00 C ATOM 0 H LEU A 13 6.055 -14.472 -29.220 1.00 25.00 H new ATOM 0 HA LEU A 13 4.834 -15.034 -31.822 1.00 25.00 H new ATOM 0 HB2 LEU A 13 7.589 -15.657 -30.662 1.00 25.00 H new ATOM 0 HB3 LEU A 13 7.095 -15.984 -32.311 1.00 25.00 H new ATOM 0 HG LEU A 13 7.316 -13.192 -31.121 1.00 25.00 H new ATOM 0 HD11 LEU A 13 9.453 -13.141 -32.505 1.00 25.00 H new ATOM 0 HD12 LEU A 13 9.520 -14.434 -31.284 1.00 25.00 H new ATOM 0 HD13 LEU A 13 9.162 -14.830 -32.982 1.00 25.00 H new ATOM 0 HD21 LEU A 13 7.261 -12.374 -33.435 1.00 25.00 H new ATOM 0 HD22 LEU A 13 6.974 -14.030 -34.020 1.00 25.00 H new ATOM 0 HD23 LEU A 13 5.759 -13.223 -33.000 1.00 25.00 H new ATOM 209 N TYR A 14 5.081 -17.102 -29.371 1.00 25.00 N ATOM 210 CA TYR A 14 4.803 -18.431 -28.858 1.00 25.00 C ATOM 211 C TYR A 14 3.781 -18.282 -27.738 1.00 25.00 C ATOM 212 O TYR A 14 3.525 -17.169 -27.284 1.00 25.00 O ATOM 213 CB TYR A 14 6.114 -19.000 -28.293 1.00 25.00 C ATOM 214 CG TYR A 14 7.190 -19.018 -29.381 1.00 25.00 C ATOM 215 CD1 TYR A 14 8.128 -17.945 -29.455 1.00 25.00 C ATOM 216 CD2 TYR A 14 7.259 -20.070 -30.301 1.00 25.00 C ATOM 217 CE1 TYR A 14 9.080 -17.915 -30.491 1.00 25.00 C ATOM 218 CE2 TYR A 14 8.254 -20.063 -31.301 1.00 25.00 C ATOM 219 CZ TYR A 14 9.146 -18.972 -31.414 1.00 25.00 C ATOM 220 OH TYR A 14 10.118 -18.974 -32.390 1.00 25.00 O ATOM 0 H TYR A 14 5.211 -16.400 -28.642 1.00 25.00 H new ATOM 0 HA TYR A 14 4.417 -19.095 -29.632 1.00 25.00 H new ATOM 0 HB2 TYR A 14 6.448 -18.396 -27.450 1.00 25.00 H new ATOM 0 HB3 TYR A 14 5.949 -20.010 -27.916 1.00 25.00 H new ATOM 0 HD1 TYR A 14 8.107 -17.157 -28.717 1.00 25.00 H new ATOM 0 HD2 TYR A 14 6.553 -20.885 -30.246 1.00 25.00 H new ATOM 0 HE1 TYR A 14 9.759 -17.080 -30.576 1.00 25.00 H new ATOM 0 HE2 TYR A 14 8.335 -20.896 -31.984 1.00 25.00 H new ATOM 0 HH TYR A 14 10.024 -19.777 -32.944 1.00 25.00 H new ATOM 230 N ASP A 15 3.134 -19.387 -27.317 1.00 25.00 N ATOM 231 CA ASP A 15 2.077 -19.308 -26.306 1.00 25.00 C ATOM 232 C ASP A 15 2.651 -19.717 -24.953 1.00 25.00 C ATOM 233 O ASP A 15 3.697 -20.328 -24.927 1.00 25.00 O ATOM 234 CB ASP A 15 0.891 -20.215 -26.626 1.00 25.00 C ATOM 235 CG ASP A 15 1.294 -21.682 -26.758 1.00 25.00 C ATOM 236 OD1 ASP A 15 0.584 -22.508 -26.230 1.00 25.00 O ATOM 237 OD2 ASP A 15 2.150 -21.973 -27.605 1.00 25.00 O ATOM 0 H ASP A 15 3.325 -20.329 -27.659 1.00 25.00 H new ATOM 0 HA ASP A 15 1.716 -18.279 -26.292 1.00 25.00 H new ATOM 0 HB2 ASP A 15 0.141 -20.117 -25.841 1.00 25.00 H new ATOM 0 HB3 ASP A 15 0.426 -19.885 -27.555 1.00 25.00 H new ATOM 242 N ASN A 16 1.976 -19.347 -23.862 1.00 25.00 N ATOM 243 CA ASN A 16 2.457 -19.730 -22.546 1.00 25.00 C ATOM 244 C ASN A 16 1.323 -19.943 -21.571 1.00 25.00 C ATOM 245 O ASN A 16 0.390 -19.161 -21.427 1.00 25.00 O ATOM 246 CB ASN A 16 3.388 -18.644 -22.012 1.00 25.00 C ATOM 247 CG ASN A 16 4.151 -19.093 -20.794 1.00 25.00 C ATOM 248 OD1 ASN A 16 5.107 -19.840 -20.926 1.00 25.00 O ATOM 249 ND2 ASN A 16 3.795 -18.605 -19.653 1.00 25.00 N ATOM 0 H ASN A 16 1.117 -18.797 -23.867 1.00 25.00 H new ATOM 0 HA ASN A 16 2.992 -20.674 -22.647 1.00 25.00 H new ATOM 0 HB2 ASN A 16 4.092 -18.356 -22.793 1.00 25.00 H new ATOM 0 HB3 ASN A 16 2.804 -17.757 -21.766 1.00 25.00 H new ATOM 0 HD21 ASN A 16 4.321 -18.840 -18.811 1.00 25.00 H new ATOM 0 HD22 ASN A 16 2.988 -17.984 -19.593 1.00 25.00 H new ATOM 256 N VAL A 17 1.432 -21.023 -20.801 1.00 25.00 N ATOM 257 CA VAL A 17 0.509 -21.246 -19.634 1.00 25.00 C ATOM 258 C VAL A 17 1.215 -20.785 -18.353 1.00 25.00 C ATOM 259 O VAL A 17 2.277 -21.291 -18.047 1.00 25.00 O ATOM 260 CB VAL A 17 0.130 -22.818 -19.494 1.00 25.00 C ATOM 261 CG1 VAL A 17 -0.832 -23.036 -18.315 1.00 25.00 C ATOM 262 CG2 VAL A 17 -0.587 -23.342 -20.791 1.00 25.00 C ATOM 0 H VAL A 17 2.127 -21.757 -20.939 1.00 25.00 H new ATOM 0 HA VAL A 17 -0.408 -20.679 -19.793 1.00 25.00 H new ATOM 0 HB VAL A 17 1.062 -23.360 -19.335 1.00 25.00 H new ATOM 0 HG11 VAL A 17 -1.076 -24.095 -18.235 1.00 25.00 H new ATOM 0 HG12 VAL A 17 -0.358 -22.702 -17.392 1.00 25.00 H new ATOM 0 HG13 VAL A 17 -1.746 -22.465 -18.480 1.00 25.00 H new ATOM 0 HG21 VAL A 17 -0.830 -24.398 -20.671 1.00 25.00 H new ATOM 0 HG22 VAL A 17 -1.503 -22.775 -20.954 1.00 25.00 H new ATOM 0 HG23 VAL A 17 0.075 -23.217 -21.648 1.00 25.00 H new ATOM 272 N ALA A 18 0.599 -19.844 -17.631 1.00 25.00 N ATOM 273 CA ALA A 18 1.227 -19.312 -16.424 1.00 25.00 C ATOM 274 C ALA A 18 0.911 -20.255 -15.215 1.00 25.00 C ATOM 275 O ALA A 18 -0.224 -20.385 -14.791 1.00 25.00 O ATOM 276 CB ALA A 18 0.754 -17.880 -16.152 1.00 25.00 C ATOM 0 H ALA A 18 -0.312 -19.444 -17.856 1.00 25.00 H new ATOM 0 HA ALA A 18 2.307 -19.275 -16.566 1.00 25.00 H new ATOM 0 HB1 ALA A 18 1.234 -17.504 -15.249 1.00 25.00 H new ATOM 0 HB2 ALA A 18 1.019 -17.243 -16.996 1.00 25.00 H new ATOM 0 HB3 ALA A 18 -0.328 -17.873 -16.018 1.00 25.00 H new ATOM 282 N GLU A 19 1.962 -20.861 -14.680 1.00 25.00 N ATOM 283 CA GLU A 19 1.860 -21.725 -13.508 1.00 25.00 C ATOM 284 C GLU A 19 2.335 -21.011 -12.252 1.00 25.00 C ATOM 285 O GLU A 19 1.953 -21.357 -11.137 1.00 25.00 O ATOM 286 CB GLU A 19 2.749 -22.972 -13.668 1.00 25.00 C ATOM 287 CG GLU A 19 2.436 -23.819 -14.881 1.00 25.00 C ATOM 288 CD GLU A 19 3.156 -25.141 -14.810 1.00 25.00 C ATOM 289 OE1 GLU A 19 2.678 -26.046 -14.039 1.00 25.00 O ATOM 290 OE2 GLU A 19 4.123 -25.352 -15.556 1.00 25.00 O ATOM 0 H GLU A 19 2.910 -20.769 -15.045 1.00 25.00 H new ATOM 0 HA GLU A 19 0.809 -22.000 -13.419 1.00 25.00 H new ATOM 0 HB2 GLU A 19 3.790 -22.655 -13.722 1.00 25.00 H new ATOM 0 HB3 GLU A 19 2.650 -23.589 -12.775 1.00 25.00 H new ATOM 0 HG2 GLU A 19 1.361 -23.988 -14.945 1.00 25.00 H new ATOM 0 HG3 GLU A 19 2.729 -23.288 -15.787 1.00 25.00 H new ATOM 297 N SER A 20 3.125 -19.967 -12.457 1.00 25.00 N ATOM 298 CA SER A 20 3.615 -19.146 -11.365 1.00 25.00 C ATOM 299 C SER A 20 2.740 -17.937 -11.193 1.00 25.00 C ATOM 300 O SER A 20 2.161 -17.462 -12.140 1.00 25.00 O ATOM 301 CB SER A 20 5.039 -18.697 -11.622 1.00 25.00 C ATOM 302 OG SER A 20 5.353 -17.424 -11.043 1.00 25.00 O ATOM 0 H SER A 20 3.441 -19.668 -13.380 1.00 25.00 H new ATOM 0 HA SER A 20 3.593 -19.748 -10.457 1.00 25.00 H new ATOM 0 HB2 SER A 20 5.724 -19.446 -11.225 1.00 25.00 H new ATOM 0 HB3 SER A 20 5.207 -18.649 -12.698 1.00 25.00 H new ATOM 0 HG SER A 20 6.284 -17.194 -11.244 1.00 25.00 H new ATOM 308 N PRO A 21 2.647 -17.406 -9.979 1.00 25.00 N ATOM 309 CA PRO A 21 1.786 -16.225 -9.827 1.00 25.00 C ATOM 310 C PRO A 21 2.433 -14.930 -10.351 1.00 25.00 C ATOM 311 O PRO A 21 1.772 -13.964 -10.639 1.00 25.00 O ATOM 312 CB PRO A 21 1.532 -16.162 -8.330 1.00 25.00 C ATOM 313 CG PRO A 21 2.757 -16.678 -7.745 1.00 25.00 C ATOM 314 CD PRO A 21 3.250 -17.790 -8.673 1.00 25.00 C ATOM 0 HA PRO A 21 0.873 -16.311 -10.416 1.00 25.00 H new ATOM 0 HB2 PRO A 21 1.331 -15.142 -8.002 1.00 25.00 H new ATOM 0 HB3 PRO A 21 0.669 -16.764 -8.046 1.00 25.00 H new ATOM 0 HG2 PRO A 21 3.504 -15.890 -7.653 1.00 25.00 H new ATOM 0 HG3 PRO A 21 2.575 -17.063 -6.742 1.00 25.00 H new ATOM 0 HD2 PRO A 21 4.338 -17.825 -8.723 1.00 25.00 H new ATOM 0 HD3 PRO A 21 2.914 -18.773 -8.344 1.00 25.00 H new ATOM 322 N ASP A 22 3.795 -14.980 -10.470 1.00 25.00 N ATOM 323 CA ASP A 22 4.579 -13.853 -10.960 1.00 25.00 C ATOM 324 C ASP A 22 4.641 -13.889 -12.502 1.00 25.00 C ATOM 325 O ASP A 22 4.945 -12.901 -13.193 1.00 25.00 O ATOM 326 CB ASP A 22 5.981 -13.964 -10.403 1.00 25.00 C ATOM 327 CG ASP A 22 6.037 -13.705 -8.902 1.00 25.00 C ATOM 328 OD1 ASP A 22 6.397 -14.686 -8.160 1.00 25.00 O ATOM 329 OD2 ASP A 22 5.820 -12.541 -8.456 1.00 25.00 O ATOM 0 H ASP A 22 4.352 -15.799 -10.227 1.00 25.00 H new ATOM 0 HA ASP A 22 4.118 -12.918 -10.643 1.00 25.00 H new ATOM 0 HB2 ASP A 22 6.373 -14.960 -10.611 1.00 25.00 H new ATOM 0 HB3 ASP A 22 6.629 -13.253 -10.915 1.00 25.00 H new ATOM 334 N GLU A 23 4.392 -15.048 -13.041 1.00 25.00 N ATOM 335 CA GLU A 23 4.371 -15.243 -14.483 1.00 25.00 C ATOM 336 C GLU A 23 3.081 -14.732 -15.167 1.00 25.00 C ATOM 337 O GLU A 23 2.008 -14.893 -14.601 1.00 25.00 O ATOM 338 CB GLU A 23 4.556 -16.742 -14.742 1.00 25.00 C ATOM 339 CG GLU A 23 4.745 -17.180 -16.163 1.00 25.00 C ATOM 340 CD GLU A 23 4.935 -18.654 -16.310 1.00 25.00 C ATOM 341 OE1 GLU A 23 5.611 -19.008 -17.278 1.00 25.00 O ATOM 342 OE2 GLU A 23 4.429 -19.441 -15.487 1.00 25.00 O ATOM 0 H GLU A 23 4.196 -15.892 -12.503 1.00 25.00 H new ATOM 0 HA GLU A 23 5.175 -14.651 -14.920 1.00 25.00 H new ATOM 0 HB2 GLU A 23 5.420 -17.078 -14.168 1.00 25.00 H new ATOM 0 HB3 GLU A 23 3.686 -17.262 -14.342 1.00 25.00 H new ATOM 0 HG2 GLU A 23 3.878 -16.873 -16.748 1.00 25.00 H new ATOM 0 HG3 GLU A 23 5.610 -16.666 -16.582 1.00 25.00 H new ATOM 349 N LEU A 24 3.174 -14.182 -16.374 1.00 25.00 N ATOM 350 CA LEU A 24 1.986 -13.743 -17.132 1.00 25.00 C ATOM 351 C LEU A 24 1.457 -14.832 -18.081 1.00 25.00 C ATOM 352 O LEU A 24 2.186 -15.468 -18.843 1.00 25.00 O ATOM 353 CB LEU A 24 2.310 -12.488 -17.975 1.00 25.00 C ATOM 354 CG LEU A 24 1.347 -11.297 -17.760 1.00 25.00 C ATOM 355 CD1 LEU A 24 1.833 -10.104 -18.663 1.00 25.00 C ATOM 356 CD2 LEU A 24 -0.125 -11.550 -18.089 1.00 25.00 C ATOM 0 H LEU A 24 4.059 -14.025 -16.857 1.00 25.00 H new ATOM 0 HA LEU A 24 1.219 -13.521 -16.390 1.00 25.00 H new ATOM 0 HB2 LEU A 24 3.324 -12.164 -17.743 1.00 25.00 H new ATOM 0 HB3 LEU A 24 2.296 -12.762 -19.030 1.00 25.00 H new ATOM 0 HG LEU A 24 1.383 -11.093 -16.690 1.00 25.00 H new ATOM 0 HD11 LEU A 24 1.168 -9.251 -18.528 1.00 25.00 H new ATOM 0 HD12 LEU A 24 2.847 -9.822 -18.379 1.00 25.00 H new ATOM 0 HD13 LEU A 24 1.821 -10.411 -19.709 1.00 25.00 H new ATOM 0 HD21 LEU A 24 -0.701 -10.644 -17.899 1.00 25.00 H new ATOM 0 HD22 LEU A 24 -0.221 -11.828 -19.139 1.00 25.00 H new ATOM 0 HD23 LEU A 24 -0.504 -12.359 -17.464 1.00 25.00 H new ATOM 368 N SER A 25 0.144 -14.955 -18.094 1.00 25.00 N ATOM 369 CA SER A 25 -0.527 -15.825 -19.072 1.00 25.00 C ATOM 370 C SER A 25 -0.677 -15.092 -20.386 1.00 25.00 C ATOM 371 O SER A 25 -1.200 -13.975 -20.386 1.00 25.00 O ATOM 372 CB SER A 25 -1.926 -16.224 -18.547 1.00 25.00 C ATOM 373 OG SER A 25 -2.664 -15.083 -18.121 1.00 25.00 O ATOM 0 H SER A 25 -0.484 -14.474 -17.450 1.00 25.00 H new ATOM 0 HA SER A 25 0.074 -16.722 -19.220 1.00 25.00 H new ATOM 0 HB2 SER A 25 -2.476 -16.744 -19.331 1.00 25.00 H new ATOM 0 HB3 SER A 25 -1.820 -16.922 -17.716 1.00 25.00 H new ATOM 0 HG SER A 25 -2.428 -14.313 -18.680 1.00 25.00 H new ATOM 379 N PHE A 26 -0.182 -15.679 -21.485 1.00 25.00 N ATOM 380 CA PHE A 26 -0.358 -15.099 -22.805 1.00 25.00 C ATOM 381 C PHE A 26 -0.385 -16.160 -23.912 1.00 25.00 C ATOM 382 O PHE A 26 -0.181 -17.310 -23.679 1.00 25.00 O ATOM 383 CB PHE A 26 0.745 -14.071 -23.100 1.00 25.00 C ATOM 384 CG PHE A 26 2.149 -14.632 -23.092 1.00 25.00 C ATOM 385 CD1 PHE A 26 2.734 -15.127 -24.284 1.00 25.00 C ATOM 386 CD2 PHE A 26 2.908 -14.690 -21.871 1.00 25.00 C ATOM 387 CE1 PHE A 26 4.004 -15.713 -24.264 1.00 25.00 C ATOM 388 CE2 PHE A 26 4.199 -15.236 -21.861 1.00 25.00 C ATOM 389 CZ PHE A 26 4.754 -15.757 -23.064 1.00 25.00 C ATOM 0 H PHE A 26 0.342 -16.554 -21.476 1.00 25.00 H new ATOM 0 HA PHE A 26 -1.328 -14.601 -22.799 1.00 25.00 H new ATOM 0 HB2 PHE A 26 0.553 -13.622 -24.074 1.00 25.00 H new ATOM 0 HB3 PHE A 26 0.684 -13.271 -22.363 1.00 25.00 H new ATOM 0 HD1 PHE A 26 2.194 -15.051 -25.216 1.00 25.00 H new ATOM 0 HD2 PHE A 26 2.480 -14.310 -20.955 1.00 25.00 H new ATOM 0 HE1 PHE A 26 4.415 -16.134 -25.169 1.00 25.00 H new ATOM 0 HE2 PHE A 26 4.770 -15.261 -20.945 1.00 25.00 H new ATOM 0 HZ PHE A 26 5.746 -16.185 -23.061 1.00 25.00 H new ATOM 399 N ARG A 27 -0.692 -15.739 -25.145 1.00 25.00 N ATOM 400 CA ARG A 27 -0.768 -16.698 -26.230 1.00 25.00 C ATOM 401 C ARG A 27 -0.025 -16.100 -27.387 1.00 25.00 C ATOM 402 O ARG A 27 0.185 -14.894 -27.427 1.00 25.00 O ATOM 403 CB ARG A 27 -2.214 -17.007 -26.631 1.00 25.00 C ATOM 404 CG ARG A 27 -3.095 -17.499 -25.446 1.00 25.00 C ATOM 405 CD ARG A 27 -4.465 -17.856 -25.957 1.00 25.00 C ATOM 406 NE ARG A 27 -5.391 -18.276 -24.919 1.00 25.00 N ATOM 407 CZ ARG A 27 -6.162 -17.488 -24.183 1.00 25.00 C ATOM 408 NH1 ARG A 27 -6.211 -16.215 -24.345 1.00 25.00 N ATOM 409 NH2 ARG A 27 -6.906 -18.013 -23.235 1.00 25.00 N ATOM 0 H ARG A 27 -0.885 -14.771 -25.402 1.00 25.00 H new ATOM 0 HA ARG A 27 -0.331 -17.646 -25.915 1.00 25.00 H new ATOM 0 HB2 ARG A 27 -2.663 -16.111 -27.060 1.00 25.00 H new ATOM 0 HB3 ARG A 27 -2.212 -17.767 -27.412 1.00 25.00 H new ATOM 0 HG2 ARG A 27 -2.635 -18.365 -24.971 1.00 25.00 H new ATOM 0 HG3 ARG A 27 -3.169 -16.721 -24.686 1.00 25.00 H new ATOM 0 HD2 ARG A 27 -4.884 -16.994 -26.477 1.00 25.00 H new ATOM 0 HD3 ARG A 27 -4.371 -18.656 -26.691 1.00 25.00 H new ATOM 0 HE ARG A 27 -5.454 -19.278 -24.739 1.00 25.00 H new ATOM 0 HH11 ARG A 27 -5.641 -15.770 -25.064 1.00 25.00 H new ATOM 0 HH12 ARG A 27 -6.820 -15.649 -23.754 1.00 25.00 H new ATOM 0 HH21 ARG A 27 -6.887 -19.019 -23.070 1.00 25.00 H new ATOM 0 HH22 ARG A 27 -7.502 -17.414 -22.664 1.00 25.00 H new ATOM 423 N LYS A 28 0.305 -16.950 -28.348 1.00 25.00 N ATOM 424 CA LYS A 28 0.934 -16.482 -29.588 1.00 25.00 C ATOM 425 C LYS A 28 -0.072 -15.585 -30.295 1.00 25.00 C ATOM 426 O LYS A 28 -1.281 -15.810 -30.195 1.00 25.00 O ATOM 427 CB LYS A 28 1.293 -17.703 -30.457 1.00 25.00 C ATOM 428 CG LYS A 28 0.086 -18.688 -30.729 1.00 25.00 C ATOM 429 CD LYS A 28 0.464 -19.835 -31.591 1.00 25.00 C ATOM 430 CE LYS A 28 -0.688 -20.831 -31.727 1.00 25.00 C ATOM 431 NZ LYS A 28 -0.312 -22.015 -32.538 1.00 25.00 N ATOM 0 H LYS A 28 0.153 -17.957 -28.301 1.00 25.00 H new ATOM 0 HA LYS A 28 1.850 -15.924 -29.392 1.00 25.00 H new ATOM 0 HB2 LYS A 28 1.682 -17.352 -31.413 1.00 25.00 H new ATOM 0 HB3 LYS A 28 2.096 -18.257 -29.970 1.00 25.00 H new ATOM 0 HG2 LYS A 28 -0.293 -19.063 -29.778 1.00 25.00 H new ATOM 0 HG3 LYS A 28 -0.728 -18.137 -31.201 1.00 25.00 H new ATOM 0 HD2 LYS A 28 0.752 -19.472 -32.578 1.00 25.00 H new ATOM 0 HD3 LYS A 28 1.335 -20.338 -31.170 1.00 25.00 H new ATOM 0 HE2 LYS A 28 -1.003 -21.157 -30.736 1.00 25.00 H new ATOM 0 HE3 LYS A 28 -1.543 -20.335 -32.186 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 -1.123 -22.663 -32.603 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 -0.036 -21.708 -33.493 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 0.487 -22.505 -32.087 1.00 25.00 H new ATOM 445 N GLY A 29 0.406 -14.496 -30.897 1.00 25.00 N ATOM 446 CA GLY A 29 -0.480 -13.529 -31.552 1.00 25.00 C ATOM 447 C GLY A 29 -1.061 -12.447 -30.702 1.00 25.00 C ATOM 448 O GLY A 29 -1.405 -11.400 -31.218 1.00 25.00 O ATOM 0 H GLY A 29 1.397 -14.260 -30.946 1.00 25.00 H new ATOM 0 HA2 GLY A 29 0.075 -13.059 -32.364 1.00 25.00 H new ATOM 0 HA3 GLY A 29 -1.304 -14.080 -32.006 1.00 25.00 H new ATOM 452 N ASP A 30 -0.992 -12.619 -29.391 1.00 25.00 N ATOM 453 CA ASP A 30 -1.412 -11.543 -28.470 1.00 25.00 C ATOM 454 C ASP A 30 -0.348 -10.428 -28.415 1.00 25.00 C ATOM 455 O ASP A 30 0.852 -10.681 -28.715 1.00 25.00 O ATOM 456 CB ASP A 30 -1.675 -12.052 -27.076 1.00 25.00 C ATOM 457 CG ASP A 30 -2.946 -11.498 -26.486 1.00 25.00 C ATOM 458 OD1 ASP A 30 -3.357 -10.424 -26.894 1.00 25.00 O ATOM 459 OD2 ASP A 30 -3.535 -12.157 -25.613 1.00 25.00 O ATOM 0 H ASP A 30 -0.659 -13.469 -28.936 1.00 25.00 H new ATOM 0 HA ASP A 30 -2.346 -11.142 -28.864 1.00 25.00 H new ATOM 0 HB2 ASP A 30 -1.732 -13.140 -27.096 1.00 25.00 H new ATOM 0 HB3 ASP A 30 -0.835 -11.789 -26.433 1.00 25.00 H new ATOM 464 N ILE A 31 -0.785 -9.230 -28.032 1.00 25.00 N ATOM 465 CA ILE A 31 0.063 -8.051 -27.994 1.00 25.00 C ATOM 466 C ILE A 31 0.128 -7.568 -26.519 1.00 25.00 C ATOM 467 O ILE A 31 -0.909 -7.413 -25.864 1.00 25.00 O ATOM 468 CB ILE A 31 -0.542 -6.871 -28.808 1.00 25.00 C ATOM 469 CG1 ILE A 31 -0.835 -7.317 -30.236 1.00 25.00 C ATOM 470 CG2 ILE A 31 0.349 -5.645 -28.773 1.00 25.00 C ATOM 471 CD1 ILE A 31 0.433 -7.762 -31.032 1.00 25.00 C ATOM 0 H ILE A 31 -1.746 -9.054 -27.738 1.00 25.00 H new ATOM 0 HA ILE A 31 1.033 -8.320 -28.411 1.00 25.00 H new ATOM 0 HB ILE A 31 -1.482 -6.581 -28.340 1.00 25.00 H new ATOM 0 HG12 ILE A 31 -1.544 -8.144 -30.210 1.00 25.00 H new ATOM 0 HG13 ILE A 31 -1.319 -6.499 -30.770 1.00 25.00 H new ATOM 0 HG21 ILE A 31 -0.110 -4.845 -29.353 1.00 25.00 H new ATOM 0 HG22 ILE A 31 0.477 -5.318 -27.741 1.00 25.00 H new ATOM 0 HG23 ILE A 31 1.322 -5.890 -29.199 1.00 25.00 H new ATOM 0 HD11 ILE A 31 0.143 -8.065 -32.038 1.00 25.00 H new ATOM 0 HD12 ILE A 31 1.136 -6.931 -31.091 1.00 25.00 H new ATOM 0 HD13 ILE A 31 0.906 -8.601 -30.523 1.00 25.00 H new ATOM 483 N MET A 32 1.311 -7.326 -25.987 1.00 25.00 N ATOM 484 CA MET A 32 1.408 -6.878 -24.636 1.00 25.00 C ATOM 485 C MET A 32 2.424 -5.757 -24.510 1.00 25.00 C ATOM 486 O MET A 32 3.399 -5.682 -25.272 1.00 25.00 O ATOM 487 CB MET A 32 1.751 -8.012 -23.651 1.00 25.00 C ATOM 488 CG MET A 32 3.067 -8.796 -23.955 1.00 25.00 C ATOM 489 SD MET A 32 3.017 -9.886 -25.427 1.00 25.00 S ATOM 490 CE MET A 32 1.694 -10.941 -25.059 1.00 25.00 C ATOM 0 H MET A 32 2.201 -7.434 -26.473 1.00 25.00 H new ATOM 0 HA MET A 32 0.420 -6.504 -24.367 1.00 25.00 H new ATOM 0 HB2 MET A 32 1.825 -7.589 -22.649 1.00 25.00 H new ATOM 0 HB3 MET A 32 0.922 -8.720 -23.638 1.00 25.00 H new ATOM 0 HG2 MET A 32 3.875 -8.077 -24.085 1.00 25.00 H new ATOM 0 HG3 MET A 32 3.317 -9.402 -23.084 1.00 25.00 H new ATOM 0 HE1 MET A 32 1.547 -11.641 -25.882 1.00 25.00 H new ATOM 0 HE2 MET A 32 1.913 -11.495 -24.146 1.00 25.00 H new ATOM 0 HE3 MET A 32 0.788 -10.352 -24.917 1.00 25.00 H new ATOM 500 N THR A 33 2.183 -4.883 -23.529 1.00 25.00 N ATOM 501 CA THR A 33 3.029 -3.764 -23.282 1.00 25.00 C ATOM 502 C THR A 33 4.201 -4.194 -22.484 1.00 25.00 C ATOM 503 O THR A 33 4.022 -4.971 -21.544 1.00 25.00 O ATOM 504 CB THR A 33 2.238 -2.649 -22.521 1.00 25.00 C ATOM 505 OG1 THR A 33 0.942 -2.453 -23.082 1.00 25.00 O ATOM 506 CG2 THR A 33 3.001 -1.308 -22.607 1.00 25.00 C ATOM 0 H THR A 33 1.387 -4.952 -22.894 1.00 25.00 H new ATOM 0 HA THR A 33 3.374 -3.358 -24.233 1.00 25.00 H new ATOM 0 HB THR A 33 2.138 -2.973 -21.485 1.00 25.00 H new ATOM 0 HG1 THR A 33 0.473 -1.752 -22.584 1.00 25.00 H new ATOM 0 HG21 THR A 33 2.443 -0.537 -22.075 1.00 25.00 H new ATOM 0 HG22 THR A 33 3.986 -1.420 -22.155 1.00 25.00 H new ATOM 0 HG23 THR A 33 3.112 -1.019 -23.652 1.00 25.00 H new ATOM 514 N VAL A 34 5.383 -3.717 -22.782 1.00 25.00 N ATOM 515 CA VAL A 34 6.567 -4.071 -22.014 1.00 25.00 C ATOM 516 C VAL A 34 6.901 -2.843 -21.180 1.00 25.00 C ATOM 517 O VAL A 34 7.046 -1.723 -21.725 1.00 25.00 O ATOM 518 CB VAL A 34 7.760 -4.476 -22.927 1.00 25.00 C ATOM 519 CG1 VAL A 34 9.038 -4.709 -22.079 1.00 25.00 C ATOM 520 CG2 VAL A 34 7.390 -5.681 -23.740 1.00 25.00 C ATOM 0 H VAL A 34 5.559 -3.077 -23.556 1.00 25.00 H new ATOM 0 HA VAL A 34 6.377 -4.943 -21.389 1.00 25.00 H new ATOM 0 HB VAL A 34 7.982 -3.664 -23.620 1.00 25.00 H new ATOM 0 HG11 VAL A 34 9.862 -4.992 -22.734 1.00 25.00 H new ATOM 0 HG12 VAL A 34 9.294 -3.792 -21.548 1.00 25.00 H new ATOM 0 HG13 VAL A 34 8.856 -5.507 -21.359 1.00 25.00 H new ATOM 0 HG21 VAL A 34 8.228 -5.961 -24.378 1.00 25.00 H new ATOM 0 HG22 VAL A 34 7.148 -6.509 -23.074 1.00 25.00 H new ATOM 0 HG23 VAL A 34 6.524 -5.450 -24.360 1.00 25.00 H new ATOM 530 N LEU A 35 6.937 -3.048 -19.868 1.00 25.00 N ATOM 531 CA LEU A 35 7.189 -1.986 -18.940 1.00 25.00 C ATOM 532 C LEU A 35 8.651 -1.856 -18.567 1.00 25.00 C ATOM 533 O LEU A 35 9.131 -0.734 -18.434 1.00 25.00 O ATOM 534 CB LEU A 35 6.382 -2.210 -17.678 1.00 25.00 C ATOM 535 CG LEU A 35 4.855 -2.213 -17.883 1.00 25.00 C ATOM 536 CD1 LEU A 35 4.207 -2.703 -16.532 1.00 25.00 C ATOM 537 CD2 LEU A 35 4.249 -0.829 -18.229 1.00 25.00 C ATOM 0 H LEU A 35 6.791 -3.959 -19.432 1.00 25.00 H new ATOM 0 HA LEU A 35 6.894 -1.062 -19.437 1.00 25.00 H new ATOM 0 HB2 LEU A 35 6.678 -3.162 -17.238 1.00 25.00 H new ATOM 0 HB3 LEU A 35 6.637 -1.433 -16.957 1.00 25.00 H new ATOM 0 HG LEU A 35 4.645 -2.861 -18.734 1.00 25.00 H new ATOM 0 HD11 LEU A 35 3.122 -2.720 -16.634 1.00 25.00 H new ATOM 0 HD12 LEU A 35 4.565 -3.706 -16.299 1.00 25.00 H new ATOM 0 HD13 LEU A 35 4.485 -2.023 -15.727 1.00 25.00 H new ATOM 0 HD21 LEU A 35 3.171 -0.925 -18.356 1.00 25.00 H new ATOM 0 HD22 LEU A 35 4.458 -0.128 -17.421 1.00 25.00 H new ATOM 0 HD23 LEU A 35 4.691 -0.459 -19.154 1.00 25.00 H new ATOM 549 N GLU A 36 9.348 -2.980 -18.443 1.00 25.00 N ATOM 550 CA GLU A 36 10.743 -2.998 -17.971 1.00 25.00 C ATOM 551 C GLU A 36 11.432 -4.278 -18.503 1.00 25.00 C ATOM 552 O GLU A 36 10.781 -5.289 -18.714 1.00 25.00 O ATOM 553 CB GLU A 36 10.758 -2.947 -16.428 1.00 25.00 C ATOM 554 CG GLU A 36 12.087 -2.583 -15.821 1.00 25.00 C ATOM 555 CD GLU A 36 11.988 -2.510 -14.280 1.00 25.00 C ATOM 556 OE1 GLU A 36 11.588 -3.533 -13.672 1.00 25.00 O ATOM 557 OE2 GLU A 36 12.295 -1.434 -13.720 1.00 25.00 O ATOM 0 H GLU A 36 8.973 -3.903 -18.663 1.00 25.00 H new ATOM 0 HA GLU A 36 11.289 -2.131 -18.343 1.00 25.00 H new ATOM 0 HB2 GLU A 36 10.012 -2.225 -16.095 1.00 25.00 H new ATOM 0 HB3 GLU A 36 10.453 -3.920 -16.043 1.00 25.00 H new ATOM 0 HG2 GLU A 36 12.836 -3.321 -16.107 1.00 25.00 H new ATOM 0 HG3 GLU A 36 12.420 -1.622 -16.214 1.00 25.00 H new ATOM 564 N ARG A 37 12.730 -4.235 -18.756 1.00 25.00 N ATOM 565 CA ARG A 37 13.435 -5.425 -19.296 1.00 25.00 C ATOM 566 C ARG A 37 14.384 -5.908 -18.243 1.00 25.00 C ATOM 567 O ARG A 37 14.921 -5.076 -17.570 1.00 25.00 O ATOM 568 CB ARG A 37 14.215 -5.086 -20.592 1.00 25.00 C ATOM 569 CG ARG A 37 13.299 -4.376 -21.606 1.00 25.00 C ATOM 570 CD ARG A 37 13.837 -4.501 -23.036 1.00 25.00 C ATOM 571 NE ARG A 37 15.261 -4.154 -23.135 1.00 25.00 N ATOM 572 CZ ARG A 37 15.928 -4.016 -24.265 1.00 25.00 C ATOM 573 NH1 ARG A 37 15.357 -4.097 -25.449 1.00 25.00 N ATOM 574 NH2 ARG A 37 17.214 -3.790 -24.175 1.00 25.00 N ATOM 0 H ARG A 37 13.321 -3.417 -18.606 1.00 25.00 H new ATOM 0 HA ARG A 37 12.705 -6.194 -19.550 1.00 25.00 H new ATOM 0 HB2 ARG A 37 15.066 -4.448 -20.354 1.00 25.00 H new ATOM 0 HB3 ARG A 37 14.614 -6.000 -21.032 1.00 25.00 H new ATOM 0 HG2 ARG A 37 12.298 -4.804 -21.555 1.00 25.00 H new ATOM 0 HG3 ARG A 37 13.210 -3.322 -21.341 1.00 25.00 H new ATOM 0 HD2 ARG A 37 13.690 -5.522 -23.388 1.00 25.00 H new ATOM 0 HD3 ARG A 37 13.262 -3.851 -23.695 1.00 25.00 H new ATOM 0 HE ARG A 37 15.773 -4.009 -22.265 1.00 25.00 H new ATOM 0 HH11 ARG A 37 14.355 -4.274 -25.521 1.00 25.00 H new ATOM 0 HH12 ARG A 37 15.917 -3.983 -26.294 1.00 25.00 H new ATOM 0 HH21 ARG A 37 17.658 -3.728 -23.259 1.00 25.00 H new ATOM 0 HH22 ARG A 37 17.772 -3.676 -25.021 1.00 25.00 H new ATOM 588 N ASP A 38 14.622 -7.218 -18.182 1.00 25.00 N ATOM 589 CA ASP A 38 15.525 -7.821 -17.234 1.00 25.00 C ATOM 590 C ASP A 38 15.105 -7.428 -15.828 1.00 25.00 C ATOM 591 O ASP A 38 15.891 -7.077 -14.989 1.00 25.00 O ATOM 592 CB ASP A 38 16.972 -7.397 -17.515 1.00 25.00 C ATOM 593 CG ASP A 38 17.422 -7.765 -18.961 1.00 25.00 C ATOM 594 OD1 ASP A 38 16.765 -8.711 -19.558 1.00 25.00 O ATOM 595 OD2 ASP A 38 18.213 -7.004 -19.565 1.00 25.00 O ATOM 0 H ASP A 38 14.179 -7.892 -18.806 1.00 25.00 H new ATOM 0 HA ASP A 38 15.479 -8.906 -17.330 1.00 25.00 H new ATOM 0 HB2 ASP A 38 17.069 -6.321 -17.369 1.00 25.00 H new ATOM 0 HB3 ASP A 38 17.636 -7.877 -16.796 1.00 25.00 H new ATOM 600 N THR A 39 13.807 -7.496 -15.590 1.00 25.00 N ATOM 601 CA THR A 39 13.227 -7.023 -14.332 1.00 25.00 C ATOM 602 C THR A 39 13.492 -7.878 -13.107 1.00 25.00 C ATOM 603 O THR A 39 13.245 -7.476 -11.995 1.00 25.00 O ATOM 604 CB THR A 39 11.663 -6.853 -14.473 1.00 25.00 C ATOM 605 OG1 THR A 39 11.088 -6.090 -13.408 1.00 25.00 O ATOM 606 CG2 THR A 39 10.940 -8.240 -14.479 1.00 25.00 C ATOM 0 H THR A 39 13.127 -7.874 -16.250 1.00 25.00 H new ATOM 0 HA THR A 39 13.737 -6.075 -14.160 1.00 25.00 H new ATOM 0 HB THR A 39 11.520 -6.328 -15.417 1.00 25.00 H new ATOM 0 HG1 THR A 39 11.335 -5.147 -13.511 1.00 25.00 H new ATOM 0 HG21 THR A 39 9.865 -8.089 -14.577 1.00 25.00 H new ATOM 0 HG22 THR A 39 11.301 -8.835 -15.318 1.00 25.00 H new ATOM 0 HG23 THR A 39 11.149 -8.763 -13.546 1.00 25.00 H new ATOM 614 N GLN A 40 13.984 -9.086 -13.320 1.00 25.00 N ATOM 615 CA GLN A 40 14.174 -10.043 -12.217 1.00 25.00 C ATOM 616 C GLN A 40 15.673 -10.339 -12.040 1.00 25.00 C ATOM 617 O GLN A 40 16.085 -11.198 -11.221 1.00 25.00 O ATOM 618 CB GLN A 40 13.404 -11.358 -12.520 1.00 25.00 C ATOM 619 CG GLN A 40 13.146 -12.232 -11.280 1.00 25.00 C ATOM 620 CD GLN A 40 11.967 -11.736 -10.455 1.00 25.00 C ATOM 621 OE1 GLN A 40 12.061 -10.805 -9.688 1.00 25.00 O ATOM 622 NE2 GLN A 40 10.874 -12.431 -10.547 1.00 25.00 N ATOM 0 H GLN A 40 14.261 -9.437 -14.237 1.00 25.00 H new ATOM 0 HA GLN A 40 13.785 -9.611 -11.295 1.00 25.00 H new ATOM 0 HB2 GLN A 40 12.448 -11.109 -12.982 1.00 25.00 H new ATOM 0 HB3 GLN A 40 13.969 -11.938 -13.250 1.00 25.00 H new ATOM 0 HG2 GLN A 40 12.959 -13.259 -11.595 1.00 25.00 H new ATOM 0 HG3 GLN A 40 14.041 -12.248 -10.657 1.00 25.00 H new ATOM 0 HE21 GLN A 40 10.819 -13.211 -11.201 1.00 25.00 H new ATOM 0 HE22 GLN A 40 10.070 -12.196 -9.965 1.00 25.00 H new ATOM 631 N GLY A 41 16.467 -9.636 -12.854 1.00 25.00 N ATOM 632 CA GLY A 41 17.874 -9.842 -12.814 1.00 25.00 C ATOM 633 C GLY A 41 18.261 -10.911 -13.788 1.00 25.00 C ATOM 634 O GLY A 41 19.428 -11.031 -14.098 1.00 25.00 O ATOM 0 H GLY A 41 16.146 -8.939 -13.526 1.00 25.00 H new ATOM 0 HA2 GLY A 41 18.393 -8.914 -13.054 1.00 25.00 H new ATOM 0 HA3 GLY A 41 18.180 -10.127 -11.807 1.00 25.00 H new ATOM 638 N LEU A 42 17.263 -11.666 -14.235 1.00 25.00 N ATOM 639 CA LEU A 42 17.483 -12.681 -15.236 1.00 25.00 C ATOM 640 C LEU A 42 17.491 -12.089 -16.612 1.00 25.00 C ATOM 641 O LEU A 42 16.608 -11.308 -16.951 1.00 25.00 O ATOM 642 CB LEU A 42 16.428 -13.715 -15.239 1.00 25.00 C ATOM 643 CG LEU A 42 16.168 -14.399 -13.895 1.00 25.00 C ATOM 644 CD1 LEU A 42 14.866 -15.216 -13.963 1.00 25.00 C ATOM 645 CD2 LEU A 42 17.368 -15.299 -13.512 1.00 25.00 C ATOM 0 H LEU A 42 16.298 -11.588 -13.915 1.00 25.00 H new ATOM 0 HA LEU A 42 18.445 -13.127 -14.983 1.00 25.00 H new ATOM 0 HB2 LEU A 42 15.499 -13.259 -15.580 1.00 25.00 H new ATOM 0 HB3 LEU A 42 16.695 -14.479 -15.969 1.00 25.00 H new ATOM 0 HG LEU A 42 16.055 -13.638 -13.123 1.00 25.00 H new ATOM 0 HD11 LEU A 42 14.689 -15.699 -13.002 1.00 25.00 H new ATOM 0 HD12 LEU A 42 14.032 -14.553 -14.195 1.00 25.00 H new ATOM 0 HD13 LEU A 42 14.953 -15.975 -14.740 1.00 25.00 H new ATOM 0 HD21 LEU A 42 17.171 -15.780 -12.554 1.00 25.00 H new ATOM 0 HD22 LEU A 42 17.510 -16.061 -14.278 1.00 25.00 H new ATOM 0 HD23 LEU A 42 18.269 -14.690 -13.434 1.00 25.00 H new ATOM 657 N ASP A 43 18.533 -12.359 -17.369 1.00 25.00 N ATOM 658 CA ASP A 43 18.654 -11.787 -18.710 1.00 25.00 C ATOM 659 C ASP A 43 17.531 -12.333 -19.613 1.00 25.00 C ATOM 660 O ASP A 43 17.308 -13.531 -19.746 1.00 25.00 O ATOM 661 CB ASP A 43 20.036 -12.024 -19.284 1.00 25.00 C ATOM 662 CG ASP A 43 20.237 -11.297 -20.586 1.00 25.00 C ATOM 663 OD1 ASP A 43 20.538 -11.966 -21.572 1.00 25.00 O ATOM 664 OD2 ASP A 43 20.050 -10.047 -20.614 1.00 25.00 O ATOM 0 H ASP A 43 19.306 -12.964 -17.091 1.00 25.00 H new ATOM 0 HA ASP A 43 18.533 -10.705 -18.652 1.00 25.00 H new ATOM 0 HB2 ASP A 43 20.788 -11.697 -18.566 1.00 25.00 H new ATOM 0 HB3 ASP A 43 20.186 -13.093 -19.438 1.00 25.00 H new ATOM 669 N GLY A 44 16.846 -11.425 -20.258 1.00 25.00 N ATOM 670 CA GLY A 44 15.838 -11.818 -21.222 1.00 25.00 C ATOM 671 C GLY A 44 14.439 -12.085 -20.648 1.00 25.00 C ATOM 672 O GLY A 44 13.584 -12.546 -21.374 1.00 25.00 O ATOM 0 H GLY A 44 16.961 -10.419 -20.139 1.00 25.00 H new ATOM 0 HA2 GLY A 44 15.758 -11.036 -21.977 1.00 25.00 H new ATOM 0 HA3 GLY A 44 16.180 -12.719 -21.732 1.00 25.00 H new ATOM 676 N TRP A 45 14.202 -11.742 -19.375 1.00 25.00 N ATOM 677 CA TRP A 45 12.884 -11.760 -18.731 1.00 25.00 C ATOM 678 C TRP A 45 12.314 -10.343 -18.479 1.00 25.00 C ATOM 679 O TRP A 45 12.703 -9.607 -17.598 1.00 25.00 O ATOM 680 CB TRP A 45 12.937 -12.453 -17.390 1.00 25.00 C ATOM 681 CG TRP A 45 13.014 -13.940 -17.566 1.00 25.00 C ATOM 682 CD1 TRP A 45 14.110 -14.694 -17.686 1.00 25.00 C ATOM 683 CD2 TRP A 45 11.908 -14.849 -17.712 1.00 25.00 C ATOM 684 NE1 TRP A 45 13.827 -16.023 -17.852 1.00 25.00 N ATOM 685 CE2 TRP A 45 12.460 -16.169 -17.896 1.00 25.00 C ATOM 686 CE3 TRP A 45 10.513 -14.694 -17.736 1.00 25.00 C ATOM 687 CZ2 TRP A 45 11.641 -17.302 -18.079 1.00 25.00 C ATOM 688 CZ3 TRP A 45 9.715 -15.816 -17.917 1.00 25.00 C ATOM 689 CH2 TRP A 45 10.277 -17.129 -18.097 1.00 25.00 C ATOM 0 H TRP A 45 14.945 -11.435 -18.747 1.00 25.00 H new ATOM 0 HA TRP A 45 12.239 -12.295 -19.429 1.00 25.00 H new ATOM 0 HB2 TRP A 45 13.803 -12.103 -16.828 1.00 25.00 H new ATOM 0 HB3 TRP A 45 12.053 -12.196 -16.807 1.00 25.00 H new ATOM 0 HD1 TRP A 45 15.114 -14.297 -17.655 1.00 25.00 H new ATOM 0 HE1 TRP A 45 14.512 -16.775 -17.930 1.00 25.00 H new ATOM 0 HE3 TRP A 45 10.067 -13.718 -17.616 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 12.075 -18.283 -18.202 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 8.641 -15.700 -17.923 1.00 25.00 H new ATOM 0 HH2 TRP A 45 9.627 -17.979 -18.246 1.00 25.00 H new ATOM 700 N TRP A 46 11.379 -9.956 -19.310 1.00 25.00 N ATOM 701 CA TRP A 46 10.830 -8.596 -19.268 1.00 25.00 C ATOM 702 C TRP A 46 9.516 -8.566 -18.485 1.00 25.00 C ATOM 703 O TRP A 46 8.822 -9.586 -18.456 1.00 25.00 O ATOM 704 CB TRP A 46 10.532 -8.114 -20.699 1.00 25.00 C ATOM 705 CG TRP A 46 11.711 -8.264 -21.630 1.00 25.00 C ATOM 706 CD1 TRP A 46 13.008 -8.505 -21.306 1.00 25.00 C ATOM 707 CD2 TRP A 46 11.687 -8.213 -23.078 1.00 25.00 C ATOM 708 NE1 TRP A 46 13.809 -8.577 -22.400 1.00 25.00 N ATOM 709 CE2 TRP A 46 13.033 -8.387 -23.534 1.00 25.00 C ATOM 710 CE3 TRP A 46 10.669 -8.030 -24.037 1.00 25.00 C ATOM 711 CZ2 TRP A 46 13.373 -8.354 -24.913 1.00 25.00 C ATOM 712 CZ3 TRP A 46 10.998 -7.991 -25.384 1.00 25.00 C ATOM 713 CH2 TRP A 46 12.341 -8.149 -25.806 1.00 25.00 C ATOM 0 H TRP A 46 10.972 -10.554 -20.030 1.00 25.00 H new ATOM 0 HA TRP A 46 11.565 -7.952 -18.784 1.00 25.00 H new ATOM 0 HB2 TRP A 46 9.688 -8.677 -21.097 1.00 25.00 H new ATOM 0 HB3 TRP A 46 10.231 -7.067 -20.668 1.00 25.00 H new ATOM 0 HD1 TRP A 46 13.362 -8.626 -20.293 1.00 25.00 H new ATOM 0 HE1 TRP A 46 14.815 -8.743 -22.390 1.00 25.00 H new ATOM 0 HE3 TRP A 46 9.641 -7.921 -23.725 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 14.392 -8.483 -25.247 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 10.222 -7.838 -26.119 1.00 25.00 H new ATOM 0 HH2 TRP A 46 12.565 -8.108 -26.862 1.00 25.00 H new ATOM 724 N LEU A 47 9.194 -7.417 -17.895 1.00 25.00 N ATOM 725 CA LEU A 47 7.903 -7.204 -17.215 1.00 25.00 C ATOM 726 C LEU A 47 6.903 -6.693 -18.250 1.00 25.00 C ATOM 727 O LEU A 47 7.093 -5.630 -18.846 1.00 25.00 O ATOM 728 CB LEU A 47 8.052 -6.200 -16.117 1.00 25.00 C ATOM 729 CG LEU A 47 6.831 -5.993 -15.198 1.00 25.00 C ATOM 730 CD1 LEU A 47 6.567 -7.207 -14.362 1.00 25.00 C ATOM 731 CD2 LEU A 47 7.013 -4.717 -14.332 1.00 25.00 C ATOM 0 H LEU A 47 9.812 -6.606 -17.871 1.00 25.00 H new ATOM 0 HA LEU A 47 7.555 -8.139 -16.776 1.00 25.00 H new ATOM 0 HB2 LEU A 47 8.898 -6.497 -15.497 1.00 25.00 H new ATOM 0 HB3 LEU A 47 8.307 -5.240 -16.566 1.00 25.00 H new ATOM 0 HG LEU A 47 5.950 -5.845 -15.823 1.00 25.00 H new ATOM 0 HD11 LEU A 47 5.700 -7.029 -13.725 1.00 25.00 H new ATOM 0 HD12 LEU A 47 6.371 -8.060 -15.011 1.00 25.00 H new ATOM 0 HD13 LEU A 47 7.437 -7.417 -13.740 1.00 25.00 H new ATOM 0 HD21 LEU A 47 6.142 -4.586 -13.689 1.00 25.00 H new ATOM 0 HD22 LEU A 47 7.906 -4.820 -13.716 1.00 25.00 H new ATOM 0 HD23 LEU A 47 7.118 -3.848 -14.982 1.00 25.00 H new ATOM 743 N CYS A 48 5.813 -7.421 -18.467 1.00 25.00 N ATOM 744 CA CYS A 48 4.824 -7.020 -19.424 1.00 25.00 C ATOM 745 C CYS A 48 3.508 -6.888 -18.716 1.00 25.00 C ATOM 746 O CYS A 48 3.306 -7.494 -17.665 1.00 25.00 O ATOM 747 CB CYS A 48 4.702 -8.083 -20.516 1.00 25.00 C ATOM 748 SG CYS A 48 6.260 -8.329 -21.393 1.00 25.00 S ATOM 0 H CYS A 48 5.604 -8.294 -17.983 1.00 25.00 H new ATOM 0 HA CYS A 48 5.110 -6.071 -19.879 1.00 25.00 H new ATOM 0 HB2 CYS A 48 4.383 -9.026 -20.071 1.00 25.00 H new ATOM 0 HB3 CYS A 48 3.929 -7.788 -21.225 1.00 25.00 H new ATOM 0 HG CYS A 48 6.016 -8.695 -22.616 1.00 25.00 H new ATOM 754 N SER A 49 2.583 -6.207 -19.329 1.00 25.00 N ATOM 755 CA SER A 49 1.226 -6.130 -18.759 1.00 25.00 C ATOM 756 C SER A 49 0.232 -6.557 -19.859 1.00 25.00 C ATOM 757 O SER A 49 0.388 -6.122 -21.009 1.00 25.00 O ATOM 758 CB SER A 49 0.974 -4.696 -18.294 1.00 25.00 C ATOM 759 OG SER A 49 -0.322 -4.581 -17.747 1.00 25.00 O ATOM 0 H SER A 49 2.716 -5.700 -20.204 1.00 25.00 H new ATOM 0 HA SER A 49 1.105 -6.789 -17.899 1.00 25.00 H new ATOM 0 HB2 SER A 49 1.717 -4.412 -17.549 1.00 25.00 H new ATOM 0 HB3 SER A 49 1.085 -4.009 -19.133 1.00 25.00 H new ATOM 0 HG SER A 49 -0.472 -3.659 -17.451 1.00 25.00 H new ATOM 765 N LEU A 50 -0.722 -7.430 -19.493 1.00 25.00 N ATOM 766 CA LEU A 50 -1.722 -7.945 -20.439 1.00 25.00 C ATOM 767 C LEU A 50 -2.980 -8.377 -19.695 1.00 25.00 C ATOM 768 O LEU A 50 -2.938 -9.038 -18.675 1.00 25.00 O ATOM 769 CB LEU A 50 -1.208 -9.152 -21.183 1.00 25.00 C ATOM 770 CG LEU A 50 -2.206 -9.861 -22.116 1.00 25.00 C ATOM 771 CD1 LEU A 50 -2.613 -9.033 -23.359 1.00 25.00 C ATOM 772 CD2 LEU A 50 -1.478 -11.101 -22.587 1.00 25.00 C ATOM 0 H LEU A 50 -0.820 -7.794 -18.545 1.00 25.00 H new ATOM 0 HA LEU A 50 -1.937 -7.139 -21.141 1.00 25.00 H new ATOM 0 HB2 LEU A 50 -0.346 -8.846 -21.775 1.00 25.00 H new ATOM 0 HB3 LEU A 50 -0.851 -9.877 -20.452 1.00 25.00 H new ATOM 0 HG LEU A 50 -3.132 -10.049 -21.573 1.00 25.00 H new ATOM 0 HD11 LEU A 50 -3.318 -9.605 -23.963 1.00 25.00 H new ATOM 0 HD12 LEU A 50 -3.082 -8.102 -23.039 1.00 25.00 H new ATOM 0 HD13 LEU A 50 -1.727 -8.808 -23.952 1.00 25.00 H new ATOM 0 HD21 LEU A 50 -2.122 -11.667 -23.260 1.00 25.00 H new ATOM 0 HD22 LEU A 50 -0.568 -10.811 -23.113 1.00 25.00 H new ATOM 0 HD23 LEU A 50 -1.219 -11.719 -21.728 1.00 25.00 H new ATOM 784 N HIS A 51 -4.136 -7.999 -20.285 1.00 25.00 N ATOM 785 CA HIS A 51 -5.426 -8.333 -19.732 1.00 25.00 C ATOM 786 C HIS A 51 -5.554 -7.739 -18.295 1.00 25.00 C ATOM 787 O HIS A 51 -6.163 -8.303 -17.449 1.00 25.00 O ATOM 788 CB HIS A 51 -5.649 -9.856 -19.741 1.00 25.00 C ATOM 789 CG HIS A 51 -7.089 -10.252 -19.796 1.00 25.00 C ATOM 790 ND1 HIS A 51 -7.988 -10.035 -18.792 1.00 25.00 N ATOM 791 CD2 HIS A 51 -7.785 -10.913 -20.756 1.00 25.00 C ATOM 792 CE1 HIS A 51 -9.160 -10.510 -19.167 1.00 25.00 C ATOM 793 NE2 HIS A 51 -9.107 -11.048 -20.374 1.00 25.00 N ATOM 0 H HIS A 51 -4.180 -7.459 -21.149 1.00 25.00 H new ATOM 0 HA HIS A 51 -6.206 -7.892 -20.353 1.00 25.00 H new ATOM 0 HB2 HIS A 51 -5.130 -10.285 -20.598 1.00 25.00 H new ATOM 0 HB3 HIS A 51 -5.197 -10.286 -18.847 1.00 25.00 H new ATOM 0 HD1 HIS A 51 -7.787 -9.581 -17.901 1.00 25.00 H new ATOM 0 HD2 HIS A 51 -7.367 -11.280 -21.682 1.00 25.00 H new ATOM 0 HE1 HIS A 51 -10.054 -10.465 -18.562 1.00 25.00 H new ATOM 801 N GLY A 52 -4.914 -6.593 -18.044 1.00 25.00 N ATOM 802 CA GLY A 52 -4.993 -5.999 -16.729 1.00 25.00 C ATOM 803 C GLY A 52 -4.082 -6.684 -15.686 1.00 25.00 C ATOM 804 O GLY A 52 -4.178 -6.341 -14.503 1.00 25.00 O ATOM 0 H GLY A 52 -4.352 -6.078 -18.722 1.00 25.00 H new ATOM 0 HA2 GLY A 52 -4.723 -4.945 -16.799 1.00 25.00 H new ATOM 0 HA3 GLY A 52 -6.025 -6.042 -16.381 1.00 25.00 H new ATOM 808 N ARG A 53 -3.266 -7.647 -16.063 1.00 25.00 N ATOM 809 CA ARG A 53 -2.362 -8.337 -15.115 1.00 25.00 C ATOM 810 C ARG A 53 -0.953 -8.071 -15.554 1.00 25.00 C ATOM 811 O ARG A 53 -0.683 -8.088 -16.758 1.00 25.00 O ATOM 812 CB ARG A 53 -2.673 -9.838 -15.065 1.00 25.00 C ATOM 813 CG ARG A 53 -4.133 -10.125 -14.688 1.00 25.00 C ATOM 814 CD ARG A 53 -4.331 -11.623 -14.431 1.00 25.00 C ATOM 815 NE ARG A 53 -3.809 -11.954 -13.091 1.00 25.00 N ATOM 816 CZ ARG A 53 -4.509 -11.937 -11.971 1.00 25.00 C ATOM 817 NH1 ARG A 53 -5.790 -11.692 -11.960 1.00 25.00 N ATOM 818 NH2 ARG A 53 -3.900 -12.157 -10.847 1.00 25.00 N ATOM 0 H ARG A 53 -3.197 -7.984 -17.023 1.00 25.00 H new ATOM 0 HA ARG A 53 -2.504 -7.960 -14.102 1.00 25.00 H new ATOM 0 HB2 ARG A 53 -2.458 -10.283 -16.037 1.00 25.00 H new ATOM 0 HB3 ARG A 53 -2.014 -10.318 -14.342 1.00 25.00 H new ATOM 0 HG2 ARG A 53 -4.404 -9.557 -13.798 1.00 25.00 H new ATOM 0 HG3 ARG A 53 -4.794 -9.796 -15.490 1.00 25.00 H new ATOM 0 HD2 ARG A 53 -5.388 -11.880 -14.497 1.00 25.00 H new ATOM 0 HD3 ARG A 53 -3.813 -12.207 -15.192 1.00 25.00 H new ATOM 0 HE ARG A 53 -2.826 -12.218 -13.024 1.00 25.00 H new ATOM 0 HH11 ARG A 53 -6.281 -11.506 -12.834 1.00 25.00 H new ATOM 0 HH12 ARG A 53 -6.301 -11.687 -11.077 1.00 25.00 H new ATOM 0 HH21 ARG A 53 -2.896 -12.339 -10.838 1.00 25.00 H new ATOM 0 HH22 ARG A 53 -4.425 -12.148 -9.972 1.00 25.00 H new ATOM 832 N GLN A 54 -0.041 -7.837 -14.651 1.00 25.00 N ATOM 833 CA GLN A 54 1.341 -7.659 -15.026 1.00 25.00 C ATOM 834 C GLN A 54 2.064 -8.958 -14.670 1.00 25.00 C ATOM 835 O GLN A 54 1.631 -9.658 -13.767 1.00 25.00 O ATOM 836 CB GLN A 54 2.009 -6.524 -14.229 1.00 25.00 C ATOM 837 CG GLN A 54 1.340 -5.194 -14.264 1.00 25.00 C ATOM 838 CD GLN A 54 0.615 -4.907 -12.995 1.00 25.00 C ATOM 839 OE1 GLN A 54 -0.360 -5.587 -12.672 1.00 25.00 O ATOM 840 NE2 GLN A 54 1.063 -3.923 -12.243 1.00 25.00 N ATOM 0 H GLN A 54 -0.226 -7.765 -13.651 1.00 25.00 H new ATOM 0 HA GLN A 54 1.394 -7.412 -16.086 1.00 25.00 H new ATOM 0 HB2 GLN A 54 2.085 -6.839 -13.188 1.00 25.00 H new ATOM 0 HB3 GLN A 54 3.027 -6.402 -14.600 1.00 25.00 H new ATOM 0 HG2 GLN A 54 2.084 -4.417 -14.441 1.00 25.00 H new ATOM 0 HG3 GLN A 54 0.640 -5.161 -15.098 1.00 25.00 H new ATOM 0 HE21 GLN A 54 1.873 -3.381 -12.542 1.00 25.00 H new ATOM 0 HE22 GLN A 54 0.600 -3.703 -11.361 1.00 25.00 H new ATOM 849 N GLY A 55 3.108 -9.268 -15.372 1.00 25.00 N ATOM 850 CA GLY A 55 3.879 -10.432 -14.994 1.00 25.00 C ATOM 851 C GLY A 55 5.164 -10.616 -15.807 1.00 25.00 C ATOM 852 O GLY A 55 5.400 -9.844 -16.778 1.00 25.00 O ATOM 0 H GLY A 55 3.447 -8.756 -16.187 1.00 25.00 H new ATOM 0 HA2 GLY A 55 4.137 -10.358 -13.938 1.00 25.00 H new ATOM 0 HA3 GLY A 55 3.258 -11.320 -15.109 1.00 25.00 H new ATOM 856 N ILE A 56 6.005 -11.570 -15.417 1.00 25.00 N ATOM 857 CA ILE A 56 7.280 -11.777 -16.118 1.00 25.00 C ATOM 858 C ILE A 56 7.049 -12.562 -17.382 1.00 25.00 C ATOM 859 O ILE A 56 6.143 -13.365 -17.458 1.00 25.00 O ATOM 860 CB ILE A 56 8.369 -12.420 -15.177 1.00 25.00 C ATOM 861 CG1 ILE A 56 8.016 -13.842 -14.727 1.00 25.00 C ATOM 862 CG2 ILE A 56 8.677 -11.470 -14.014 1.00 25.00 C ATOM 863 CD1 ILE A 56 9.182 -14.586 -14.037 1.00 25.00 C ATOM 0 H ILE A 56 5.837 -12.204 -14.636 1.00 25.00 H new ATOM 0 HA ILE A 56 7.686 -10.807 -16.406 1.00 25.00 H new ATOM 0 HB ILE A 56 9.284 -12.547 -15.755 1.00 25.00 H new ATOM 0 HG12 ILE A 56 7.170 -13.796 -14.041 1.00 25.00 H new ATOM 0 HG13 ILE A 56 7.693 -14.418 -15.594 1.00 25.00 H new ATOM 0 HG21 ILE A 56 9.430 -11.919 -13.367 1.00 25.00 H new ATOM 0 HG22 ILE A 56 9.053 -10.525 -14.406 1.00 25.00 H new ATOM 0 HG23 ILE A 56 7.767 -11.289 -13.441 1.00 25.00 H new ATOM 0 HD11 ILE A 56 8.856 -15.585 -13.747 1.00 25.00 H new ATOM 0 HD12 ILE A 56 10.022 -14.665 -14.727 1.00 25.00 H new ATOM 0 HD13 ILE A 56 9.492 -14.034 -13.150 1.00 25.00 H new ATOM 875 N VAL A 57 7.776 -12.227 -18.430 1.00 25.00 N ATOM 876 CA VAL A 57 7.564 -12.834 -19.775 1.00 25.00 C ATOM 877 C VAL A 57 8.879 -13.098 -20.448 1.00 25.00 C ATOM 878 O VAL A 57 9.732 -12.174 -20.560 1.00 25.00 O ATOM 879 CB VAL A 57 6.688 -11.889 -20.686 1.00 25.00 C ATOM 880 CG1 VAL A 57 6.514 -12.479 -22.093 1.00 25.00 C ATOM 881 CG2 VAL A 57 5.272 -11.700 -20.083 1.00 25.00 C ATOM 0 H VAL A 57 8.527 -11.537 -18.399 1.00 25.00 H new ATOM 0 HA VAL A 57 7.037 -13.778 -19.635 1.00 25.00 H new ATOM 0 HB VAL A 57 7.211 -10.934 -20.741 1.00 25.00 H new ATOM 0 HG11 VAL A 57 5.906 -11.806 -22.697 1.00 25.00 H new ATOM 0 HG12 VAL A 57 7.491 -12.602 -22.559 1.00 25.00 H new ATOM 0 HG13 VAL A 57 6.021 -13.448 -22.023 1.00 25.00 H new ATOM 0 HG21 VAL A 57 4.686 -11.045 -20.728 1.00 25.00 H new ATOM 0 HG22 VAL A 57 4.778 -12.668 -20.004 1.00 25.00 H new ATOM 0 HG23 VAL A 57 5.355 -11.254 -19.092 1.00 25.00 H new ATOM 891 N PRO A 58 9.039 -14.326 -20.997 1.00 25.00 N ATOM 892 CA PRO A 58 10.340 -14.454 -21.644 1.00 25.00 C ATOM 893 C PRO A 58 10.408 -13.639 -22.916 1.00 25.00 C ATOM 894 O PRO A 58 9.574 -13.687 -23.789 1.00 25.00 O ATOM 895 CB PRO A 58 10.427 -15.984 -21.944 1.00 25.00 C ATOM 896 CG PRO A 58 8.995 -16.372 -22.109 1.00 25.00 C ATOM 897 CD PRO A 58 8.251 -15.551 -21.063 1.00 25.00 C ATOM 0 HA PRO A 58 11.163 -14.087 -21.031 1.00 25.00 H new ATOM 0 HB2 PRO A 58 11.007 -16.187 -22.844 1.00 25.00 H new ATOM 0 HB3 PRO A 58 10.902 -16.529 -21.129 1.00 25.00 H new ATOM 0 HG2 PRO A 58 8.638 -16.150 -23.115 1.00 25.00 H new ATOM 0 HG3 PRO A 58 8.853 -17.441 -21.949 1.00 25.00 H new ATOM 0 HD2 PRO A 58 7.221 -15.354 -21.360 1.00 25.00 H new ATOM 0 HD3 PRO A 58 8.213 -16.061 -20.100 1.00 25.00 H new ATOM 905 N GLY A 59 11.410 -12.803 -22.977 1.00 25.00 N ATOM 906 CA GLY A 59 11.542 -11.815 -24.044 1.00 25.00 C ATOM 907 C GLY A 59 12.073 -12.382 -25.333 1.00 25.00 C ATOM 908 O GLY A 59 11.785 -11.894 -26.410 1.00 25.00 O ATOM 0 H GLY A 59 12.166 -12.778 -22.292 1.00 25.00 H new ATOM 0 HA2 GLY A 59 10.568 -11.363 -24.231 1.00 25.00 H new ATOM 0 HA3 GLY A 59 12.205 -11.017 -23.708 1.00 25.00 H new ATOM 912 N ASN A 60 12.747 -13.504 -25.277 1.00 25.00 N ATOM 913 CA ASN A 60 13.261 -14.142 -26.482 1.00 25.00 C ATOM 914 C ASN A 60 12.060 -14.811 -27.225 1.00 25.00 C ATOM 915 O ASN A 60 12.220 -15.367 -28.288 1.00 25.00 O ATOM 916 CB ASN A 60 14.336 -15.196 -26.100 1.00 25.00 C ATOM 917 CG ASN A 60 15.194 -15.645 -27.304 1.00 25.00 C ATOM 918 OD1 ASN A 60 15.552 -14.828 -28.159 1.00 25.00 O ATOM 919 ND2 ASN A 60 15.491 -16.905 -27.397 1.00 25.00 N ATOM 0 H ASN A 60 12.957 -14.002 -24.412 1.00 25.00 H new ATOM 0 HA ASN A 60 13.732 -13.409 -27.137 1.00 25.00 H new ATOM 0 HB2 ASN A 60 14.987 -14.781 -25.331 1.00 25.00 H new ATOM 0 HB3 ASN A 60 13.845 -16.067 -25.665 1.00 25.00 H new ATOM 0 HD21 ASN A 60 16.034 -17.244 -28.191 1.00 25.00 H new ATOM 0 HD22 ASN A 60 15.182 -17.556 -26.676 1.00 25.00 H new ATOM 926 N ARG A 61 10.866 -14.754 -26.626 1.00 25.00 N ATOM 927 CA ARG A 61 9.627 -15.278 -27.249 1.00 25.00 C ATOM 928 C ARG A 61 8.723 -14.140 -27.648 1.00 25.00 C ATOM 929 O ARG A 61 7.576 -14.336 -28.050 1.00 25.00 O ATOM 930 CB ARG A 61 8.883 -16.209 -26.283 1.00 25.00 C ATOM 931 CG ARG A 61 9.657 -17.514 -25.815 1.00 25.00 C ATOM 932 CD ARG A 61 8.683 -18.753 -25.643 1.00 25.00 C ATOM 933 NE ARG A 61 9.077 -19.629 -24.503 1.00 25.00 N ATOM 934 CZ ARG A 61 10.123 -20.456 -24.471 1.00 25.00 C ATOM 935 NH1 ARG A 61 10.912 -20.646 -25.512 1.00 25.00 N ATOM 936 NH2 ARG A 61 10.361 -21.086 -23.346 1.00 25.00 N ATOM 0 H ARG A 61 10.722 -14.348 -25.702 1.00 25.00 H new ATOM 0 HA ARG A 61 9.908 -15.845 -28.136 1.00 25.00 H new ATOM 0 HB2 ARG A 61 8.615 -15.635 -25.396 1.00 25.00 H new ATOM 0 HB3 ARG A 61 7.951 -16.517 -26.757 1.00 25.00 H new ATOM 0 HG2 ARG A 61 10.429 -17.759 -26.544 1.00 25.00 H new ATOM 0 HG3 ARG A 61 10.162 -17.316 -24.870 1.00 25.00 H new ATOM 0 HD2 ARG A 61 7.666 -18.394 -25.487 1.00 25.00 H new ATOM 0 HD3 ARG A 61 8.677 -19.338 -26.563 1.00 25.00 H new ATOM 0 HE ARG A 61 8.491 -19.593 -23.669 1.00 25.00 H new ATOM 0 HH11 ARG A 61 10.732 -20.150 -26.385 1.00 25.00 H new ATOM 0 HH12 ARG A 61 11.701 -21.288 -25.443 1.00 25.00 H new ATOM 0 HH21 ARG A 61 9.756 -20.934 -22.539 1.00 25.00 H new ATOM 0 HH22 ARG A 61 11.151 -21.728 -23.278 1.00 25.00 H new ATOM 950 N LEU A 62 9.262 -12.932 -27.621 1.00 25.00 N ATOM 951 CA LEU A 62 8.522 -11.747 -28.039 1.00 25.00 C ATOM 952 C LEU A 62 9.193 -11.057 -29.182 1.00 25.00 C ATOM 953 O LEU A 62 10.410 -11.086 -29.344 1.00 25.00 O ATOM 954 CB LEU A 62 8.372 -10.724 -26.868 1.00 25.00 C ATOM 955 CG LEU A 62 7.665 -11.116 -25.574 1.00 25.00 C ATOM 956 CD1 LEU A 62 7.541 -9.959 -24.611 1.00 25.00 C ATOM 957 CD2 LEU A 62 6.291 -11.712 -25.830 1.00 25.00 C ATOM 0 H LEU A 62 10.216 -12.743 -27.312 1.00 25.00 H new ATOM 0 HA LEU A 62 7.537 -12.095 -28.350 1.00 25.00 H new ATOM 0 HB2 LEU A 62 9.376 -10.397 -26.598 1.00 25.00 H new ATOM 0 HB3 LEU A 62 7.850 -9.854 -27.267 1.00 25.00 H new ATOM 0 HG LEU A 62 8.297 -11.877 -25.116 1.00 25.00 H new ATOM 0 HD11 LEU A 62 7.031 -10.291 -23.707 1.00 25.00 H new ATOM 0 HD12 LEU A 62 8.535 -9.592 -24.353 1.00 25.00 H new ATOM 0 HD13 LEU A 62 6.968 -9.157 -25.077 1.00 25.00 H new ATOM 0 HD21 LEU A 62 5.826 -11.976 -24.880 1.00 25.00 H new ATOM 0 HD22 LEU A 62 5.669 -10.982 -26.348 1.00 25.00 H new ATOM 0 HD23 LEU A 62 6.391 -12.606 -26.445 1.00 25.00 H new ATOM 969 N LYS A 63 8.398 -10.339 -29.957 1.00 25.00 N ATOM 970 CA LYS A 63 8.934 -9.446 -31.011 1.00 25.00 C ATOM 971 C LYS A 63 8.363 -8.055 -30.833 1.00 25.00 C ATOM 972 O LYS A 63 7.166 -7.840 -31.055 1.00 25.00 O ATOM 973 CB LYS A 63 8.603 -9.965 -32.416 1.00 25.00 C ATOM 974 CG LYS A 63 9.350 -9.211 -33.467 1.00 25.00 C ATOM 975 CD LYS A 63 8.797 -9.487 -34.815 1.00 25.00 C ATOM 976 CE LYS A 63 7.557 -8.645 -35.091 1.00 25.00 C ATOM 977 NZ LYS A 63 7.085 -8.849 -36.513 1.00 25.00 N ATOM 0 H LYS A 63 7.380 -10.346 -29.889 1.00 25.00 H new ATOM 0 HA LYS A 63 10.019 -9.421 -30.912 1.00 25.00 H new ATOM 0 HB2 LYS A 63 8.850 -11.025 -32.481 1.00 25.00 H new ATOM 0 HB3 LYS A 63 7.531 -9.876 -32.595 1.00 25.00 H new ATOM 0 HG2 LYS A 63 9.296 -8.142 -33.260 1.00 25.00 H new ATOM 0 HG3 LYS A 63 10.404 -9.488 -33.439 1.00 25.00 H new ATOM 0 HD2 LYS A 63 9.555 -9.279 -35.570 1.00 25.00 H new ATOM 0 HD3 LYS A 63 8.546 -10.545 -34.897 1.00 25.00 H new ATOM 0 HE2 LYS A 63 6.763 -8.917 -34.395 1.00 25.00 H new ATOM 0 HE3 LYS A 63 7.781 -7.591 -34.923 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 6.239 -8.268 -36.685 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 7.838 -8.567 -37.173 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 6.852 -9.852 -36.661 1.00 25.00 H new ATOM 991 N ILE A 64 9.251 -7.125 -30.501 1.00 25.00 N ATOM 992 CA ILE A 64 8.946 -5.647 -30.360 1.00 25.00 C ATOM 993 C ILE A 64 8.326 -5.161 -31.616 1.00 25.00 C ATOM 994 O ILE A 64 8.761 -5.541 -32.703 1.00 25.00 O ATOM 995 CB ILE A 64 10.290 -4.804 -30.104 1.00 25.00 C ATOM 996 CG1 ILE A 64 11.050 -5.341 -28.850 1.00 25.00 C ATOM 997 CG2 ILE A 64 9.968 -3.256 -29.947 1.00 25.00 C ATOM 998 CD1 ILE A 64 10.331 -5.154 -27.501 1.00 25.00 C ATOM 0 H ILE A 64 10.228 -7.348 -30.312 1.00 25.00 H new ATOM 0 HA ILE A 64 8.274 -5.514 -29.512 1.00 25.00 H new ATOM 0 HB ILE A 64 10.936 -4.928 -30.973 1.00 25.00 H new ATOM 0 HG12 ILE A 64 11.243 -6.404 -28.993 1.00 25.00 H new ATOM 0 HG13 ILE A 64 12.019 -4.845 -28.796 1.00 25.00 H new ATOM 0 HG21 ILE A 64 10.894 -2.707 -29.775 1.00 25.00 H new ATOM 0 HG22 ILE A 64 9.493 -2.889 -30.857 1.00 25.00 H new ATOM 0 HG23 ILE A 64 9.296 -3.108 -29.102 1.00 25.00 H new ATOM 0 HD11 ILE A 64 10.948 -5.562 -26.700 1.00 25.00 H new ATOM 0 HD12 ILE A 64 10.162 -4.092 -27.323 1.00 25.00 H new ATOM 0 HD13 ILE A 64 9.374 -5.675 -27.523 1.00 25.00 H new ATOM 1010 N LEU A 65 7.264 -4.349 -31.471 1.00 25.00 N ATOM 1011 CA LEU A 65 6.529 -3.832 -32.599 1.00 25.00 C ATOM 1012 C LEU A 65 7.248 -2.691 -33.309 1.00 25.00 C ATOM 1013 O LEU A 65 8.421 -2.444 -33.055 1.00 25.00 O ATOM 1014 CB LEU A 65 5.149 -3.332 -32.134 1.00 25.00 C ATOM 1015 CG LEU A 65 3.978 -4.060 -32.777 1.00 25.00 C ATOM 1016 CD1 LEU A 65 3.873 -5.471 -32.242 1.00 25.00 C ATOM 1017 CD2 LEU A 65 2.658 -3.295 -32.530 1.00 25.00 C ATOM 0 H LEU A 65 6.906 -4.044 -30.566 1.00 25.00 H new ATOM 0 HA LEU A 65 6.431 -4.653 -33.309 1.00 25.00 H new ATOM 0 HB2 LEU A 65 5.081 -3.440 -31.052 1.00 25.00 H new ATOM 0 HB3 LEU A 65 5.067 -2.268 -32.354 1.00 25.00 H new ATOM 0 HG LEU A 65 4.155 -4.107 -33.852 1.00 25.00 H new ATOM 0 HD11 LEU A 65 3.030 -5.977 -32.713 1.00 25.00 H new ATOM 0 HD12 LEU A 65 4.792 -6.014 -32.464 1.00 25.00 H new ATOM 0 HD13 LEU A 65 3.721 -5.441 -31.163 1.00 25.00 H new ATOM 0 HD21 LEU A 65 1.833 -3.832 -32.998 1.00 25.00 H new ATOM 0 HD22 LEU A 65 2.478 -3.216 -31.458 1.00 25.00 H new ATOM 0 HD23 LEU A 65 2.731 -2.296 -32.960 1.00 25.00 H new ATOM 1029 N VAL A 66 6.556 -2.057 -34.233 1.00 25.00 N ATOM 1030 CA VAL A 66 7.100 -0.929 -34.984 1.00 25.00 C ATOM 1031 C VAL A 66 7.541 0.225 -34.066 1.00 25.00 C ATOM 1032 O VAL A 66 7.132 0.315 -32.899 1.00 25.00 O ATOM 1033 CB VAL A 66 6.018 -0.404 -35.956 1.00 25.00 C ATOM 1034 CG1 VAL A 66 5.643 -1.510 -37.014 1.00 25.00 C ATOM 1035 CG2 VAL A 66 4.692 -0.002 -35.206 1.00 25.00 C ATOM 0 H VAL A 66 5.600 -2.304 -34.489 1.00 25.00 H new ATOM 0 HA VAL A 66 7.979 -1.283 -35.523 1.00 25.00 H new ATOM 0 HB VAL A 66 6.443 0.475 -36.440 1.00 25.00 H new ATOM 0 HG11 VAL A 66 4.880 -1.123 -37.690 1.00 25.00 H new ATOM 0 HG12 VAL A 66 6.530 -1.782 -37.586 1.00 25.00 H new ATOM 0 HG13 VAL A 66 5.259 -2.391 -36.499 1.00 25.00 H new ATOM 0 HG21 VAL A 66 3.961 0.361 -35.929 1.00 25.00 H new ATOM 0 HG22 VAL A 66 4.289 -0.872 -34.688 1.00 25.00 H new ATOM 0 HG23 VAL A 66 4.907 0.784 -34.482 1.00 25.00 H new ATOM 1045 N GLY A 67 8.365 1.120 -34.618 1.00 25.00 N ATOM 1046 CA GLY A 67 8.825 2.309 -33.882 1.00 25.00 C ATOM 1047 C GLY A 67 10.334 2.492 -34.030 1.00 25.00 C ATOM 1048 O GLY A 67 10.840 3.649 -34.108 1.00 25.00 O ATOM 0 H GLY A 67 8.728 1.048 -35.568 1.00 25.00 H new ATOM 0 HA2 GLY A 67 8.309 3.194 -34.254 1.00 25.00 H new ATOM 0 HA3 GLY A 67 8.568 2.210 -32.827 1.00 25.00 H new ATOM 1052 N MET A 68 11.038 1.369 -34.123 1.00 25.00 N ATOM 1053 CA MET A 68 12.516 1.342 -34.287 1.00 25.00 C ATOM 1054 C MET A 68 12.885 0.000 -34.894 1.00 25.00 C ATOM 1055 O MET A 68 12.115 -0.950 -34.745 1.00 25.00 O ATOM 1056 CB MET A 68 13.204 1.502 -32.930 1.00 25.00 C ATOM 1057 CG MET A 68 14.653 1.890 -32.996 1.00 25.00 C ATOM 1058 SD MET A 68 15.779 0.467 -32.983 1.00 25.00 S ATOM 1059 CE MET A 68 17.332 1.369 -32.775 1.00 25.00 C ATOM 0 H MET A 68 10.614 0.442 -34.088 1.00 25.00 H new ATOM 0 HA MET A 68 12.840 2.161 -34.930 1.00 25.00 H new ATOM 0 HB2 MET A 68 12.667 2.256 -32.354 1.00 25.00 H new ATOM 0 HB3 MET A 68 13.119 0.563 -32.383 1.00 25.00 H new ATOM 0 HG2 MET A 68 14.825 2.472 -33.901 1.00 25.00 H new ATOM 0 HG3 MET A 68 14.887 2.538 -32.151 1.00 25.00 H new ATOM 0 HE1 MET A 68 17.987 1.165 -33.622 1.00 25.00 H new ATOM 0 HE2 MET A 68 17.128 2.438 -32.723 1.00 25.00 H new ATOM 0 HE3 MET A 68 17.819 1.048 -31.854 1.00 25.00 H new ATOM 1069 N TYR A 69 13.993 -0.080 -35.605 1.00 25.00 N ATOM 1070 CA TYR A 69 14.424 -1.322 -36.210 1.00 25.00 C ATOM 1071 C TYR A 69 15.952 -1.443 -36.229 1.00 25.00 C ATOM 1072 O TYR A 69 16.598 -0.607 -36.839 1.00 25.00 O ATOM 1073 CB TYR A 69 13.893 -1.426 -37.661 1.00 25.00 C ATOM 1074 CG TYR A 69 14.343 -2.703 -38.336 1.00 25.00 C ATOM 1075 CD1 TYR A 69 13.568 -3.873 -38.227 1.00 25.00 C ATOM 1076 CD2 TYR A 69 15.540 -2.768 -39.080 1.00 25.00 C ATOM 1077 CE1 TYR A 69 14.003 -5.101 -38.850 1.00 25.00 C ATOM 1078 CE2 TYR A 69 15.999 -4.000 -39.645 1.00 25.00 C ATOM 1079 CZ TYR A 69 15.231 -5.159 -39.504 1.00 25.00 C ATOM 1080 OH TYR A 69 15.627 -6.375 -40.006 1.00 25.00 O ATOM 0 H TYR A 69 14.615 0.710 -35.778 1.00 25.00 H new ATOM 0 HA TYR A 69 14.018 -2.133 -35.605 1.00 25.00 H new ATOM 0 HB2 TYR A 69 12.804 -1.384 -37.653 1.00 25.00 H new ATOM 0 HB3 TYR A 69 14.241 -0.569 -38.237 1.00 25.00 H new ATOM 0 HD1 TYR A 69 12.641 -3.852 -37.673 1.00 25.00 H new ATOM 0 HD2 TYR A 69 16.122 -1.870 -39.226 1.00 25.00 H new ATOM 0 HE1 TYR A 69 13.374 -5.978 -38.809 1.00 25.00 H new ATOM 0 HE2 TYR A 69 16.937 -4.034 -40.179 1.00 25.00 H new ATOM 0 HH TYR A 69 16.600 -6.460 -39.927 1.00 25.00 H new ATOM 1090 N ASP A 70 16.489 -2.450 -35.559 1.00 25.00 N ATOM 1091 CA ASP A 70 17.943 -2.688 -35.480 1.00 25.00 C ATOM 1092 C ASP A 70 18.167 -4.244 -35.634 1.00 25.00 C ATOM 1093 O ASP A 70 18.470 -4.937 -34.657 1.00 25.00 O ATOM 1094 CB ASP A 70 18.488 -2.157 -34.160 1.00 25.00 C ATOM 1095 CG ASP A 70 20.030 -2.231 -34.079 1.00 25.00 C ATOM 1096 OD1 ASP A 70 20.580 -1.812 -33.031 1.00 25.00 O ATOM 1097 OD2 ASP A 70 20.667 -2.684 -35.061 1.00 25.00 O ATOM 0 H ASP A 70 15.935 -3.136 -35.047 1.00 25.00 H new ATOM 0 HA ASP A 70 18.480 -2.163 -36.270 1.00 25.00 H new ATOM 0 HB2 ASP A 70 18.171 -1.122 -34.030 1.00 25.00 H new ATOM 0 HB3 ASP A 70 18.057 -2.728 -33.338 1.00 25.00 H new ATOM 1102 N LYS A 71 17.925 -4.817 -36.823 1.00 25.00 N ATOM 1103 CA LYS A 71 18.111 -6.272 -37.004 1.00 25.00 C ATOM 1104 C LYS A 71 18.671 -6.643 -38.353 1.00 25.00 C ATOM 1105 O LYS A 71 18.434 -5.960 -39.365 1.00 25.00 O ATOM 1106 CB LYS A 71 16.846 -7.082 -36.781 1.00 25.00 C ATOM 1107 CG LYS A 71 16.712 -7.650 -35.361 1.00 25.00 C ATOM 1108 CD LYS A 71 15.779 -6.842 -34.492 1.00 25.00 C ATOM 1109 CE LYS A 71 15.718 -7.400 -33.102 1.00 25.00 C ATOM 1110 NZ LYS A 71 14.839 -6.567 -32.251 1.00 25.00 N ATOM 0 H LYS A 71 17.609 -4.316 -37.654 1.00 25.00 H new ATOM 0 HA LYS A 71 18.836 -6.525 -36.231 1.00 25.00 H new ATOM 0 HB2 LYS A 71 15.982 -6.453 -36.993 1.00 25.00 H new ATOM 0 HB3 LYS A 71 16.823 -7.906 -37.495 1.00 25.00 H new ATOM 0 HG2 LYS A 71 16.350 -8.676 -35.418 1.00 25.00 H new ATOM 0 HG3 LYS A 71 17.696 -7.685 -34.894 1.00 25.00 H new ATOM 0 HD2 LYS A 71 16.116 -5.806 -34.457 1.00 25.00 H new ATOM 0 HD3 LYS A 71 14.781 -6.838 -34.930 1.00 25.00 H new ATOM 0 HE2 LYS A 71 15.344 -8.424 -33.130 1.00 25.00 H new ATOM 0 HE3 LYS A 71 16.720 -7.438 -32.674 1.00 25.00 H new ATOM 0 HZ1 LYS A 71 14.806 -6.966 -31.291 1.00 25.00 H new ATOM 0 HZ2 LYS A 71 15.212 -5.597 -32.211 1.00 25.00 H new ATOM 0 HZ3 LYS A 71 13.880 -6.552 -32.653 1.00 25.00 H new ATOM 1124 N LYS A 72 19.368 -7.754 -38.400 1.00 25.00 N ATOM 1125 CA LYS A 72 19.939 -8.216 -39.669 1.00 25.00 C ATOM 1126 C LYS A 72 18.764 -8.848 -40.462 1.00 25.00 C ATOM 1127 O LYS A 72 17.868 -9.447 -39.850 1.00 25.00 O ATOM 1128 CB LYS A 72 21.012 -9.280 -39.393 1.00 25.00 C ATOM 1129 CG LYS A 72 22.253 -8.718 -38.729 1.00 25.00 C ATOM 1130 CD LYS A 72 23.097 -9.871 -38.152 1.00 25.00 C ATOM 1131 CE LYS A 72 23.660 -10.887 -39.193 1.00 25.00 C ATOM 1132 NZ LYS A 72 22.739 -12.076 -39.628 1.00 25.00 N ATOM 0 H LYS A 72 19.558 -8.354 -37.597 1.00 25.00 H new ATOM 0 HA LYS A 72 20.404 -7.401 -40.224 1.00 25.00 H new ATOM 0 HB2 LYS A 72 20.588 -10.058 -38.758 1.00 25.00 H new ATOM 0 HB3 LYS A 72 21.294 -9.755 -40.333 1.00 25.00 H new ATOM 0 HG2 LYS A 72 22.839 -8.151 -39.452 1.00 25.00 H new ATOM 0 HG3 LYS A 72 21.971 -8.027 -37.935 1.00 25.00 H new ATOM 0 HD2 LYS A 72 23.934 -9.443 -37.601 1.00 25.00 H new ATOM 0 HD3 LYS A 72 22.488 -10.417 -37.432 1.00 25.00 H new ATOM 0 HE2 LYS A 72 23.933 -10.330 -40.089 1.00 25.00 H new ATOM 0 HE3 LYS A 72 24.580 -11.308 -38.786 1.00 25.00 H new ATOM 0 HZ1 LYS A 72 23.327 -12.868 -39.957 1.00 25.00 H new ATOM 0 HZ2 LYS A 72 22.164 -12.384 -38.818 1.00 25.00 H new ATOM 0 HZ3 LYS A 72 22.113 -11.766 -40.399 1.00 25.00 H new ATOM 1146 N PRO A 73 18.728 -8.715 -41.804 1.00 25.00 N ATOM 1147 CA PRO A 73 17.627 -9.358 -42.506 1.00 25.00 C ATOM 1148 C PRO A 73 17.729 -10.870 -42.486 1.00 25.00 C ATOM 1149 O PRO A 73 18.816 -11.421 -42.395 1.00 25.00 O ATOM 1150 CB PRO A 73 17.755 -8.800 -43.912 1.00 25.00 C ATOM 1151 CG PRO A 73 19.199 -8.562 -44.090 1.00 25.00 C ATOM 1152 CD PRO A 73 19.665 -8.083 -42.745 1.00 25.00 C ATOM 0 HA PRO A 73 16.659 -9.157 -42.047 1.00 25.00 H new ATOM 0 HB2 PRO A 73 17.375 -9.503 -44.653 1.00 25.00 H new ATOM 0 HB3 PRO A 73 17.185 -7.878 -44.026 1.00 25.00 H new ATOM 0 HG2 PRO A 73 19.718 -9.472 -44.390 1.00 25.00 H new ATOM 0 HG3 PRO A 73 19.387 -7.818 -44.864 1.00 25.00 H new ATOM 0 HD2 PRO A 73 20.694 -8.384 -42.548 1.00 25.00 H new ATOM 0 HD3 PRO A 73 19.631 -6.996 -42.674 1.00 25.00 H new ATOM 1160 N ALA A 74 16.588 -11.543 -42.503 1.00 25.00 N ATOM 1161 CA ALA A 74 16.552 -13.002 -42.447 1.00 25.00 C ATOM 1162 C ALA A 74 16.874 -13.551 -43.859 1.00 25.00 C ATOM 1163 O ALA A 74 16.498 -12.946 -44.849 1.00 25.00 O ATOM 1164 CB ALA A 74 15.131 -13.507 -41.990 1.00 25.00 C ATOM 0 H ALA A 74 15.670 -11.102 -42.555 1.00 25.00 H new ATOM 0 HA ALA A 74 17.286 -13.357 -41.723 1.00 25.00 H new ATOM 0 HB1 ALA A 74 15.126 -14.596 -41.955 1.00 25.00 H new ATOM 0 HB2 ALA A 74 14.905 -13.111 -41.000 1.00 25.00 H new ATOM 0 HB3 ALA A 74 14.377 -13.163 -42.699 1.00 25.00 H new ATOM 1170 N GLY A 75 17.512 -14.694 -43.951 1.00 25.00 N ATOM 1171 CA GLY A 75 17.855 -15.274 -45.228 1.00 25.00 C ATOM 1172 C GLY A 75 18.042 -16.789 -45.130 1.00 25.00 C ATOM 1173 O GLY A 75 18.686 -17.261 -44.171 1.00 25.00 O ATOM 0 H GLY A 75 17.807 -15.246 -43.146 1.00 25.00 H new ATOM 0 HA2 GLY A 75 17.071 -15.050 -45.952 1.00 25.00 H new ATOM 0 HA3 GLY A 75 18.772 -14.818 -45.600 1.00 25.00 H new ATOM 1177 N GLU A 76 17.621 -17.506 -46.148 1.00 25.00 N ATOM 1178 CA GLU A 76 17.880 -18.938 -46.236 1.00 25.00 C ATOM 1179 C GLU A 76 19.395 -19.204 -46.504 1.00 25.00 C ATOM 1180 O GLU A 76 20.138 -18.320 -46.828 1.00 25.00 O ATOM 1181 CB GLU A 76 16.987 -19.497 -47.399 1.00 25.00 C ATOM 1182 CG GLU A 76 15.504 -19.664 -47.061 1.00 25.00 C ATOM 1183 CD GLU A 76 14.749 -18.338 -46.798 1.00 25.00 C ATOM 1184 OE1 GLU A 76 13.833 -18.377 -45.944 1.00 25.00 O ATOM 1185 OE2 GLU A 76 15.047 -17.309 -47.473 1.00 25.00 O ATOM 0 H GLU A 76 17.094 -17.124 -46.934 1.00 25.00 H new ATOM 0 HA GLU A 76 17.634 -19.439 -45.299 1.00 25.00 H new ATOM 0 HB2 GLU A 76 17.075 -18.829 -48.256 1.00 25.00 H new ATOM 0 HB3 GLU A 76 17.384 -20.464 -47.707 1.00 25.00 H new ATOM 0 HG2 GLU A 76 15.015 -20.189 -47.882 1.00 25.00 H new ATOM 0 HG3 GLU A 76 15.415 -20.298 -46.179 1.00 25.00 H new ATOM 1192 N PHE A 77 19.782 -20.458 -46.382 1.00 25.00 N ATOM 1193 CA PHE A 77 21.149 -20.940 -46.588 1.00 25.00 C ATOM 1194 C PHE A 77 21.158 -22.126 -47.515 1.00 25.00 C ATOM 1195 O PHE A 77 20.121 -22.743 -47.764 1.00 25.00 O ATOM 1196 CB PHE A 77 21.737 -21.309 -45.219 1.00 25.00 C ATOM 1197 CG PHE A 77 20.931 -22.341 -44.440 1.00 25.00 C ATOM 1198 CD1 PHE A 77 21.163 -23.725 -44.611 1.00 25.00 C ATOM 1199 CD2 PHE A 77 19.926 -21.911 -43.534 1.00 25.00 C ATOM 1200 CE1 PHE A 77 20.417 -24.650 -43.907 1.00 25.00 C ATOM 1201 CE2 PHE A 77 19.152 -22.866 -42.797 1.00 25.00 C ATOM 1202 CZ PHE A 77 19.401 -24.222 -43.003 1.00 25.00 C ATOM 0 H PHE A 77 19.135 -21.204 -46.127 1.00 25.00 H new ATOM 0 HA PHE A 77 21.755 -20.162 -47.052 1.00 25.00 H new ATOM 0 HB2 PHE A 77 22.748 -21.690 -45.363 1.00 25.00 H new ATOM 0 HB3 PHE A 77 21.821 -20.403 -44.618 1.00 25.00 H new ATOM 0 HD1 PHE A 77 21.928 -24.061 -45.296 1.00 25.00 H new ATOM 0 HD2 PHE A 77 19.743 -20.855 -43.399 1.00 25.00 H new ATOM 0 HE1 PHE A 77 20.605 -25.705 -44.042 1.00 25.00 H new ATOM 0 HE2 PHE A 77 18.394 -22.543 -42.099 1.00 25.00 H new ATOM 0 HZ PHE A 77 18.817 -24.958 -42.471 1.00 25.00 H new ATOM 1212 N ILE A 78 22.336 -22.464 -48.011 1.00 25.00 N ATOM 1213 CA ILE A 78 22.496 -23.629 -48.864 1.00 25.00 C ATOM 1214 C ILE A 78 23.131 -24.763 -48.103 1.00 25.00 C ATOM 1215 O ILE A 78 23.715 -24.513 -47.038 1.00 25.00 O ATOM 1216 CB ILE A 78 23.338 -23.266 -50.140 1.00 25.00 C ATOM 1217 CG1 ILE A 78 24.825 -22.915 -49.838 1.00 25.00 C ATOM 1218 CG2 ILE A 78 22.684 -22.056 -50.879 1.00 25.00 C ATOM 1219 CD1 ILE A 78 25.723 -22.708 -51.069 1.00 25.00 C ATOM 0 H ILE A 78 23.198 -21.947 -47.837 1.00 25.00 H new ATOM 0 HA ILE A 78 21.509 -23.955 -49.191 1.00 25.00 H new ATOM 0 HB ILE A 78 23.338 -24.162 -50.761 1.00 25.00 H new ATOM 0 HG12 ILE A 78 24.850 -22.007 -49.236 1.00 25.00 H new ATOM 0 HG13 ILE A 78 25.251 -23.713 -49.230 1.00 25.00 H new ATOM 0 HG21 ILE A 78 23.272 -21.809 -51.763 1.00 25.00 H new ATOM 0 HG22 ILE A 78 21.670 -22.318 -51.180 1.00 25.00 H new ATOM 0 HG23 ILE A 78 22.653 -21.195 -50.211 1.00 25.00 H new ATOM 0 HD11 ILE A 78 26.736 -22.469 -50.745 1.00 25.00 H new ATOM 0 HD12 ILE A 78 25.739 -23.620 -51.665 1.00 25.00 H new ATOM 0 HD13 ILE A 78 25.332 -21.888 -51.671 1.00 25.00 H new ATOM 1231 N VAL A 79 23.051 -25.972 -48.646 1.00 25.00 N ATOM 1232 CA VAL A 79 23.707 -27.179 -48.079 1.00 25.00 C ATOM 1233 C VAL A 79 24.344 -27.960 -49.260 1.00 25.00 C ATOM 1234 O VAL A 79 24.038 -27.692 -50.431 1.00 25.00 O ATOM 1235 CB VAL A 79 22.656 -28.057 -47.378 1.00 25.00 C ATOM 1236 CG1 VAL A 79 22.182 -27.341 -46.098 1.00 25.00 C ATOM 1237 CG2 VAL A 79 21.513 -28.421 -48.352 1.00 25.00 C ATOM 0 H VAL A 79 22.527 -26.160 -49.501 1.00 25.00 H new ATOM 0 HA VAL A 79 24.467 -26.901 -47.349 1.00 25.00 H new ATOM 0 HB VAL A 79 23.090 -29.010 -47.074 1.00 25.00 H new ATOM 0 HG11 VAL A 79 21.436 -27.955 -45.593 1.00 25.00 H new ATOM 0 HG12 VAL A 79 23.032 -27.182 -45.434 1.00 25.00 H new ATOM 0 HG13 VAL A 79 21.742 -26.379 -46.361 1.00 25.00 H new ATOM 0 HG21 VAL A 79 20.780 -29.042 -47.837 1.00 25.00 H new ATOM 0 HG22 VAL A 79 21.032 -27.509 -48.705 1.00 25.00 H new ATOM 0 HG23 VAL A 79 21.920 -28.969 -49.202 1.00 25.00 H new ATOM 1247 N THR A 80 25.220 -28.897 -48.951 1.00 25.00 N ATOM 1248 CA THR A 80 25.987 -29.589 -50.007 1.00 25.00 C ATOM 1249 C THR A 80 25.795 -31.077 -49.778 1.00 25.00 C ATOM 1250 O THR A 80 25.414 -31.479 -48.688 1.00 25.00 O ATOM 1251 CB THR A 80 27.531 -29.250 -49.935 1.00 25.00 C ATOM 1252 OG1 THR A 80 27.730 -28.137 -49.048 1.00 25.00 O ATOM 1253 CG2 THR A 80 28.087 -28.908 -51.295 1.00 25.00 C ATOM 0 H THR A 80 25.427 -29.203 -48.000 1.00 25.00 H new ATOM 0 HA THR A 80 25.632 -29.269 -50.987 1.00 25.00 H new ATOM 0 HB THR A 80 28.056 -30.131 -49.566 1.00 25.00 H new ATOM 0 HG1 THR A 80 28.685 -27.925 -48.999 1.00 25.00 H new ATOM 0 HG21 THR A 80 29.149 -28.681 -51.207 1.00 25.00 H new ATOM 0 HG22 THR A 80 27.952 -29.755 -51.967 1.00 25.00 H new ATOM 0 HG23 THR A 80 27.562 -28.040 -51.695 1.00 25.00 H new ATOM 1261 N ASP A 81 26.088 -31.886 -50.825 1.00 25.00 N ATOM 1262 CA ASP A 81 25.978 -33.389 -50.817 1.00 25.00 C ATOM 1263 C ASP A 81 24.533 -33.916 -50.583 1.00 25.00 C ATOM 1264 O ASP A 81 23.696 -33.890 -51.467 1.00 25.00 O ATOM 1265 CB ASP A 81 27.037 -34.084 -49.905 1.00 25.00 C ATOM 1266 CG ASP A 81 27.374 -35.417 -50.427 1.00 25.00 C ATOM 1267 OD1 ASP A 81 26.486 -36.202 -50.753 1.00 25.00 O ATOM 1268 OD2 ASP A 81 28.568 -35.647 -50.601 1.00 25.00 O ATOM 1269 OXT ASP A 81 24.257 -34.427 -49.426 1.00 25.00 O ATOM 0 H ASP A 81 26.414 -31.519 -51.719 1.00 25.00 H new ATOM 0 HA ASP A 81 26.226 -33.687 -51.836 1.00 25.00 H new ATOM 0 HB2 ASP A 81 27.936 -33.471 -49.850 1.00 25.00 H new ATOM 0 HB3 ASP A 81 26.649 -34.172 -48.890 1.00 25.00 H new TER 1275 ASP A 81