USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 807 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 1 MET CE :methyl 137:sc= -0.764 (180deg=-3.85!) USER MOD Set 1.2: A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET N :NH3+ -121:sc= 1.22 (180deg=-0.738) USER MOD Single : A 8 SER OG : rot 180:sc=-0.00805 USER MOD Single : A 10 ASN : amide:sc= 0 K(o=0,f=-2.4!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0.564 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 HIS : no HD1:sc= -0.416 X(o=-0.42,f=-0.83) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -1.92! C(o=-1.9!,f=-2.4!) USER MOD Single : A 35 ASN : amide:sc= 0.596 K(o=0.6,f=-0.061) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 1.69 K(o=1.7,f=-5.7!) USER MOD Single : A 58 ASN : amide:sc= -0.019 X(o=-0.019,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 MET CE :methyl -172:sc= -0.343 (180deg=-0.392) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0228 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=-0.038) USER MOD Single : A 102 GLN : amide:sc= -0.0638 X(o=-0.064,f=-0.35) USER MOD Single : A 105 SER OG : rot 85:sc= 1.27 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 LYS NZ :NH3+ -168:sc= 0.407 (180deg=0.325) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.294 -9.561 -4.979 1.00 0.00 N ATOM 2 CA MET A 1 -3.569 -8.370 -4.161 1.00 0.00 C ATOM 3 C MET A 1 -2.395 -7.982 -3.273 1.00 0.00 C ATOM 4 O MET A 1 -1.889 -8.812 -2.511 1.00 0.00 O ATOM 5 CB MET A 1 -4.849 -8.545 -3.347 1.00 0.00 C ATOM 6 CG MET A 1 -5.330 -7.191 -2.827 1.00 0.00 C ATOM 7 SD MET A 1 -7.116 -6.987 -3.032 1.00 0.00 S ATOM 8 CE MET A 1 -7.230 -5.207 -3.309 1.00 0.00 C ATOM 0 H1 MET A 1 -3.390 -9.320 -5.986 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.327 -9.894 -4.793 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.971 -10.312 -4.737 1.00 0.00 H new ATOM 0 HA MET A 1 -3.717 -7.542 -4.854 1.00 0.00 H new ATOM 0 HB2 MET A 1 -5.622 -9.002 -3.965 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.668 -9.221 -2.511 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.072 -7.094 -1.772 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.810 -6.393 -3.357 1.00 0.00 H new ATOM 0 HE1 MET A 1 -7.932 -5.009 -4.119 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.579 -4.719 -2.399 1.00 0.00 H new ATOM 0 HE3 MET A 1 -6.248 -4.817 -3.577 1.00 0.00 H new ATOM 18 N ILE A 2 -1.992 -6.705 -3.340 1.00 0.00 N ATOM 19 CA ILE A 2 -0.938 -6.073 -2.552 1.00 0.00 C ATOM 20 C ILE A 2 -1.475 -4.687 -2.162 1.00 0.00 C ATOM 21 O ILE A 2 -2.280 -4.119 -2.908 1.00 0.00 O ATOM 22 CB ILE A 2 0.373 -5.950 -3.371 1.00 0.00 C ATOM 23 CG1 ILE A 2 0.624 -7.165 -4.293 1.00 0.00 C ATOM 24 CG2 ILE A 2 1.588 -5.671 -2.479 1.00 0.00 C ATOM 25 CD1 ILE A 2 1.984 -7.198 -4.993 1.00 0.00 C ATOM 0 H ILE A 2 -2.425 -6.049 -3.990 1.00 0.00 H new ATOM 0 HA ILE A 2 -0.693 -6.666 -1.671 1.00 0.00 H new ATOM 0 HB ILE A 2 0.234 -5.086 -4.021 1.00 0.00 H new ATOM 0 HG12 ILE A 2 0.519 -8.074 -3.701 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -0.156 -7.187 -5.054 1.00 0.00 H new ATOM 0 HG21 ILE A 2 2.483 -5.593 -3.097 1.00 0.00 H new ATOM 0 HG22 ILE A 2 1.437 -4.736 -1.940 1.00 0.00 H new ATOM 0 HG23 ILE A 2 1.710 -6.486 -1.765 1.00 0.00 H new ATOM 0 HD11 ILE A 2 2.052 -8.092 -5.613 1.00 0.00 H new ATOM 0 HD12 ILE A 2 2.092 -6.313 -5.619 1.00 0.00 H new ATOM 0 HD13 ILE A 2 2.777 -7.213 -4.246 1.00 0.00 H new ATOM 37 N ILE A 3 -1.041 -4.167 -1.014 1.00 0.00 N ATOM 38 CA ILE A 3 -1.597 -3.059 -0.246 1.00 0.00 C ATOM 39 C ILE A 3 -0.455 -2.120 0.126 1.00 0.00 C ATOM 40 O ILE A 3 0.368 -2.478 0.963 1.00 0.00 O ATOM 41 CB ILE A 3 -2.276 -3.616 1.027 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.453 -4.555 0.679 1.00 0.00 C ATOM 43 CG2 ILE A 3 -2.721 -2.481 1.967 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.328 -5.901 1.389 1.00 0.00 C ATOM 0 H ILE A 3 -0.213 -4.549 -0.557 1.00 0.00 H new ATOM 0 HA ILE A 3 -2.342 -2.516 -0.828 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.533 -4.211 1.559 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.393 -4.081 0.961 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -3.486 -4.713 -0.399 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -3.194 -2.906 2.852 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.852 -1.895 2.266 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.432 -1.837 1.449 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -4.173 -6.534 1.120 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.400 -6.387 1.087 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -3.321 -5.744 2.468 1.00 0.00 H new ATOM 56 N ALA A 4 -0.343 -0.963 -0.528 1.00 0.00 N ATOM 57 CA ALA A 4 0.745 -0.037 -0.216 1.00 0.00 C ATOM 58 C ALA A 4 0.417 0.763 1.026 1.00 0.00 C ATOM 59 O ALA A 4 -0.734 1.176 1.188 1.00 0.00 O ATOM 60 CB ALA A 4 1.056 0.928 -1.364 1.00 0.00 C ATOM 0 H ALA A 4 -0.978 -0.650 -1.262 1.00 0.00 H new ATOM 0 HA ALA A 4 1.630 -0.651 -0.050 1.00 0.00 H new ATOM 0 HB1 ALA A 4 1.872 1.590 -1.072 1.00 0.00 H new ATOM 0 HB2 ALA A 4 1.347 0.360 -2.248 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.170 1.522 -1.590 1.00 0.00 H new ATOM 66 N ILE A 5 1.440 1.082 1.818 1.00 0.00 N ATOM 67 CA ILE A 5 1.330 1.960 2.971 1.00 0.00 C ATOM 68 C ILE A 5 2.636 2.755 2.993 1.00 0.00 C ATOM 69 O ILE A 5 3.698 2.171 3.211 1.00 0.00 O ATOM 70 CB ILE A 5 1.066 1.197 4.295 1.00 0.00 C ATOM 71 CG1 ILE A 5 -0.217 0.342 4.185 1.00 0.00 C ATOM 72 CG2 ILE A 5 0.926 2.224 5.439 1.00 0.00 C ATOM 73 CD1 ILE A 5 -0.612 -0.437 5.438 1.00 0.00 C ATOM 0 H ILE A 5 2.385 0.728 1.669 1.00 0.00 H new ATOM 0 HA ILE A 5 0.464 2.617 2.886 1.00 0.00 H new ATOM 0 HB ILE A 5 1.900 0.526 4.499 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -1.044 0.997 3.913 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -0.089 -0.366 3.366 1.00 0.00 H new ATOM 0 HG21 ILE A 5 0.740 1.701 6.377 1.00 0.00 H new ATOM 0 HG22 ILE A 5 1.846 2.803 5.523 1.00 0.00 H new ATOM 0 HG23 ILE A 5 0.093 2.894 5.226 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -1.525 -0.999 5.244 1.00 0.00 H new ATOM 0 HD12 ILE A 5 0.189 -1.127 5.705 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -0.782 0.258 6.260 1.00 0.00 H new ATOM 85 N PRO A 6 2.609 4.070 2.724 1.00 0.00 N ATOM 86 CA PRO A 6 3.777 4.901 2.933 1.00 0.00 C ATOM 87 C PRO A 6 3.993 4.983 4.441 1.00 0.00 C ATOM 88 O PRO A 6 3.076 5.400 5.154 1.00 0.00 O ATOM 89 CB PRO A 6 3.427 6.249 2.305 1.00 0.00 C ATOM 90 CG PRO A 6 1.908 6.341 2.423 1.00 0.00 C ATOM 91 CD PRO A 6 1.439 4.884 2.438 1.00 0.00 C ATOM 0 HA PRO A 6 4.698 4.527 2.486 1.00 0.00 H new ATOM 0 HB2 PRO A 6 3.916 7.070 2.829 1.00 0.00 H new ATOM 0 HB3 PRO A 6 3.748 6.298 1.265 1.00 0.00 H new ATOM 0 HG2 PRO A 6 1.611 6.864 3.332 1.00 0.00 H new ATOM 0 HG3 PRO A 6 1.477 6.889 1.585 1.00 0.00 H new ATOM 0 HD2 PRO A 6 0.669 4.733 3.194 1.00 0.00 H new ATOM 0 HD3 PRO A 6 1.001 4.609 1.478 1.00 0.00 H new ATOM 99 N VAL A 7 5.162 4.597 4.942 1.00 0.00 N ATOM 100 CA VAL A 7 5.485 4.696 6.363 1.00 0.00 C ATOM 101 C VAL A 7 6.550 5.763 6.569 1.00 0.00 C ATOM 102 O VAL A 7 7.232 6.154 5.622 1.00 0.00 O ATOM 103 CB VAL A 7 5.851 3.322 6.963 1.00 0.00 C ATOM 104 CG1 VAL A 7 4.602 2.454 7.094 1.00 0.00 C ATOM 105 CG2 VAL A 7 6.924 2.542 6.193 1.00 0.00 C ATOM 0 H VAL A 7 5.914 4.206 4.374 1.00 0.00 H new ATOM 0 HA VAL A 7 4.601 5.013 6.917 1.00 0.00 H new ATOM 0 HB VAL A 7 6.282 3.548 7.938 1.00 0.00 H new ATOM 0 HG11 VAL A 7 4.874 1.487 7.518 1.00 0.00 H new ATOM 0 HG12 VAL A 7 3.883 2.948 7.747 1.00 0.00 H new ATOM 0 HG13 VAL A 7 4.157 2.306 6.110 1.00 0.00 H new ATOM 0 HG21 VAL A 7 7.112 1.591 6.692 1.00 0.00 H new ATOM 0 HG22 VAL A 7 6.579 2.356 5.176 1.00 0.00 H new ATOM 0 HG23 VAL A 7 7.845 3.124 6.163 1.00 0.00 H new ATOM 115 N SER A 8 6.656 6.290 7.788 1.00 0.00 N ATOM 116 CA SER A 8 7.731 7.208 8.133 1.00 0.00 C ATOM 117 C SER A 8 9.045 6.446 8.294 1.00 0.00 C ATOM 118 O SER A 8 10.096 6.974 7.957 1.00 0.00 O ATOM 119 CB SER A 8 7.406 7.966 9.422 1.00 0.00 C ATOM 120 OG SER A 8 6.188 8.682 9.293 1.00 0.00 O ATOM 0 H SER A 8 6.008 6.094 8.551 1.00 0.00 H new ATOM 0 HA SER A 8 7.835 7.931 7.324 1.00 0.00 H new ATOM 0 HB2 SER A 8 7.334 7.265 10.253 1.00 0.00 H new ATOM 0 HB3 SER A 8 8.216 8.657 9.657 1.00 0.00 H new ATOM 0 HG SER A 8 5.998 9.158 10.128 1.00 0.00 H new ATOM 126 N GLU A 9 9.000 5.215 8.808 1.00 0.00 N ATOM 127 CA GLU A 9 10.177 4.417 9.111 1.00 0.00 C ATOM 128 C GLU A 9 9.821 2.955 8.860 1.00 0.00 C ATOM 129 O GLU A 9 8.654 2.567 8.974 1.00 0.00 O ATOM 130 CB GLU A 9 10.596 4.628 10.576 1.00 0.00 C ATOM 131 CG GLU A 9 11.039 6.063 10.903 1.00 0.00 C ATOM 132 CD GLU A 9 12.257 6.588 10.115 1.00 0.00 C ATOM 133 OE1 GLU A 9 13.128 5.782 9.699 1.00 0.00 O ATOM 134 OE2 GLU A 9 12.377 7.829 9.939 1.00 0.00 O ATOM 0 H GLU A 9 8.124 4.741 9.028 1.00 0.00 H new ATOM 0 HA GLU A 9 11.015 4.713 8.481 1.00 0.00 H new ATOM 0 HB2 GLU A 9 9.761 4.361 11.223 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.412 3.945 10.811 1.00 0.00 H new ATOM 0 HG2 GLU A 9 10.198 6.732 10.722 1.00 0.00 H new ATOM 0 HG3 GLU A 9 11.268 6.118 11.967 1.00 0.00 H new ATOM 141 N ASN A 10 10.831 2.145 8.559 1.00 0.00 N ATOM 142 CA ASN A 10 10.704 0.703 8.480 1.00 0.00 C ATOM 143 C ASN A 10 10.759 0.213 9.908 1.00 0.00 C ATOM 144 O ASN A 10 11.799 0.375 10.552 1.00 0.00 O ATOM 145 CB ASN A 10 11.860 0.060 7.697 1.00 0.00 C ATOM 146 CG ASN A 10 11.920 -1.426 8.048 1.00 0.00 C ATOM 147 OD1 ASN A 10 11.023 -2.183 7.705 1.00 0.00 O ATOM 148 ND2 ASN A 10 12.888 -1.848 8.847 1.00 0.00 N ATOM 0 H ASN A 10 11.773 2.482 8.361 1.00 0.00 H new ATOM 0 HA ASN A 10 9.781 0.438 7.964 1.00 0.00 H new ATOM 0 HB2 ASN A 10 11.709 0.190 6.625 1.00 0.00 H new ATOM 0 HB3 ASN A 10 12.803 0.546 7.947 1.00 0.00 H new ATOM 0 HD21 ASN A 10 12.889 -2.812 9.182 1.00 0.00 H new ATOM 0 HD22 ASN A 10 13.632 -1.209 9.128 1.00 0.00 H new ATOM 155 N ARG A 11 9.678 -0.376 10.418 1.00 0.00 N ATOM 156 CA ARG A 11 9.738 -1.045 11.709 1.00 0.00 C ATOM 157 C ARG A 11 8.961 -2.365 11.658 1.00 0.00 C ATOM 158 O ARG A 11 8.296 -2.708 12.626 1.00 0.00 O ATOM 159 CB ARG A 11 9.241 -0.091 12.824 1.00 0.00 C ATOM 160 CG ARG A 11 9.979 1.255 12.874 1.00 0.00 C ATOM 161 CD ARG A 11 9.615 2.060 14.119 1.00 0.00 C ATOM 162 NE ARG A 11 10.594 3.137 14.356 1.00 0.00 N ATOM 163 CZ ARG A 11 10.843 3.673 15.556 1.00 0.00 C ATOM 164 NH1 ARG A 11 10.025 3.456 16.577 1.00 0.00 N ATOM 165 NH2 ARG A 11 11.920 4.421 15.742 1.00 0.00 N ATOM 0 H ARG A 11 8.766 -0.402 9.963 1.00 0.00 H new ATOM 0 HA ARG A 11 10.771 -1.299 11.948 1.00 0.00 H new ATOM 0 HB2 ARG A 11 8.177 0.096 12.680 1.00 0.00 H new ATOM 0 HB3 ARG A 11 9.350 -0.588 13.788 1.00 0.00 H new ATOM 0 HG2 ARG A 11 11.055 1.080 12.857 1.00 0.00 H new ATOM 0 HG3 ARG A 11 9.737 1.835 11.983 1.00 0.00 H new ATOM 0 HD2 ARG A 11 8.619 2.488 14.002 1.00 0.00 H new ATOM 0 HD3 ARG A 11 9.578 1.400 14.986 1.00 0.00 H new ATOM 0 HE ARG A 11 11.114 3.496 13.555 1.00 0.00 H new ATOM 0 HH11 ARG A 11 9.196 2.875 16.452 1.00 0.00 H new ATOM 0 HH12 ARG A 11 10.225 3.870 17.488 1.00 0.00 H new ATOM 0 HH21 ARG A 11 12.563 4.590 14.969 1.00 0.00 H new ATOM 0 HH22 ARG A 11 12.106 4.828 16.659 1.00 0.00 H new ATOM 179 N GLY A 12 9.045 -3.127 10.556 1.00 0.00 N ATOM 180 CA GLY A 12 8.389 -4.428 10.390 1.00 0.00 C ATOM 181 C GLY A 12 7.034 -4.545 11.033 1.00 0.00 C ATOM 182 O GLY A 12 6.909 -5.296 11.994 1.00 0.00 O ATOM 0 H GLY A 12 9.585 -2.846 9.737 1.00 0.00 H new ATOM 0 HA2 GLY A 12 8.287 -4.633 9.324 1.00 0.00 H new ATOM 0 HA3 GLY A 12 9.038 -5.200 10.803 1.00 0.00 H new ATOM 186 N LYS A 13 6.042 -3.898 10.406 1.00 0.00 N ATOM 187 CA LYS A 13 4.615 -3.796 10.729 1.00 0.00 C ATOM 188 C LYS A 13 4.313 -2.800 11.864 1.00 0.00 C ATOM 189 O LYS A 13 3.244 -2.182 11.844 1.00 0.00 O ATOM 190 CB LYS A 13 3.980 -5.175 10.951 1.00 0.00 C ATOM 191 CG LYS A 13 3.928 -5.492 12.446 1.00 0.00 C ATOM 192 CD LYS A 13 3.738 -6.965 12.784 1.00 0.00 C ATOM 193 CE LYS A 13 5.108 -7.638 12.716 1.00 0.00 C ATOM 194 NZ LYS A 13 5.039 -9.038 13.159 1.00 0.00 N ATOM 0 H LYS A 13 6.248 -3.370 9.558 1.00 0.00 H new ATOM 0 HA LYS A 13 4.133 -3.369 9.850 1.00 0.00 H new ATOM 0 HB2 LYS A 13 2.974 -5.193 10.532 1.00 0.00 H new ATOM 0 HB3 LYS A 13 4.557 -5.938 10.429 1.00 0.00 H new ATOM 0 HG2 LYS A 13 4.852 -5.145 12.908 1.00 0.00 H new ATOM 0 HG3 LYS A 13 3.114 -4.923 12.895 1.00 0.00 H new ATOM 0 HD2 LYS A 13 3.306 -7.076 13.779 1.00 0.00 H new ATOM 0 HD3 LYS A 13 3.047 -7.432 12.082 1.00 0.00 H new ATOM 0 HE2 LYS A 13 5.486 -7.596 11.694 1.00 0.00 H new ATOM 0 HE3 LYS A 13 5.815 -7.092 13.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 5.984 -9.467 13.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 4.701 -9.075 14.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 4.382 -9.564 12.548 1.00 0.00 H new ATOM 208 N ASP A 14 5.264 -2.596 12.785 1.00 0.00 N ATOM 209 CA ASP A 14 5.223 -1.507 13.760 1.00 0.00 C ATOM 210 C ASP A 14 5.493 -0.175 13.045 1.00 0.00 C ATOM 211 O ASP A 14 5.376 0.892 13.643 1.00 0.00 O ATOM 212 CB ASP A 14 6.238 -1.728 14.896 1.00 0.00 C ATOM 213 CG ASP A 14 6.187 -3.125 15.521 1.00 0.00 C ATOM 214 OD1 ASP A 14 5.207 -3.437 16.232 1.00 0.00 O ATOM 215 OD2 ASP A 14 7.130 -3.933 15.330 1.00 0.00 O ATOM 0 H ASP A 14 6.089 -3.189 12.872 1.00 0.00 H new ATOM 0 HA ASP A 14 4.232 -1.483 14.213 1.00 0.00 H new ATOM 0 HB2 ASP A 14 7.242 -1.551 14.510 1.00 0.00 H new ATOM 0 HB3 ASP A 14 6.061 -0.987 15.675 1.00 0.00 H new ATOM 220 N SER A 15 5.876 -0.249 11.764 1.00 0.00 N ATOM 221 CA SER A 15 6.075 0.802 10.783 1.00 0.00 C ATOM 222 C SER A 15 4.946 1.839 10.883 1.00 0.00 C ATOM 223 O SER A 15 3.803 1.510 10.557 1.00 0.00 O ATOM 224 CB SER A 15 6.155 0.141 9.410 1.00 0.00 C ATOM 225 OG SER A 15 6.947 -1.037 9.413 1.00 0.00 O ATOM 0 H SER A 15 6.075 -1.160 11.351 1.00 0.00 H new ATOM 0 HA SER A 15 7.002 1.347 10.963 1.00 0.00 H new ATOM 0 HB2 SER A 15 5.149 -0.104 9.070 1.00 0.00 H new ATOM 0 HB3 SER A 15 6.569 0.850 8.694 1.00 0.00 H new ATOM 0 HG SER A 15 6.964 -1.422 8.512 1.00 0.00 H new ATOM 231 N PRO A 16 5.216 3.051 11.391 1.00 0.00 N ATOM 232 CA PRO A 16 4.188 4.063 11.587 1.00 0.00 C ATOM 233 C PRO A 16 3.842 4.693 10.237 1.00 0.00 C ATOM 234 O PRO A 16 4.759 5.012 9.470 1.00 0.00 O ATOM 235 CB PRO A 16 4.819 5.063 12.554 1.00 0.00 C ATOM 236 CG PRO A 16 6.317 4.975 12.273 1.00 0.00 C ATOM 237 CD PRO A 16 6.516 3.524 11.848 1.00 0.00 C ATOM 0 HA PRO A 16 3.253 3.674 11.989 1.00 0.00 H new ATOM 0 HB2 PRO A 16 4.442 6.071 12.384 1.00 0.00 H new ATOM 0 HB3 PRO A 16 4.594 4.809 13.590 1.00 0.00 H new ATOM 0 HG2 PRO A 16 6.619 5.668 11.488 1.00 0.00 H new ATOM 0 HG3 PRO A 16 6.906 5.218 13.157 1.00 0.00 H new ATOM 0 HD2 PRO A 16 7.258 3.450 11.053 1.00 0.00 H new ATOM 0 HD3 PRO A 16 6.879 2.921 12.680 1.00 0.00 H new ATOM 245 N ILE A 17 2.554 4.886 9.925 1.00 0.00 N ATOM 246 CA ILE A 17 2.146 5.462 8.644 1.00 0.00 C ATOM 247 C ILE A 17 2.780 6.857 8.481 1.00 0.00 C ATOM 248 O ILE A 17 3.008 7.575 9.463 1.00 0.00 O ATOM 249 CB ILE A 17 0.602 5.439 8.500 1.00 0.00 C ATOM 250 CG1 ILE A 17 0.198 5.651 7.023 1.00 0.00 C ATOM 251 CG2 ILE A 17 -0.070 6.447 9.435 1.00 0.00 C ATOM 252 CD1 ILE A 17 -1.255 5.294 6.698 1.00 0.00 C ATOM 0 H ILE A 17 1.779 4.651 10.545 1.00 0.00 H new ATOM 0 HA ILE A 17 2.518 4.856 7.818 1.00 0.00 H new ATOM 0 HB ILE A 17 0.244 4.456 8.805 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.368 6.695 6.760 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.855 5.052 6.392 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -1.151 6.400 9.304 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.181 6.208 10.468 1.00 0.00 H new ATOM 0 HG23 ILE A 17 0.281 7.452 9.199 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -1.446 5.475 5.640 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -1.430 4.242 6.924 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -1.924 5.910 7.298 1.00 0.00 H new ATOM 264 N SER A 18 3.115 7.227 7.248 1.00 0.00 N ATOM 265 CA SER A 18 3.582 8.552 6.889 1.00 0.00 C ATOM 266 C SER A 18 2.383 9.477 6.724 1.00 0.00 C ATOM 267 O SER A 18 1.227 9.057 6.627 1.00 0.00 O ATOM 268 CB SER A 18 4.335 8.503 5.558 1.00 0.00 C ATOM 269 OG SER A 18 5.243 9.589 5.429 1.00 0.00 O ATOM 0 H SER A 18 3.066 6.591 6.452 1.00 0.00 H new ATOM 0 HA SER A 18 4.245 8.916 7.674 1.00 0.00 H new ATOM 0 HB2 SER A 18 4.880 7.562 5.482 1.00 0.00 H new ATOM 0 HB3 SER A 18 3.621 8.525 4.735 1.00 0.00 H new ATOM 0 HG SER A 18 5.708 9.526 4.569 1.00 0.00 H new ATOM 275 N GLU A 19 2.679 10.760 6.573 1.00 0.00 N ATOM 276 CA GLU A 19 1.651 11.752 6.360 1.00 0.00 C ATOM 277 C GLU A 19 1.174 11.737 4.911 1.00 0.00 C ATOM 278 O GLU A 19 -0.014 11.879 4.651 1.00 0.00 O ATOM 279 CB GLU A 19 2.196 13.138 6.699 1.00 0.00 C ATOM 280 CG GLU A 19 2.579 13.349 8.163 1.00 0.00 C ATOM 281 CD GLU A 19 3.443 14.601 8.269 1.00 0.00 C ATOM 282 OE1 GLU A 19 2.906 15.732 8.355 1.00 0.00 O ATOM 283 OE2 GLU A 19 4.682 14.466 8.227 1.00 0.00 O ATOM 0 H GLU A 19 3.628 11.133 6.595 1.00 0.00 H new ATOM 0 HA GLU A 19 0.807 11.517 7.008 1.00 0.00 H new ATOM 0 HB2 GLU A 19 3.073 13.327 6.080 1.00 0.00 H new ATOM 0 HB3 GLU A 19 1.447 13.882 6.426 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.684 13.455 8.776 1.00 0.00 H new ATOM 0 HG3 GLU A 19 3.122 12.482 8.540 1.00 0.00 H new ATOM 290 N HIS A 20 2.068 11.561 3.940 1.00 0.00 N ATOM 291 CA HIS A 20 1.799 11.772 2.516 1.00 0.00 C ATOM 292 C HIS A 20 2.312 10.562 1.739 1.00 0.00 C ATOM 293 O HIS A 20 2.722 9.564 2.330 1.00 0.00 O ATOM 294 CB HIS A 20 2.468 13.089 2.077 1.00 0.00 C ATOM 295 CG HIS A 20 2.373 14.219 3.083 1.00 0.00 C ATOM 296 ND1 HIS A 20 3.430 14.732 3.819 1.00 0.00 N ATOM 297 CD2 HIS A 20 1.223 14.807 3.536 1.00 0.00 C ATOM 298 CE1 HIS A 20 2.924 15.656 4.664 1.00 0.00 C ATOM 299 NE2 HIS A 20 1.585 15.712 4.509 1.00 0.00 N ATOM 0 H HIS A 20 3.025 11.260 4.125 1.00 0.00 H new ATOM 0 HA HIS A 20 0.731 11.864 2.316 1.00 0.00 H new ATOM 0 HB2 HIS A 20 3.520 12.894 1.870 1.00 0.00 H new ATOM 0 HB3 HIS A 20 2.014 13.416 1.141 1.00 0.00 H new ATOM 0 HD2 HIS A 20 0.220 14.600 3.194 1.00 0.00 H new ATOM 0 HE1 HIS A 20 3.500 16.255 5.354 1.00 0.00 H new ATOM 0 HE2 HIS A 20 0.949 16.321 5.024 1.00 0.00 H new ATOM 308 N PHE A 21 2.262 10.634 0.410 1.00 0.00 N ATOM 309 CA PHE A 21 2.764 9.585 -0.473 1.00 0.00 C ATOM 310 C PHE A 21 3.868 10.136 -1.372 1.00 0.00 C ATOM 311 O PHE A 21 4.883 9.480 -1.557 1.00 0.00 O ATOM 312 CB PHE A 21 1.603 8.984 -1.276 1.00 0.00 C ATOM 313 CG PHE A 21 2.032 7.928 -2.276 1.00 0.00 C ATOM 314 CD1 PHE A 21 2.459 8.312 -3.564 1.00 0.00 C ATOM 315 CD2 PHE A 21 2.059 6.569 -1.907 1.00 0.00 C ATOM 316 CE1 PHE A 21 2.936 7.349 -4.468 1.00 0.00 C ATOM 317 CE2 PHE A 21 2.557 5.610 -2.806 1.00 0.00 C ATOM 318 CZ PHE A 21 3.008 6.006 -4.077 1.00 0.00 C ATOM 0 H PHE A 21 1.867 11.432 -0.089 1.00 0.00 H new ATOM 0 HA PHE A 21 3.204 8.783 0.119 1.00 0.00 H new ATOM 0 HB2 PHE A 21 0.884 8.545 -0.584 1.00 0.00 H new ATOM 0 HB3 PHE A 21 1.087 9.785 -1.806 1.00 0.00 H new ATOM 0 HD1 PHE A 21 2.419 9.351 -3.856 1.00 0.00 H new ATOM 0 HD2 PHE A 21 1.698 6.265 -0.936 1.00 0.00 H new ATOM 0 HE1 PHE A 21 3.246 7.643 -5.460 1.00 0.00 H new ATOM 0 HE2 PHE A 21 2.593 4.569 -2.520 1.00 0.00 H new ATOM 0 HZ PHE A 21 3.413 5.270 -4.756 1.00 0.00 H new ATOM 328 N GLY A 22 3.703 11.353 -1.912 1.00 0.00 N ATOM 329 CA GLY A 22 4.651 11.919 -2.871 1.00 0.00 C ATOM 330 C GLY A 22 6.070 12.069 -2.319 1.00 0.00 C ATOM 331 O GLY A 22 7.019 12.005 -3.095 1.00 0.00 O ATOM 0 H GLY A 22 2.915 11.964 -1.696 1.00 0.00 H new ATOM 0 HA2 GLY A 22 4.681 11.284 -3.757 1.00 0.00 H new ATOM 0 HA3 GLY A 22 4.290 12.896 -3.191 1.00 0.00 H new ATOM 335 N ARG A 23 6.212 12.232 -0.999 1.00 0.00 N ATOM 336 CA ARG A 23 7.465 12.167 -0.250 1.00 0.00 C ATOM 337 C ARG A 23 7.251 11.194 0.902 1.00 0.00 C ATOM 338 O ARG A 23 7.050 11.605 2.050 1.00 0.00 O ATOM 339 CB ARG A 23 7.926 13.565 0.215 1.00 0.00 C ATOM 340 CG ARG A 23 6.894 14.399 1.010 1.00 0.00 C ATOM 341 CD ARG A 23 7.457 14.928 2.342 1.00 0.00 C ATOM 342 NE ARG A 23 6.807 16.194 2.726 1.00 0.00 N ATOM 343 CZ ARG A 23 6.398 16.594 3.936 1.00 0.00 C ATOM 344 NH1 ARG A 23 6.476 15.820 5.010 1.00 0.00 N ATOM 345 NH2 ARG A 23 5.845 17.791 4.031 1.00 0.00 N ATOM 0 H ARG A 23 5.412 12.423 -0.396 1.00 0.00 H new ATOM 0 HA ARG A 23 8.276 11.806 -0.882 1.00 0.00 H new ATOM 0 HB2 ARG A 23 8.816 13.444 0.832 1.00 0.00 H new ATOM 0 HB3 ARG A 23 8.223 14.137 -0.664 1.00 0.00 H new ATOM 0 HG2 ARG A 23 6.565 15.240 0.400 1.00 0.00 H new ATOM 0 HG3 ARG A 23 6.015 13.787 1.210 1.00 0.00 H new ATOM 0 HD2 ARG A 23 7.305 14.185 3.125 1.00 0.00 H new ATOM 0 HD3 ARG A 23 8.532 15.080 2.251 1.00 0.00 H new ATOM 0 HE ARG A 23 6.647 16.855 1.966 1.00 0.00 H new ATOM 0 HH11 ARG A 23 6.860 14.878 4.933 1.00 0.00 H new ATOM 0 HH12 ARG A 23 6.152 16.167 5.913 1.00 0.00 H new ATOM 0 HH21 ARG A 23 5.743 18.373 3.200 1.00 0.00 H new ATOM 0 HH22 ARG A 23 5.520 18.132 4.936 1.00 0.00 H new ATOM 359 N ALA A 24 7.184 9.908 0.584 1.00 0.00 N ATOM 360 CA ALA A 24 7.288 8.850 1.575 1.00 0.00 C ATOM 361 C ALA A 24 8.713 8.293 1.493 1.00 0.00 C ATOM 362 O ALA A 24 9.205 8.134 0.379 1.00 0.00 O ATOM 363 CB ALA A 24 6.271 7.756 1.269 1.00 0.00 C ATOM 0 H ALA A 24 7.056 9.571 -0.370 1.00 0.00 H new ATOM 0 HA ALA A 24 7.083 9.228 2.577 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.352 6.965 2.014 1.00 0.00 H new ATOM 0 HB2 ALA A 24 5.266 8.176 1.294 1.00 0.00 H new ATOM 0 HB3 ALA A 24 6.467 7.344 0.279 1.00 0.00 H new ATOM 369 N PRO A 25 9.377 8.000 2.615 1.00 0.00 N ATOM 370 CA PRO A 25 10.717 7.415 2.634 1.00 0.00 C ATOM 371 C PRO A 25 10.722 5.900 2.387 1.00 0.00 C ATOM 372 O PRO A 25 11.756 5.335 2.022 1.00 0.00 O ATOM 373 CB PRO A 25 11.231 7.734 4.036 1.00 0.00 C ATOM 374 CG PRO A 25 9.967 7.751 4.890 1.00 0.00 C ATOM 375 CD PRO A 25 8.930 8.333 3.951 1.00 0.00 C ATOM 0 HA PRO A 25 11.336 7.821 1.834 1.00 0.00 H new ATOM 0 HB2 PRO A 25 11.939 6.982 4.384 1.00 0.00 H new ATOM 0 HB3 PRO A 25 11.746 8.694 4.065 1.00 0.00 H new ATOM 0 HG2 PRO A 25 9.692 6.751 5.225 1.00 0.00 H new ATOM 0 HG3 PRO A 25 10.092 8.363 5.783 1.00 0.00 H new ATOM 0 HD2 PRO A 25 7.944 7.914 4.149 1.00 0.00 H new ATOM 0 HD3 PRO A 25 8.849 9.412 4.079 1.00 0.00 H new ATOM 383 N TYR A 26 9.586 5.239 2.613 1.00 0.00 N ATOM 384 CA TYR A 26 9.443 3.801 2.740 1.00 0.00 C ATOM 385 C TYR A 26 8.019 3.449 2.288 1.00 0.00 C ATOM 386 O TYR A 26 7.077 4.171 2.631 1.00 0.00 O ATOM 387 CB TYR A 26 9.645 3.441 4.223 1.00 0.00 C ATOM 388 CG TYR A 26 11.053 3.554 4.784 1.00 0.00 C ATOM 389 CD1 TYR A 26 12.070 2.655 4.402 1.00 0.00 C ATOM 390 CD2 TYR A 26 11.330 4.536 5.748 1.00 0.00 C ATOM 391 CE1 TYR A 26 13.370 2.799 4.929 1.00 0.00 C ATOM 392 CE2 TYR A 26 12.625 4.708 6.252 1.00 0.00 C ATOM 393 CZ TYR A 26 13.660 3.843 5.837 1.00 0.00 C ATOM 394 OH TYR A 26 14.920 4.022 6.320 1.00 0.00 O ATOM 0 H TYR A 26 8.696 5.726 2.717 1.00 0.00 H new ATOM 0 HA TYR A 26 10.167 3.253 2.137 1.00 0.00 H new ATOM 0 HB2 TYR A 26 8.993 4.082 4.817 1.00 0.00 H new ATOM 0 HB3 TYR A 26 9.305 2.416 4.370 1.00 0.00 H new ATOM 0 HD1 TYR A 26 11.854 1.857 3.707 1.00 0.00 H new ATOM 0 HD2 TYR A 26 10.532 5.169 6.107 1.00 0.00 H new ATOM 0 HE1 TYR A 26 14.148 2.109 4.638 1.00 0.00 H new ATOM 0 HE2 TYR A 26 12.831 5.500 6.956 1.00 0.00 H new ATOM 0 HH TYR A 26 14.930 4.789 6.931 1.00 0.00 H new ATOM 404 N PHE A 27 7.857 2.362 1.530 1.00 0.00 N ATOM 405 CA PHE A 27 6.592 1.823 1.054 1.00 0.00 C ATOM 406 C PHE A 27 6.460 0.389 1.583 1.00 0.00 C ATOM 407 O PHE A 27 6.992 -0.561 1.002 1.00 0.00 O ATOM 408 CB PHE A 27 6.531 1.900 -0.485 1.00 0.00 C ATOM 409 CG PHE A 27 6.419 3.293 -1.076 1.00 0.00 C ATOM 410 CD1 PHE A 27 5.430 4.184 -0.623 1.00 0.00 C ATOM 411 CD2 PHE A 27 7.249 3.674 -2.143 1.00 0.00 C ATOM 412 CE1 PHE A 27 5.301 5.449 -1.217 1.00 0.00 C ATOM 413 CE2 PHE A 27 7.106 4.928 -2.759 1.00 0.00 C ATOM 414 CZ PHE A 27 6.128 5.821 -2.290 1.00 0.00 C ATOM 0 H PHE A 27 8.654 1.807 1.217 1.00 0.00 H new ATOM 0 HA PHE A 27 5.749 2.406 1.424 1.00 0.00 H new ATOM 0 HB2 PHE A 27 7.426 1.426 -0.889 1.00 0.00 H new ATOM 0 HB3 PHE A 27 5.678 1.313 -0.825 1.00 0.00 H new ATOM 0 HD1 PHE A 27 4.770 3.895 0.182 1.00 0.00 H new ATOM 0 HD2 PHE A 27 8.009 2.992 -2.495 1.00 0.00 H new ATOM 0 HE1 PHE A 27 4.560 6.142 -0.846 1.00 0.00 H new ATOM 0 HE2 PHE A 27 7.743 5.204 -3.587 1.00 0.00 H new ATOM 0 HZ PHE A 27 6.012 6.790 -2.753 1.00 0.00 H new ATOM 424 N ALA A 28 5.708 0.214 2.672 1.00 0.00 N ATOM 425 CA ALA A 28 5.369 -1.076 3.261 1.00 0.00 C ATOM 426 C ALA A 28 4.221 -1.707 2.450 1.00 0.00 C ATOM 427 O ALA A 28 3.051 -1.586 2.812 1.00 0.00 O ATOM 428 CB ALA A 28 4.958 -0.861 4.726 1.00 0.00 C ATOM 0 H ALA A 28 5.305 0.999 3.184 1.00 0.00 H new ATOM 0 HA ALA A 28 6.225 -1.751 3.236 1.00 0.00 H new ATOM 0 HB1 ALA A 28 4.702 -1.820 5.177 1.00 0.00 H new ATOM 0 HB2 ALA A 28 5.786 -0.412 5.274 1.00 0.00 H new ATOM 0 HB3 ALA A 28 4.094 -0.198 4.768 1.00 0.00 H new ATOM 434 N PHE A 29 4.529 -2.283 1.285 1.00 0.00 N ATOM 435 CA PHE A 29 3.587 -3.028 0.448 1.00 0.00 C ATOM 436 C PHE A 29 3.251 -4.374 1.131 1.00 0.00 C ATOM 437 O PHE A 29 3.986 -5.352 0.999 1.00 0.00 O ATOM 438 CB PHE A 29 4.167 -3.176 -0.982 1.00 0.00 C ATOM 439 CG PHE A 29 3.565 -2.285 -2.083 1.00 0.00 C ATOM 440 CD1 PHE A 29 2.162 -2.193 -2.254 1.00 0.00 C ATOM 441 CD2 PHE A 29 4.399 -1.599 -3.004 1.00 0.00 C ATOM 442 CE1 PHE A 29 1.603 -1.352 -3.232 1.00 0.00 C ATOM 443 CE2 PHE A 29 3.820 -0.833 -4.045 1.00 0.00 C ATOM 444 CZ PHE A 29 2.428 -0.671 -4.134 1.00 0.00 C ATOM 0 H PHE A 29 5.467 -2.242 0.887 1.00 0.00 H new ATOM 0 HA PHE A 29 2.645 -2.490 0.341 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.238 -2.976 -0.934 1.00 0.00 H new ATOM 0 HB3 PHE A 29 4.050 -4.216 -1.288 1.00 0.00 H new ATOM 0 HD1 PHE A 29 1.511 -2.779 -1.622 1.00 0.00 H new ATOM 0 HD2 PHE A 29 5.473 -1.661 -2.911 1.00 0.00 H new ATOM 0 HE1 PHE A 29 0.531 -1.231 -3.287 1.00 0.00 H new ATOM 0 HE2 PHE A 29 4.458 -0.367 -4.781 1.00 0.00 H new ATOM 0 HZ PHE A 29 1.999 -0.029 -4.889 1.00 0.00 H new ATOM 454 N VAL A 30 2.161 -4.436 1.893 1.00 0.00 N ATOM 455 CA VAL A 30 1.625 -5.653 2.520 1.00 0.00 C ATOM 456 C VAL A 30 0.810 -6.444 1.485 1.00 0.00 C ATOM 457 O VAL A 30 0.521 -5.928 0.408 1.00 0.00 O ATOM 458 CB VAL A 30 0.812 -5.230 3.772 1.00 0.00 C ATOM 459 CG1 VAL A 30 0.196 -6.408 4.549 1.00 0.00 C ATOM 460 CG2 VAL A 30 1.697 -4.393 4.719 1.00 0.00 C ATOM 0 H VAL A 30 1.601 -3.609 2.102 1.00 0.00 H new ATOM 0 HA VAL A 30 2.415 -6.324 2.856 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.023 -4.637 3.399 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.355 -6.028 5.409 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.482 -6.959 3.897 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.989 -7.072 4.892 1.00 0.00 H new ATOM 0 HG21 VAL A 30 1.118 -4.101 5.595 1.00 0.00 H new ATOM 0 HG22 VAL A 30 2.556 -4.986 5.033 1.00 0.00 H new ATOM 0 HG23 VAL A 30 2.044 -3.500 4.199 1.00 0.00 H new ATOM 470 N LYS A 31 0.437 -7.695 1.763 1.00 0.00 N ATOM 471 CA LYS A 31 -0.361 -8.538 0.868 1.00 0.00 C ATOM 472 C LYS A 31 -1.630 -9.003 1.579 1.00 0.00 C ATOM 473 O LYS A 31 -1.960 -8.509 2.657 1.00 0.00 O ATOM 474 CB LYS A 31 0.497 -9.711 0.373 1.00 0.00 C ATOM 475 CG LYS A 31 1.708 -9.247 -0.437 1.00 0.00 C ATOM 476 CD LYS A 31 2.289 -10.356 -1.338 1.00 0.00 C ATOM 477 CE LYS A 31 1.813 -10.184 -2.784 1.00 0.00 C ATOM 478 NZ LYS A 31 2.322 -11.222 -3.705 1.00 0.00 N ATOM 0 H LYS A 31 0.686 -8.161 2.635 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.676 -7.967 -0.005 1.00 0.00 H new ATOM 0 HB2 LYS A 31 0.838 -10.295 1.228 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.115 -10.372 -0.240 1.00 0.00 H new ATOM 0 HG2 LYS A 31 1.421 -8.397 -1.056 1.00 0.00 H new ATOM 0 HG3 LYS A 31 2.483 -8.897 0.245 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.378 -10.327 -1.303 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.984 -11.333 -0.963 1.00 0.00 H new ATOM 0 HE2 LYS A 31 0.723 -10.197 -2.802 1.00 0.00 H new ATOM 0 HE3 LYS A 31 2.126 -9.205 -3.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 1.961 -11.043 -4.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 3.362 -11.196 -3.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.002 -12.158 -3.384 1.00 0.00 H new ATOM 492 N VAL A 32 -2.375 -9.919 0.956 1.00 0.00 N ATOM 493 CA VAL A 32 -3.429 -10.665 1.617 1.00 0.00 C ATOM 494 C VAL A 32 -3.663 -11.986 0.876 1.00 0.00 C ATOM 495 O VAL A 32 -3.697 -12.029 -0.360 1.00 0.00 O ATOM 496 CB VAL A 32 -4.694 -9.788 1.744 1.00 0.00 C ATOM 497 CG1 VAL A 32 -5.177 -9.250 0.387 1.00 0.00 C ATOM 498 CG2 VAL A 32 -5.837 -10.483 2.507 1.00 0.00 C ATOM 0 H VAL A 32 -2.257 -10.160 -0.028 1.00 0.00 H new ATOM 0 HA VAL A 32 -3.138 -10.926 2.634 1.00 0.00 H new ATOM 0 HB VAL A 32 -4.390 -8.931 2.345 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -6.068 -8.640 0.534 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -4.392 -8.643 -0.064 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -5.413 -10.085 -0.272 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -6.697 -9.815 2.562 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -6.120 -11.397 1.985 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -5.504 -10.730 3.515 1.00 0.00 H new ATOM 508 N LYS A 33 -3.821 -13.076 1.625 1.00 0.00 N ATOM 509 CA LYS A 33 -4.087 -14.435 1.167 1.00 0.00 C ATOM 510 C LYS A 33 -5.073 -15.021 2.164 1.00 0.00 C ATOM 511 O LYS A 33 -4.766 -15.021 3.351 1.00 0.00 O ATOM 512 CB LYS A 33 -2.762 -15.235 1.170 1.00 0.00 C ATOM 513 CG LYS A 33 -2.805 -16.757 0.939 1.00 0.00 C ATOM 514 CD LYS A 33 -3.166 -17.207 -0.483 1.00 0.00 C ATOM 515 CE LYS A 33 -4.665 -17.030 -0.704 1.00 0.00 C ATOM 516 NZ LYS A 33 -5.179 -17.681 -1.919 1.00 0.00 N ATOM 0 H LYS A 33 -3.762 -13.027 2.642 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.492 -14.465 0.156 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -2.117 -14.805 0.404 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.276 -15.062 2.130 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -1.830 -17.172 1.194 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.527 -17.190 1.631 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.608 -16.622 -1.214 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -2.886 -18.250 -0.628 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -5.197 -17.428 0.160 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -4.890 -15.965 -0.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.203 -17.514 -1.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.700 -17.286 -2.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -4.998 -18.704 -1.868 1.00 0.00 H new ATOM 530 N ASN A 34 -6.210 -15.556 1.712 1.00 0.00 N ATOM 531 CA ASN A 34 -7.194 -16.239 2.561 1.00 0.00 C ATOM 532 C ASN A 34 -7.607 -15.362 3.755 1.00 0.00 C ATOM 533 O ASN A 34 -7.714 -15.844 4.882 1.00 0.00 O ATOM 534 CB ASN A 34 -6.670 -17.611 3.043 1.00 0.00 C ATOM 535 CG ASN A 34 -6.318 -18.617 1.963 1.00 0.00 C ATOM 536 OD1 ASN A 34 -6.973 -18.705 0.926 1.00 0.00 O ATOM 537 ND2 ASN A 34 -5.254 -19.376 2.148 1.00 0.00 N ATOM 0 H ASN A 34 -6.479 -15.527 0.729 1.00 0.00 H new ATOM 0 HA ASN A 34 -8.080 -16.416 1.951 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -5.784 -17.442 3.655 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -7.425 -18.056 3.691 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -4.970 -20.041 1.428 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -4.715 -19.298 3.011 1.00 0.00 H new ATOM 544 N ASN A 35 -7.828 -14.064 3.525 1.00 0.00 N ATOM 545 CA ASN A 35 -8.178 -13.044 4.523 1.00 0.00 C ATOM 546 C ASN A 35 -7.069 -12.782 5.555 1.00 0.00 C ATOM 547 O ASN A 35 -7.320 -12.098 6.543 1.00 0.00 O ATOM 548 CB ASN A 35 -9.509 -13.393 5.220 1.00 0.00 C ATOM 549 CG ASN A 35 -10.349 -12.182 5.628 1.00 0.00 C ATOM 550 OD1 ASN A 35 -11.383 -11.894 5.027 1.00 0.00 O ATOM 551 ND2 ASN A 35 -9.965 -11.460 6.663 1.00 0.00 N ATOM 0 H ASN A 35 -7.764 -13.673 2.585 1.00 0.00 H new ATOM 0 HA ASN A 35 -8.298 -12.112 3.971 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -10.100 -14.021 4.553 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -9.294 -13.986 6.109 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -10.525 -10.663 6.965 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -9.108 -11.699 7.161 1.00 0.00 H new ATOM 558 N ALA A 36 -5.862 -13.321 5.374 1.00 0.00 N ATOM 559 CA ALA A 36 -4.725 -13.121 6.260 1.00 0.00 C ATOM 560 C ALA A 36 -3.661 -12.301 5.530 1.00 0.00 C ATOM 561 O ALA A 36 -3.732 -12.183 4.311 1.00 0.00 O ATOM 562 CB ALA A 36 -4.155 -14.481 6.660 1.00 0.00 C ATOM 0 H ALA A 36 -5.647 -13.926 4.582 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.038 -12.587 7.157 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.303 -14.337 7.324 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -4.922 -15.060 7.174 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.833 -15.017 5.767 1.00 0.00 H new ATOM 568 N ILE A 37 -2.644 -11.794 6.231 1.00 0.00 N ATOM 569 CA ILE A 37 -1.631 -10.859 5.713 1.00 0.00 C ATOM 570 C ILE A 37 -0.855 -11.399 4.503 1.00 0.00 C ATOM 571 O ILE A 37 -0.396 -10.621 3.674 1.00 0.00 O ATOM 572 CB ILE A 37 -0.702 -10.447 6.893 1.00 0.00 C ATOM 573 CG1 ILE A 37 -1.232 -9.192 7.614 1.00 0.00 C ATOM 574 CG2 ILE A 37 0.771 -10.172 6.529 1.00 0.00 C ATOM 575 CD1 ILE A 37 -2.615 -9.338 8.254 1.00 0.00 C ATOM 0 H ILE A 37 -2.494 -12.030 7.212 1.00 0.00 H new ATOM 0 HA ILE A 37 -2.137 -9.977 5.320 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.720 -11.330 7.531 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.519 -8.911 8.389 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.266 -8.370 6.899 1.00 0.00 H new ATOM 0 HG21 ILE A 37 1.322 -9.894 7.427 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.212 -11.070 6.096 1.00 0.00 H new ATOM 0 HG23 ILE A 37 0.821 -9.358 5.806 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -2.894 -8.400 8.734 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.347 -9.584 7.485 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.589 -10.134 8.999 1.00 0.00 H new ATOM 587 N ALA A 38 -0.733 -12.715 4.353 1.00 0.00 N ATOM 588 CA ALA A 38 0.162 -13.427 3.437 1.00 0.00 C ATOM 589 C ALA A 38 1.660 -13.127 3.593 1.00 0.00 C ATOM 590 O ALA A 38 2.467 -14.057 3.609 1.00 0.00 O ATOM 591 CB ALA A 38 -0.239 -13.191 1.978 1.00 0.00 C ATOM 0 H ALA A 38 -1.296 -13.361 4.907 1.00 0.00 H new ATOM 0 HA ALA A 38 0.033 -14.472 3.720 1.00 0.00 H new ATOM 0 HB1 ALA A 38 0.443 -13.731 1.321 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -1.256 -13.548 1.818 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -0.189 -12.125 1.755 1.00 0.00 H new ATOM 597 N ASP A 39 2.047 -11.854 3.532 1.00 0.00 N ATOM 598 CA ASP A 39 3.389 -11.397 3.196 1.00 0.00 C ATOM 599 C ASP A 39 3.479 -9.896 3.464 1.00 0.00 C ATOM 600 O ASP A 39 2.461 -9.194 3.434 1.00 0.00 O ATOM 601 CB ASP A 39 3.596 -11.614 1.691 1.00 0.00 C ATOM 602 CG ASP A 39 5.041 -11.784 1.260 1.00 0.00 C ATOM 603 OD1 ASP A 39 5.827 -10.827 1.389 1.00 0.00 O ATOM 604 OD2 ASP A 39 5.325 -12.872 0.708 1.00 0.00 O ATOM 0 H ASP A 39 1.406 -11.084 3.724 1.00 0.00 H new ATOM 0 HA ASP A 39 4.132 -11.936 3.783 1.00 0.00 H new ATOM 0 HB2 ASP A 39 3.035 -12.498 1.386 1.00 0.00 H new ATOM 0 HB3 ASP A 39 3.170 -10.766 1.155 1.00 0.00 H new ATOM 609 N ILE A 40 4.691 -9.384 3.652 1.00 0.00 N ATOM 610 CA ILE A 40 4.999 -7.966 3.745 1.00 0.00 C ATOM 611 C ILE A 40 6.290 -7.712 2.968 1.00 0.00 C ATOM 612 O ILE A 40 7.260 -8.458 3.092 1.00 0.00 O ATOM 613 CB ILE A 40 5.076 -7.520 5.230 1.00 0.00 C ATOM 614 CG1 ILE A 40 3.656 -7.536 5.836 1.00 0.00 C ATOM 615 CG2 ILE A 40 5.742 -6.142 5.377 1.00 0.00 C ATOM 616 CD1 ILE A 40 3.506 -6.849 7.193 1.00 0.00 C ATOM 0 H ILE A 40 5.518 -9.973 3.747 1.00 0.00 H new ATOM 0 HA ILE A 40 4.208 -7.362 3.300 1.00 0.00 H new ATOM 0 HB ILE A 40 5.704 -8.221 5.779 1.00 0.00 H new ATOM 0 HG12 ILE A 40 2.975 -7.059 5.131 1.00 0.00 H new ATOM 0 HG13 ILE A 40 3.336 -8.573 5.937 1.00 0.00 H new ATOM 0 HG21 ILE A 40 5.777 -5.865 6.431 1.00 0.00 H new ATOM 0 HG22 ILE A 40 6.756 -6.184 4.979 1.00 0.00 H new ATOM 0 HG23 ILE A 40 5.166 -5.399 4.826 1.00 0.00 H new ATOM 0 HD11 ILE A 40 2.470 -6.920 7.524 1.00 0.00 H new ATOM 0 HD12 ILE A 40 4.154 -7.337 7.921 1.00 0.00 H new ATOM 0 HD13 ILE A 40 3.787 -5.800 7.103 1.00 0.00 H new ATOM 628 N SER A 41 6.290 -6.612 2.218 1.00 0.00 N ATOM 629 CA SER A 41 7.439 -5.901 1.699 1.00 0.00 C ATOM 630 C SER A 41 7.483 -4.573 2.452 1.00 0.00 C ATOM 631 O SER A 41 6.421 -4.009 2.725 1.00 0.00 O ATOM 632 CB SER A 41 7.185 -5.630 0.215 1.00 0.00 C ATOM 633 OG SER A 41 7.298 -6.813 -0.546 1.00 0.00 O ATOM 0 H SER A 41 5.415 -6.167 1.940 1.00 0.00 H new ATOM 0 HA SER A 41 8.370 -6.456 1.817 1.00 0.00 H new ATOM 0 HB2 SER A 41 6.190 -5.205 0.085 1.00 0.00 H new ATOM 0 HB3 SER A 41 7.898 -4.890 -0.150 1.00 0.00 H new ATOM 0 HG SER A 41 7.129 -6.612 -1.490 1.00 0.00 H new ATOM 639 N VAL A 42 8.667 -4.048 2.759 1.00 0.00 N ATOM 640 CA VAL A 42 8.878 -2.684 3.242 1.00 0.00 C ATOM 641 C VAL A 42 10.155 -2.209 2.553 1.00 0.00 C ATOM 642 O VAL A 42 11.191 -1.975 3.168 1.00 0.00 O ATOM 643 CB VAL A 42 8.888 -2.600 4.791 1.00 0.00 C ATOM 644 CG1 VAL A 42 8.860 -1.182 5.379 1.00 0.00 C ATOM 645 CG2 VAL A 42 7.779 -3.390 5.487 1.00 0.00 C ATOM 0 H VAL A 42 9.535 -4.577 2.676 1.00 0.00 H new ATOM 0 HA VAL A 42 8.056 -2.016 2.987 1.00 0.00 H new ATOM 0 HB VAL A 42 9.856 -3.056 4.998 1.00 0.00 H new ATOM 0 HG11 VAL A 42 8.870 -1.239 6.467 1.00 0.00 H new ATOM 0 HG12 VAL A 42 9.735 -0.629 5.037 1.00 0.00 H new ATOM 0 HG13 VAL A 42 7.956 -0.670 5.051 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.869 -3.270 6.567 1.00 0.00 H new ATOM 0 HG22 VAL A 42 6.808 -3.019 5.160 1.00 0.00 H new ATOM 0 HG23 VAL A 42 7.869 -4.446 5.231 1.00 0.00 H new ATOM 655 N GLU A 43 10.052 -2.025 1.238 1.00 0.00 N ATOM 656 CA GLU A 43 11.159 -1.651 0.370 1.00 0.00 C ATOM 657 C GLU A 43 11.347 -0.139 0.524 1.00 0.00 C ATOM 658 O GLU A 43 10.358 0.599 0.578 1.00 0.00 O ATOM 659 CB GLU A 43 10.788 -1.959 -1.092 1.00 0.00 C ATOM 660 CG GLU A 43 10.249 -3.370 -1.392 1.00 0.00 C ATOM 661 CD GLU A 43 11.313 -4.463 -1.462 1.00 0.00 C ATOM 662 OE1 GLU A 43 12.069 -4.465 -2.458 1.00 0.00 O ATOM 663 OE2 GLU A 43 11.294 -5.380 -0.602 1.00 0.00 O ATOM 0 H GLU A 43 9.171 -2.136 0.737 1.00 0.00 H new ATOM 0 HA GLU A 43 12.065 -2.198 0.631 1.00 0.00 H new ATOM 0 HB2 GLU A 43 10.039 -1.235 -1.412 1.00 0.00 H new ATOM 0 HB3 GLU A 43 11.672 -1.796 -1.708 1.00 0.00 H new ATOM 0 HG2 GLU A 43 9.524 -3.637 -0.623 1.00 0.00 H new ATOM 0 HG3 GLU A 43 9.712 -3.344 -2.340 1.00 0.00 H new ATOM 670 N GLU A 44 12.577 0.347 0.636 1.00 0.00 N ATOM 671 CA GLU A 44 12.873 1.770 0.776 1.00 0.00 C ATOM 672 C GLU A 44 12.495 2.472 -0.530 1.00 0.00 C ATOM 673 O GLU A 44 12.563 1.859 -1.604 1.00 0.00 O ATOM 674 CB GLU A 44 14.370 1.994 1.075 1.00 0.00 C ATOM 675 CG GLU A 44 15.002 1.018 2.082 1.00 0.00 C ATOM 676 CD GLU A 44 15.558 -0.280 1.475 1.00 0.00 C ATOM 677 OE1 GLU A 44 15.081 -0.744 0.410 1.00 0.00 O ATOM 678 OE2 GLU A 44 16.488 -0.849 2.086 1.00 0.00 O ATOM 0 H GLU A 44 13.409 -0.243 0.632 1.00 0.00 H new ATOM 0 HA GLU A 44 12.300 2.178 1.608 1.00 0.00 H new ATOM 0 HB2 GLU A 44 14.923 1.929 0.138 1.00 0.00 H new ATOM 0 HB3 GLU A 44 14.499 3.009 1.451 1.00 0.00 H new ATOM 0 HG2 GLU A 44 15.810 1.532 2.603 1.00 0.00 H new ATOM 0 HG3 GLU A 44 14.254 0.759 2.831 1.00 0.00 H new ATOM 685 N ASN A 45 12.099 3.743 -0.470 1.00 0.00 N ATOM 686 CA ASN A 45 11.751 4.509 -1.661 1.00 0.00 C ATOM 687 C ASN A 45 13.012 5.185 -2.212 1.00 0.00 C ATOM 688 O ASN A 45 13.456 6.181 -1.626 1.00 0.00 O ATOM 689 CB ASN A 45 10.679 5.549 -1.325 1.00 0.00 C ATOM 690 CG ASN A 45 10.305 6.414 -2.525 1.00 0.00 C ATOM 691 OD1 ASN A 45 10.690 6.185 -3.669 1.00 0.00 O ATOM 692 ND2 ASN A 45 9.523 7.440 -2.272 1.00 0.00 N ATOM 0 H ASN A 45 12.011 4.266 0.401 1.00 0.00 H new ATOM 0 HA ASN A 45 11.346 3.841 -2.421 1.00 0.00 H new ATOM 0 HB2 ASN A 45 9.788 5.041 -0.956 1.00 0.00 H new ATOM 0 HB3 ASN A 45 11.038 6.188 -0.519 1.00 0.00 H new ATOM 0 HD21 ASN A 45 9.229 8.056 -3.030 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.210 7.620 -1.318 1.00 0.00 H new ATOM 699 N PRO A 46 13.577 4.735 -3.349 1.00 0.00 N ATOM 700 CA PRO A 46 14.798 5.322 -3.896 1.00 0.00 C ATOM 701 C PRO A 46 14.578 6.760 -4.385 1.00 0.00 C ATOM 702 O PRO A 46 15.542 7.456 -4.722 1.00 0.00 O ATOM 703 CB PRO A 46 15.224 4.394 -5.038 1.00 0.00 C ATOM 704 CG PRO A 46 13.905 3.793 -5.521 1.00 0.00 C ATOM 705 CD PRO A 46 13.052 3.719 -4.257 1.00 0.00 C ATOM 0 HA PRO A 46 15.573 5.400 -3.133 1.00 0.00 H new ATOM 0 HB2 PRO A 46 15.730 4.942 -5.833 1.00 0.00 H new ATOM 0 HB3 PRO A 46 15.914 3.624 -4.693 1.00 0.00 H new ATOM 0 HG2 PRO A 46 13.437 4.416 -6.283 1.00 0.00 H new ATOM 0 HG3 PRO A 46 14.053 2.807 -5.962 1.00 0.00 H new ATOM 0 HD2 PRO A 46 12.002 3.906 -4.485 1.00 0.00 H new ATOM 0 HD3 PRO A 46 13.109 2.728 -3.807 1.00 0.00 H new ATOM 713 N LEU A 47 13.327 7.237 -4.427 1.00 0.00 N ATOM 714 CA LEU A 47 12.962 8.519 -5.009 1.00 0.00 C ATOM 715 C LEU A 47 12.128 9.328 -4.003 1.00 0.00 C ATOM 716 O LEU A 47 11.265 10.130 -4.382 1.00 0.00 O ATOM 717 CB LEU A 47 12.164 8.208 -6.255 1.00 0.00 C ATOM 718 CG LEU A 47 12.996 7.462 -7.308 1.00 0.00 C ATOM 719 CD1 LEU A 47 11.999 6.676 -8.121 1.00 0.00 C ATOM 720 CD2 LEU A 47 13.884 8.413 -8.114 1.00 0.00 C ATOM 0 H LEU A 47 12.530 6.726 -4.048 1.00 0.00 H new ATOM 0 HA LEU A 47 13.838 9.119 -5.256 1.00 0.00 H new ATOM 0 HB2 LEU A 47 11.296 7.605 -5.987 1.00 0.00 H new ATOM 0 HB3 LEU A 47 11.787 9.137 -6.684 1.00 0.00 H new ATOM 0 HG LEU A 47 13.722 6.780 -6.865 1.00 0.00 H new ATOM 0 HD11 LEU A 47 12.522 6.116 -8.896 1.00 0.00 H new ATOM 0 HD12 LEU A 47 11.465 5.983 -7.471 1.00 0.00 H new ATOM 0 HD13 LEU A 47 11.288 7.360 -8.585 1.00 0.00 H new ATOM 0 HD21 LEU A 47 14.455 7.844 -8.847 1.00 0.00 H new ATOM 0 HD22 LEU A 47 13.261 9.145 -8.628 1.00 0.00 H new ATOM 0 HD23 LEU A 47 14.569 8.929 -7.441 1.00 0.00 H new ATOM 732 N ALA A 48 12.483 9.233 -2.721 1.00 0.00 N ATOM 733 CA ALA A 48 11.880 9.952 -1.607 1.00 0.00 C ATOM 734 C ALA A 48 12.324 11.412 -1.568 1.00 0.00 C ATOM 735 O ALA A 48 11.581 12.258 -1.056 1.00 0.00 O ATOM 736 CB ALA A 48 12.314 9.262 -0.314 1.00 0.00 C ATOM 0 H ALA A 48 13.240 8.619 -2.420 1.00 0.00 H new ATOM 0 HA ALA A 48 10.796 9.940 -1.724 1.00 0.00 H new ATOM 0 HB1 ALA A 48 11.876 9.780 0.539 1.00 0.00 H new ATOM 0 HB2 ALA A 48 11.975 8.226 -0.323 1.00 0.00 H new ATOM 0 HB3 ALA A 48 13.401 9.287 -0.235 1.00 0.00 H new ATOM 830 N ALA A 55 9.782 9.877 -11.269 1.00 0.00 N ATOM 831 CA ALA A 55 9.037 8.668 -11.643 1.00 0.00 C ATOM 832 C ALA A 55 8.704 7.700 -10.494 1.00 0.00 C ATOM 833 O ALA A 55 8.406 6.532 -10.741 1.00 0.00 O ATOM 834 CB ALA A 55 9.742 7.953 -12.789 1.00 0.00 C ATOM 0 HA ALA A 55 8.059 9.025 -11.966 1.00 0.00 H new ATOM 0 HB1 ALA A 55 9.182 7.058 -13.059 1.00 0.00 H new ATOM 0 HB2 ALA A 55 9.801 8.618 -13.651 1.00 0.00 H new ATOM 0 HB3 ALA A 55 10.748 7.671 -12.478 1.00 0.00 H new ATOM 840 N VAL A 56 8.597 8.218 -9.268 1.00 0.00 N ATOM 841 CA VAL A 56 8.139 7.534 -8.054 1.00 0.00 C ATOM 842 C VAL A 56 6.998 6.530 -8.344 1.00 0.00 C ATOM 843 O VAL A 56 7.095 5.391 -7.896 1.00 0.00 O ATOM 844 CB VAL A 56 7.700 8.615 -7.036 1.00 0.00 C ATOM 845 CG1 VAL A 56 6.552 8.267 -6.070 1.00 0.00 C ATOM 846 CG2 VAL A 56 8.905 9.183 -6.311 1.00 0.00 C ATOM 0 H VAL A 56 8.844 9.190 -9.084 1.00 0.00 H new ATOM 0 HA VAL A 56 8.955 6.940 -7.642 1.00 0.00 H new ATOM 0 HB VAL A 56 7.237 9.380 -7.659 1.00 0.00 H new ATOM 0 HG11 VAL A 56 6.355 9.118 -5.418 1.00 0.00 H new ATOM 0 HG12 VAL A 56 5.654 8.032 -6.642 1.00 0.00 H new ATOM 0 HG13 VAL A 56 6.834 7.404 -5.466 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.578 9.941 -5.600 1.00 0.00 H new ATOM 0 HG22 VAL A 56 9.419 8.383 -5.778 1.00 0.00 H new ATOM 0 HG23 VAL A 56 9.585 9.633 -7.034 1.00 0.00 H new ATOM 856 N PRO A 57 5.898 6.899 -9.042 1.00 0.00 N ATOM 857 CA PRO A 57 4.789 5.972 -9.221 1.00 0.00 C ATOM 858 C PRO A 57 5.094 4.889 -10.247 1.00 0.00 C ATOM 859 O PRO A 57 4.445 3.854 -10.184 1.00 0.00 O ATOM 860 CB PRO A 57 3.631 6.811 -9.749 1.00 0.00 C ATOM 861 CG PRO A 57 4.270 8.025 -10.410 1.00 0.00 C ATOM 862 CD PRO A 57 5.609 8.173 -9.700 1.00 0.00 C ATOM 0 HA PRO A 57 4.576 5.471 -8.276 1.00 0.00 H new ATOM 0 HB2 PRO A 57 3.032 6.246 -10.463 1.00 0.00 H new ATOM 0 HB3 PRO A 57 2.964 7.111 -8.941 1.00 0.00 H new ATOM 0 HG2 PRO A 57 4.402 7.872 -11.481 1.00 0.00 H new ATOM 0 HG3 PRO A 57 3.654 8.916 -10.288 1.00 0.00 H new ATOM 0 HD2 PRO A 57 6.395 8.424 -10.412 1.00 0.00 H new ATOM 0 HD3 PRO A 57 5.569 8.982 -8.970 1.00 0.00 H new ATOM 870 N ASN A 58 6.005 5.112 -11.200 1.00 0.00 N ATOM 871 CA ASN A 58 6.322 4.087 -12.184 1.00 0.00 C ATOM 872 C ASN A 58 7.043 2.933 -11.503 1.00 0.00 C ATOM 873 O ASN A 58 6.744 1.784 -11.803 1.00 0.00 O ATOM 874 CB ASN A 58 7.175 4.626 -13.336 1.00 0.00 C ATOM 875 CG ASN A 58 7.285 3.546 -14.401 1.00 0.00 C ATOM 876 OD1 ASN A 58 8.340 2.958 -14.595 1.00 0.00 O ATOM 877 ND2 ASN A 58 6.196 3.261 -15.094 1.00 0.00 N ATOM 0 H ASN A 58 6.526 5.982 -11.306 1.00 0.00 H new ATOM 0 HA ASN A 58 5.381 3.743 -12.614 1.00 0.00 H new ATOM 0 HB2 ASN A 58 6.723 5.525 -13.754 1.00 0.00 H new ATOM 0 HB3 ASN A 58 8.165 4.905 -12.976 1.00 0.00 H new ATOM 0 HD21 ASN A 58 6.223 2.536 -15.810 1.00 0.00 H new ATOM 0 HD22 ASN A 58 5.329 3.767 -14.912 1.00 0.00 H new ATOM 884 N PHE A 59 7.923 3.250 -10.543 1.00 0.00 N ATOM 885 CA PHE A 59 8.526 2.265 -9.658 1.00 0.00 C ATOM 886 C PHE A 59 7.429 1.443 -8.985 1.00 0.00 C ATOM 887 O PHE A 59 7.326 0.254 -9.263 1.00 0.00 O ATOM 888 CB PHE A 59 9.465 2.945 -8.651 1.00 0.00 C ATOM 889 CG PHE A 59 9.723 2.141 -7.389 1.00 0.00 C ATOM 890 CD1 PHE A 59 10.319 0.864 -7.456 1.00 0.00 C ATOM 891 CD2 PHE A 59 9.292 2.642 -6.146 1.00 0.00 C ATOM 892 CE1 PHE A 59 10.498 0.101 -6.288 1.00 0.00 C ATOM 893 CE2 PHE A 59 9.470 1.874 -4.987 1.00 0.00 C ATOM 894 CZ PHE A 59 10.084 0.612 -5.050 1.00 0.00 C ATOM 0 H PHE A 59 8.233 4.205 -10.364 1.00 0.00 H new ATOM 0 HA PHE A 59 9.143 1.577 -10.236 1.00 0.00 H new ATOM 0 HB2 PHE A 59 10.418 3.145 -9.140 1.00 0.00 H new ATOM 0 HB3 PHE A 59 9.041 3.910 -8.372 1.00 0.00 H new ATOM 0 HD1 PHE A 59 10.640 0.470 -8.409 1.00 0.00 H new ATOM 0 HD2 PHE A 59 8.826 3.614 -6.086 1.00 0.00 H new ATOM 0 HE1 PHE A 59 10.953 -0.877 -6.345 1.00 0.00 H new ATOM 0 HE2 PHE A 59 9.132 2.257 -4.035 1.00 0.00 H new ATOM 0 HZ PHE A 59 10.236 0.038 -4.148 1.00 0.00 H new ATOM 904 N VAL A 60 6.589 2.044 -8.130 1.00 0.00 N ATOM 905 CA VAL A 60 5.585 1.253 -7.420 1.00 0.00 C ATOM 906 C VAL A 60 4.624 0.540 -8.380 1.00 0.00 C ATOM 907 O VAL A 60 4.292 -0.591 -8.092 1.00 0.00 O ATOM 908 CB VAL A 60 4.853 2.037 -6.318 1.00 0.00 C ATOM 909 CG1 VAL A 60 5.662 2.122 -5.005 1.00 0.00 C ATOM 910 CG2 VAL A 60 4.452 3.440 -6.735 1.00 0.00 C ATOM 0 H VAL A 60 6.585 3.042 -7.920 1.00 0.00 H new ATOM 0 HA VAL A 60 6.138 0.474 -6.895 1.00 0.00 H new ATOM 0 HB VAL A 60 3.946 1.458 -6.144 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.095 2.687 -4.264 1.00 0.00 H new ATOM 0 HG12 VAL A 60 5.851 1.117 -4.628 1.00 0.00 H new ATOM 0 HG13 VAL A 60 6.611 2.623 -5.194 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.941 3.933 -5.908 1.00 0.00 H new ATOM 0 HG22 VAL A 60 5.343 4.009 -7.002 1.00 0.00 H new ATOM 0 HG23 VAL A 60 3.784 3.387 -7.595 1.00 0.00 H new ATOM 920 N LYS A 61 4.204 1.108 -9.512 1.00 0.00 N ATOM 921 CA LYS A 61 3.418 0.460 -10.585 1.00 0.00 C ATOM 922 C LYS A 61 4.093 -0.768 -11.209 1.00 0.00 C ATOM 923 O LYS A 61 3.430 -1.558 -11.873 1.00 0.00 O ATOM 924 CB LYS A 61 3.059 1.486 -11.682 1.00 0.00 C ATOM 925 CG LYS A 61 1.886 1.053 -12.585 1.00 0.00 C ATOM 926 CD LYS A 61 2.176 0.919 -14.079 1.00 0.00 C ATOM 927 CE LYS A 61 2.412 2.267 -14.759 1.00 0.00 C ATOM 928 NZ LYS A 61 2.542 2.096 -16.218 1.00 0.00 N ATOM 0 H LYS A 61 4.410 2.084 -9.724 1.00 0.00 H new ATOM 0 HA LYS A 61 2.512 0.090 -10.105 1.00 0.00 H new ATOM 0 HB2 LYS A 61 2.809 2.436 -11.209 1.00 0.00 H new ATOM 0 HB3 LYS A 61 3.937 1.661 -12.303 1.00 0.00 H new ATOM 0 HG2 LYS A 61 1.516 0.093 -12.224 1.00 0.00 H new ATOM 0 HG3 LYS A 61 1.078 1.773 -12.460 1.00 0.00 H new ATOM 0 HD2 LYS A 61 3.054 0.288 -14.219 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.340 0.414 -14.563 1.00 0.00 H new ATOM 0 HE2 LYS A 61 1.585 2.941 -14.539 1.00 0.00 H new ATOM 0 HE3 LYS A 61 3.315 2.729 -14.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.702 3.022 -16.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 3.346 1.469 -16.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 1.670 1.676 -16.597 1.00 0.00 H new ATOM 942 N GLU A 62 5.394 -0.958 -11.039 1.00 0.00 N ATOM 943 CA GLU A 62 6.058 -2.219 -11.364 1.00 0.00 C ATOM 944 C GLU A 62 5.795 -3.259 -10.264 1.00 0.00 C ATOM 945 O GLU A 62 5.790 -4.462 -10.522 1.00 0.00 O ATOM 946 CB GLU A 62 7.547 -1.937 -11.659 1.00 0.00 C ATOM 947 CG GLU A 62 8.593 -2.503 -10.683 1.00 0.00 C ATOM 948 CD GLU A 62 9.320 -3.732 -11.239 1.00 0.00 C ATOM 949 OE1 GLU A 62 8.690 -4.606 -11.874 1.00 0.00 O ATOM 950 OE2 GLU A 62 10.566 -3.747 -11.108 1.00 0.00 O ATOM 0 H GLU A 62 6.022 -0.243 -10.672 1.00 0.00 H new ATOM 0 HA GLU A 62 5.647 -2.666 -12.270 1.00 0.00 H new ATOM 0 HB2 GLU A 62 7.771 -2.326 -12.652 1.00 0.00 H new ATOM 0 HB3 GLU A 62 7.681 -0.856 -11.703 1.00 0.00 H new ATOM 0 HG2 GLU A 62 9.324 -1.728 -10.451 1.00 0.00 H new ATOM 0 HG3 GLU A 62 8.103 -2.769 -9.747 1.00 0.00 H new ATOM 957 N LYS A 63 5.531 -2.822 -9.031 1.00 0.00 N ATOM 958 CA LYS A 63 5.415 -3.667 -7.847 1.00 0.00 C ATOM 959 C LYS A 63 3.998 -4.247 -7.716 1.00 0.00 C ATOM 960 O LYS A 63 3.503 -4.414 -6.602 1.00 0.00 O ATOM 961 CB LYS A 63 5.792 -2.857 -6.591 1.00 0.00 C ATOM 962 CG LYS A 63 7.094 -2.041 -6.639 1.00 0.00 C ATOM 963 CD LYS A 63 8.382 -2.860 -6.683 1.00 0.00 C ATOM 964 CE LYS A 63 8.668 -3.505 -5.325 1.00 0.00 C ATOM 965 NZ LYS A 63 10.018 -4.109 -5.268 1.00 0.00 N ATOM 0 H LYS A 63 5.387 -1.833 -8.825 1.00 0.00 H new ATOM 0 HA LYS A 63 6.104 -4.505 -7.949 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.973 -2.171 -6.374 1.00 0.00 H new ATOM 0 HB3 LYS A 63 5.859 -3.549 -5.752 1.00 0.00 H new ATOM 0 HG2 LYS A 63 7.065 -1.395 -7.516 1.00 0.00 H new ATOM 0 HG3 LYS A 63 7.127 -1.391 -5.765 1.00 0.00 H new ATOM 0 HD2 LYS A 63 8.300 -3.633 -7.447 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.216 -2.218 -6.968 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.574 -2.754 -4.541 1.00 0.00 H new ATOM 0 HE3 LYS A 63 7.920 -4.272 -5.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 10.169 -4.534 -4.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 10.101 -4.844 -5.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 10.735 -3.374 -5.434 1.00 0.00 H new ATOM 979 N GLY A 64 3.382 -4.612 -8.842 1.00 0.00 N ATOM 980 CA GLY A 64 2.187 -5.439 -8.993 1.00 0.00 C ATOM 981 C GLY A 64 0.992 -5.158 -8.072 1.00 0.00 C ATOM 982 O GLY A 64 0.251 -6.101 -7.787 1.00 0.00 O ATOM 0 H GLY A 64 3.739 -4.310 -9.748 1.00 0.00 H new ATOM 0 HA2 GLY A 64 1.844 -5.344 -10.023 1.00 0.00 H new ATOM 0 HA3 GLY A 64 2.481 -6.479 -8.850 1.00 0.00 H new ATOM 986 N ALA A 65 0.814 -3.935 -7.567 1.00 0.00 N ATOM 987 CA ALA A 65 -0.183 -3.613 -6.553 1.00 0.00 C ATOM 988 C ALA A 65 -1.639 -3.641 -7.036 1.00 0.00 C ATOM 989 O ALA A 65 -1.916 -3.700 -8.230 1.00 0.00 O ATOM 990 CB ALA A 65 0.148 -2.251 -5.945 1.00 0.00 C ATOM 0 H ALA A 65 1.369 -3.130 -7.858 1.00 0.00 H new ATOM 0 HA ALA A 65 -0.124 -4.407 -5.808 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -0.593 -2.002 -5.185 1.00 0.00 H new ATOM 0 HB2 ALA A 65 1.137 -2.287 -5.489 1.00 0.00 H new ATOM 0 HB3 ALA A 65 0.136 -1.491 -6.726 1.00 0.00 H new ATOM 996 N GLU A 66 -2.570 -3.529 -6.076 1.00 0.00 N ATOM 997 CA GLU A 66 -4.026 -3.528 -6.279 1.00 0.00 C ATOM 998 C GLU A 66 -4.745 -2.592 -5.293 1.00 0.00 C ATOM 999 O GLU A 66 -5.829 -2.085 -5.599 1.00 0.00 O ATOM 1000 CB GLU A 66 -4.553 -4.950 -6.080 1.00 0.00 C ATOM 1001 CG GLU A 66 -4.546 -5.770 -7.369 1.00 0.00 C ATOM 1002 CD GLU A 66 -4.724 -7.243 -7.014 1.00 0.00 C ATOM 1003 OE1 GLU A 66 -5.743 -7.596 -6.376 1.00 0.00 O ATOM 1004 OE2 GLU A 66 -3.767 -8.035 -7.132 1.00 0.00 O ATOM 0 H GLU A 66 -2.316 -3.432 -5.093 1.00 0.00 H new ATOM 0 HA GLU A 66 -4.224 -3.170 -7.289 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.945 -5.456 -5.330 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.570 -4.904 -5.689 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -5.348 -5.441 -8.030 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -3.609 -5.621 -7.906 1.00 0.00 H new ATOM 1011 N LEU A 67 -4.162 -2.361 -4.109 1.00 0.00 N ATOM 1012 CA LEU A 67 -4.682 -1.485 -3.071 1.00 0.00 C ATOM 1013 C LEU A 67 -3.555 -0.576 -2.586 1.00 0.00 C ATOM 1014 O LEU A 67 -2.372 -0.927 -2.646 1.00 0.00 O ATOM 1015 CB LEU A 67 -5.235 -2.322 -1.895 1.00 0.00 C ATOM 1016 CG LEU A 67 -6.192 -1.552 -0.966 1.00 0.00 C ATOM 1017 CD1 LEU A 67 -7.602 -1.540 -1.550 1.00 0.00 C ATOM 1018 CD2 LEU A 67 -6.230 -2.158 0.426 1.00 0.00 C ATOM 0 H LEU A 67 -3.280 -2.801 -3.846 1.00 0.00 H new ATOM 0 HA LEU A 67 -5.495 -0.881 -3.473 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -5.757 -3.191 -2.296 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -4.398 -2.697 -1.306 1.00 0.00 H new ATOM 0 HG LEU A 67 -5.817 -0.532 -0.887 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -8.268 -0.992 -0.883 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -7.587 -1.055 -2.526 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -7.959 -2.564 -1.659 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -6.916 -1.588 1.053 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -6.570 -3.192 0.364 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -5.232 -2.130 0.862 1.00 0.00 H new ATOM 1030 N VAL A 68 -3.927 0.568 -2.031 1.00 0.00 N ATOM 1031 CA VAL A 68 -3.072 1.510 -1.330 1.00 0.00 C ATOM 1032 C VAL A 68 -3.918 2.048 -0.174 1.00 0.00 C ATOM 1033 O VAL A 68 -5.135 2.204 -0.328 1.00 0.00 O ATOM 1034 CB VAL A 68 -2.620 2.648 -2.279 1.00 0.00 C ATOM 1035 CG1 VAL A 68 -1.338 3.345 -1.811 1.00 0.00 C ATOM 1036 CG2 VAL A 68 -2.366 2.178 -3.715 1.00 0.00 C ATOM 0 H VAL A 68 -4.897 0.882 -2.061 1.00 0.00 H new ATOM 0 HA VAL A 68 -2.159 1.040 -0.965 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.460 3.342 -2.256 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -1.073 4.132 -2.517 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -1.500 3.781 -0.825 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.528 2.618 -1.757 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -2.053 3.025 -4.325 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -1.582 1.420 -3.717 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.282 1.754 -4.126 1.00 0.00 H new ATOM 1046 N ILE A 69 -3.294 2.352 0.958 1.00 0.00 N ATOM 1047 CA ILE A 69 -3.904 2.989 2.112 1.00 0.00 C ATOM 1048 C ILE A 69 -2.959 4.134 2.463 1.00 0.00 C ATOM 1049 O ILE A 69 -1.794 3.907 2.793 1.00 0.00 O ATOM 1050 CB ILE A 69 -4.108 1.989 3.272 1.00 0.00 C ATOM 1051 CG1 ILE A 69 -5.018 0.798 2.881 1.00 0.00 C ATOM 1052 CG2 ILE A 69 -4.692 2.734 4.484 1.00 0.00 C ATOM 1053 CD1 ILE A 69 -4.945 -0.375 3.870 1.00 0.00 C ATOM 0 H ILE A 69 -2.304 2.151 1.100 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.908 3.360 1.906 1.00 0.00 H new ATOM 0 HB ILE A 69 -3.135 1.566 3.523 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.049 1.145 2.815 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -4.736 0.445 1.889 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -4.838 2.033 5.306 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -4.003 3.519 4.795 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -5.649 3.178 4.211 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.606 -1.174 3.536 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -3.922 -0.747 3.918 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.255 -0.037 4.859 1.00 0.00 H new ATOM 1065 N VAL A 70 -3.429 5.368 2.309 1.00 0.00 N ATOM 1066 CA VAL A 70 -2.645 6.577 2.504 1.00 0.00 C ATOM 1067 C VAL A 70 -3.394 7.527 3.439 1.00 0.00 C ATOM 1068 O VAL A 70 -4.515 7.260 3.881 1.00 0.00 O ATOM 1069 CB VAL A 70 -2.287 7.208 1.136 1.00 0.00 C ATOM 1070 CG1 VAL A 70 -1.415 6.275 0.290 1.00 0.00 C ATOM 1071 CG2 VAL A 70 -3.510 7.580 0.292 1.00 0.00 C ATOM 0 H VAL A 70 -4.394 5.557 2.037 1.00 0.00 H new ATOM 0 HA VAL A 70 -1.696 6.342 2.987 1.00 0.00 H new ATOM 0 HB VAL A 70 -1.746 8.118 1.395 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -1.186 6.755 -0.662 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -0.488 6.062 0.822 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -1.950 5.343 0.107 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -3.182 8.016 -0.652 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -4.100 6.686 0.093 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -4.119 8.303 0.834 1.00 0.00 H new ATOM 1081 N ARG A 71 -2.757 8.651 3.752 1.00 0.00 N ATOM 1082 CA ARG A 71 -3.276 9.687 4.623 1.00 0.00 C ATOM 1083 C ARG A 71 -3.526 10.918 3.745 1.00 0.00 C ATOM 1084 O ARG A 71 -4.590 10.989 3.129 1.00 0.00 O ATOM 1085 CB ARG A 71 -2.326 9.787 5.837 1.00 0.00 C ATOM 1086 CG ARG A 71 -2.788 10.782 6.905 1.00 0.00 C ATOM 1087 CD ARG A 71 -2.345 10.380 8.326 1.00 0.00 C ATOM 1088 NE ARG A 71 -3.324 10.898 9.284 1.00 0.00 N ATOM 1089 CZ ARG A 71 -3.212 11.855 10.206 1.00 0.00 C ATOM 1090 NH1 ARG A 71 -2.045 12.443 10.458 1.00 0.00 N ATOM 1091 NH2 ARG A 71 -4.309 12.212 10.856 1.00 0.00 N ATOM 0 H ARG A 71 -1.829 8.869 3.389 1.00 0.00 H new ATOM 0 HA ARG A 71 -4.245 9.504 5.087 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -2.227 8.801 6.291 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -1.335 10.078 5.488 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -2.391 11.770 6.671 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -3.875 10.860 6.876 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -2.273 9.295 8.407 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -1.355 10.782 8.542 1.00 0.00 H new ATOM 0 HE ARG A 71 -4.241 10.454 9.239 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -1.211 12.164 9.941 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -1.984 13.173 11.168 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -5.198 11.759 10.644 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -4.265 12.940 11.569 1.00 0.00 H new ATOM 1105 N GLY A 72 -2.555 11.819 3.592 1.00 0.00 N ATOM 1106 CA GLY A 72 -2.641 13.055 2.819 1.00 0.00 C ATOM 1107 C GLY A 72 -1.830 12.989 1.523 1.00 0.00 C ATOM 1108 O GLY A 72 -0.850 13.714 1.335 1.00 0.00 O ATOM 0 H GLY A 72 -1.640 11.698 4.027 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -3.685 13.260 2.581 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -2.283 13.886 3.427 1.00 0.00 H new ATOM 1112 N ILE A 73 -2.223 12.108 0.608 1.00 0.00 N ATOM 1113 CA ILE A 73 -1.702 12.006 -0.760 1.00 0.00 C ATOM 1114 C ILE A 73 -2.027 13.277 -1.597 1.00 0.00 C ATOM 1115 O ILE A 73 -2.713 14.179 -1.110 1.00 0.00 O ATOM 1116 CB ILE A 73 -2.271 10.696 -1.360 1.00 0.00 C ATOM 1117 CG1 ILE A 73 -1.723 10.343 -2.753 1.00 0.00 C ATOM 1118 CG2 ILE A 73 -3.808 10.721 -1.412 1.00 0.00 C ATOM 1119 CD1 ILE A 73 -1.806 8.847 -3.063 1.00 0.00 C ATOM 0 H ILE A 73 -2.944 11.414 0.804 1.00 0.00 H new ATOM 0 HA ILE A 73 -0.613 11.958 -0.768 1.00 0.00 H new ATOM 0 HB ILE A 73 -1.931 9.916 -0.679 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -2.280 10.897 -3.508 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -0.684 10.666 -2.822 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.173 9.787 -1.838 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -4.204 10.839 -0.403 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -4.138 11.555 -2.031 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -1.405 8.659 -4.059 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -1.226 8.290 -2.327 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -2.846 8.525 -3.024 1.00 0.00 H new ATOM 1131 N GLY A 74 -1.558 13.368 -2.851 1.00 0.00 N ATOM 1132 CA GLY A 74 -1.861 14.435 -3.812 1.00 0.00 C ATOM 1133 C GLY A 74 -2.279 13.855 -5.169 1.00 0.00 C ATOM 1134 O GLY A 74 -1.951 12.706 -5.471 1.00 0.00 O ATOM 0 H GLY A 74 -0.928 12.666 -3.239 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -2.660 15.065 -3.421 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -0.986 15.073 -3.940 1.00 0.00 H new ATOM 1138 N ARG A 75 -2.973 14.640 -6.008 1.00 0.00 N ATOM 1139 CA ARG A 75 -3.703 14.129 -7.180 1.00 0.00 C ATOM 1140 C ARG A 75 -2.815 13.412 -8.197 1.00 0.00 C ATOM 1141 O ARG A 75 -3.271 12.428 -8.770 1.00 0.00 O ATOM 1142 CB ARG A 75 -4.530 15.259 -7.829 1.00 0.00 C ATOM 1143 CG ARG A 75 -5.433 14.859 -9.020 1.00 0.00 C ATOM 1144 CD ARG A 75 -6.395 13.690 -8.732 1.00 0.00 C ATOM 1145 NE ARG A 75 -7.596 13.717 -9.589 1.00 0.00 N ATOM 1146 CZ ARG A 75 -7.867 12.984 -10.682 1.00 0.00 C ATOM 1147 NH1 ARG A 75 -6.990 12.121 -11.190 1.00 0.00 N ATOM 1148 NH2 ARG A 75 -9.038 13.153 -11.271 1.00 0.00 N ATOM 0 H ARG A 75 -3.044 15.651 -5.892 1.00 0.00 H new ATOM 0 HA ARG A 75 -4.384 13.360 -6.815 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -5.159 15.706 -7.059 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -3.842 16.033 -8.168 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -6.018 15.727 -9.323 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -4.799 14.591 -9.865 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -5.869 12.747 -8.880 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -6.699 13.724 -7.686 1.00 0.00 H new ATOM 0 HE ARG A 75 -8.319 14.382 -9.314 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -6.079 12.000 -10.748 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -7.229 11.581 -12.021 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -9.706 13.825 -10.894 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -9.273 12.611 -12.103 1.00 0.00 H new ATOM 1162 N ARG A 76 -1.559 13.831 -8.412 1.00 0.00 N ATOM 1163 CA ARG A 76 -0.657 13.102 -9.316 1.00 0.00 C ATOM 1164 C ARG A 76 -0.524 11.642 -8.889 1.00 0.00 C ATOM 1165 O ARG A 76 -0.494 10.752 -9.730 1.00 0.00 O ATOM 1166 CB ARG A 76 0.731 13.769 -9.369 1.00 0.00 C ATOM 1167 CG ARG A 76 1.656 13.094 -10.406 1.00 0.00 C ATOM 1168 CD ARG A 76 3.065 13.688 -10.404 1.00 0.00 C ATOM 1169 NE ARG A 76 3.806 13.349 -9.174 1.00 0.00 N ATOM 1170 CZ ARG A 76 4.581 14.167 -8.449 1.00 0.00 C ATOM 1171 NH1 ARG A 76 4.834 15.414 -8.819 1.00 0.00 N ATOM 1172 NH2 ARG A 76 5.117 13.707 -7.333 1.00 0.00 N ATOM 0 H ARG A 76 -1.149 14.659 -7.979 1.00 0.00 H new ATOM 0 HA ARG A 76 -1.092 13.134 -10.315 1.00 0.00 H new ATOM 0 HB2 ARG A 76 0.617 14.824 -9.617 1.00 0.00 H new ATOM 0 HB3 ARG A 76 1.195 13.721 -8.384 1.00 0.00 H new ATOM 0 HG2 ARG A 76 1.715 12.026 -10.196 1.00 0.00 H new ATOM 0 HG3 ARG A 76 1.221 13.200 -11.400 1.00 0.00 H new ATOM 0 HD2 ARG A 76 3.614 13.321 -11.271 1.00 0.00 H new ATOM 0 HD3 ARG A 76 3.002 14.772 -10.502 1.00 0.00 H new ATOM 0 HE ARG A 76 3.719 12.389 -8.840 1.00 0.00 H new ATOM 0 HH11 ARG A 76 4.434 15.781 -9.682 1.00 0.00 H new ATOM 0 HH12 ARG A 76 5.429 16.007 -8.240 1.00 0.00 H new ATOM 0 HH21 ARG A 76 4.938 12.747 -7.039 1.00 0.00 H new ATOM 0 HH22 ARG A 76 5.710 14.312 -6.765 1.00 0.00 H new ATOM 1186 N ALA A 77 -0.428 11.381 -7.586 1.00 0.00 N ATOM 1187 CA ALA A 77 -0.263 10.024 -7.103 1.00 0.00 C ATOM 1188 C ALA A 77 -1.564 9.225 -7.188 1.00 0.00 C ATOM 1189 O ALA A 77 -1.491 8.016 -7.353 1.00 0.00 O ATOM 1190 CB ALA A 77 0.308 10.055 -5.690 1.00 0.00 C ATOM 0 H ALA A 77 -0.462 12.091 -6.855 1.00 0.00 H new ATOM 0 HA ALA A 77 0.445 9.504 -7.749 1.00 0.00 H new ATOM 0 HB1 ALA A 77 0.433 9.035 -5.325 1.00 0.00 H new ATOM 0 HB2 ALA A 77 1.275 10.558 -5.699 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.375 10.594 -5.033 1.00 0.00 H new ATOM 1196 N ILE A 78 -2.737 9.865 -7.149 1.00 0.00 N ATOM 1197 CA ILE A 78 -3.991 9.197 -7.502 1.00 0.00 C ATOM 1198 C ILE A 78 -3.893 8.749 -8.964 1.00 0.00 C ATOM 1199 O ILE A 78 -4.141 7.584 -9.266 1.00 0.00 O ATOM 1200 CB ILE A 78 -5.204 10.111 -7.250 1.00 0.00 C ATOM 1201 CG1 ILE A 78 -5.230 10.655 -5.809 1.00 0.00 C ATOM 1202 CG2 ILE A 78 -6.534 9.418 -7.588 1.00 0.00 C ATOM 1203 CD1 ILE A 78 -5.349 9.603 -4.703 1.00 0.00 C ATOM 0 H ILE A 78 -2.843 10.842 -6.877 1.00 0.00 H new ATOM 0 HA ILE A 78 -4.144 8.323 -6.868 1.00 0.00 H new ATOM 0 HB ILE A 78 -5.089 10.958 -7.926 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -4.319 11.230 -5.641 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -6.066 11.348 -5.717 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -7.360 10.102 -7.394 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -6.538 9.133 -8.640 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -6.648 8.527 -6.970 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.358 10.096 -3.731 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -6.274 9.041 -4.833 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.500 8.922 -4.756 1.00 0.00 H new ATOM 1215 N ALA A 79 -3.470 9.652 -9.861 1.00 0.00 N ATOM 1216 CA ALA A 79 -3.345 9.366 -11.286 1.00 0.00 C ATOM 1217 C ALA A 79 -2.360 8.220 -11.586 1.00 0.00 C ATOM 1218 O ALA A 79 -2.438 7.619 -12.657 1.00 0.00 O ATOM 1219 CB ALA A 79 -2.958 10.634 -12.053 1.00 0.00 C ATOM 0 H ALA A 79 -3.205 10.605 -9.610 1.00 0.00 H new ATOM 0 HA ALA A 79 -4.323 9.026 -11.627 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -2.869 10.404 -13.115 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.726 11.394 -11.910 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -2.004 11.007 -11.681 1.00 0.00 H new ATOM 1225 N ALA A 80 -1.438 7.887 -10.672 1.00 0.00 N ATOM 1226 CA ALA A 80 -0.595 6.712 -10.806 1.00 0.00 C ATOM 1227 C ALA A 80 -1.408 5.432 -10.732 1.00 0.00 C ATOM 1228 O ALA A 80 -1.326 4.597 -11.627 1.00 0.00 O ATOM 1229 CB ALA A 80 0.439 6.685 -9.687 1.00 0.00 C ATOM 0 H ALA A 80 -1.263 8.428 -9.825 1.00 0.00 H new ATOM 0 HA ALA A 80 -0.108 6.770 -11.780 1.00 0.00 H new ATOM 0 HB1 ALA A 80 1.068 5.801 -9.794 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.059 7.580 -9.743 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -0.069 6.655 -8.723 1.00 0.00 H new ATOM 1235 N PHE A 81 -2.126 5.253 -9.631 1.00 0.00 N ATOM 1236 CA PHE A 81 -2.956 4.130 -9.333 1.00 0.00 C ATOM 1237 C PHE A 81 -4.075 4.042 -10.360 1.00 0.00 C ATOM 1238 O PHE A 81 -4.335 2.952 -10.855 1.00 0.00 O ATOM 1239 CB PHE A 81 -3.440 4.343 -7.896 1.00 0.00 C ATOM 1240 CG PHE A 81 -2.348 4.596 -6.867 1.00 0.00 C ATOM 1241 CD1 PHE A 81 -1.094 3.954 -6.953 1.00 0.00 C ATOM 1242 CD2 PHE A 81 -2.599 5.478 -5.802 1.00 0.00 C ATOM 1243 CE1 PHE A 81 -0.100 4.204 -5.993 1.00 0.00 C ATOM 1244 CE2 PHE A 81 -1.617 5.706 -4.826 1.00 0.00 C ATOM 1245 CZ PHE A 81 -0.365 5.079 -4.926 1.00 0.00 C ATOM 0 H PHE A 81 -2.133 5.945 -8.882 1.00 0.00 H new ATOM 0 HA PHE A 81 -2.437 3.173 -9.393 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -4.128 5.188 -7.885 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -4.008 3.465 -7.589 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -0.898 3.266 -7.762 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -3.552 5.982 -5.735 1.00 0.00 H new ATOM 0 HE1 PHE A 81 0.865 3.725 -6.075 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -1.825 6.365 -3.996 1.00 0.00 H new ATOM 0 HZ PHE A 81 0.395 5.269 -4.182 1.00 0.00 H new ATOM 1255 N GLU A 82 -4.629 5.173 -10.801 1.00 0.00 N ATOM 1256 CA GLU A 82 -5.571 5.221 -11.907 1.00 0.00 C ATOM 1257 C GLU A 82 -5.011 4.587 -13.182 1.00 0.00 C ATOM 1258 O GLU A 82 -5.804 4.042 -13.950 1.00 0.00 O ATOM 1259 CB GLU A 82 -5.945 6.668 -12.223 1.00 0.00 C ATOM 1260 CG GLU A 82 -6.859 7.329 -11.184 1.00 0.00 C ATOM 1261 CD GLU A 82 -8.174 7.743 -11.837 1.00 0.00 C ATOM 1262 OE1 GLU A 82 -8.961 6.832 -12.195 1.00 0.00 O ATOM 1263 OE2 GLU A 82 -8.355 8.957 -12.069 1.00 0.00 O ATOM 0 H GLU A 82 -4.431 6.087 -10.393 1.00 0.00 H new ATOM 0 HA GLU A 82 -6.445 4.653 -11.590 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.031 7.256 -12.311 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -6.438 6.699 -13.195 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.052 6.637 -10.364 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.365 8.201 -10.755 1.00 0.00 H new ATOM 1270 N ALA A 83 -3.687 4.621 -13.411 1.00 0.00 N ATOM 1271 CA ALA A 83 -3.082 4.045 -14.605 1.00 0.00 C ATOM 1272 C ALA A 83 -3.067 2.514 -14.568 1.00 0.00 C ATOM 1273 O ALA A 83 -2.689 1.897 -15.567 1.00 0.00 O ATOM 1274 CB ALA A 83 -1.644 4.543 -14.745 1.00 0.00 C ATOM 0 H ALA A 83 -3.017 5.048 -12.772 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.687 4.360 -15.455 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.195 4.110 -15.639 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.642 5.630 -14.827 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -1.069 4.244 -13.869 1.00 0.00 H new ATOM 1280 N MET A 84 -3.424 1.919 -13.432 1.00 0.00 N ATOM 1281 CA MET A 84 -3.484 0.480 -13.195 1.00 0.00 C ATOM 1282 C MET A 84 -4.773 0.076 -12.464 1.00 0.00 C ATOM 1283 O MET A 84 -4.864 -1.034 -11.938 1.00 0.00 O ATOM 1284 CB MET A 84 -2.219 0.023 -12.451 1.00 0.00 C ATOM 1285 CG MET A 84 -1.773 0.953 -11.320 1.00 0.00 C ATOM 1286 SD MET A 84 -0.348 0.418 -10.322 1.00 0.00 S ATOM 1287 CE MET A 84 -0.260 -1.381 -10.648 1.00 0.00 C ATOM 0 H MET A 84 -3.693 2.457 -12.609 1.00 0.00 H new ATOM 0 HA MET A 84 -3.514 -0.033 -14.156 1.00 0.00 H new ATOM 0 HB2 MET A 84 -2.395 -0.970 -12.038 1.00 0.00 H new ATOM 0 HB3 MET A 84 -1.405 -0.070 -13.169 1.00 0.00 H new ATOM 0 HG2 MET A 84 -1.537 1.925 -11.754 1.00 0.00 H new ATOM 0 HG3 MET A 84 -2.620 1.101 -10.649 1.00 0.00 H new ATOM 0 HE1 MET A 84 0.477 -1.835 -9.986 1.00 0.00 H new ATOM 0 HE2 MET A 84 -1.236 -1.832 -10.468 1.00 0.00 H new ATOM 0 HE3 MET A 84 0.031 -1.549 -11.685 1.00 0.00 H new ATOM 1297 N GLY A 85 -5.761 0.973 -12.373 1.00 0.00 N ATOM 1298 CA GLY A 85 -6.976 0.745 -11.599 1.00 0.00 C ATOM 1299 C GLY A 85 -6.680 0.302 -10.168 1.00 0.00 C ATOM 1300 O GLY A 85 -7.407 -0.522 -9.616 1.00 0.00 O ATOM 0 H GLY A 85 -5.736 1.880 -12.838 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -7.567 1.660 -11.578 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -7.582 -0.014 -12.094 1.00 0.00 H new ATOM 1304 N VAL A 86 -5.601 0.789 -9.560 1.00 0.00 N ATOM 1305 CA VAL A 86 -5.222 0.465 -8.191 1.00 0.00 C ATOM 1306 C VAL A 86 -6.099 1.329 -7.290 1.00 0.00 C ATOM 1307 O VAL A 86 -6.110 2.550 -7.415 1.00 0.00 O ATOM 1308 CB VAL A 86 -3.687 0.638 -8.040 1.00 0.00 C ATOM 1309 CG1 VAL A 86 -3.184 0.784 -6.599 1.00 0.00 C ATOM 1310 CG2 VAL A 86 -3.034 -0.636 -8.580 1.00 0.00 C ATOM 0 H VAL A 86 -4.954 1.432 -10.016 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.399 -0.571 -7.901 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.434 1.556 -8.570 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.100 0.899 -6.602 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.641 1.661 -6.141 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.453 -0.105 -6.028 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -1.951 -0.555 -8.492 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -3.382 -1.495 -8.006 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -3.304 -0.767 -9.628 1.00 0.00 H new ATOM 1320 N LYS A 87 -6.940 0.714 -6.457 1.00 0.00 N ATOM 1321 CA LYS A 87 -7.805 1.484 -5.565 1.00 0.00 C ATOM 1322 C LYS A 87 -6.932 2.157 -4.512 1.00 0.00 C ATOM 1323 O LYS A 87 -5.991 1.529 -4.011 1.00 0.00 O ATOM 1324 CB LYS A 87 -8.854 0.572 -4.916 1.00 0.00 C ATOM 1325 CG LYS A 87 -10.035 1.382 -4.359 1.00 0.00 C ATOM 1326 CD LYS A 87 -10.628 0.802 -3.065 1.00 0.00 C ATOM 1327 CE LYS A 87 -11.805 -0.155 -3.260 1.00 0.00 C ATOM 1328 NZ LYS A 87 -11.499 -1.299 -4.138 1.00 0.00 N ATOM 0 H LYS A 87 -7.040 -0.298 -6.382 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.343 2.246 -6.129 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -9.218 -0.146 -5.651 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -8.392 -0.001 -4.112 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.706 2.404 -4.171 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.818 1.433 -5.116 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -9.839 0.277 -2.526 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -10.953 1.627 -2.431 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.122 -0.530 -2.287 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -12.646 0.398 -3.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -12.340 -1.904 -4.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -11.224 -0.951 -5.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -10.717 -1.850 -3.730 1.00 0.00 H new ATOM 1342 N VAL A 88 -7.297 3.352 -4.055 1.00 0.00 N ATOM 1343 CA VAL A 88 -6.543 4.083 -3.049 1.00 0.00 C ATOM 1344 C VAL A 88 -7.474 4.640 -1.964 1.00 0.00 C ATOM 1345 O VAL A 88 -8.255 5.556 -2.199 1.00 0.00 O ATOM 1346 CB VAL A 88 -5.656 5.126 -3.765 1.00 0.00 C ATOM 1347 CG1 VAL A 88 -6.393 5.992 -4.808 1.00 0.00 C ATOM 1348 CG2 VAL A 88 -4.917 6.038 -2.777 1.00 0.00 C ATOM 0 H VAL A 88 -8.132 3.841 -4.377 1.00 0.00 H new ATOM 0 HA VAL A 88 -5.868 3.427 -2.500 1.00 0.00 H new ATOM 0 HB VAL A 88 -4.935 4.518 -4.311 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -5.692 6.694 -5.259 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.812 5.350 -5.583 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -7.196 6.544 -4.320 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.307 6.753 -3.329 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -5.642 6.575 -2.165 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.276 5.434 -2.134 1.00 0.00 H new ATOM 1358 N ILE A 89 -7.383 4.076 -0.763 1.00 0.00 N ATOM 1359 CA ILE A 89 -8.036 4.529 0.451 1.00 0.00 C ATOM 1360 C ILE A 89 -7.180 5.659 0.994 1.00 0.00 C ATOM 1361 O ILE A 89 -5.954 5.555 1.008 1.00 0.00 O ATOM 1362 CB ILE A 89 -8.096 3.357 1.449 1.00 0.00 C ATOM 1363 CG1 ILE A 89 -9.147 2.322 0.995 1.00 0.00 C ATOM 1364 CG2 ILE A 89 -8.379 3.829 2.883 1.00 0.00 C ATOM 1365 CD1 ILE A 89 -8.754 0.906 1.396 1.00 0.00 C ATOM 0 H ILE A 89 -6.817 3.242 -0.607 1.00 0.00 H new ATOM 0 HA ILE A 89 -9.055 4.873 0.274 1.00 0.00 H new ATOM 0 HB ILE A 89 -7.114 2.885 1.459 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -10.114 2.569 1.433 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -9.265 2.374 -0.087 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -8.412 2.967 3.550 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -7.589 4.507 3.205 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -9.337 4.348 2.913 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -9.519 0.207 1.059 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -7.800 0.649 0.936 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -8.662 0.847 2.481 1.00 0.00 H new ATOM 1377 N LYS A 90 -7.815 6.703 1.508 1.00 0.00 N ATOM 1378 CA LYS A 90 -7.165 7.888 2.036 1.00 0.00 C ATOM 1379 C LYS A 90 -7.613 8.131 3.472 1.00 0.00 C ATOM 1380 O LYS A 90 -8.516 7.454 3.964 1.00 0.00 O ATOM 1381 CB LYS A 90 -7.568 9.033 1.115 1.00 0.00 C ATOM 1382 CG LYS A 90 -6.831 8.994 -0.234 1.00 0.00 C ATOM 1383 CD LYS A 90 -7.660 9.596 -1.373 1.00 0.00 C ATOM 1384 CE LYS A 90 -8.653 8.555 -1.896 1.00 0.00 C ATOM 1385 NZ LYS A 90 -9.542 9.050 -2.967 1.00 0.00 N ATOM 0 H LYS A 90 -8.832 6.747 1.570 1.00 0.00 H new ATOM 0 HA LYS A 90 -6.080 7.786 2.064 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.643 8.992 0.939 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -7.362 9.982 1.610 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -5.891 9.538 -0.146 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -6.580 7.962 -0.478 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -8.195 10.477 -1.019 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.004 9.924 -2.179 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -8.097 7.695 -2.269 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -9.265 8.203 -1.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -10.183 8.288 -3.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -10.100 9.852 -2.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -8.969 9.359 -3.778 1.00 0.00 H new ATOM 1399 N GLY A 91 -7.005 9.118 4.131 1.00 0.00 N ATOM 1400 CA GLY A 91 -7.453 9.588 5.433 1.00 0.00 C ATOM 1401 C GLY A 91 -7.170 8.624 6.587 1.00 0.00 C ATOM 1402 O GLY A 91 -7.694 8.859 7.676 1.00 0.00 O ATOM 0 H GLY A 91 -6.187 9.612 3.773 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -6.971 10.542 5.647 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -8.526 9.776 5.388 1.00 0.00 H new ATOM 1406 N ALA A 92 -6.373 7.567 6.384 1.00 0.00 N ATOM 1407 CA ALA A 92 -6.003 6.629 7.442 1.00 0.00 C ATOM 1408 C ALA A 92 -5.104 7.299 8.495 1.00 0.00 C ATOM 1409 O ALA A 92 -4.603 8.403 8.278 1.00 0.00 O ATOM 1410 CB ALA A 92 -5.289 5.427 6.809 1.00 0.00 C ATOM 0 H ALA A 92 -5.967 7.341 5.476 1.00 0.00 H new ATOM 0 HA ALA A 92 -6.906 6.296 7.954 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -5.007 4.719 7.589 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -5.957 4.939 6.100 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -4.394 5.768 6.288 1.00 0.00 H new ATOM 1416 N SER A 93 -4.823 6.600 9.597 1.00 0.00 N ATOM 1417 CA SER A 93 -3.724 6.858 10.520 1.00 0.00 C ATOM 1418 C SER A 93 -3.458 5.565 11.312 1.00 0.00 C ATOM 1419 O SER A 93 -4.378 4.747 11.436 1.00 0.00 O ATOM 1420 CB SER A 93 -3.985 8.091 11.404 1.00 0.00 C ATOM 1421 OG SER A 93 -5.111 8.053 12.251 1.00 0.00 O ATOM 0 H SER A 93 -5.387 5.799 9.881 1.00 0.00 H new ATOM 0 HA SER A 93 -2.819 7.118 9.971 1.00 0.00 H new ATOM 0 HB2 SER A 93 -3.103 8.255 12.023 1.00 0.00 H new ATOM 0 HB3 SER A 93 -4.083 8.959 10.752 1.00 0.00 H new ATOM 0 HG SER A 93 -5.166 8.889 12.759 1.00 0.00 H new ATOM 1427 N GLY A 94 -2.234 5.355 11.809 1.00 0.00 N ATOM 1428 CA GLY A 94 -1.899 4.205 12.657 1.00 0.00 C ATOM 1429 C GLY A 94 -0.526 3.607 12.354 1.00 0.00 C ATOM 1430 O GLY A 94 0.311 4.241 11.706 1.00 0.00 O ATOM 0 H GLY A 94 -1.446 5.979 11.634 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -1.931 4.512 13.702 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -2.659 3.434 12.528 1.00 0.00 H new ATOM 1434 N THR A 95 -0.242 2.413 12.865 1.00 0.00 N ATOM 1435 CA THR A 95 0.848 1.573 12.377 1.00 0.00 C ATOM 1436 C THR A 95 0.369 0.780 11.159 1.00 0.00 C ATOM 1437 O THR A 95 -0.820 0.781 10.837 1.00 0.00 O ATOM 1438 CB THR A 95 1.321 0.633 13.504 1.00 0.00 C ATOM 1439 OG1 THR A 95 0.212 -0.033 14.080 1.00 0.00 O ATOM 1440 CG2 THR A 95 2.052 1.404 14.605 1.00 0.00 C ATOM 0 H THR A 95 -0.766 1.997 13.635 1.00 0.00 H new ATOM 0 HA THR A 95 1.692 2.193 12.075 1.00 0.00 H new ATOM 0 HB THR A 95 2.007 -0.088 13.061 1.00 0.00 H new ATOM 0 HG1 THR A 95 0.523 -0.629 14.793 1.00 0.00 H new ATOM 0 HG21 THR A 95 2.372 0.711 15.383 1.00 0.00 H new ATOM 0 HG22 THR A 95 2.924 1.903 14.182 1.00 0.00 H new ATOM 0 HG23 THR A 95 1.381 2.148 15.035 1.00 0.00 H new ATOM 1448 N VAL A 96 1.283 0.082 10.482 1.00 0.00 N ATOM 1449 CA VAL A 96 0.946 -0.754 9.341 1.00 0.00 C ATOM 1450 C VAL A 96 -0.028 -1.829 9.777 1.00 0.00 C ATOM 1451 O VAL A 96 -1.083 -1.948 9.164 1.00 0.00 O ATOM 1452 CB VAL A 96 2.218 -1.334 8.689 1.00 0.00 C ATOM 1453 CG1 VAL A 96 2.009 -2.640 7.907 1.00 0.00 C ATOM 1454 CG2 VAL A 96 2.774 -0.285 7.740 1.00 0.00 C ATOM 0 H VAL A 96 2.276 0.084 10.714 1.00 0.00 H new ATOM 0 HA VAL A 96 0.458 -0.152 8.575 1.00 0.00 H new ATOM 0 HB VAL A 96 2.899 -1.582 9.503 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.959 -2.968 7.486 1.00 0.00 H new ATOM 0 HG12 VAL A 96 1.624 -3.408 8.578 1.00 0.00 H new ATOM 0 HG13 VAL A 96 1.295 -2.471 7.101 1.00 0.00 H new ATOM 0 HG21 VAL A 96 3.676 -0.668 7.263 1.00 0.00 H new ATOM 0 HG22 VAL A 96 2.030 -0.054 6.977 1.00 0.00 H new ATOM 0 HG23 VAL A 96 3.015 0.620 8.298 1.00 0.00 H new ATOM 1464 N GLU A 97 0.316 -2.619 10.795 1.00 0.00 N ATOM 1465 CA GLU A 97 -0.539 -3.754 11.144 1.00 0.00 C ATOM 1466 C GLU A 97 -1.952 -3.309 11.529 1.00 0.00 C ATOM 1467 O GLU A 97 -2.920 -3.994 11.197 1.00 0.00 O ATOM 1468 CB GLU A 97 0.092 -4.695 12.177 1.00 0.00 C ATOM 1469 CG GLU A 97 0.391 -4.062 13.544 1.00 0.00 C ATOM 1470 CD GLU A 97 0.847 -5.096 14.584 1.00 0.00 C ATOM 1471 OE1 GLU A 97 0.576 -6.312 14.436 1.00 0.00 O ATOM 1472 OE2 GLU A 97 1.491 -4.718 15.586 1.00 0.00 O ATOM 0 H GLU A 97 1.148 -2.502 11.373 1.00 0.00 H new ATOM 0 HA GLU A 97 -0.635 -4.352 10.237 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -0.575 -5.544 12.326 1.00 0.00 H new ATOM 0 HB3 GLU A 97 1.022 -5.088 11.766 1.00 0.00 H new ATOM 0 HG2 GLU A 97 1.165 -3.303 13.428 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -0.502 -3.554 13.909 1.00 0.00 H new ATOM 1479 N GLU A 98 -2.071 -2.137 12.150 1.00 0.00 N ATOM 1480 CA GLU A 98 -3.340 -1.563 12.556 1.00 0.00 C ATOM 1481 C GLU A 98 -4.123 -1.086 11.335 1.00 0.00 C ATOM 1482 O GLU A 98 -5.281 -1.455 11.178 1.00 0.00 O ATOM 1483 CB GLU A 98 -3.067 -0.433 13.548 1.00 0.00 C ATOM 1484 CG GLU A 98 -4.352 0.136 14.156 1.00 0.00 C ATOM 1485 CD GLU A 98 -3.982 1.000 15.354 1.00 0.00 C ATOM 1486 OE1 GLU A 98 -3.714 0.433 16.440 1.00 0.00 O ATOM 1487 OE2 GLU A 98 -3.818 2.231 15.190 1.00 0.00 O ATOM 0 H GLU A 98 -1.269 -1.553 12.387 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.958 -2.314 13.048 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.423 -0.802 14.347 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -2.523 0.365 13.044 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -4.891 0.727 13.416 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -5.015 -0.673 14.463 1.00 0.00 H new ATOM 1494 N VAL A 99 -3.516 -0.295 10.448 1.00 0.00 N ATOM 1495 CA VAL A 99 -4.136 0.193 9.229 1.00 0.00 C ATOM 1496 C VAL A 99 -4.577 -0.985 8.350 1.00 0.00 C ATOM 1497 O VAL A 99 -5.683 -0.967 7.807 1.00 0.00 O ATOM 1498 CB VAL A 99 -3.116 1.129 8.547 1.00 0.00 C ATOM 1499 CG1 VAL A 99 -3.471 1.448 7.108 1.00 0.00 C ATOM 1500 CG2 VAL A 99 -3.047 2.489 9.258 1.00 0.00 C ATOM 0 H VAL A 99 -2.556 0.028 10.567 1.00 0.00 H new ATOM 0 HA VAL A 99 -5.046 0.758 9.428 1.00 0.00 H new ATOM 0 HB VAL A 99 -2.172 0.586 8.596 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -2.715 2.110 6.685 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -3.510 0.525 6.530 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -4.444 1.939 7.073 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.320 3.126 8.755 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -4.027 2.964 9.230 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.745 2.343 10.295 1.00 0.00 H new ATOM 1510 N VAL A 100 -3.745 -2.018 8.222 1.00 0.00 N ATOM 1511 CA VAL A 100 -4.082 -3.247 7.520 1.00 0.00 C ATOM 1512 C VAL A 100 -5.330 -3.831 8.181 1.00 0.00 C ATOM 1513 O VAL A 100 -6.330 -4.038 7.493 1.00 0.00 O ATOM 1514 CB VAL A 100 -2.856 -4.189 7.502 1.00 0.00 C ATOM 1515 CG1 VAL A 100 -3.160 -5.614 7.026 1.00 0.00 C ATOM 1516 CG2 VAL A 100 -1.772 -3.637 6.565 1.00 0.00 C ATOM 0 H VAL A 100 -2.802 -2.020 8.612 1.00 0.00 H new ATOM 0 HA VAL A 100 -4.323 -3.077 6.471 1.00 0.00 H new ATOM 0 HB VAL A 100 -2.530 -4.234 8.541 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -2.245 -6.207 7.044 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -3.900 -6.068 7.685 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.551 -5.582 6.009 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.915 -4.311 6.563 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -2.172 -3.555 5.554 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -1.458 -2.652 6.912 1.00 0.00 H new ATOM 1526 N ASN A 101 -5.322 -4.052 9.499 1.00 0.00 N ATOM 1527 CA ASN A 101 -6.478 -4.597 10.202 1.00 0.00 C ATOM 1528 C ASN A 101 -7.737 -3.748 9.999 1.00 0.00 C ATOM 1529 O ASN A 101 -8.806 -4.304 9.754 1.00 0.00 O ATOM 1530 CB ASN A 101 -6.162 -4.742 11.695 1.00 0.00 C ATOM 1531 CG ASN A 101 -7.394 -5.187 12.475 1.00 0.00 C ATOM 1532 OD1 ASN A 101 -8.059 -6.143 12.089 1.00 0.00 O ATOM 1533 ND2 ASN A 101 -7.703 -4.541 13.588 1.00 0.00 N ATOM 0 H ASN A 101 -4.521 -3.859 10.100 1.00 0.00 H new ATOM 0 HA ASN A 101 -6.687 -5.579 9.778 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -5.360 -5.467 11.832 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -5.803 -3.791 12.088 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -8.507 -4.836 14.142 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -7.137 -3.749 13.892 1.00 0.00 H new ATOM 1540 N GLN A 102 -7.641 -2.417 10.044 1.00 0.00 N ATOM 1541 CA GLN A 102 -8.780 -1.527 9.827 1.00 0.00 C ATOM 1542 C GLN A 102 -9.382 -1.704 8.429 1.00 0.00 C ATOM 1543 O GLN A 102 -10.594 -1.544 8.259 1.00 0.00 O ATOM 1544 CB GLN A 102 -8.385 -0.056 10.032 1.00 0.00 C ATOM 1545 CG GLN A 102 -8.005 0.295 11.484 1.00 0.00 C ATOM 1546 CD GLN A 102 -8.606 1.629 11.921 1.00 0.00 C ATOM 1547 OE1 GLN A 102 -9.786 1.891 11.686 1.00 0.00 O ATOM 1548 NE2 GLN A 102 -7.834 2.500 12.546 1.00 0.00 N ATOM 0 H GLN A 102 -6.767 -1.926 10.233 1.00 0.00 H new ATOM 0 HA GLN A 102 -9.534 -1.800 10.566 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -7.543 0.178 9.380 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -9.215 0.579 9.721 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -8.350 -0.495 12.151 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -6.920 0.338 11.575 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -6.858 2.272 12.736 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -8.214 3.400 12.839 1.00 0.00 H new ATOM 1557 N TYR A 103 -8.566 -2.021 7.427 1.00 0.00 N ATOM 1558 CA TYR A 103 -9.038 -2.271 6.078 1.00 0.00 C ATOM 1559 C TYR A 103 -9.606 -3.679 5.939 1.00 0.00 C ATOM 1560 O TYR A 103 -10.684 -3.826 5.368 1.00 0.00 O ATOM 1561 CB TYR A 103 -7.924 -1.969 5.085 1.00 0.00 C ATOM 1562 CG TYR A 103 -8.174 -2.606 3.742 1.00 0.00 C ATOM 1563 CD1 TYR A 103 -9.130 -2.063 2.863 1.00 0.00 C ATOM 1564 CD2 TYR A 103 -7.544 -3.823 3.437 1.00 0.00 C ATOM 1565 CE1 TYR A 103 -9.435 -2.726 1.660 1.00 0.00 C ATOM 1566 CE2 TYR A 103 -7.881 -4.502 2.265 1.00 0.00 C ATOM 1567 CZ TYR A 103 -8.833 -3.968 1.372 1.00 0.00 C ATOM 1568 OH TYR A 103 -9.130 -4.633 0.222 1.00 0.00 O ATOM 0 H TYR A 103 -7.556 -2.111 7.534 1.00 0.00 H new ATOM 0 HA TYR A 103 -9.867 -1.601 5.852 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -7.831 -0.890 4.962 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -6.975 -2.327 5.485 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -9.629 -1.138 3.112 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -6.802 -4.232 4.106 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -10.128 -2.285 0.959 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -7.408 -5.446 2.040 1.00 0.00 H new ATOM 0 HH TYR A 103 -8.623 -5.471 0.188 1.00 0.00 H new ATOM 1578 N LEU A 104 -8.968 -4.702 6.512 1.00 0.00 N ATOM 1579 CA LEU A 104 -9.525 -6.051 6.550 1.00 0.00 C ATOM 1580 C LEU A 104 -10.870 -6.062 7.280 1.00 0.00 C ATOM 1581 O LEU A 104 -11.744 -6.871 6.953 1.00 0.00 O ATOM 1582 CB LEU A 104 -8.541 -7.028 7.219 1.00 0.00 C ATOM 1583 CG LEU A 104 -7.505 -7.571 6.223 1.00 0.00 C ATOM 1584 CD1 LEU A 104 -6.364 -6.616 5.904 1.00 0.00 C ATOM 1585 CD2 LEU A 104 -6.839 -8.828 6.758 1.00 0.00 C ATOM 0 H LEU A 104 -8.056 -4.617 6.960 1.00 0.00 H new ATOM 0 HA LEU A 104 -9.689 -6.378 5.523 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.028 -6.523 8.037 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -9.095 -7.859 7.655 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.091 -7.747 5.321 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.684 -7.086 5.193 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.766 -5.701 5.470 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -5.823 -6.376 6.820 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -6.111 -9.191 6.033 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.334 -8.601 7.697 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.594 -9.595 6.929 1.00 0.00 H new ATOM 1597 N SER A 105 -11.056 -5.140 8.225 1.00 0.00 N ATOM 1598 CA SER A 105 -12.300 -4.913 8.941 1.00 0.00 C ATOM 1599 C SER A 105 -13.363 -4.208 8.084 1.00 0.00 C ATOM 1600 O SER A 105 -14.528 -4.142 8.487 1.00 0.00 O ATOM 1601 CB SER A 105 -11.992 -4.053 10.168 1.00 0.00 C ATOM 1602 OG SER A 105 -11.134 -4.714 11.075 1.00 0.00 O ATOM 0 H SER A 105 -10.311 -4.509 8.520 1.00 0.00 H new ATOM 0 HA SER A 105 -12.710 -5.884 9.220 1.00 0.00 H new ATOM 0 HB2 SER A 105 -11.532 -3.118 9.849 1.00 0.00 H new ATOM 0 HB3 SER A 105 -12.923 -3.794 10.672 1.00 0.00 H new ATOM 0 HG SER A 105 -10.202 -4.572 10.807 1.00 0.00 H new ATOM 1608 N GLY A 106 -12.995 -3.648 6.930 1.00 0.00 N ATOM 1609 CA GLY A 106 -13.845 -2.799 6.106 1.00 0.00 C ATOM 1610 C GLY A 106 -14.149 -1.443 6.750 1.00 0.00 C ATOM 1611 O GLY A 106 -15.053 -0.750 6.286 1.00 0.00 O ATOM 0 H GLY A 106 -12.065 -3.780 6.534 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -13.361 -2.636 5.143 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -14.783 -3.318 5.907 1.00 0.00 H new ATOM 1615 N GLN A 107 -13.442 -1.056 7.818 1.00 0.00 N ATOM 1616 CA GLN A 107 -13.637 0.247 8.452 1.00 0.00 C ATOM 1617 C GLN A 107 -13.134 1.321 7.481 1.00 0.00 C ATOM 1618 O GLN A 107 -13.840 2.283 7.160 1.00 0.00 O ATOM 1619 CB GLN A 107 -12.900 0.323 9.803 1.00 0.00 C ATOM 1620 CG GLN A 107 -13.355 -0.724 10.839 1.00 0.00 C ATOM 1621 CD GLN A 107 -14.638 -0.349 11.577 1.00 0.00 C ATOM 1622 OE1 GLN A 107 -15.656 -1.025 11.477 1.00 0.00 O ATOM 1623 NE2 GLN A 107 -14.619 0.717 12.363 1.00 0.00 N ATOM 0 H GLN A 107 -12.727 -1.632 8.261 1.00 0.00 H new ATOM 0 HA GLN A 107 -14.694 0.406 8.666 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -11.831 0.201 9.627 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -13.042 1.318 10.224 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -13.504 -1.679 10.335 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -12.558 -0.869 11.568 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -13.770 1.276 12.443 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -15.453 0.978 12.888 1.00 0.00 H new ATOM 1632 N LEU A 108 -11.906 1.126 6.994 1.00 0.00 N ATOM 1633 CA LEU A 108 -11.264 1.957 5.989 1.00 0.00 C ATOM 1634 C LEU A 108 -12.008 1.843 4.660 1.00 0.00 C ATOM 1635 O LEU A 108 -12.331 0.739 4.223 1.00 0.00 O ATOM 1636 CB LEU A 108 -9.804 1.511 5.834 1.00 0.00 C ATOM 1637 CG LEU A 108 -8.857 2.262 6.779 1.00 0.00 C ATOM 1638 CD1 LEU A 108 -7.512 1.546 6.814 1.00 0.00 C ATOM 1639 CD2 LEU A 108 -8.610 3.731 6.440 1.00 0.00 C ATOM 0 H LEU A 108 -11.315 0.355 7.304 1.00 0.00 H new ATOM 0 HA LEU A 108 -11.289 3.001 6.301 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -9.732 0.441 6.028 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -9.486 1.671 4.804 1.00 0.00 H new ATOM 0 HG LEU A 108 -9.363 2.259 7.745 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -6.835 2.076 7.484 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -7.652 0.526 7.172 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -7.086 1.524 5.811 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -7.927 4.163 7.171 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -8.171 3.806 5.445 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -9.555 4.273 6.461 1.00 0.00 H new ATOM 1651 N LYS A 109 -12.227 2.980 3.999 1.00 0.00 N ATOM 1652 CA LYS A 109 -12.753 3.079 2.637 1.00 0.00 C ATOM 1653 C LYS A 109 -12.109 4.260 1.933 1.00 0.00 C ATOM 1654 O LYS A 109 -11.566 5.145 2.594 1.00 0.00 O ATOM 1655 CB LYS A 109 -14.287 3.224 2.610 1.00 0.00 C ATOM 1656 CG LYS A 109 -14.890 4.480 3.271 1.00 0.00 C ATOM 1657 CD LYS A 109 -15.244 4.296 4.753 1.00 0.00 C ATOM 1658 CE LYS A 109 -16.485 3.419 4.963 1.00 0.00 C ATOM 1659 NZ LYS A 109 -16.693 3.118 6.396 1.00 0.00 N ATOM 0 H LYS A 109 -12.036 3.892 4.413 1.00 0.00 H new ATOM 0 HA LYS A 109 -12.509 2.152 2.119 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -14.610 3.203 1.569 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -14.717 2.348 3.095 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -14.182 5.303 3.177 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -15.789 4.769 2.726 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -14.396 3.848 5.272 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -15.414 5.273 5.205 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -17.363 3.926 4.564 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -16.374 2.489 4.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -17.407 2.368 6.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -15.797 2.800 6.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -17.022 3.974 6.886 1.00 0.00 H new