USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 738 hydrogens (10 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 14 SER OG : rot 180:sc= 0.00323 USER MOD Set 1.2: A 113 ASN : amide:sc= -0.43 K(o=-0.43,f=0.16) USER MOD Single : A 1 ALA N :NH3+ 137:sc= 0.00505 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 63:sc= 0.73 USER MOD Single : A 8 THR OG1 : rot 180:sc= -0.0158 USER MOD Single : A 10 SER OG : rot -160:sc= -0.503 USER MOD Single : A 11 SER OG : rot 180:sc= 0.0187 USER MOD Single : A 17 THR OG1 : rot 107:sc= 1.31 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.63) USER MOD Single : A 30 THR OG1 : rot -150:sc= -0.0872 USER MOD Single : A 32 TYR OH : rot -50:sc= -0.367 USER MOD Single : A 36 GLN : amide:sc= -0.972! C(o=-0.97!,f=-6!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.128 USER MOD Single : A 48 ASN : amide:sc= 0.703 K(o=0.7,f=-9!) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0.0671 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= -0.624! K(o=-0.62!,f=0) USER MOD Single : A 62 SER OG : rot 63:sc= 0.453 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 170:sc= -0.0305 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot -90:sc= 1.22 USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.0645 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.268 USER MOD Single : A 90 THR OG1 : rot -45:sc= 0.326 USER MOD Single : A 94 GLN : amide:sc= -0.0569 X(o=-0.057,f=0) USER MOD Single : A 98 SER OG : rot -3:sc= 0.205 USER MOD Single : A 103 ASN : amide:sc= -0.0695 K(o=-0.07,f=-1.1!) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -16.824 5.447 15.306 1.00 0.00 N ATOM 2 CA ALA A 1 -17.297 4.063 15.080 1.00 0.00 C ATOM 3 C ALA A 1 -16.157 3.191 14.587 1.00 0.00 C ATOM 4 O ALA A 1 -15.399 3.593 13.703 1.00 0.00 O ATOM 5 CB ALA A 1 -18.438 4.050 14.079 1.00 0.00 C ATOM 0 H1 ALA A 1 -17.526 6.119 14.935 1.00 0.00 H new ATOM 0 H2 ALA A 1 -16.696 5.608 16.325 1.00 0.00 H new ATOM 0 H3 ALA A 1 -15.917 5.588 14.816 1.00 0.00 H new ATOM 0 HA ALA A 1 -17.660 3.662 16.026 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -18.774 3.025 13.924 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -19.264 4.649 14.461 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -18.096 4.467 13.132 1.00 0.00 H new ATOM 11 N ALA A 2 -16.043 2.000 15.158 1.00 0.00 N ATOM 12 CA ALA A 2 -14.995 1.064 14.780 1.00 0.00 C ATOM 13 C ALA A 2 -15.198 0.565 13.353 1.00 0.00 C ATOM 14 O ALA A 2 -16.280 0.090 12.999 1.00 0.00 O ATOM 15 CB ALA A 2 -14.960 -0.105 15.751 1.00 0.00 C ATOM 0 H ALA A 2 -16.667 1.658 15.889 1.00 0.00 H new ATOM 0 HA ALA A 2 -14.039 1.586 14.823 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -14.172 -0.798 15.457 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -14.763 0.264 16.758 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -15.921 -0.620 15.735 1.00 0.00 H new ATOM 21 N PRO A 3 -14.164 0.684 12.510 1.00 0.00 N ATOM 22 CA PRO A 3 -14.224 0.246 11.120 1.00 0.00 C ATOM 23 C PRO A 3 -13.986 -1.256 10.975 1.00 0.00 C ATOM 24 O PRO A 3 -13.630 -1.938 11.941 1.00 0.00 O ATOM 25 CB PRO A 3 -13.092 1.037 10.467 1.00 0.00 C ATOM 26 CG PRO A 3 -12.084 1.212 11.554 1.00 0.00 C ATOM 27 CD PRO A 3 -12.853 1.270 12.849 1.00 0.00 C ATOM 0 HA PRO A 3 -15.202 0.418 10.671 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -12.671 0.499 9.618 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -13.444 1.999 10.093 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -11.375 0.385 11.561 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -11.507 2.125 11.404 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -12.354 0.704 13.636 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -12.954 2.294 13.208 1.00 0.00 H new ATOM 35 N THR A 4 -14.179 -1.765 9.769 1.00 0.00 N ATOM 36 CA THR A 4 -13.990 -3.177 9.496 1.00 0.00 C ATOM 37 C THR A 4 -12.893 -3.390 8.451 1.00 0.00 C ATOM 38 O THR A 4 -13.107 -3.174 7.256 1.00 0.00 O ATOM 39 CB THR A 4 -15.298 -3.815 8.999 1.00 0.00 C ATOM 40 OG1 THR A 4 -16.416 -3.229 9.684 1.00 0.00 O ATOM 41 CG2 THR A 4 -15.290 -5.321 9.219 1.00 0.00 C ATOM 0 H THR A 4 -14.468 -1.216 8.960 1.00 0.00 H new ATOM 0 HA THR A 4 -13.689 -3.655 10.428 1.00 0.00 H new ATOM 0 HB THR A 4 -15.386 -3.626 7.929 1.00 0.00 H new ATOM 0 HG1 THR A 4 -17.247 -3.637 9.363 1.00 0.00 H new ATOM 0 HG21 THR A 4 -16.227 -5.746 8.859 1.00 0.00 H new ATOM 0 HG22 THR A 4 -14.457 -5.764 8.674 1.00 0.00 H new ATOM 0 HG23 THR A 4 -15.181 -5.533 10.283 1.00 0.00 H new ATOM 49 N ALA A 5 -11.713 -3.793 8.905 1.00 0.00 N ATOM 50 CA ALA A 5 -10.595 -4.034 8.002 1.00 0.00 C ATOM 51 C ALA A 5 -10.580 -5.492 7.558 1.00 0.00 C ATOM 52 O ALA A 5 -10.724 -6.400 8.380 1.00 0.00 O ATOM 53 CB ALA A 5 -9.279 -3.667 8.671 1.00 0.00 C ATOM 0 H ALA A 5 -11.506 -3.959 9.890 1.00 0.00 H new ATOM 0 HA ALA A 5 -10.718 -3.404 7.121 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -8.456 -3.854 7.981 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -9.291 -2.612 8.944 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -9.146 -4.272 9.568 1.00 0.00 H new ATOM 59 N THR A 6 -10.421 -5.710 6.259 1.00 0.00 N ATOM 60 CA THR A 6 -10.384 -7.056 5.705 1.00 0.00 C ATOM 61 C THR A 6 -9.337 -7.159 4.602 1.00 0.00 C ATOM 62 O THR A 6 -9.665 -7.144 3.416 1.00 0.00 O ATOM 63 CB THR A 6 -11.756 -7.463 5.133 1.00 0.00 C ATOM 64 OG1 THR A 6 -12.675 -6.362 5.225 1.00 0.00 O ATOM 65 CG2 THR A 6 -12.316 -8.662 5.881 1.00 0.00 C ATOM 0 H THR A 6 -10.315 -4.968 5.567 1.00 0.00 H new ATOM 0 HA THR A 6 -10.123 -7.732 6.519 1.00 0.00 H new ATOM 0 HB THR A 6 -11.623 -7.736 4.086 1.00 0.00 H new ATOM 0 HG1 THR A 6 -12.352 -5.619 4.674 1.00 0.00 H new ATOM 0 HG21 THR A 6 -13.285 -8.933 5.461 1.00 0.00 H new ATOM 0 HG22 THR A 6 -11.631 -9.504 5.784 1.00 0.00 H new ATOM 0 HG23 THR A 6 -12.435 -8.410 6.935 1.00 0.00 H new ATOM 73 N VAL A 7 -8.074 -7.240 4.988 1.00 0.00 N ATOM 74 CA VAL A 7 -7.000 -7.340 4.015 1.00 0.00 C ATOM 75 C VAL A 7 -6.339 -8.711 4.066 1.00 0.00 C ATOM 76 O VAL A 7 -6.160 -9.287 5.141 1.00 0.00 O ATOM 77 CB VAL A 7 -5.935 -6.236 4.215 1.00 0.00 C ATOM 78 CG1 VAL A 7 -6.542 -4.865 3.966 1.00 0.00 C ATOM 79 CG2 VAL A 7 -5.325 -6.301 5.610 1.00 0.00 C ATOM 0 H VAL A 7 -7.769 -7.238 5.961 1.00 0.00 H new ATOM 0 HA VAL A 7 -7.452 -7.201 3.033 1.00 0.00 H new ATOM 0 HB VAL A 7 -5.137 -6.405 3.492 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -5.781 -4.098 4.111 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.919 -4.814 2.945 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -7.362 -4.698 4.664 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -4.581 -5.512 5.719 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -6.108 -6.166 6.356 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -4.850 -7.271 5.754 1.00 0.00 H new ATOM 89 N THR A 8 -5.996 -9.231 2.899 1.00 0.00 N ATOM 90 CA THR A 8 -5.355 -10.535 2.794 1.00 0.00 C ATOM 91 C THR A 8 -3.850 -10.380 2.568 1.00 0.00 C ATOM 92 O THR A 8 -3.419 -9.957 1.496 1.00 0.00 O ATOM 93 CB THR A 8 -5.963 -11.351 1.639 1.00 0.00 C ATOM 94 OG1 THR A 8 -7.394 -11.276 1.694 1.00 0.00 O ATOM 95 CG2 THR A 8 -5.526 -12.810 1.705 1.00 0.00 C ATOM 0 H THR A 8 -6.152 -8.767 2.004 1.00 0.00 H new ATOM 0 HA THR A 8 -5.524 -11.064 3.732 1.00 0.00 H new ATOM 0 HB THR A 8 -5.606 -10.928 0.700 1.00 0.00 H new ATOM 0 HG1 THR A 8 -7.777 -11.795 0.956 1.00 0.00 H new ATOM 0 HG21 THR A 8 -5.971 -13.361 0.877 1.00 0.00 H new ATOM 0 HG22 THR A 8 -4.440 -12.868 1.637 1.00 0.00 H new ATOM 0 HG23 THR A 8 -5.854 -13.246 2.649 1.00 0.00 H new ATOM 103 N PRO A 9 -3.035 -10.714 3.580 1.00 0.00 N ATOM 104 CA PRO A 9 -1.580 -10.606 3.485 1.00 0.00 C ATOM 105 C PRO A 9 -0.938 -11.800 2.774 1.00 0.00 C ATOM 106 O PRO A 9 -1.397 -12.937 2.899 1.00 0.00 O ATOM 107 CB PRO A 9 -1.146 -10.570 4.949 1.00 0.00 C ATOM 108 CG PRO A 9 -2.178 -11.372 5.671 1.00 0.00 C ATOM 109 CD PRO A 9 -3.466 -11.222 4.898 1.00 0.00 C ATOM 0 HA PRO A 9 -1.275 -9.738 2.901 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -0.151 -10.997 5.078 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -1.105 -9.548 5.325 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -1.882 -12.419 5.730 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -2.298 -11.017 6.694 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -3.990 -12.173 4.807 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -4.148 -10.528 5.390 1.00 0.00 H new ATOM 117 N SER A 10 0.121 -11.532 2.027 1.00 0.00 N ATOM 118 CA SER A 10 0.843 -12.573 1.310 1.00 0.00 C ATOM 119 C SER A 10 1.993 -13.108 2.167 1.00 0.00 C ATOM 120 O SER A 10 3.162 -13.013 1.793 1.00 0.00 O ATOM 121 CB SER A 10 1.382 -12.013 -0.007 1.00 0.00 C ATOM 122 OG SER A 10 0.440 -11.134 -0.598 1.00 0.00 O ATOM 0 H SER A 10 0.503 -10.595 1.900 1.00 0.00 H new ATOM 0 HA SER A 10 0.160 -13.395 1.095 1.00 0.00 H new ATOM 0 HB2 SER A 10 2.318 -11.484 0.172 1.00 0.00 H new ATOM 0 HB3 SER A 10 1.604 -12.831 -0.692 1.00 0.00 H new ATOM 0 HG SER A 10 0.639 -11.035 -1.553 1.00 0.00 H new ATOM 128 N SER A 11 1.647 -13.665 3.316 1.00 0.00 N ATOM 129 CA SER A 11 2.636 -14.196 4.241 1.00 0.00 C ATOM 130 C SER A 11 3.207 -15.525 3.747 1.00 0.00 C ATOM 131 O SER A 11 2.473 -16.506 3.593 1.00 0.00 O ATOM 132 CB SER A 11 1.992 -14.384 5.614 1.00 0.00 C ATOM 133 OG SER A 11 0.929 -13.460 5.800 1.00 0.00 O ATOM 0 H SER A 11 0.682 -13.762 3.632 1.00 0.00 H new ATOM 0 HA SER A 11 3.460 -13.486 4.310 1.00 0.00 H new ATOM 0 HB2 SER A 11 1.616 -15.403 5.709 1.00 0.00 H new ATOM 0 HB3 SER A 11 2.741 -14.247 6.394 1.00 0.00 H new ATOM 0 HG SER A 11 0.528 -13.597 6.684 1.00 0.00 H new ATOM 139 N GLY A 12 4.511 -15.542 3.482 1.00 0.00 N ATOM 140 CA GLY A 12 5.168 -16.758 3.031 1.00 0.00 C ATOM 141 C GLY A 12 4.823 -17.133 1.603 1.00 0.00 C ATOM 142 O GLY A 12 4.862 -18.308 1.236 1.00 0.00 O ATOM 0 H GLY A 12 5.126 -14.733 3.572 1.00 0.00 H new ATOM 0 HA2 GLY A 12 6.247 -16.632 3.115 1.00 0.00 H new ATOM 0 HA3 GLY A 12 4.890 -17.579 3.692 1.00 0.00 H new ATOM 146 N LEU A 13 4.489 -16.143 0.793 1.00 0.00 N ATOM 147 CA LEU A 13 4.143 -16.393 -0.598 1.00 0.00 C ATOM 148 C LEU A 13 5.281 -15.958 -1.513 1.00 0.00 C ATOM 149 O LEU A 13 6.389 -15.679 -1.050 1.00 0.00 O ATOM 150 CB LEU A 13 2.839 -15.675 -0.964 1.00 0.00 C ATOM 151 CG LEU A 13 1.588 -16.199 -0.250 1.00 0.00 C ATOM 152 CD1 LEU A 13 0.332 -15.544 -0.798 1.00 0.00 C ATOM 153 CD2 LEU A 13 1.484 -17.708 -0.379 1.00 0.00 C ATOM 0 H LEU A 13 4.450 -15.163 1.072 1.00 0.00 H new ATOM 0 HA LEU A 13 3.988 -17.463 -0.733 1.00 0.00 H new ATOM 0 HB2 LEU A 13 2.950 -14.614 -0.738 1.00 0.00 H new ATOM 0 HB3 LEU A 13 2.686 -15.758 -2.040 1.00 0.00 H new ATOM 0 HG LEU A 13 1.680 -15.943 0.806 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -0.540 -15.934 -0.274 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.391 -14.465 -0.652 1.00 0.00 H new ATOM 0 HD13 LEU A 13 0.243 -15.762 -1.862 1.00 0.00 H new ATOM 0 HD21 LEU A 13 0.588 -18.056 0.136 1.00 0.00 H new ATOM 0 HD22 LEU A 13 1.426 -17.980 -1.433 1.00 0.00 H new ATOM 0 HD23 LEU A 13 2.363 -18.173 0.068 1.00 0.00 H new ATOM 165 N SER A 14 5.026 -15.931 -2.811 1.00 0.00 N ATOM 166 CA SER A 14 6.038 -15.527 -3.775 1.00 0.00 C ATOM 167 C SER A 14 5.761 -14.114 -4.283 1.00 0.00 C ATOM 168 O SER A 14 4.811 -13.466 -3.841 1.00 0.00 O ATOM 169 CB SER A 14 6.066 -16.517 -4.941 1.00 0.00 C ATOM 170 OG SER A 14 6.158 -17.858 -4.477 1.00 0.00 O ATOM 0 H SER A 14 4.127 -16.184 -3.222 1.00 0.00 H new ATOM 0 HA SER A 14 7.012 -15.528 -3.285 1.00 0.00 H new ATOM 0 HB2 SER A 14 5.165 -16.399 -5.543 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.914 -16.295 -5.589 1.00 0.00 H new ATOM 0 HG SER A 14 6.172 -18.469 -5.243 1.00 0.00 H new ATOM 176 N ASP A 15 6.586 -13.633 -5.203 1.00 0.00 N ATOM 177 CA ASP A 15 6.409 -12.297 -5.760 1.00 0.00 C ATOM 178 C ASP A 15 5.369 -12.328 -6.869 1.00 0.00 C ATOM 179 O ASP A 15 5.133 -13.370 -7.482 1.00 0.00 O ATOM 180 CB ASP A 15 7.734 -11.739 -6.288 1.00 0.00 C ATOM 181 CG ASP A 15 8.355 -12.604 -7.364 1.00 0.00 C ATOM 182 OD1 ASP A 15 8.763 -13.740 -7.055 1.00 0.00 O ATOM 183 OD2 ASP A 15 8.464 -12.143 -8.514 1.00 0.00 O ATOM 0 H ASP A 15 7.383 -14.146 -5.579 1.00 0.00 H new ATOM 0 HA ASP A 15 6.061 -11.639 -4.964 1.00 0.00 H new ATOM 0 HB2 ASP A 15 7.567 -10.738 -6.686 1.00 0.00 H new ATOM 0 HB3 ASP A 15 8.436 -11.640 -5.460 1.00 0.00 H new ATOM 188 N GLY A 16 4.730 -11.195 -7.111 1.00 0.00 N ATOM 189 CA GLY A 16 3.713 -11.125 -8.141 1.00 0.00 C ATOM 190 C GLY A 16 2.366 -11.599 -7.632 1.00 0.00 C ATOM 191 O GLY A 16 1.418 -11.741 -8.400 1.00 0.00 O ATOM 0 H GLY A 16 4.897 -10.321 -6.613 1.00 0.00 H new ATOM 0 HA2 GLY A 16 3.627 -10.099 -8.498 1.00 0.00 H new ATOM 0 HA3 GLY A 16 4.015 -11.734 -8.993 1.00 0.00 H new ATOM 195 N THR A 17 2.291 -11.844 -6.331 1.00 0.00 N ATOM 196 CA THR A 17 1.066 -12.311 -5.700 1.00 0.00 C ATOM 197 C THR A 17 0.041 -11.182 -5.599 1.00 0.00 C ATOM 198 O THR A 17 0.401 -10.020 -5.390 1.00 0.00 O ATOM 199 CB THR A 17 1.368 -12.886 -4.303 1.00 0.00 C ATOM 200 OG1 THR A 17 2.321 -13.951 -4.424 1.00 0.00 O ATOM 201 CG2 THR A 17 0.106 -13.412 -3.633 1.00 0.00 C ATOM 0 H THR A 17 3.073 -11.725 -5.687 1.00 0.00 H new ATOM 0 HA THR A 17 0.643 -13.101 -6.321 1.00 0.00 H new ATOM 0 HB THR A 17 1.772 -12.084 -3.685 1.00 0.00 H new ATOM 0 HG1 THR A 17 3.191 -13.652 -4.085 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.355 -13.810 -2.649 1.00 0.00 H new ATOM 0 HG22 THR A 17 -0.613 -12.600 -3.524 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.328 -14.202 -4.245 1.00 0.00 H new ATOM 209 N VAL A 18 -1.225 -11.531 -5.773 1.00 0.00 N ATOM 210 CA VAL A 18 -2.311 -10.568 -5.714 1.00 0.00 C ATOM 211 C VAL A 18 -2.761 -10.340 -4.275 1.00 0.00 C ATOM 212 O VAL A 18 -3.289 -11.244 -3.624 1.00 0.00 O ATOM 213 CB VAL A 18 -3.516 -11.040 -6.553 1.00 0.00 C ATOM 214 CG1 VAL A 18 -4.602 -9.976 -6.594 1.00 0.00 C ATOM 215 CG2 VAL A 18 -3.077 -11.409 -7.962 1.00 0.00 C ATOM 0 H VAL A 18 -1.526 -12.488 -5.959 1.00 0.00 H new ATOM 0 HA VAL A 18 -1.935 -9.631 -6.125 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.930 -11.928 -6.077 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -5.440 -10.334 -7.192 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -4.943 -9.765 -5.580 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -4.202 -9.065 -7.039 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -3.942 -11.739 -8.538 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -2.631 -10.539 -8.444 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -2.343 -12.214 -7.915 1.00 0.00 H new ATOM 225 N VAL A 19 -2.529 -9.137 -3.780 1.00 0.00 N ATOM 226 CA VAL A 19 -2.925 -8.768 -2.431 1.00 0.00 C ATOM 227 C VAL A 19 -4.340 -8.208 -2.448 1.00 0.00 C ATOM 228 O VAL A 19 -4.606 -7.191 -3.093 1.00 0.00 O ATOM 229 CB VAL A 19 -1.973 -7.716 -1.819 1.00 0.00 C ATOM 230 CG1 VAL A 19 -2.327 -7.450 -0.365 1.00 0.00 C ATOM 231 CG2 VAL A 19 -0.526 -8.166 -1.936 1.00 0.00 C ATOM 0 H VAL A 19 -2.064 -8.392 -4.298 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.878 -9.667 -1.817 1.00 0.00 H new ATOM 0 HB VAL A 19 -2.092 -6.788 -2.379 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -1.644 -6.706 0.046 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.349 -7.078 -0.302 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -2.242 -8.375 0.205 1.00 0.00 H new ATOM 0 HG21 VAL A 19 0.127 -7.410 -1.499 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -0.394 -9.109 -1.406 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.271 -8.301 -2.987 1.00 0.00 H new ATOM 241 N LYS A 20 -5.246 -8.879 -1.757 1.00 0.00 N ATOM 242 CA LYS A 20 -6.632 -8.447 -1.704 1.00 0.00 C ATOM 243 C LYS A 20 -6.833 -7.452 -0.565 1.00 0.00 C ATOM 244 O LYS A 20 -6.676 -7.795 0.609 1.00 0.00 O ATOM 245 CB LYS A 20 -7.558 -9.654 -1.529 1.00 0.00 C ATOM 246 CG LYS A 20 -9.030 -9.325 -1.718 1.00 0.00 C ATOM 247 CD LYS A 20 -9.890 -10.581 -1.763 1.00 0.00 C ATOM 248 CE LYS A 20 -9.583 -11.429 -2.988 1.00 0.00 C ATOM 249 NZ LYS A 20 -10.544 -12.551 -3.143 1.00 0.00 N ATOM 0 H LYS A 20 -5.046 -9.726 -1.225 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.880 -7.953 -2.643 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.273 -10.427 -2.243 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -7.413 -10.071 -0.533 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -9.366 -8.683 -0.904 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -9.161 -8.762 -2.642 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -9.722 -11.170 -0.861 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -10.943 -10.301 -1.769 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.611 -10.802 -3.879 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.571 -11.827 -2.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.299 -13.104 -3.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.500 -13.164 -2.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -11.507 -12.172 -3.244 1.00 0.00 H new ATOM 263 N VAL A 21 -7.171 -6.220 -0.918 1.00 0.00 N ATOM 264 CA VAL A 21 -7.388 -5.168 0.065 1.00 0.00 C ATOM 265 C VAL A 21 -8.851 -4.740 0.073 1.00 0.00 C ATOM 266 O VAL A 21 -9.336 -4.141 -0.887 1.00 0.00 O ATOM 267 CB VAL A 21 -6.495 -3.940 -0.220 1.00 0.00 C ATOM 268 CG1 VAL A 21 -6.732 -2.846 0.811 1.00 0.00 C ATOM 269 CG2 VAL A 21 -5.027 -4.343 -0.252 1.00 0.00 C ATOM 0 H VAL A 21 -7.302 -5.923 -1.885 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.122 -5.572 1.042 1.00 0.00 H new ATOM 0 HB VAL A 21 -6.763 -3.543 -1.199 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.092 -1.992 0.589 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.776 -2.535 0.778 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -6.498 -3.226 1.805 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -4.413 -3.465 -0.454 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -4.746 -4.769 0.711 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -4.870 -5.084 -1.036 1.00 0.00 H new ATOM 279 N ALA A 22 -9.555 -5.070 1.148 1.00 0.00 N ATOM 280 CA ALA A 22 -10.960 -4.712 1.279 1.00 0.00 C ATOM 281 C ALA A 22 -11.218 -3.993 2.598 1.00 0.00 C ATOM 282 O ALA A 22 -11.075 -4.575 3.674 1.00 0.00 O ATOM 283 CB ALA A 22 -11.833 -5.951 1.175 1.00 0.00 C ATOM 0 H ALA A 22 -9.175 -5.585 1.942 1.00 0.00 H new ATOM 0 HA ALA A 22 -11.215 -4.033 0.465 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -12.881 -5.667 1.275 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -11.676 -6.426 0.207 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -11.569 -6.650 1.969 1.00 0.00 H new ATOM 289 N GLY A 23 -11.596 -2.731 2.517 1.00 0.00 N ATOM 290 CA GLY A 23 -11.867 -1.964 3.712 1.00 0.00 C ATOM 291 C GLY A 23 -13.310 -1.521 3.786 1.00 0.00 C ATOM 292 O GLY A 23 -13.886 -1.113 2.779 1.00 0.00 O ATOM 0 H GLY A 23 -11.721 -2.221 1.642 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -11.627 -2.564 4.590 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -11.218 -1.089 3.736 1.00 0.00 H new ATOM 296 N ALA A 24 -13.903 -1.617 4.968 1.00 0.00 N ATOM 297 CA ALA A 24 -15.284 -1.207 5.166 1.00 0.00 C ATOM 298 C ALA A 24 -15.375 -0.234 6.335 1.00 0.00 C ATOM 299 O ALA A 24 -14.609 -0.329 7.297 1.00 0.00 O ATOM 300 CB ALA A 24 -16.178 -2.417 5.392 1.00 0.00 C ATOM 0 H ALA A 24 -13.446 -1.977 5.806 1.00 0.00 H new ATOM 0 HA ALA A 24 -15.633 -0.701 4.266 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -17.207 -2.087 5.538 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -16.127 -3.074 4.524 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -15.842 -2.958 6.277 1.00 0.00 H new ATOM 306 N GLY A 25 -16.306 0.703 6.245 1.00 0.00 N ATOM 307 CA GLY A 25 -16.464 1.698 7.284 1.00 0.00 C ATOM 308 C GLY A 25 -15.618 2.918 7.001 1.00 0.00 C ATOM 309 O GLY A 25 -15.268 3.674 7.904 1.00 0.00 O ATOM 0 H GLY A 25 -16.958 0.792 5.466 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -17.512 1.988 7.358 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -16.182 1.271 8.247 1.00 0.00 H new ATOM 313 N LEU A 26 -15.291 3.107 5.732 1.00 0.00 N ATOM 314 CA LEU A 26 -14.473 4.227 5.302 1.00 0.00 C ATOM 315 C LEU A 26 -15.355 5.422 4.962 1.00 0.00 C ATOM 316 O LEU A 26 -16.572 5.380 5.157 1.00 0.00 O ATOM 317 CB LEU A 26 -13.636 3.818 4.083 1.00 0.00 C ATOM 318 CG LEU A 26 -12.883 2.491 4.219 1.00 0.00 C ATOM 319 CD1 LEU A 26 -12.164 2.154 2.925 1.00 0.00 C ATOM 320 CD2 LEU A 26 -11.897 2.543 5.376 1.00 0.00 C ATOM 0 H LEU A 26 -15.585 2.490 4.975 1.00 0.00 H new ATOM 0 HA LEU A 26 -13.803 4.512 6.113 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -14.294 3.756 3.216 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -12.913 4.607 3.879 1.00 0.00 H new ATOM 0 HG LEU A 26 -13.611 1.707 4.427 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -11.634 1.208 3.039 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -12.890 2.068 2.117 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -11.451 2.944 2.689 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -11.375 1.589 5.452 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -11.174 3.340 5.202 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -12.435 2.737 6.304 1.00 0.00 H new ATOM 332 N GLN A 27 -14.747 6.482 4.459 1.00 0.00 N ATOM 333 CA GLN A 27 -15.486 7.679 4.095 1.00 0.00 C ATOM 334 C GLN A 27 -15.826 7.650 2.608 1.00 0.00 C ATOM 335 O GLN A 27 -14.933 7.629 1.760 1.00 0.00 O ATOM 336 CB GLN A 27 -14.673 8.933 4.437 1.00 0.00 C ATOM 337 CG GLN A 27 -15.492 10.214 4.405 1.00 0.00 C ATOM 338 CD GLN A 27 -16.631 10.211 5.408 1.00 0.00 C ATOM 339 OE1 GLN A 27 -16.533 9.615 6.484 1.00 0.00 O ATOM 340 NE2 GLN A 27 -17.718 10.878 5.062 1.00 0.00 N ATOM 0 H GLN A 27 -13.742 6.539 4.293 1.00 0.00 H new ATOM 0 HA GLN A 27 -16.415 7.707 4.665 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -14.237 8.814 5.429 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -13.845 9.023 3.734 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -14.838 11.062 4.607 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -15.897 10.356 3.403 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -17.758 11.357 4.162 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -18.517 10.914 5.694 1.00 0.00 H new ATOM 349 N ALA A 28 -17.118 7.635 2.303 1.00 0.00 N ATOM 350 CA ALA A 28 -17.581 7.595 0.922 1.00 0.00 C ATOM 351 C ALA A 28 -17.143 8.840 0.159 1.00 0.00 C ATOM 352 O ALA A 28 -17.223 9.954 0.677 1.00 0.00 O ATOM 353 CB ALA A 28 -19.094 7.446 0.888 1.00 0.00 C ATOM 0 H ALA A 28 -17.866 7.650 2.997 1.00 0.00 H new ATOM 0 HA ALA A 28 -17.130 6.733 0.431 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -19.434 7.417 -0.147 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -19.380 6.522 1.390 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -19.555 8.293 1.397 1.00 0.00 H new ATOM 359 N GLY A 29 -16.656 8.640 -1.059 1.00 0.00 N ATOM 360 CA GLY A 29 -16.211 9.754 -1.875 1.00 0.00 C ATOM 361 C GLY A 29 -14.761 10.119 -1.615 1.00 0.00 C ATOM 362 O GLY A 29 -14.277 11.147 -2.086 1.00 0.00 O ATOM 0 H GLY A 29 -16.561 7.724 -1.498 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -16.336 9.502 -2.928 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -16.842 10.621 -1.677 1.00 0.00 H new ATOM 366 N THR A 30 -14.073 9.280 -0.855 1.00 0.00 N ATOM 367 CA THR A 30 -12.672 9.497 -0.529 1.00 0.00 C ATOM 368 C THR A 30 -11.787 8.492 -1.271 1.00 0.00 C ATOM 369 O THR A 30 -12.131 7.310 -1.377 1.00 0.00 O ATOM 370 CB THR A 30 -12.453 9.374 0.992 1.00 0.00 C ATOM 371 OG1 THR A 30 -13.325 10.287 1.674 1.00 0.00 O ATOM 372 CG2 THR A 30 -11.009 9.667 1.377 1.00 0.00 C ATOM 0 H THR A 30 -14.469 8.432 -0.448 1.00 0.00 H new ATOM 0 HA THR A 30 -12.396 10.503 -0.845 1.00 0.00 H new ATOM 0 HB THR A 30 -12.677 8.348 1.284 1.00 0.00 H new ATOM 0 HG1 THR A 30 -12.907 10.574 2.513 1.00 0.00 H new ATOM 0 HG21 THR A 30 -10.894 9.570 2.457 1.00 0.00 H new ATOM 0 HG22 THR A 30 -10.348 8.959 0.877 1.00 0.00 H new ATOM 0 HG23 THR A 30 -10.750 10.682 1.074 1.00 0.00 H new ATOM 380 N ALA A 31 -10.666 8.972 -1.797 1.00 0.00 N ATOM 381 CA ALA A 31 -9.733 8.128 -2.537 1.00 0.00 C ATOM 382 C ALA A 31 -8.624 7.614 -1.628 1.00 0.00 C ATOM 383 O ALA A 31 -7.938 8.395 -0.962 1.00 0.00 O ATOM 384 CB ALA A 31 -9.135 8.891 -3.711 1.00 0.00 C ATOM 0 H ALA A 31 -10.379 9.948 -1.724 1.00 0.00 H new ATOM 0 HA ALA A 31 -10.288 7.272 -2.921 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -8.442 8.245 -4.250 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -9.933 9.208 -4.383 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -8.602 9.767 -3.342 1.00 0.00 H new ATOM 390 N TYR A 32 -8.446 6.303 -1.615 1.00 0.00 N ATOM 391 CA TYR A 32 -7.429 5.672 -0.789 1.00 0.00 C ATOM 392 C TYR A 32 -6.321 5.091 -1.655 1.00 0.00 C ATOM 393 O TYR A 32 -6.564 4.241 -2.514 1.00 0.00 O ATOM 394 CB TYR A 32 -8.054 4.578 0.080 1.00 0.00 C ATOM 395 CG TYR A 32 -9.060 5.100 1.085 1.00 0.00 C ATOM 396 CD1 TYR A 32 -8.657 5.502 2.352 1.00 0.00 C ATOM 397 CD2 TYR A 32 -10.409 5.191 0.768 1.00 0.00 C ATOM 398 CE1 TYR A 32 -9.570 5.981 3.276 1.00 0.00 C ATOM 399 CE2 TYR A 32 -11.329 5.669 1.683 1.00 0.00 C ATOM 400 CZ TYR A 32 -10.905 6.062 2.937 1.00 0.00 C ATOM 401 OH TYR A 32 -11.818 6.543 3.855 1.00 0.00 O ATOM 0 H TYR A 32 -8.998 5.650 -2.172 1.00 0.00 H new ATOM 0 HA TYR A 32 -6.995 6.430 -0.137 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -8.543 3.849 -0.566 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -7.262 4.052 0.612 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -7.613 5.440 2.621 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -10.746 4.883 -0.211 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -9.239 6.290 4.257 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -12.374 5.735 1.418 1.00 0.00 H new ATOM 0 HH TYR A 32 -11.699 6.078 4.709 1.00 0.00 H new ATOM 411 N ASP A 33 -5.107 5.559 -1.419 1.00 0.00 N ATOM 412 CA ASP A 33 -3.944 5.106 -2.164 1.00 0.00 C ATOM 413 C ASP A 33 -3.346 3.880 -1.492 1.00 0.00 C ATOM 414 O ASP A 33 -2.887 3.948 -0.350 1.00 0.00 O ATOM 415 CB ASP A 33 -2.886 6.214 -2.249 1.00 0.00 C ATOM 416 CG ASP A 33 -3.202 7.256 -3.307 1.00 0.00 C ATOM 417 OD1 ASP A 33 -4.397 7.532 -3.547 1.00 0.00 O ATOM 418 OD2 ASP A 33 -2.255 7.828 -3.892 1.00 0.00 O ATOM 0 H ASP A 33 -4.900 6.261 -0.709 1.00 0.00 H new ATOM 0 HA ASP A 33 -4.262 4.850 -3.175 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -2.802 6.703 -1.279 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -1.916 5.767 -2.466 1.00 0.00 H new ATOM 423 N VAL A 34 -3.374 2.758 -2.193 1.00 0.00 N ATOM 424 CA VAL A 34 -2.837 1.514 -1.662 1.00 0.00 C ATOM 425 C VAL A 34 -1.734 0.975 -2.564 1.00 0.00 C ATOM 426 O VAL A 34 -1.964 0.704 -3.747 1.00 0.00 O ATOM 427 CB VAL A 34 -3.931 0.433 -1.514 1.00 0.00 C ATOM 428 CG1 VAL A 34 -3.391 -0.776 -0.764 1.00 0.00 C ATOM 429 CG2 VAL A 34 -5.162 0.992 -0.814 1.00 0.00 C ATOM 0 H VAL A 34 -3.763 2.682 -3.133 1.00 0.00 H new ATOM 0 HA VAL A 34 -2.433 1.742 -0.676 1.00 0.00 H new ATOM 0 HB VAL A 34 -4.228 0.115 -2.514 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -4.176 -1.526 -0.670 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -2.549 -1.198 -1.313 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -3.060 -0.470 0.229 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -5.916 0.210 -0.723 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -4.886 1.347 0.179 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -5.567 1.820 -1.396 1.00 0.00 H new ATOM 439 N GLY A 35 -0.533 0.846 -2.017 1.00 0.00 N ATOM 440 CA GLY A 35 0.571 0.317 -2.787 1.00 0.00 C ATOM 441 C GLY A 35 1.540 -0.457 -1.925 1.00 0.00 C ATOM 442 O GLY A 35 1.393 -0.495 -0.702 1.00 0.00 O ATOM 0 H GLY A 35 -0.305 1.098 -1.055 1.00 0.00 H new ATOM 0 HA2 GLY A 35 0.187 -0.332 -3.574 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.096 1.136 -3.278 1.00 0.00 H new ATOM 446 N GLN A 36 2.516 -1.094 -2.553 1.00 0.00 N ATOM 447 CA GLN A 36 3.514 -1.843 -1.813 1.00 0.00 C ATOM 448 C GLN A 36 4.616 -0.898 -1.365 1.00 0.00 C ATOM 449 O GLN A 36 5.221 -0.206 -2.184 1.00 0.00 O ATOM 450 CB GLN A 36 4.089 -2.993 -2.648 1.00 0.00 C ATOM 451 CG GLN A 36 4.672 -2.561 -3.984 1.00 0.00 C ATOM 452 CD GLN A 36 5.534 -3.635 -4.618 1.00 0.00 C ATOM 453 OE1 GLN A 36 5.569 -3.771 -5.835 1.00 0.00 O ATOM 454 NE2 GLN A 36 6.250 -4.394 -3.799 1.00 0.00 N ATOM 0 H GLN A 36 2.636 -1.107 -3.566 1.00 0.00 H new ATOM 0 HA GLN A 36 3.040 -2.289 -0.939 1.00 0.00 H new ATOM 0 HB2 GLN A 36 4.866 -3.494 -2.070 1.00 0.00 H new ATOM 0 HB3 GLN A 36 3.302 -3.726 -2.827 1.00 0.00 H new ATOM 0 HG2 GLN A 36 3.860 -2.303 -4.664 1.00 0.00 H new ATOM 0 HG3 GLN A 36 5.267 -1.659 -3.842 1.00 0.00 H new ATOM 0 HE21 GLN A 36 6.194 -4.250 -2.791 1.00 0.00 H new ATOM 0 HE22 GLN A 36 6.857 -5.121 -4.177 1.00 0.00 H new ATOM 463 N CYS A 37 4.846 -0.844 -0.068 1.00 0.00 N ATOM 464 CA CYS A 37 5.854 0.034 0.489 1.00 0.00 C ATOM 465 C CYS A 37 6.862 -0.741 1.324 1.00 0.00 C ATOM 466 O CYS A 37 6.603 -1.868 1.742 1.00 0.00 O ATOM 467 CB CYS A 37 5.183 1.105 1.346 1.00 0.00 C ATOM 468 SG CYS A 37 3.455 1.443 0.885 1.00 0.00 S ATOM 0 H CYS A 37 4.345 -1.402 0.623 1.00 0.00 H new ATOM 0 HA CYS A 37 6.391 0.504 -0.335 1.00 0.00 H new ATOM 0 HB2 CYS A 37 5.216 0.794 2.390 1.00 0.00 H new ATOM 0 HB3 CYS A 37 5.756 2.029 1.270 1.00 0.00 H new ATOM 473 N ALA A 38 8.012 -0.130 1.555 1.00 0.00 N ATOM 474 CA ALA A 38 9.068 -0.739 2.349 1.00 0.00 C ATOM 475 C ALA A 38 9.989 0.343 2.882 1.00 0.00 C ATOM 476 O ALA A 38 9.800 1.525 2.578 1.00 0.00 O ATOM 477 CB ALA A 38 9.848 -1.753 1.520 1.00 0.00 C ATOM 0 H ALA A 38 8.240 0.798 1.199 1.00 0.00 H new ATOM 0 HA ALA A 38 8.621 -1.270 3.189 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.633 -2.197 2.132 1.00 0.00 H new ATOM 0 HB2 ALA A 38 9.173 -2.535 1.172 1.00 0.00 H new ATOM 0 HB3 ALA A 38 10.297 -1.253 0.662 1.00 0.00 H new ATOM 483 N TRP A 39 10.965 -0.053 3.686 1.00 0.00 N ATOM 484 CA TRP A 39 11.916 0.892 4.248 1.00 0.00 C ATOM 485 C TRP A 39 12.844 1.417 3.160 1.00 0.00 C ATOM 486 O TRP A 39 13.812 0.762 2.782 1.00 0.00 O ATOM 487 CB TRP A 39 12.728 0.238 5.365 1.00 0.00 C ATOM 488 CG TRP A 39 12.392 0.752 6.733 1.00 0.00 C ATOM 489 CD1 TRP A 39 11.149 1.022 7.231 1.00 0.00 C ATOM 490 CD2 TRP A 39 13.318 1.055 7.785 1.00 0.00 C ATOM 491 NE1 TRP A 39 11.248 1.475 8.525 1.00 0.00 N ATOM 492 CE2 TRP A 39 12.568 1.504 8.885 1.00 0.00 C ATOM 493 CE3 TRP A 39 14.711 0.992 7.898 1.00 0.00 C ATOM 494 CZ2 TRP A 39 13.162 1.882 10.087 1.00 0.00 C ATOM 495 CZ3 TRP A 39 15.299 1.370 9.091 1.00 0.00 C ATOM 496 CH2 TRP A 39 14.527 1.809 10.170 1.00 0.00 C ATOM 0 H TRP A 39 11.118 -1.023 3.963 1.00 0.00 H new ATOM 0 HA TRP A 39 11.361 1.729 4.670 1.00 0.00 H new ATOM 0 HB2 TRP A 39 12.562 -0.839 5.340 1.00 0.00 H new ATOM 0 HB3 TRP A 39 13.789 0.402 5.175 1.00 0.00 H new ATOM 0 HD1 TRP A 39 10.224 0.898 6.688 1.00 0.00 H new ATOM 0 HE1 TRP A 39 10.465 1.746 9.120 1.00 0.00 H new ATOM 0 HE3 TRP A 39 15.316 0.655 7.069 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 12.568 2.220 10.923 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 16.373 1.325 9.191 1.00 0.00 H new ATOM 0 HH2 TRP A 39 15.017 2.097 11.088 1.00 0.00 H new ATOM 507 N VAL A 40 12.538 2.600 2.653 1.00 0.00 N ATOM 508 CA VAL A 40 13.341 3.211 1.608 1.00 0.00 C ATOM 509 C VAL A 40 14.546 3.927 2.219 1.00 0.00 C ATOM 510 O VAL A 40 15.524 4.233 1.533 1.00 0.00 O ATOM 511 CB VAL A 40 12.493 4.190 0.760 1.00 0.00 C ATOM 512 CG1 VAL A 40 12.137 5.439 1.550 1.00 0.00 C ATOM 513 CG2 VAL A 40 13.207 4.551 -0.533 1.00 0.00 C ATOM 0 H VAL A 40 11.737 3.157 2.950 1.00 0.00 H new ATOM 0 HA VAL A 40 13.703 2.424 0.947 1.00 0.00 H new ATOM 0 HB VAL A 40 11.563 3.683 0.502 1.00 0.00 H new ATOM 0 HG11 VAL A 40 11.542 6.106 0.927 1.00 0.00 H new ATOM 0 HG12 VAL A 40 11.563 5.159 2.434 1.00 0.00 H new ATOM 0 HG13 VAL A 40 13.051 5.948 1.857 1.00 0.00 H new ATOM 0 HG21 VAL A 40 12.589 5.240 -1.110 1.00 0.00 H new ATOM 0 HG22 VAL A 40 14.161 5.025 -0.302 1.00 0.00 H new ATOM 0 HG23 VAL A 40 13.383 3.647 -1.116 1.00 0.00 H new ATOM 523 N ASP A 41 14.465 4.168 3.522 1.00 0.00 N ATOM 524 CA ASP A 41 15.529 4.826 4.271 1.00 0.00 C ATOM 525 C ASP A 41 15.371 4.492 5.747 1.00 0.00 C ATOM 526 O ASP A 41 14.405 3.832 6.135 1.00 0.00 O ATOM 527 CB ASP A 41 15.492 6.347 4.064 1.00 0.00 C ATOM 528 CG ASP A 41 16.859 6.998 4.200 1.00 0.00 C ATOM 529 OD1 ASP A 41 17.420 6.993 5.317 1.00 0.00 O ATOM 530 OD2 ASP A 41 17.375 7.526 3.194 1.00 0.00 O ATOM 0 H ASP A 41 13.658 3.912 4.090 1.00 0.00 H new ATOM 0 HA ASP A 41 16.493 4.467 3.910 1.00 0.00 H new ATOM 0 HB2 ASP A 41 15.089 6.564 3.075 1.00 0.00 H new ATOM 0 HB3 ASP A 41 14.811 6.791 4.790 1.00 0.00 H new ATOM 535 N THR A 42 16.299 4.945 6.567 1.00 0.00 N ATOM 536 CA THR A 42 16.251 4.686 7.994 1.00 0.00 C ATOM 537 C THR A 42 15.139 5.493 8.650 1.00 0.00 C ATOM 538 O THR A 42 15.341 6.642 9.043 1.00 0.00 O ATOM 539 CB THR A 42 17.596 5.029 8.654 1.00 0.00 C ATOM 540 OG1 THR A 42 18.577 5.291 7.638 1.00 0.00 O ATOM 541 CG2 THR A 42 18.074 3.890 9.538 1.00 0.00 C ATOM 0 H THR A 42 17.102 5.499 6.267 1.00 0.00 H new ATOM 0 HA THR A 42 16.048 3.624 8.134 1.00 0.00 H new ATOM 0 HB THR A 42 17.459 5.914 9.275 1.00 0.00 H new ATOM 0 HG1 THR A 42 19.434 5.511 8.060 1.00 0.00 H new ATOM 0 HG21 THR A 42 19.028 4.158 9.993 1.00 0.00 H new ATOM 0 HG22 THR A 42 17.338 3.703 10.320 1.00 0.00 H new ATOM 0 HG23 THR A 42 18.200 2.990 8.936 1.00 0.00 H new ATOM 549 N GLY A 43 13.958 4.894 8.722 1.00 0.00 N ATOM 550 CA GLY A 43 12.815 5.553 9.321 1.00 0.00 C ATOM 551 C GLY A 43 11.892 6.140 8.274 1.00 0.00 C ATOM 552 O GLY A 43 10.884 6.771 8.598 1.00 0.00 O ATOM 0 H GLY A 43 13.771 3.954 8.372 1.00 0.00 H new ATOM 0 HA2 GLY A 43 12.263 4.839 9.933 1.00 0.00 H new ATOM 0 HA3 GLY A 43 13.159 6.344 9.987 1.00 0.00 H new ATOM 556 N VAL A 44 12.232 5.923 7.011 1.00 0.00 N ATOM 557 CA VAL A 44 11.437 6.439 5.908 1.00 0.00 C ATOM 558 C VAL A 44 10.877 5.297 5.069 1.00 0.00 C ATOM 559 O VAL A 44 11.597 4.359 4.720 1.00 0.00 O ATOM 560 CB VAL A 44 12.257 7.371 4.992 1.00 0.00 C ATOM 561 CG1 VAL A 44 11.348 8.118 4.025 1.00 0.00 C ATOM 562 CG2 VAL A 44 13.079 8.351 5.816 1.00 0.00 C ATOM 0 H VAL A 44 13.055 5.392 6.726 1.00 0.00 H new ATOM 0 HA VAL A 44 10.622 7.012 6.350 1.00 0.00 H new ATOM 0 HB VAL A 44 12.941 6.754 4.410 1.00 0.00 H new ATOM 0 HG11 VAL A 44 11.949 8.769 3.390 1.00 0.00 H new ATOM 0 HG12 VAL A 44 10.810 7.402 3.405 1.00 0.00 H new ATOM 0 HG13 VAL A 44 10.634 8.719 4.588 1.00 0.00 H new ATOM 0 HG21 VAL A 44 13.649 8.998 5.149 1.00 0.00 H new ATOM 0 HG22 VAL A 44 12.413 8.958 6.430 1.00 0.00 H new ATOM 0 HG23 VAL A 44 13.764 7.800 6.460 1.00 0.00 H new ATOM 572 N LEU A 45 9.595 5.379 4.751 1.00 0.00 N ATOM 573 CA LEU A 45 8.938 4.359 3.949 1.00 0.00 C ATOM 574 C LEU A 45 8.442 4.971 2.653 1.00 0.00 C ATOM 575 O LEU A 45 8.183 6.168 2.593 1.00 0.00 O ATOM 576 CB LEU A 45 7.770 3.741 4.721 1.00 0.00 C ATOM 577 CG LEU A 45 8.125 3.215 6.111 1.00 0.00 C ATOM 578 CD1 LEU A 45 7.458 4.060 7.185 1.00 0.00 C ATOM 579 CD2 LEU A 45 7.725 1.754 6.244 1.00 0.00 C ATOM 0 H LEU A 45 8.986 6.145 5.038 1.00 0.00 H new ATOM 0 HA LEU A 45 9.656 3.571 3.723 1.00 0.00 H new ATOM 0 HB2 LEU A 45 6.983 4.489 4.821 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.357 2.921 4.133 1.00 0.00 H new ATOM 0 HG LEU A 45 9.204 3.285 6.245 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.721 3.672 8.169 1.00 0.00 H new ATOM 0 HD12 LEU A 45 7.798 5.092 7.099 1.00 0.00 H new ATOM 0 HD13 LEU A 45 6.376 4.023 7.058 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.985 1.395 7.240 1.00 0.00 H new ATOM 0 HD22 LEU A 45 6.650 1.656 6.092 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.253 1.163 5.496 1.00 0.00 H new ATOM 591 N ALA A 46 8.331 4.156 1.617 1.00 0.00 N ATOM 592 CA ALA A 46 7.867 4.631 0.324 1.00 0.00 C ATOM 593 C ALA A 46 7.226 3.498 -0.465 1.00 0.00 C ATOM 594 O ALA A 46 7.658 2.350 -0.366 1.00 0.00 O ATOM 595 CB ALA A 46 9.022 5.242 -0.449 1.00 0.00 C ATOM 0 H ALA A 46 8.556 3.162 1.646 1.00 0.00 H new ATOM 0 HA ALA A 46 7.110 5.399 0.482 1.00 0.00 H new ATOM 0 HB1 ALA A 46 8.666 5.595 -1.417 1.00 0.00 H new ATOM 0 HB2 ALA A 46 9.434 6.080 0.114 1.00 0.00 H new ATOM 0 HB3 ALA A 46 9.797 4.490 -0.600 1.00 0.00 H new ATOM 601 N CYS A 47 6.191 3.821 -1.232 1.00 0.00 N ATOM 602 CA CYS A 47 5.484 2.823 -2.029 1.00 0.00 C ATOM 603 C CYS A 47 5.714 3.044 -3.515 1.00 0.00 C ATOM 604 O CYS A 47 6.180 4.105 -3.931 1.00 0.00 O ATOM 605 CB CYS A 47 3.978 2.871 -1.759 1.00 0.00 C ATOM 606 SG CYS A 47 3.525 3.251 -0.036 1.00 0.00 S ATOM 0 H CYS A 47 5.822 4.768 -1.319 1.00 0.00 H new ATOM 0 HA CYS A 47 5.878 1.849 -1.740 1.00 0.00 H new ATOM 0 HB2 CYS A 47 3.529 3.620 -2.412 1.00 0.00 H new ATOM 0 HB3 CYS A 47 3.543 1.909 -2.031 1.00 0.00 H new ATOM 611 N ASN A 48 5.393 2.035 -4.307 1.00 0.00 N ATOM 612 CA ASN A 48 5.535 2.121 -5.752 1.00 0.00 C ATOM 613 C ASN A 48 4.246 2.656 -6.364 1.00 0.00 C ATOM 614 O ASN A 48 3.186 2.059 -6.195 1.00 0.00 O ATOM 615 CB ASN A 48 5.870 0.752 -6.342 1.00 0.00 C ATOM 616 CG ASN A 48 6.083 0.807 -7.840 1.00 0.00 C ATOM 617 OD1 ASN A 48 5.182 0.495 -8.617 1.00 0.00 O ATOM 618 ND2 ASN A 48 7.266 1.233 -8.257 1.00 0.00 N ATOM 0 H ASN A 48 5.031 1.142 -3.972 1.00 0.00 H new ATOM 0 HA ASN A 48 6.353 2.803 -5.984 1.00 0.00 H new ATOM 0 HB2 ASN A 48 6.769 0.363 -5.864 1.00 0.00 H new ATOM 0 HB3 ASN A 48 5.063 0.055 -6.118 1.00 0.00 H new ATOM 0 HD21 ASN A 48 7.456 1.312 -9.256 1.00 0.00 H new ATOM 0 HD22 ASN A 48 7.986 1.482 -7.579 1.00 0.00 H new ATOM 625 N PRO A 49 4.317 3.787 -7.081 1.00 0.00 N ATOM 626 CA PRO A 49 3.144 4.408 -7.695 1.00 0.00 C ATOM 627 C PRO A 49 2.792 3.839 -9.070 1.00 0.00 C ATOM 628 O PRO A 49 1.834 4.280 -9.701 1.00 0.00 O ATOM 629 CB PRO A 49 3.575 5.861 -7.824 1.00 0.00 C ATOM 630 CG PRO A 49 5.048 5.792 -8.066 1.00 0.00 C ATOM 631 CD PRO A 49 5.544 4.569 -7.335 1.00 0.00 C ATOM 0 HA PRO A 49 2.245 4.241 -7.102 1.00 0.00 H new ATOM 0 HB2 PRO A 49 3.060 6.357 -8.647 1.00 0.00 H new ATOM 0 HB3 PRO A 49 3.347 6.425 -6.919 1.00 0.00 H new ATOM 0 HG2 PRO A 49 5.263 5.721 -9.132 1.00 0.00 H new ATOM 0 HG3 PRO A 49 5.544 6.691 -7.700 1.00 0.00 H new ATOM 0 HD2 PRO A 49 6.259 4.007 -7.936 1.00 0.00 H new ATOM 0 HD3 PRO A 49 6.048 4.835 -6.406 1.00 0.00 H new ATOM 639 N ALA A 50 3.559 2.867 -9.537 1.00 0.00 N ATOM 640 CA ALA A 50 3.304 2.272 -10.843 1.00 0.00 C ATOM 641 C ALA A 50 2.358 1.083 -10.728 1.00 0.00 C ATOM 642 O ALA A 50 1.352 1.005 -11.431 1.00 0.00 O ATOM 643 CB ALA A 50 4.606 1.858 -11.507 1.00 0.00 C ATOM 0 H ALA A 50 4.357 2.475 -9.038 1.00 0.00 H new ATOM 0 HA ALA A 50 2.823 3.025 -11.467 1.00 0.00 H new ATOM 0 HB1 ALA A 50 4.394 1.416 -12.481 1.00 0.00 H new ATOM 0 HB2 ALA A 50 5.243 2.733 -11.637 1.00 0.00 H new ATOM 0 HB3 ALA A 50 5.117 1.127 -10.881 1.00 0.00 H new ATOM 649 N ASP A 51 2.682 0.163 -9.829 1.00 0.00 N ATOM 650 CA ASP A 51 1.861 -1.025 -9.620 1.00 0.00 C ATOM 651 C ASP A 51 0.910 -0.820 -8.443 1.00 0.00 C ATOM 652 O ASP A 51 0.604 -1.756 -7.705 1.00 0.00 O ATOM 653 CB ASP A 51 2.749 -2.249 -9.371 1.00 0.00 C ATOM 654 CG ASP A 51 2.354 -3.445 -10.224 1.00 0.00 C ATOM 655 OD1 ASP A 51 1.144 -3.657 -10.443 1.00 0.00 O ATOM 656 OD2 ASP A 51 3.258 -4.177 -10.689 1.00 0.00 O ATOM 0 H ASP A 51 3.507 0.215 -9.232 1.00 0.00 H new ATOM 0 HA ASP A 51 1.270 -1.196 -10.520 1.00 0.00 H new ATOM 0 HB2 ASP A 51 3.787 -1.988 -9.578 1.00 0.00 H new ATOM 0 HB3 ASP A 51 2.693 -2.525 -8.318 1.00 0.00 H new ATOM 661 N PHE A 52 0.448 0.411 -8.268 1.00 0.00 N ATOM 662 CA PHE A 52 -0.471 0.737 -7.185 1.00 0.00 C ATOM 663 C PHE A 52 -1.839 1.093 -7.753 1.00 0.00 C ATOM 664 O PHE A 52 -1.956 1.457 -8.925 1.00 0.00 O ATOM 665 CB PHE A 52 0.091 1.886 -6.326 1.00 0.00 C ATOM 666 CG PHE A 52 -0.646 3.197 -6.449 1.00 0.00 C ATOM 667 CD1 PHE A 52 -0.429 4.038 -7.529 1.00 0.00 C ATOM 668 CD2 PHE A 52 -1.556 3.587 -5.476 1.00 0.00 C ATOM 669 CE1 PHE A 52 -1.105 5.236 -7.640 1.00 0.00 C ATOM 670 CE2 PHE A 52 -2.235 4.785 -5.584 1.00 0.00 C ATOM 671 CZ PHE A 52 -2.008 5.610 -6.666 1.00 0.00 C ATOM 0 H PHE A 52 0.695 1.202 -8.863 1.00 0.00 H new ATOM 0 HA PHE A 52 -0.583 -0.135 -6.541 1.00 0.00 H new ATOM 0 HB2 PHE A 52 0.079 1.577 -5.281 1.00 0.00 H new ATOM 0 HB3 PHE A 52 1.134 2.046 -6.599 1.00 0.00 H new ATOM 0 HD1 PHE A 52 0.278 3.752 -8.294 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -1.735 2.947 -4.625 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -0.927 5.880 -8.488 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -2.943 5.076 -4.822 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.537 6.548 -6.751 1.00 0.00 H new ATOM 681 N SER A 53 -2.868 0.997 -6.929 1.00 0.00 N ATOM 682 CA SER A 53 -4.215 1.311 -7.369 1.00 0.00 C ATOM 683 C SER A 53 -4.920 2.223 -6.371 1.00 0.00 C ATOM 684 O SER A 53 -4.905 1.978 -5.163 1.00 0.00 O ATOM 685 CB SER A 53 -5.018 0.024 -7.580 1.00 0.00 C ATOM 686 OG SER A 53 -4.371 -0.832 -8.510 1.00 0.00 O ATOM 0 H SER A 53 -2.796 0.705 -5.954 1.00 0.00 H new ATOM 0 HA SER A 53 -4.147 1.842 -8.319 1.00 0.00 H new ATOM 0 HB2 SER A 53 -5.140 -0.493 -6.628 1.00 0.00 H new ATOM 0 HB3 SER A 53 -6.017 0.269 -7.940 1.00 0.00 H new ATOM 0 HG SER A 53 -4.901 -1.648 -8.627 1.00 0.00 H new ATOM 692 N SER A 54 -5.505 3.295 -6.886 1.00 0.00 N ATOM 693 CA SER A 54 -6.232 4.243 -6.061 1.00 0.00 C ATOM 694 C SER A 54 -7.686 3.806 -5.944 1.00 0.00 C ATOM 695 O SER A 54 -8.495 4.051 -6.843 1.00 0.00 O ATOM 696 CB SER A 54 -6.135 5.648 -6.661 1.00 0.00 C ATOM 697 OG SER A 54 -5.889 5.584 -8.058 1.00 0.00 O ATOM 0 H SER A 54 -5.489 3.529 -7.879 1.00 0.00 H new ATOM 0 HA SER A 54 -5.791 4.268 -5.064 1.00 0.00 H new ATOM 0 HB2 SER A 54 -7.061 6.192 -6.475 1.00 0.00 H new ATOM 0 HB3 SER A 54 -5.335 6.203 -6.171 1.00 0.00 H new ATOM 0 HG SER A 54 -5.832 6.492 -8.422 1.00 0.00 H new ATOM 703 N VAL A 55 -8.005 3.138 -4.852 1.00 0.00 N ATOM 704 CA VAL A 55 -9.353 2.652 -4.625 1.00 0.00 C ATOM 705 C VAL A 55 -10.220 3.753 -4.011 1.00 0.00 C ATOM 706 O VAL A 55 -9.764 4.522 -3.164 1.00 0.00 O ATOM 707 CB VAL A 55 -9.348 1.392 -3.723 1.00 0.00 C ATOM 708 CG1 VAL A 55 -8.925 1.725 -2.300 1.00 0.00 C ATOM 709 CG2 VAL A 55 -10.709 0.715 -3.732 1.00 0.00 C ATOM 0 H VAL A 55 -7.346 2.919 -4.105 1.00 0.00 H new ATOM 0 HA VAL A 55 -9.779 2.371 -5.588 1.00 0.00 H new ATOM 0 HB VAL A 55 -8.614 0.698 -4.134 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -8.933 0.818 -1.696 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.920 2.146 -2.308 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -9.619 2.450 -1.874 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -10.681 -0.167 -3.092 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -11.463 1.409 -3.361 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -10.960 0.417 -4.750 1.00 0.00 H new ATOM 719 N THR A 56 -11.459 3.845 -4.460 1.00 0.00 N ATOM 720 CA THR A 56 -12.371 4.851 -3.952 1.00 0.00 C ATOM 721 C THR A 56 -13.475 4.191 -3.137 1.00 0.00 C ATOM 722 O THR A 56 -13.923 3.088 -3.461 1.00 0.00 O ATOM 723 CB THR A 56 -12.967 5.695 -5.104 1.00 0.00 C ATOM 724 OG1 THR A 56 -13.629 6.853 -4.581 1.00 0.00 O ATOM 725 CG2 THR A 56 -13.947 4.886 -5.945 1.00 0.00 C ATOM 0 H THR A 56 -11.855 3.235 -5.175 1.00 0.00 H new ATOM 0 HA THR A 56 -11.813 5.526 -3.303 1.00 0.00 H new ATOM 0 HB THR A 56 -12.140 6.003 -5.744 1.00 0.00 H new ATOM 0 HG1 THR A 56 -14.000 7.379 -5.320 1.00 0.00 H new ATOM 0 HG21 THR A 56 -14.344 5.512 -6.744 1.00 0.00 H new ATOM 0 HG22 THR A 56 -13.433 4.028 -6.378 1.00 0.00 H new ATOM 0 HG23 THR A 56 -14.766 4.538 -5.315 1.00 0.00 H new ATOM 733 N ALA A 57 -13.894 4.851 -2.066 1.00 0.00 N ATOM 734 CA ALA A 57 -14.936 4.315 -1.210 1.00 0.00 C ATOM 735 C ALA A 57 -16.300 4.456 -1.869 1.00 0.00 C ATOM 736 O ALA A 57 -16.641 5.519 -2.401 1.00 0.00 O ATOM 737 CB ALA A 57 -14.925 5.002 0.145 1.00 0.00 C ATOM 0 H ALA A 57 -13.527 5.756 -1.772 1.00 0.00 H new ATOM 0 HA ALA A 57 -14.737 3.254 -1.058 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -15.714 4.585 0.771 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -13.959 4.844 0.625 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -15.094 6.071 0.012 1.00 0.00 H new ATOM 743 N ASP A 58 -17.066 3.375 -1.840 1.00 0.00 N ATOM 744 CA ASP A 58 -18.402 3.356 -2.428 1.00 0.00 C ATOM 745 C ASP A 58 -19.430 3.970 -1.481 1.00 0.00 C ATOM 746 O ASP A 58 -19.088 4.437 -0.392 1.00 0.00 O ATOM 747 CB ASP A 58 -18.815 1.924 -2.807 1.00 0.00 C ATOM 748 CG ASP A 58 -18.599 0.911 -1.698 1.00 0.00 C ATOM 749 OD1 ASP A 58 -19.142 1.102 -0.589 1.00 0.00 O ATOM 750 OD2 ASP A 58 -17.903 -0.095 -1.941 1.00 0.00 O ATOM 0 H ASP A 58 -16.784 2.493 -1.413 1.00 0.00 H new ATOM 0 HA ASP A 58 -18.371 3.959 -3.336 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -19.868 1.922 -3.088 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -18.250 1.613 -3.686 1.00 0.00 H new ATOM 755 N ALA A 59 -20.696 3.942 -1.889 1.00 0.00 N ATOM 756 CA ALA A 59 -21.781 4.520 -1.098 1.00 0.00 C ATOM 757 C ALA A 59 -22.001 3.785 0.221 1.00 0.00 C ATOM 758 O ALA A 59 -22.653 4.308 1.125 1.00 0.00 O ATOM 759 CB ALA A 59 -23.070 4.528 -1.900 1.00 0.00 C ATOM 0 H ALA A 59 -20.998 3.523 -2.768 1.00 0.00 H new ATOM 0 HA ALA A 59 -21.487 5.542 -0.858 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -23.870 4.961 -1.299 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -22.933 5.122 -2.804 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -23.334 3.507 -2.174 1.00 0.00 H new ATOM 765 N ASN A 60 -21.472 2.575 0.326 1.00 0.00 N ATOM 766 CA ASN A 60 -21.618 1.788 1.544 1.00 0.00 C ATOM 767 C ASN A 60 -20.478 2.104 2.496 1.00 0.00 C ATOM 768 O ASN A 60 -20.534 1.792 3.686 1.00 0.00 O ATOM 769 CB ASN A 60 -21.628 0.286 1.240 1.00 0.00 C ATOM 770 CG ASN A 60 -22.350 -0.059 -0.047 1.00 0.00 C ATOM 771 OD1 ASN A 60 -23.561 -0.268 -0.060 1.00 0.00 O ATOM 772 ND2 ASN A 60 -21.607 -0.128 -1.140 1.00 0.00 N ATOM 0 H ASN A 60 -20.940 2.117 -0.414 1.00 0.00 H new ATOM 0 HA ASN A 60 -22.571 2.050 2.004 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -20.600 -0.073 1.180 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -22.102 -0.242 2.067 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -22.037 -0.362 -2.035 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -20.604 0.053 -1.087 1.00 0.00 H new ATOM 779 N GLY A 61 -19.451 2.742 1.959 1.00 0.00 N ATOM 780 CA GLY A 61 -18.292 3.093 2.746 1.00 0.00 C ATOM 781 C GLY A 61 -17.236 2.015 2.682 1.00 0.00 C ATOM 782 O GLY A 61 -16.461 1.837 3.619 1.00 0.00 O ATOM 0 H GLY A 61 -19.401 3.025 0.980 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -17.876 4.034 2.385 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -18.589 3.253 3.783 1.00 0.00 H new ATOM 786 N SER A 62 -17.215 1.284 1.581 1.00 0.00 N ATOM 787 CA SER A 62 -16.253 0.212 1.403 1.00 0.00 C ATOM 788 C SER A 62 -15.324 0.505 0.232 1.00 0.00 C ATOM 789 O SER A 62 -15.651 1.299 -0.653 1.00 0.00 O ATOM 790 CB SER A 62 -16.980 -1.117 1.179 1.00 0.00 C ATOM 791 OG SER A 62 -18.391 -0.948 1.230 1.00 0.00 O ATOM 0 H SER A 62 -17.854 1.414 0.797 1.00 0.00 H new ATOM 0 HA SER A 62 -15.650 0.140 2.308 1.00 0.00 H new ATOM 0 HB2 SER A 62 -16.696 -1.531 0.212 1.00 0.00 H new ATOM 0 HB3 SER A 62 -16.670 -1.836 1.937 1.00 0.00 H new ATOM 0 HG SER A 62 -18.677 -0.360 0.500 1.00 0.00 H new ATOM 797 N ALA A 63 -14.159 -0.121 0.251 1.00 0.00 N ATOM 798 CA ALA A 63 -13.172 0.042 -0.802 1.00 0.00 C ATOM 799 C ALA A 63 -12.409 -1.260 -0.993 1.00 0.00 C ATOM 800 O ALA A 63 -11.681 -1.696 -0.101 1.00 0.00 O ATOM 801 CB ALA A 63 -12.213 1.172 -0.467 1.00 0.00 C ATOM 0 H ALA A 63 -13.872 -0.756 0.996 1.00 0.00 H new ATOM 0 HA ALA A 63 -13.685 0.296 -1.730 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -11.482 1.278 -1.268 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -12.770 2.102 -0.359 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -11.698 0.947 0.467 1.00 0.00 H new ATOM 807 N SER A 64 -12.590 -1.884 -2.143 1.00 0.00 N ATOM 808 CA SER A 64 -11.924 -3.144 -2.432 1.00 0.00 C ATOM 809 C SER A 64 -11.064 -3.030 -3.688 1.00 0.00 C ATOM 810 O SER A 64 -11.518 -2.532 -4.718 1.00 0.00 O ATOM 811 CB SER A 64 -12.968 -4.249 -2.597 1.00 0.00 C ATOM 812 OG SER A 64 -14.012 -4.110 -1.644 1.00 0.00 O ATOM 0 H SER A 64 -13.191 -1.541 -2.892 1.00 0.00 H new ATOM 0 HA SER A 64 -11.267 -3.393 -1.599 1.00 0.00 H new ATOM 0 HB2 SER A 64 -13.383 -4.214 -3.604 1.00 0.00 H new ATOM 0 HB3 SER A 64 -12.493 -5.223 -2.482 1.00 0.00 H new ATOM 0 HG SER A 64 -14.668 -4.827 -1.771 1.00 0.00 H new ATOM 818 N THR A 65 -9.820 -3.477 -3.591 1.00 0.00 N ATOM 819 CA THR A 65 -8.893 -3.431 -4.711 1.00 0.00 C ATOM 820 C THR A 65 -7.845 -4.540 -4.579 1.00 0.00 C ATOM 821 O THR A 65 -7.741 -5.183 -3.530 1.00 0.00 O ATOM 822 CB THR A 65 -8.208 -2.049 -4.807 1.00 0.00 C ATOM 823 OG1 THR A 65 -7.513 -1.925 -6.054 1.00 0.00 O ATOM 824 CG2 THR A 65 -7.235 -1.830 -3.657 1.00 0.00 C ATOM 0 H THR A 65 -9.428 -3.879 -2.740 1.00 0.00 H new ATOM 0 HA THR A 65 -9.459 -3.591 -5.628 1.00 0.00 H new ATOM 0 HB THR A 65 -8.987 -1.289 -4.747 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.221 -0.997 -6.175 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.771 -0.849 -3.755 1.00 0.00 H new ATOM 0 HG22 THR A 65 -7.773 -1.884 -2.710 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.464 -2.600 -3.681 1.00 0.00 H new ATOM 832 N SER A 66 -7.078 -4.764 -5.640 1.00 0.00 N ATOM 833 CA SER A 66 -6.048 -5.796 -5.642 1.00 0.00 C ATOM 834 C SER A 66 -4.692 -5.201 -6.011 1.00 0.00 C ATOM 835 O SER A 66 -4.576 -4.450 -6.982 1.00 0.00 O ATOM 836 CB SER A 66 -6.417 -6.900 -6.631 1.00 0.00 C ATOM 837 OG SER A 66 -7.822 -7.078 -6.684 1.00 0.00 O ATOM 0 H SER A 66 -7.151 -4.242 -6.513 1.00 0.00 H new ATOM 0 HA SER A 66 -5.981 -6.219 -4.640 1.00 0.00 H new ATOM 0 HB2 SER A 66 -6.040 -6.648 -7.622 1.00 0.00 H new ATOM 0 HB3 SER A 66 -5.938 -7.834 -6.336 1.00 0.00 H new ATOM 0 HG SER A 66 -8.038 -7.788 -7.324 1.00 0.00 H new ATOM 843 N LEU A 67 -3.671 -5.541 -5.234 1.00 0.00 N ATOM 844 CA LEU A 67 -2.322 -5.036 -5.471 1.00 0.00 C ATOM 845 C LEU A 67 -1.376 -6.165 -5.867 1.00 0.00 C ATOM 846 O LEU A 67 -1.505 -7.287 -5.386 1.00 0.00 O ATOM 847 CB LEU A 67 -1.785 -4.338 -4.214 1.00 0.00 C ATOM 848 CG LEU A 67 -2.081 -2.837 -4.093 1.00 0.00 C ATOM 849 CD1 LEU A 67 -1.509 -2.081 -5.275 1.00 0.00 C ATOM 850 CD2 LEU A 67 -3.575 -2.585 -3.973 1.00 0.00 C ATOM 0 H LEU A 67 -3.751 -6.166 -4.432 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.374 -4.319 -6.290 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.199 -4.840 -3.340 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.705 -4.478 -4.180 1.00 0.00 H new ATOM 0 HG LEU A 67 -1.601 -2.472 -3.185 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -1.730 -1.019 -5.169 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.429 -2.225 -5.311 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.956 -2.455 -6.196 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -3.758 -1.514 -3.889 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -4.081 -2.971 -4.858 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -3.959 -3.089 -3.086 1.00 0.00 H new ATOM 862 N THR A 68 -0.434 -5.864 -6.745 1.00 0.00 N ATOM 863 CA THR A 68 0.542 -6.847 -7.183 1.00 0.00 C ATOM 864 C THR A 68 1.895 -6.546 -6.545 1.00 0.00 C ATOM 865 O THR A 68 2.621 -5.657 -6.987 1.00 0.00 O ATOM 866 CB THR A 68 0.677 -6.860 -8.714 1.00 0.00 C ATOM 867 OG1 THR A 68 -0.620 -6.717 -9.316 1.00 0.00 O ATOM 868 CG2 THR A 68 1.319 -8.153 -9.186 1.00 0.00 C ATOM 0 H THR A 68 -0.325 -4.943 -7.170 1.00 0.00 H new ATOM 0 HA THR A 68 0.197 -7.832 -6.868 1.00 0.00 H new ATOM 0 HB THR A 68 1.313 -6.027 -9.013 1.00 0.00 H new ATOM 0 HG1 THR A 68 -0.530 -6.724 -10.292 1.00 0.00 H new ATOM 0 HG21 THR A 68 1.405 -8.141 -10.273 1.00 0.00 H new ATOM 0 HG22 THR A 68 2.311 -8.249 -8.745 1.00 0.00 H new ATOM 0 HG23 THR A 68 0.702 -8.998 -8.880 1.00 0.00 H new ATOM 876 N VAL A 69 2.212 -7.275 -5.486 1.00 0.00 N ATOM 877 CA VAL A 69 3.466 -7.080 -4.766 1.00 0.00 C ATOM 878 C VAL A 69 4.665 -7.609 -5.562 1.00 0.00 C ATOM 879 O VAL A 69 4.766 -8.802 -5.855 1.00 0.00 O ATOM 880 CB VAL A 69 3.423 -7.734 -3.359 1.00 0.00 C ATOM 881 CG1 VAL A 69 3.053 -9.211 -3.434 1.00 0.00 C ATOM 882 CG2 VAL A 69 4.747 -7.541 -2.627 1.00 0.00 C ATOM 0 H VAL A 69 1.617 -8.010 -5.103 1.00 0.00 H new ATOM 0 HA VAL A 69 3.592 -6.005 -4.639 1.00 0.00 H new ATOM 0 HB VAL A 69 2.642 -7.230 -2.790 1.00 0.00 H new ATOM 0 HG11 VAL A 69 3.034 -9.633 -2.429 1.00 0.00 H new ATOM 0 HG12 VAL A 69 2.069 -9.317 -3.891 1.00 0.00 H new ATOM 0 HG13 VAL A 69 3.791 -9.741 -4.036 1.00 0.00 H new ATOM 0 HG21 VAL A 69 4.691 -8.008 -1.644 1.00 0.00 H new ATOM 0 HG22 VAL A 69 5.551 -8.001 -3.202 1.00 0.00 H new ATOM 0 HG23 VAL A 69 4.947 -6.476 -2.511 1.00 0.00 H new ATOM 892 N ARG A 70 5.556 -6.702 -5.934 1.00 0.00 N ATOM 893 CA ARG A 70 6.752 -7.063 -6.675 1.00 0.00 C ATOM 894 C ARG A 70 7.919 -7.286 -5.715 1.00 0.00 C ATOM 895 O ARG A 70 7.861 -6.887 -4.549 1.00 0.00 O ATOM 896 CB ARG A 70 7.108 -5.971 -7.689 1.00 0.00 C ATOM 897 CG ARG A 70 5.999 -5.673 -8.694 1.00 0.00 C ATOM 898 CD ARG A 70 5.642 -6.900 -9.519 1.00 0.00 C ATOM 899 NE ARG A 70 4.616 -6.618 -10.521 1.00 0.00 N ATOM 900 CZ ARG A 70 4.270 -7.467 -11.488 1.00 0.00 C ATOM 901 NH1 ARG A 70 4.861 -8.654 -11.589 1.00 0.00 N ATOM 902 NH2 ARG A 70 3.330 -7.131 -12.354 1.00 0.00 N ATOM 0 H ARG A 70 5.471 -5.706 -5.733 1.00 0.00 H new ATOM 0 HA ARG A 70 6.556 -7.989 -7.216 1.00 0.00 H new ATOM 0 HB2 ARG A 70 7.352 -5.055 -7.151 1.00 0.00 H new ATOM 0 HB3 ARG A 70 8.005 -6.271 -8.231 1.00 0.00 H new ATOM 0 HG2 ARG A 70 5.114 -5.320 -8.165 1.00 0.00 H new ATOM 0 HG3 ARG A 70 6.316 -4.868 -9.357 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.538 -7.274 -10.015 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.291 -7.691 -8.856 1.00 0.00 H new ATOM 0 HE ARG A 70 4.137 -5.719 -10.478 1.00 0.00 H new ATOM 0 HH11 ARG A 70 5.586 -8.921 -10.923 1.00 0.00 H new ATOM 0 HH12 ARG A 70 4.589 -9.297 -12.333 1.00 0.00 H new ATOM 0 HH21 ARG A 70 2.871 -6.223 -12.282 1.00 0.00 H new ATOM 0 HH22 ARG A 70 3.064 -7.780 -13.095 1.00 0.00 H new ATOM 916 N ARG A 71 8.968 -7.926 -6.211 1.00 0.00 N ATOM 917 CA ARG A 71 10.152 -8.216 -5.409 1.00 0.00 C ATOM 918 C ARG A 71 10.931 -6.940 -5.092 1.00 0.00 C ATOM 919 O ARG A 71 11.362 -6.725 -3.961 1.00 0.00 O ATOM 920 CB ARG A 71 11.045 -9.213 -6.151 1.00 0.00 C ATOM 921 CG ARG A 71 12.239 -9.705 -5.344 1.00 0.00 C ATOM 922 CD ARG A 71 11.844 -10.772 -4.337 1.00 0.00 C ATOM 923 NE ARG A 71 11.203 -11.919 -4.977 1.00 0.00 N ATOM 924 CZ ARG A 71 11.148 -13.142 -4.443 1.00 0.00 C ATOM 925 NH1 ARG A 71 11.745 -13.393 -3.284 1.00 0.00 N ATOM 926 NH2 ARG A 71 10.493 -14.110 -5.067 1.00 0.00 N ATOM 0 H ARG A 71 9.025 -8.258 -7.174 1.00 0.00 H new ATOM 0 HA ARG A 71 9.830 -8.653 -4.464 1.00 0.00 H new ATOM 0 HB2 ARG A 71 10.443 -10.072 -6.447 1.00 0.00 H new ATOM 0 HB3 ARG A 71 11.408 -8.747 -7.067 1.00 0.00 H new ATOM 0 HG2 ARG A 71 12.993 -10.106 -6.021 1.00 0.00 H new ATOM 0 HG3 ARG A 71 12.695 -8.864 -4.821 1.00 0.00 H new ATOM 0 HD2 ARG A 71 12.730 -11.106 -3.797 1.00 0.00 H new ATOM 0 HD3 ARG A 71 11.165 -10.342 -3.601 1.00 0.00 H new ATOM 0 HE ARG A 71 10.770 -11.776 -5.890 1.00 0.00 H new ATOM 0 HH11 ARG A 71 12.248 -12.651 -2.798 1.00 0.00 H new ATOM 0 HH12 ARG A 71 11.701 -14.328 -2.880 1.00 0.00 H new ATOM 0 HH21 ARG A 71 10.030 -13.922 -5.956 1.00 0.00 H new ATOM 0 HH22 ARG A 71 10.452 -15.044 -4.658 1.00 0.00 H new ATOM 940 N SER A 72 11.107 -6.104 -6.100 1.00 0.00 N ATOM 941 CA SER A 72 11.820 -4.846 -5.951 1.00 0.00 C ATOM 942 C SER A 72 11.020 -3.742 -6.636 1.00 0.00 C ATOM 943 O SER A 72 10.358 -3.995 -7.642 1.00 0.00 O ATOM 944 CB SER A 72 13.215 -4.963 -6.565 1.00 0.00 C ATOM 945 OG SER A 72 13.753 -6.262 -6.352 1.00 0.00 O ATOM 0 H SER A 72 10.761 -6.277 -7.044 1.00 0.00 H new ATOM 0 HA SER A 72 11.933 -4.604 -4.894 1.00 0.00 H new ATOM 0 HB2 SER A 72 13.165 -4.756 -7.634 1.00 0.00 H new ATOM 0 HB3 SER A 72 13.875 -4.215 -6.126 1.00 0.00 H new ATOM 0 HG SER A 72 14.251 -6.276 -5.508 1.00 0.00 H new ATOM 951 N PHE A 73 11.079 -2.523 -6.111 1.00 0.00 N ATOM 952 CA PHE A 73 10.309 -1.426 -6.691 1.00 0.00 C ATOM 953 C PHE A 73 10.888 -0.065 -6.326 1.00 0.00 C ATOM 954 O PHE A 73 11.646 0.061 -5.365 1.00 0.00 O ATOM 955 CB PHE A 73 8.861 -1.493 -6.191 1.00 0.00 C ATOM 956 CG PHE A 73 8.732 -1.313 -4.696 1.00 0.00 C ATOM 957 CD1 PHE A 73 8.862 -2.397 -3.840 1.00 0.00 C ATOM 958 CD2 PHE A 73 8.492 -0.061 -4.148 1.00 0.00 C ATOM 959 CE1 PHE A 73 8.754 -2.236 -2.474 1.00 0.00 C ATOM 960 CE2 PHE A 73 8.383 0.104 -2.781 1.00 0.00 C ATOM 961 CZ PHE A 73 8.513 -0.982 -1.944 1.00 0.00 C ATOM 0 H PHE A 73 11.642 -2.271 -5.299 1.00 0.00 H new ATOM 0 HA PHE A 73 10.351 -1.537 -7.775 1.00 0.00 H new ATOM 0 HB2 PHE A 73 8.275 -0.724 -6.694 1.00 0.00 H new ATOM 0 HB3 PHE A 73 8.432 -2.455 -6.472 1.00 0.00 H new ATOM 0 HD1 PHE A 73 9.050 -3.379 -4.248 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.389 0.795 -4.798 1.00 0.00 H new ATOM 0 HE1 PHE A 73 8.858 -3.089 -1.819 1.00 0.00 H new ATOM 0 HE2 PHE A 73 8.196 1.084 -2.369 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.427 -0.854 -0.875 1.00 0.00 H new ATOM 971 N GLU A 74 10.527 0.948 -7.099 1.00 0.00 N ATOM 972 CA GLU A 74 10.962 2.307 -6.823 1.00 0.00 C ATOM 973 C GLU A 74 10.049 2.912 -5.765 1.00 0.00 C ATOM 974 O GLU A 74 8.830 2.940 -5.937 1.00 0.00 O ATOM 975 CB GLU A 74 10.927 3.164 -8.086 1.00 0.00 C ATOM 976 CG GLU A 74 11.641 2.535 -9.269 1.00 0.00 C ATOM 977 CD GLU A 74 10.684 1.992 -10.305 1.00 0.00 C ATOM 978 OE1 GLU A 74 10.071 0.932 -10.061 1.00 0.00 O ATOM 979 OE2 GLU A 74 10.531 2.633 -11.370 1.00 0.00 O ATOM 0 H GLU A 74 9.933 0.854 -7.923 1.00 0.00 H new ATOM 0 HA GLU A 74 11.991 2.281 -6.463 1.00 0.00 H new ATOM 0 HB2 GLU A 74 9.888 3.353 -8.358 1.00 0.00 H new ATOM 0 HB3 GLU A 74 11.381 4.131 -7.871 1.00 0.00 H new ATOM 0 HG2 GLU A 74 12.290 3.277 -9.733 1.00 0.00 H new ATOM 0 HG3 GLU A 74 12.282 1.728 -8.914 1.00 0.00 H new ATOM 986 N GLY A 75 10.637 3.383 -4.678 1.00 0.00 N ATOM 987 CA GLY A 75 9.856 3.955 -3.603 1.00 0.00 C ATOM 988 C GLY A 75 9.582 5.434 -3.788 1.00 0.00 C ATOM 989 O GLY A 75 10.502 6.220 -4.044 1.00 0.00 O ATOM 0 H GLY A 75 11.645 3.379 -4.520 1.00 0.00 H new ATOM 0 HA2 GLY A 75 8.908 3.423 -3.528 1.00 0.00 H new ATOM 0 HA3 GLY A 75 10.382 3.804 -2.660 1.00 0.00 H new ATOM 993 N PHE A 76 8.320 5.815 -3.640 1.00 0.00 N ATOM 994 CA PHE A 76 7.910 7.202 -3.791 1.00 0.00 C ATOM 995 C PHE A 76 7.169 7.653 -2.542 1.00 0.00 C ATOM 996 O PHE A 76 6.457 6.865 -1.921 1.00 0.00 O ATOM 997 CB PHE A 76 7.001 7.369 -5.017 1.00 0.00 C ATOM 998 CG PHE A 76 7.729 7.419 -6.338 1.00 0.00 C ATOM 999 CD1 PHE A 76 8.531 6.366 -6.749 1.00 0.00 C ATOM 1000 CD2 PHE A 76 7.601 8.519 -7.170 1.00 0.00 C ATOM 1001 CE1 PHE A 76 9.191 6.409 -7.962 1.00 0.00 C ATOM 1002 CE2 PHE A 76 8.260 8.567 -8.386 1.00 0.00 C ATOM 1003 CZ PHE A 76 9.056 7.509 -8.782 1.00 0.00 C ATOM 0 H PHE A 76 7.558 5.176 -3.414 1.00 0.00 H new ATOM 0 HA PHE A 76 8.800 7.814 -3.932 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.290 6.543 -5.040 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.422 8.285 -4.901 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.641 5.500 -6.113 1.00 0.00 H new ATOM 0 HD2 PHE A 76 6.980 9.349 -6.866 1.00 0.00 H new ATOM 0 HE1 PHE A 76 9.813 5.581 -8.268 1.00 0.00 H new ATOM 0 HE2 PHE A 76 8.152 9.431 -9.025 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.571 7.544 -9.731 1.00 0.00 H new ATOM 1013 N LEU A 77 7.350 8.911 -2.166 1.00 0.00 N ATOM 1014 CA LEU A 77 6.681 9.454 -0.997 1.00 0.00 C ATOM 1015 C LEU A 77 5.199 9.673 -1.297 1.00 0.00 C ATOM 1016 O LEU A 77 4.761 9.545 -2.443 1.00 0.00 O ATOM 1017 CB LEU A 77 7.333 10.775 -0.572 1.00 0.00 C ATOM 1018 CG LEU A 77 8.817 10.696 -0.204 1.00 0.00 C ATOM 1019 CD1 LEU A 77 9.290 12.025 0.366 1.00 0.00 C ATOM 1020 CD2 LEU A 77 9.074 9.573 0.789 1.00 0.00 C ATOM 0 H LEU A 77 7.954 9.572 -2.654 1.00 0.00 H new ATOM 0 HA LEU A 77 6.776 8.741 -0.178 1.00 0.00 H new ATOM 0 HB2 LEU A 77 7.217 11.494 -1.383 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.786 11.170 0.284 1.00 0.00 H new ATOM 0 HG LEU A 77 9.381 10.481 -1.111 1.00 0.00 H new ATOM 0 HD11 LEU A 77 10.347 11.955 0.623 1.00 0.00 H new ATOM 0 HD12 LEU A 77 9.149 12.810 -0.377 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.714 12.263 1.260 1.00 0.00 H new ATOM 0 HD21 LEU A 77 10.136 9.539 1.033 1.00 0.00 H new ATOM 0 HD22 LEU A 77 8.498 9.751 1.697 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.772 8.622 0.349 1.00 0.00 H new ATOM 1032 N PHE A 78 4.434 10.037 -0.280 1.00 0.00 N ATOM 1033 CA PHE A 78 3.002 10.258 -0.449 1.00 0.00 C ATOM 1034 C PHE A 78 2.734 11.569 -1.177 1.00 0.00 C ATOM 1035 O PHE A 78 1.617 11.829 -1.621 1.00 0.00 O ATOM 1036 CB PHE A 78 2.292 10.246 0.903 1.00 0.00 C ATOM 1037 CG PHE A 78 1.159 9.262 0.962 1.00 0.00 C ATOM 1038 CD1 PHE A 78 -0.103 9.615 0.516 1.00 0.00 C ATOM 1039 CD2 PHE A 78 1.363 7.983 1.452 1.00 0.00 C ATOM 1040 CE1 PHE A 78 -1.143 8.708 0.558 1.00 0.00 C ATOM 1041 CE2 PHE A 78 0.324 7.072 1.500 1.00 0.00 C ATOM 1042 CZ PHE A 78 -0.931 7.435 1.050 1.00 0.00 C ATOM 0 H PHE A 78 4.777 10.186 0.669 1.00 0.00 H new ATOM 0 HA PHE A 78 2.606 9.444 -1.056 1.00 0.00 H new ATOM 0 HB2 PHE A 78 3.014 10.008 1.684 1.00 0.00 H new ATOM 0 HB3 PHE A 78 1.910 11.245 1.116 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -0.276 10.609 0.132 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.344 7.694 1.800 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -2.123 8.994 0.206 1.00 0.00 H new ATOM 0 HE2 PHE A 78 0.493 6.079 1.888 1.00 0.00 H new ATOM 0 HZ PHE A 78 -1.744 6.725 1.083 1.00 0.00 H new ATOM 1052 N ASP A 79 3.767 12.391 -1.294 1.00 0.00 N ATOM 1053 CA ASP A 79 3.645 13.667 -1.986 1.00 0.00 C ATOM 1054 C ASP A 79 3.947 13.496 -3.472 1.00 0.00 C ATOM 1055 O ASP A 79 3.581 14.335 -4.291 1.00 0.00 O ATOM 1056 CB ASP A 79 4.582 14.710 -1.364 1.00 0.00 C ATOM 1057 CG ASP A 79 5.897 14.845 -2.105 1.00 0.00 C ATOM 1058 OD1 ASP A 79 6.748 13.943 -1.984 1.00 0.00 O ATOM 1059 OD2 ASP A 79 6.091 15.859 -2.809 1.00 0.00 O ATOM 0 H ASP A 79 4.696 12.199 -0.920 1.00 0.00 H new ATOM 0 HA ASP A 79 2.620 14.021 -1.879 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.080 15.677 -1.348 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.782 14.438 -0.328 1.00 0.00 H new ATOM 1064 N GLY A 80 4.604 12.391 -3.813 1.00 0.00 N ATOM 1065 CA GLY A 80 4.941 12.129 -5.201 1.00 0.00 C ATOM 1066 C GLY A 80 6.434 12.196 -5.473 1.00 0.00 C ATOM 1067 O GLY A 80 6.881 11.931 -6.591 1.00 0.00 O ATOM 0 H GLY A 80 4.908 11.674 -3.155 1.00 0.00 H new ATOM 0 HA2 GLY A 80 4.571 11.142 -5.479 1.00 0.00 H new ATOM 0 HA3 GLY A 80 4.429 12.852 -5.836 1.00 0.00 H new ATOM 1071 N THR A 81 7.211 12.544 -4.461 1.00 0.00 N ATOM 1072 CA THR A 81 8.654 12.637 -4.611 1.00 0.00 C ATOM 1073 C THR A 81 9.317 11.283 -4.395 1.00 0.00 C ATOM 1074 O THR A 81 9.069 10.614 -3.394 1.00 0.00 O ATOM 1075 CB THR A 81 9.232 13.659 -3.622 1.00 0.00 C ATOM 1076 OG1 THR A 81 8.547 14.904 -3.785 1.00 0.00 O ATOM 1077 CG2 THR A 81 10.725 13.858 -3.838 1.00 0.00 C ATOM 0 H THR A 81 6.867 12.767 -3.527 1.00 0.00 H new ATOM 0 HA THR A 81 8.861 12.966 -5.629 1.00 0.00 H new ATOM 0 HB THR A 81 9.090 13.282 -2.609 1.00 0.00 H new ATOM 0 HG1 THR A 81 8.909 15.562 -3.155 1.00 0.00 H new ATOM 0 HG21 THR A 81 11.102 14.588 -3.121 1.00 0.00 H new ATOM 0 HG22 THR A 81 11.243 12.909 -3.697 1.00 0.00 H new ATOM 0 HG23 THR A 81 10.901 14.220 -4.851 1.00 0.00 H new ATOM 1085 N ARG A 82 10.142 10.874 -5.350 1.00 0.00 N ATOM 1086 CA ARG A 82 10.844 9.601 -5.264 1.00 0.00 C ATOM 1087 C ARG A 82 12.013 9.705 -4.290 1.00 0.00 C ATOM 1088 O ARG A 82 12.709 10.720 -4.256 1.00 0.00 O ATOM 1089 CB ARG A 82 11.345 9.172 -6.647 1.00 0.00 C ATOM 1090 CG ARG A 82 12.158 10.238 -7.364 1.00 0.00 C ATOM 1091 CD ARG A 82 12.363 9.888 -8.827 1.00 0.00 C ATOM 1092 NE ARG A 82 13.111 10.928 -9.534 1.00 0.00 N ATOM 1093 CZ ARG A 82 12.543 11.880 -10.277 1.00 0.00 C ATOM 1094 NH1 ARG A 82 11.220 11.960 -10.374 1.00 0.00 N ATOM 1095 NH2 ARG A 82 13.297 12.768 -10.909 1.00 0.00 N ATOM 0 H ARG A 82 10.342 11.408 -6.196 1.00 0.00 H new ATOM 0 HA ARG A 82 10.148 8.847 -4.896 1.00 0.00 H new ATOM 0 HB2 ARG A 82 11.954 8.275 -6.540 1.00 0.00 H new ATOM 0 HB3 ARG A 82 10.489 8.904 -7.266 1.00 0.00 H new ATOM 0 HG2 ARG A 82 11.650 11.199 -7.286 1.00 0.00 H new ATOM 0 HG3 ARG A 82 13.126 10.349 -6.876 1.00 0.00 H new ATOM 0 HD2 ARG A 82 12.897 8.941 -8.903 1.00 0.00 H new ATOM 0 HD3 ARG A 82 11.394 9.747 -9.306 1.00 0.00 H new ATOM 0 HE ARG A 82 14.128 10.925 -9.454 1.00 0.00 H new ATOM 0 HH11 ARG A 82 10.631 11.291 -9.878 1.00 0.00 H new ATOM 0 HH12 ARG A 82 10.794 12.691 -10.944 1.00 0.00 H new ATOM 0 HH21 ARG A 82 14.313 12.724 -10.828 1.00 0.00 H new ATOM 0 HH22 ARG A 82 12.861 13.495 -11.477 1.00 0.00 H new ATOM 1109 N TRP A 83 12.225 8.662 -3.500 1.00 0.00 N ATOM 1110 CA TRP A 83 13.312 8.649 -2.531 1.00 0.00 C ATOM 1111 C TRP A 83 14.422 7.707 -2.995 1.00 0.00 C ATOM 1112 O TRP A 83 15.604 7.991 -2.818 1.00 0.00 O ATOM 1113 CB TRP A 83 12.795 8.230 -1.150 1.00 0.00 C ATOM 1114 CG TRP A 83 13.721 8.591 -0.020 1.00 0.00 C ATOM 1115 CD1 TRP A 83 14.775 7.856 0.441 1.00 0.00 C ATOM 1116 CD2 TRP A 83 13.675 9.773 0.790 1.00 0.00 C ATOM 1117 NE1 TRP A 83 15.389 8.508 1.484 1.00 0.00 N ATOM 1118 CE2 TRP A 83 14.731 9.688 1.718 1.00 0.00 C ATOM 1119 CE3 TRP A 83 12.844 10.895 0.818 1.00 0.00 C ATOM 1120 CZ2 TRP A 83 14.974 10.681 2.665 1.00 0.00 C ATOM 1121 CZ3 TRP A 83 13.086 11.881 1.757 1.00 0.00 C ATOM 1122 CH2 TRP A 83 14.144 11.768 2.669 1.00 0.00 C ATOM 0 H TRP A 83 11.659 7.814 -3.511 1.00 0.00 H new ATOM 0 HA TRP A 83 13.721 9.657 -2.453 1.00 0.00 H new ATOM 0 HB2 TRP A 83 11.826 8.699 -0.977 1.00 0.00 H new ATOM 0 HB3 TRP A 83 12.633 7.152 -1.145 1.00 0.00 H new ATOM 0 HD1 TRP A 83 15.082 6.900 0.044 1.00 0.00 H new ATOM 0 HE1 TRP A 83 16.201 8.169 2.000 1.00 0.00 H new ATOM 0 HE3 TRP A 83 12.027 10.991 0.119 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 15.788 10.595 3.370 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 12.449 12.753 1.788 1.00 0.00 H new ATOM 0 HH2 TRP A 83 14.307 12.555 3.390 1.00 0.00 H new ATOM 1133 N GLY A 84 14.036 6.589 -3.594 1.00 0.00 N ATOM 1134 CA GLY A 84 15.011 5.629 -4.078 1.00 0.00 C ATOM 1135 C GLY A 84 14.378 4.294 -4.391 1.00 0.00 C ATOM 1136 O GLY A 84 13.184 4.110 -4.167 1.00 0.00 O ATOM 0 H GLY A 84 13.063 6.328 -3.754 1.00 0.00 H new ATOM 0 HA2 GLY A 84 15.493 6.021 -4.973 1.00 0.00 H new ATOM 0 HA3 GLY A 84 15.791 5.494 -3.329 1.00 0.00 H new ATOM 1140 N THR A 85 15.166 3.363 -4.901 1.00 0.00 N ATOM 1141 CA THR A 85 14.663 2.044 -5.243 1.00 0.00 C ATOM 1142 C THR A 85 14.844 1.077 -4.073 1.00 0.00 C ATOM 1143 O THR A 85 15.940 0.945 -3.525 1.00 0.00 O ATOM 1144 CB THR A 85 15.371 1.500 -6.496 1.00 0.00 C ATOM 1145 OG1 THR A 85 15.534 2.557 -7.453 1.00 0.00 O ATOM 1146 CG2 THR A 85 14.572 0.366 -7.123 1.00 0.00 C ATOM 0 H THR A 85 16.160 3.497 -5.088 1.00 0.00 H new ATOM 0 HA THR A 85 13.598 2.134 -5.458 1.00 0.00 H new ATOM 0 HB THR A 85 16.346 1.114 -6.200 1.00 0.00 H new ATOM 0 HG1 THR A 85 15.987 2.210 -8.250 1.00 0.00 H new ATOM 0 HG21 THR A 85 15.094 -0.001 -8.007 1.00 0.00 H new ATOM 0 HG22 THR A 85 14.464 -0.445 -6.402 1.00 0.00 H new ATOM 0 HG23 THR A 85 13.586 0.731 -7.409 1.00 0.00 H new ATOM 1154 N VAL A 86 13.764 0.406 -3.695 1.00 0.00 N ATOM 1155 CA VAL A 86 13.790 -0.531 -2.577 1.00 0.00 C ATOM 1156 C VAL A 86 13.715 -1.970 -3.070 1.00 0.00 C ATOM 1157 O VAL A 86 13.098 -2.256 -4.098 1.00 0.00 O ATOM 1158 CB VAL A 86 12.619 -0.286 -1.598 1.00 0.00 C ATOM 1159 CG1 VAL A 86 12.993 -0.731 -0.191 1.00 0.00 C ATOM 1160 CG2 VAL A 86 12.189 1.175 -1.609 1.00 0.00 C ATOM 0 H VAL A 86 12.854 0.493 -4.148 1.00 0.00 H new ATOM 0 HA VAL A 86 14.733 -0.366 -2.055 1.00 0.00 H new ATOM 0 HB VAL A 86 11.771 -0.884 -1.932 1.00 0.00 H new ATOM 0 HG11 VAL A 86 12.155 -0.550 0.483 1.00 0.00 H new ATOM 0 HG12 VAL A 86 13.231 -1.795 -0.197 1.00 0.00 H new ATOM 0 HG13 VAL A 86 13.861 -0.167 0.150 1.00 0.00 H new ATOM 0 HG21 VAL A 86 11.364 1.317 -0.911 1.00 0.00 H new ATOM 0 HG22 VAL A 86 13.028 1.804 -1.311 1.00 0.00 H new ATOM 0 HG23 VAL A 86 11.867 1.452 -2.613 1.00 0.00 H new ATOM 1170 N ASP A 87 14.343 -2.870 -2.330 1.00 0.00 N ATOM 1171 CA ASP A 87 14.344 -4.281 -2.672 1.00 0.00 C ATOM 1172 C ASP A 87 13.819 -5.099 -1.504 1.00 0.00 C ATOM 1173 O ASP A 87 14.266 -4.928 -0.371 1.00 0.00 O ATOM 1174 CB ASP A 87 15.755 -4.735 -3.038 1.00 0.00 C ATOM 1175 CG ASP A 87 15.821 -6.218 -3.312 1.00 0.00 C ATOM 1176 OD1 ASP A 87 16.055 -6.988 -2.361 1.00 0.00 O ATOM 1177 OD2 ASP A 87 15.636 -6.620 -4.479 1.00 0.00 O ATOM 0 H ASP A 87 14.862 -2.644 -1.482 1.00 0.00 H new ATOM 0 HA ASP A 87 13.693 -4.434 -3.533 1.00 0.00 H new ATOM 0 HB2 ASP A 87 16.094 -4.189 -3.918 1.00 0.00 H new ATOM 0 HB3 ASP A 87 16.438 -4.486 -2.226 1.00 0.00 H new ATOM 1182 N CYS A 88 12.871 -5.979 -1.772 1.00 0.00 N ATOM 1183 CA CYS A 88 12.287 -6.805 -0.729 1.00 0.00 C ATOM 1184 C CYS A 88 12.755 -8.253 -0.829 1.00 0.00 C ATOM 1185 O CYS A 88 12.092 -9.166 -0.330 1.00 0.00 O ATOM 1186 CB CYS A 88 10.760 -6.727 -0.783 1.00 0.00 C ATOM 1187 SG CYS A 88 10.090 -5.135 -0.199 1.00 0.00 S ATOM 0 H CYS A 88 12.488 -6.141 -2.704 1.00 0.00 H new ATOM 0 HA CYS A 88 12.626 -6.418 0.232 1.00 0.00 H new ATOM 0 HB2 CYS A 88 10.432 -6.896 -1.809 1.00 0.00 H new ATOM 0 HB3 CYS A 88 10.342 -7.532 -0.178 1.00 0.00 H new ATOM 1192 N THR A 89 13.894 -8.465 -1.473 1.00 0.00 N ATOM 1193 CA THR A 89 14.454 -9.800 -1.599 1.00 0.00 C ATOM 1194 C THR A 89 15.177 -10.157 -0.307 1.00 0.00 C ATOM 1195 O THR A 89 15.044 -11.260 0.219 1.00 0.00 O ATOM 1196 CB THR A 89 15.437 -9.895 -2.782 1.00 0.00 C ATOM 1197 OG1 THR A 89 14.905 -9.193 -3.911 1.00 0.00 O ATOM 1198 CG2 THR A 89 15.704 -11.345 -3.159 1.00 0.00 C ATOM 0 H THR A 89 14.446 -7.730 -1.915 1.00 0.00 H new ATOM 0 HA THR A 89 13.638 -10.498 -1.787 1.00 0.00 H new ATOM 0 HB THR A 89 16.380 -9.441 -2.478 1.00 0.00 H new ATOM 0 HG1 THR A 89 15.534 -9.254 -4.660 1.00 0.00 H new ATOM 0 HG21 THR A 89 16.401 -11.381 -3.996 1.00 0.00 H new ATOM 0 HG22 THR A 89 16.135 -11.869 -2.306 1.00 0.00 H new ATOM 0 HG23 THR A 89 14.768 -11.825 -3.445 1.00 0.00 H new ATOM 1206 N THR A 90 15.926 -9.194 0.207 1.00 0.00 N ATOM 1207 CA THR A 90 16.665 -9.371 1.443 1.00 0.00 C ATOM 1208 C THR A 90 16.059 -8.483 2.532 1.00 0.00 C ATOM 1209 O THR A 90 16.693 -8.176 3.540 1.00 0.00 O ATOM 1210 CB THR A 90 18.166 -9.045 1.245 1.00 0.00 C ATOM 1211 OG1 THR A 90 18.927 -9.481 2.378 1.00 0.00 O ATOM 1212 CG2 THR A 90 18.385 -7.555 1.022 1.00 0.00 C ATOM 0 H THR A 90 16.037 -8.274 -0.219 1.00 0.00 H new ATOM 0 HA THR A 90 16.592 -10.414 1.749 1.00 0.00 H new ATOM 0 HB THR A 90 18.504 -9.579 0.357 1.00 0.00 H new ATOM 0 HG1 THR A 90 18.463 -9.224 3.202 1.00 0.00 H new ATOM 0 HG21 THR A 90 19.449 -7.360 0.887 1.00 0.00 H new ATOM 0 HG22 THR A 90 17.841 -7.236 0.132 1.00 0.00 H new ATOM 0 HG23 THR A 90 18.022 -7.000 1.887 1.00 0.00 H new ATOM 1220 N ALA A 91 14.809 -8.094 2.320 1.00 0.00 N ATOM 1221 CA ALA A 91 14.092 -7.241 3.257 1.00 0.00 C ATOM 1222 C ALA A 91 12.621 -7.632 3.306 1.00 0.00 C ATOM 1223 O ALA A 91 12.225 -8.649 2.732 1.00 0.00 O ATOM 1224 CB ALA A 91 14.252 -5.780 2.858 1.00 0.00 C ATOM 0 H ALA A 91 14.266 -8.359 1.498 1.00 0.00 H new ATOM 0 HA ALA A 91 14.512 -7.374 4.254 1.00 0.00 H new ATOM 0 HB1 ALA A 91 13.713 -5.149 3.564 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.309 -5.514 2.867 1.00 0.00 H new ATOM 0 HB3 ALA A 91 13.849 -5.630 1.856 1.00 0.00 H new ATOM 1230 N ALA A 92 11.818 -6.828 3.983 1.00 0.00 N ATOM 1231 CA ALA A 92 10.398 -7.102 4.105 1.00 0.00 C ATOM 1232 C ALA A 92 9.570 -6.027 3.410 1.00 0.00 C ATOM 1233 O ALA A 92 9.888 -4.840 3.480 1.00 0.00 O ATOM 1234 CB ALA A 92 10.008 -7.205 5.571 1.00 0.00 C ATOM 0 H ALA A 92 12.127 -5.979 4.457 1.00 0.00 H new ATOM 0 HA ALA A 92 10.192 -8.054 3.616 1.00 0.00 H new ATOM 0 HB1 ALA A 92 8.941 -7.411 5.650 1.00 0.00 H new ATOM 0 HB2 ALA A 92 10.569 -8.013 6.041 1.00 0.00 H new ATOM 0 HB3 ALA A 92 10.235 -6.265 6.075 1.00 0.00 H new ATOM 1240 N CYS A 93 8.517 -6.453 2.734 1.00 0.00 N ATOM 1241 CA CYS A 93 7.626 -5.539 2.030 1.00 0.00 C ATOM 1242 C CYS A 93 6.333 -5.390 2.825 1.00 0.00 C ATOM 1243 O CYS A 93 5.886 -6.346 3.447 1.00 0.00 O ATOM 1244 CB CYS A 93 7.317 -6.079 0.628 1.00 0.00 C ATOM 1245 SG CYS A 93 8.134 -5.184 -0.737 1.00 0.00 S ATOM 0 H CYS A 93 8.254 -7.435 2.656 1.00 0.00 H new ATOM 0 HA CYS A 93 8.109 -4.567 1.931 1.00 0.00 H new ATOM 0 HB2 CYS A 93 7.613 -7.127 0.585 1.00 0.00 H new ATOM 0 HB3 CYS A 93 6.239 -6.046 0.471 1.00 0.00 H new ATOM 1250 N GLN A 94 5.734 -4.208 2.831 1.00 0.00 N ATOM 1251 CA GLN A 94 4.496 -4.013 3.568 1.00 0.00 C ATOM 1252 C GLN A 94 3.458 -3.291 2.722 1.00 0.00 C ATOM 1253 O GLN A 94 3.789 -2.510 1.833 1.00 0.00 O ATOM 1254 CB GLN A 94 4.753 -3.265 4.882 1.00 0.00 C ATOM 1255 CG GLN A 94 5.286 -1.852 4.712 1.00 0.00 C ATOM 1256 CD GLN A 94 5.922 -1.325 5.985 1.00 0.00 C ATOM 1257 OE1 GLN A 94 7.124 -1.475 6.198 1.00 0.00 O ATOM 1258 NE2 GLN A 94 5.121 -0.714 6.843 1.00 0.00 N ATOM 0 H GLN A 94 6.079 -3.382 2.342 1.00 0.00 H new ATOM 0 HA GLN A 94 4.096 -4.997 3.813 1.00 0.00 H new ATOM 0 HB2 GLN A 94 3.823 -3.223 5.449 1.00 0.00 H new ATOM 0 HB3 GLN A 94 5.463 -3.838 5.478 1.00 0.00 H new ATOM 0 HG2 GLN A 94 6.021 -1.837 3.907 1.00 0.00 H new ATOM 0 HG3 GLN A 94 4.472 -1.191 4.414 1.00 0.00 H new ATOM 0 HE21 GLN A 94 4.129 -0.610 6.629 1.00 0.00 H new ATOM 0 HE22 GLN A 94 5.495 -0.347 7.718 1.00 0.00 H new ATOM 1267 N VAL A 95 2.199 -3.581 2.993 1.00 0.00 N ATOM 1268 CA VAL A 95 1.098 -2.974 2.268 1.00 0.00 C ATOM 1269 C VAL A 95 0.735 -1.625 2.874 1.00 0.00 C ATOM 1270 O VAL A 95 0.355 -1.541 4.046 1.00 0.00 O ATOM 1271 CB VAL A 95 -0.145 -3.885 2.272 1.00 0.00 C ATOM 1272 CG1 VAL A 95 -1.268 -3.274 1.447 1.00 0.00 C ATOM 1273 CG2 VAL A 95 0.207 -5.275 1.759 1.00 0.00 C ATOM 0 H VAL A 95 1.912 -4.240 3.717 1.00 0.00 H new ATOM 0 HA VAL A 95 1.426 -2.833 1.238 1.00 0.00 H new ATOM 0 HB VAL A 95 -0.494 -3.978 3.300 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.134 -3.935 1.465 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.542 -2.306 1.866 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.933 -3.142 0.418 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -0.684 -5.903 1.770 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.587 -5.201 0.740 1.00 0.00 H new ATOM 0 HG23 VAL A 95 0.970 -5.717 2.400 1.00 0.00 H new ATOM 1283 N GLY A 96 0.870 -0.577 2.075 1.00 0.00 N ATOM 1284 CA GLY A 96 0.555 0.753 2.537 1.00 0.00 C ATOM 1285 C GLY A 96 -0.796 1.215 2.036 1.00 0.00 C ATOM 1286 O GLY A 96 -0.961 1.510 0.854 1.00 0.00 O ATOM 0 H GLY A 96 1.194 -0.628 1.109 1.00 0.00 H new ATOM 0 HA2 GLY A 96 0.565 0.771 3.627 1.00 0.00 H new ATOM 0 HA3 GLY A 96 1.325 1.447 2.200 1.00 0.00 H new ATOM 1290 N LEU A 97 -1.763 1.259 2.935 1.00 0.00 N ATOM 1291 CA LEU A 97 -3.111 1.682 2.588 1.00 0.00 C ATOM 1292 C LEU A 97 -3.504 2.912 3.394 1.00 0.00 C ATOM 1293 O LEU A 97 -3.679 2.841 4.609 1.00 0.00 O ATOM 1294 CB LEU A 97 -4.111 0.542 2.837 1.00 0.00 C ATOM 1295 CG LEU A 97 -3.655 -0.533 3.834 1.00 0.00 C ATOM 1296 CD1 LEU A 97 -4.001 -0.141 5.263 1.00 0.00 C ATOM 1297 CD2 LEU A 97 -4.272 -1.878 3.492 1.00 0.00 C ATOM 0 H LEU A 97 -1.640 1.006 3.916 1.00 0.00 H new ATOM 0 HA LEU A 97 -3.131 1.938 1.529 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -5.045 0.974 3.197 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -4.330 0.060 1.884 1.00 0.00 H new ATOM 0 HG LEU A 97 -2.571 -0.617 3.759 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -3.666 -0.922 5.946 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -3.506 0.797 5.513 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.080 -0.017 5.355 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -3.936 -2.626 4.211 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -5.359 -1.800 3.530 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -3.965 -2.175 2.489 1.00 0.00 H new ATOM 1309 N SER A 98 -3.606 4.049 2.728 1.00 0.00 N ATOM 1310 CA SER A 98 -3.977 5.289 3.395 1.00 0.00 C ATOM 1311 C SER A 98 -4.678 6.229 2.422 1.00 0.00 C ATOM 1312 O SER A 98 -4.594 6.046 1.208 1.00 0.00 O ATOM 1313 CB SER A 98 -2.736 5.963 3.990 1.00 0.00 C ATOM 1314 OG SER A 98 -2.094 5.109 4.929 1.00 0.00 O ATOM 0 H SER A 98 -3.438 4.141 1.726 1.00 0.00 H new ATOM 0 HA SER A 98 -4.668 5.055 4.205 1.00 0.00 H new ATOM 0 HB2 SER A 98 -2.040 6.221 3.192 1.00 0.00 H new ATOM 0 HB3 SER A 98 -3.022 6.895 4.477 1.00 0.00 H new ATOM 0 HG SER A 98 -2.618 4.288 5.037 1.00 0.00 H new ATOM 1320 N ASP A 99 -5.374 7.222 2.957 1.00 0.00 N ATOM 1321 CA ASP A 99 -6.087 8.191 2.134 1.00 0.00 C ATOM 1322 C ASP A 99 -5.121 9.236 1.594 1.00 0.00 C ATOM 1323 O ASP A 99 -3.915 9.147 1.827 1.00 0.00 O ATOM 1324 CB ASP A 99 -7.196 8.872 2.943 1.00 0.00 C ATOM 1325 CG ASP A 99 -6.678 10.007 3.800 1.00 0.00 C ATOM 1326 OD1 ASP A 99 -5.917 9.743 4.757 1.00 0.00 O ATOM 1327 OD2 ASP A 99 -7.036 11.171 3.519 1.00 0.00 O ATOM 0 H ASP A 99 -5.461 7.379 3.961 1.00 0.00 H new ATOM 0 HA ASP A 99 -6.541 7.662 1.296 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -7.956 9.254 2.261 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -7.682 8.133 3.580 1.00 0.00 H new ATOM 1332 N ALA A 100 -5.655 10.226 0.881 1.00 0.00 N ATOM 1333 CA ALA A 100 -4.844 11.295 0.306 1.00 0.00 C ATOM 1334 C ALA A 100 -3.980 11.981 1.363 1.00 0.00 C ATOM 1335 O ALA A 100 -2.826 12.333 1.105 1.00 0.00 O ATOM 1336 CB ALA A 100 -5.735 12.316 -0.387 1.00 0.00 C ATOM 0 H ALA A 100 -6.653 10.309 0.687 1.00 0.00 H new ATOM 0 HA ALA A 100 -4.175 10.844 -0.427 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -5.118 13.108 -0.812 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -6.297 11.828 -1.183 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -6.428 12.744 0.337 1.00 0.00 H new ATOM 1342 N ALA A 101 -4.545 12.168 2.552 1.00 0.00 N ATOM 1343 CA ALA A 101 -3.828 12.796 3.648 1.00 0.00 C ATOM 1344 C ALA A 101 -2.718 11.876 4.144 1.00 0.00 C ATOM 1345 O ALA A 101 -1.546 12.259 4.181 1.00 0.00 O ATOM 1346 CB ALA A 101 -4.786 13.137 4.780 1.00 0.00 C ATOM 0 H ALA A 101 -5.500 11.891 2.778 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.377 13.721 3.289 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -4.234 13.607 5.594 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -5.550 13.824 4.416 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -5.261 12.225 5.142 1.00 0.00 H new ATOM 1352 N GLY A 102 -3.092 10.654 4.500 1.00 0.00 N ATOM 1353 CA GLY A 102 -2.120 9.693 4.981 1.00 0.00 C ATOM 1354 C GLY A 102 -2.569 9.002 6.250 1.00 0.00 C ATOM 1355 O GLY A 102 -1.749 8.680 7.111 1.00 0.00 O ATOM 0 H GLY A 102 -4.052 10.311 4.464 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -1.939 8.946 4.208 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -1.172 10.199 5.163 1.00 0.00 H new ATOM 1359 N ASN A 103 -3.867 8.779 6.379 1.00 0.00 N ATOM 1360 CA ASN A 103 -4.413 8.115 7.551 1.00 0.00 C ATOM 1361 C ASN A 103 -5.213 6.889 7.139 1.00 0.00 C ATOM 1362 O ASN A 103 -5.452 6.668 5.948 1.00 0.00 O ATOM 1363 CB ASN A 103 -5.301 9.077 8.343 1.00 0.00 C ATOM 1364 CG ASN A 103 -4.516 9.968 9.285 1.00 0.00 C ATOM 1365 OD1 ASN A 103 -3.501 9.557 9.850 1.00 0.00 O ATOM 1366 ND2 ASN A 103 -4.974 11.199 9.453 1.00 0.00 N ATOM 0 H ASN A 103 -4.563 9.049 5.684 1.00 0.00 H new ATOM 0 HA ASN A 103 -3.585 7.798 8.185 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -5.864 9.700 7.647 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -6.028 8.503 8.917 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -4.482 11.846 10.069 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -5.818 11.500 8.966 1.00 0.00 H new ATOM 1373 N GLY A 104 -5.626 6.096 8.118 1.00 0.00 N ATOM 1374 CA GLY A 104 -6.397 4.904 7.832 1.00 0.00 C ATOM 1375 C GLY A 104 -5.924 3.717 8.645 1.00 0.00 C ATOM 1376 O GLY A 104 -5.314 3.894 9.702 1.00 0.00 O ATOM 0 H GLY A 104 -5.440 6.258 9.108 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -7.449 5.093 8.044 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -6.323 4.670 6.770 1.00 0.00 H new ATOM 1380 N PRO A 105 -6.193 2.490 8.176 1.00 0.00 N ATOM 1381 CA PRO A 105 -5.780 1.268 8.870 1.00 0.00 C ATOM 1382 C PRO A 105 -4.261 1.124 8.897 1.00 0.00 C ATOM 1383 O PRO A 105 -3.551 1.776 8.126 1.00 0.00 O ATOM 1384 CB PRO A 105 -6.415 0.139 8.045 1.00 0.00 C ATOM 1385 CG PRO A 105 -7.427 0.805 7.173 1.00 0.00 C ATOM 1386 CD PRO A 105 -6.917 2.197 6.937 1.00 0.00 C ATOM 0 HA PRO A 105 -6.095 1.263 9.913 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -5.665 -0.382 7.449 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -6.882 -0.605 8.691 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -7.545 0.268 6.232 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -8.405 0.824 7.654 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -6.264 2.247 6.065 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -7.730 2.903 6.767 1.00 0.00 H new ATOM 1394 N GLU A 106 -3.769 0.270 9.779 1.00 0.00 N ATOM 1395 CA GLU A 106 -2.336 0.057 9.912 1.00 0.00 C ATOM 1396 C GLU A 106 -1.807 -0.829 8.789 1.00 0.00 C ATOM 1397 O GLU A 106 -2.520 -1.699 8.279 1.00 0.00 O ATOM 1398 CB GLU A 106 -2.025 -0.572 11.267 1.00 0.00 C ATOM 1399 CG GLU A 106 -0.973 0.184 12.055 1.00 0.00 C ATOM 1400 CD GLU A 106 -0.575 -0.536 13.321 1.00 0.00 C ATOM 1401 OE1 GLU A 106 -1.393 -0.595 14.260 1.00 0.00 O ATOM 1402 OE2 GLU A 106 0.562 -1.049 13.382 1.00 0.00 O ATOM 0 H GLU A 106 -4.340 -0.288 10.414 1.00 0.00 H new ATOM 0 HA GLU A 106 -1.840 1.025 9.843 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -2.942 -0.623 11.855 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -1.687 -1.597 11.114 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -0.091 0.331 11.431 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -1.353 1.174 12.307 1.00 0.00 H new ATOM 1409 N GLY A 107 -0.559 -0.598 8.407 1.00 0.00 N ATOM 1410 CA GLY A 107 0.059 -1.375 7.353 1.00 0.00 C ATOM 1411 C GLY A 107 0.449 -2.766 7.812 1.00 0.00 C ATOM 1412 O GLY A 107 0.765 -2.979 8.987 1.00 0.00 O ATOM 0 H GLY A 107 0.041 0.120 8.813 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -0.630 -1.453 6.512 1.00 0.00 H new ATOM 0 HA3 GLY A 107 0.945 -0.853 6.992 1.00 0.00 H new ATOM 1416 N VAL A 108 0.425 -3.714 6.888 1.00 0.00 N ATOM 1417 CA VAL A 108 0.772 -5.094 7.195 1.00 0.00 C ATOM 1418 C VAL A 108 2.023 -5.509 6.434 1.00 0.00 C ATOM 1419 O VAL A 108 2.078 -5.394 5.206 1.00 0.00 O ATOM 1420 CB VAL A 108 -0.380 -6.059 6.840 1.00 0.00 C ATOM 1421 CG1 VAL A 108 -0.068 -7.474 7.301 1.00 0.00 C ATOM 1422 CG2 VAL A 108 -1.690 -5.584 7.444 1.00 0.00 C ATOM 0 H VAL A 108 0.168 -3.552 5.914 1.00 0.00 H new ATOM 0 HA VAL A 108 0.957 -5.151 8.268 1.00 0.00 H new ATOM 0 HB VAL A 108 -0.483 -6.067 5.755 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -0.896 -8.133 7.039 1.00 0.00 H new ATOM 0 HG12 VAL A 108 0.842 -7.823 6.814 1.00 0.00 H new ATOM 0 HG13 VAL A 108 0.073 -7.482 8.382 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -2.486 -6.280 7.180 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -1.594 -5.537 8.529 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -1.931 -4.594 7.057 1.00 0.00 H new ATOM 1432 N ALA A 109 3.026 -5.973 7.165 1.00 0.00 N ATOM 1433 CA ALA A 109 4.276 -6.407 6.562 1.00 0.00 C ATOM 1434 C ALA A 109 4.197 -7.871 6.144 1.00 0.00 C ATOM 1435 O ALA A 109 3.634 -8.705 6.859 1.00 0.00 O ATOM 1436 CB ALA A 109 5.440 -6.188 7.518 1.00 0.00 C ATOM 0 H ALA A 109 2.997 -6.058 8.181 1.00 0.00 H new ATOM 0 HA ALA A 109 4.446 -5.805 5.669 1.00 0.00 H new ATOM 0 HB1 ALA A 109 6.365 -6.520 7.047 1.00 0.00 H new ATOM 0 HB2 ALA A 109 5.516 -5.128 7.762 1.00 0.00 H new ATOM 0 HB3 ALA A 109 5.273 -6.759 8.431 1.00 0.00 H new ATOM 1442 N ILE A 110 4.748 -8.167 4.976 1.00 0.00 N ATOM 1443 CA ILE A 110 4.756 -9.517 4.435 1.00 0.00 C ATOM 1444 C ILE A 110 6.159 -9.887 3.968 1.00 0.00 C ATOM 1445 O ILE A 110 7.020 -9.019 3.798 1.00 0.00 O ATOM 1446 CB ILE A 110 3.770 -9.665 3.251 1.00 0.00 C ATOM 1447 CG1 ILE A 110 4.056 -8.604 2.183 1.00 0.00 C ATOM 1448 CG2 ILE A 110 2.329 -9.562 3.735 1.00 0.00 C ATOM 1449 CD1 ILE A 110 3.243 -8.776 0.919 1.00 0.00 C ATOM 0 H ILE A 110 5.202 -7.478 4.377 1.00 0.00 H new ATOM 0 HA ILE A 110 4.439 -10.189 5.232 1.00 0.00 H new ATOM 0 HB ILE A 110 3.911 -10.650 2.807 1.00 0.00 H new ATOM 0 HG12 ILE A 110 3.856 -7.618 2.601 1.00 0.00 H new ATOM 0 HG13 ILE A 110 5.116 -8.634 1.929 1.00 0.00 H new ATOM 0 HG21 ILE A 110 1.652 -9.669 2.887 1.00 0.00 H new ATOM 0 HG22 ILE A 110 2.131 -10.352 4.459 1.00 0.00 H new ATOM 0 HG23 ILE A 110 2.172 -8.591 4.205 1.00 0.00 H new ATOM 0 HD11 ILE A 110 3.500 -7.988 0.211 1.00 0.00 H new ATOM 0 HD12 ILE A 110 3.461 -9.748 0.476 1.00 0.00 H new ATOM 0 HD13 ILE A 110 2.181 -8.716 1.158 1.00 0.00 H new ATOM 1461 N SER A 111 6.402 -11.169 3.782 1.00 0.00 N ATOM 1462 CA SER A 111 7.706 -11.628 3.339 1.00 0.00 C ATOM 1463 C SER A 111 7.570 -12.807 2.391 1.00 0.00 C ATOM 1464 O SER A 111 6.633 -13.600 2.500 1.00 0.00 O ATOM 1465 CB SER A 111 8.561 -12.023 4.537 1.00 0.00 C ATOM 1466 OG SER A 111 8.710 -10.937 5.437 1.00 0.00 O ATOM 0 H SER A 111 5.717 -11.910 3.930 1.00 0.00 H new ATOM 0 HA SER A 111 8.192 -10.810 2.807 1.00 0.00 H new ATOM 0 HB2 SER A 111 8.103 -12.867 5.053 1.00 0.00 H new ATOM 0 HB3 SER A 111 9.542 -12.353 4.195 1.00 0.00 H new ATOM 0 HG SER A 111 9.261 -11.216 6.198 1.00 0.00 H new ATOM 1472 N PHE A 112 8.508 -12.909 1.464 1.00 0.00 N ATOM 1473 CA PHE A 112 8.509 -13.986 0.490 1.00 0.00 C ATOM 1474 C PHE A 112 9.130 -15.244 1.083 1.00 0.00 C ATOM 1475 O PHE A 112 9.870 -15.182 2.070 1.00 0.00 O ATOM 1476 CB PHE A 112 9.269 -13.555 -0.766 1.00 0.00 C ATOM 1477 CG PHE A 112 8.758 -12.272 -1.360 1.00 0.00 C ATOM 1478 CD1 PHE A 112 7.477 -12.196 -1.881 1.00 0.00 C ATOM 1479 CD2 PHE A 112 9.559 -11.143 -1.399 1.00 0.00 C ATOM 1480 CE1 PHE A 112 7.002 -11.018 -2.427 1.00 0.00 C ATOM 1481 CE2 PHE A 112 9.092 -9.962 -1.945 1.00 0.00 C ATOM 1482 CZ PHE A 112 7.813 -9.899 -2.460 1.00 0.00 C ATOM 0 H PHE A 112 9.283 -12.254 1.366 1.00 0.00 H new ATOM 0 HA PHE A 112 7.478 -14.211 0.217 1.00 0.00 H new ATOM 0 HB2 PHE A 112 10.325 -13.439 -0.521 1.00 0.00 H new ATOM 0 HB3 PHE A 112 9.200 -14.346 -1.513 1.00 0.00 H new ATOM 0 HD1 PHE A 112 6.841 -13.068 -1.860 1.00 0.00 H new ATOM 0 HD2 PHE A 112 10.561 -11.186 -0.998 1.00 0.00 H new ATOM 0 HE1 PHE A 112 6.000 -10.972 -2.827 1.00 0.00 H new ATOM 0 HE2 PHE A 112 9.728 -9.089 -1.969 1.00 0.00 H new ATOM 0 HZ PHE A 112 7.447 -8.978 -2.888 1.00 0.00 H new ATOM 1492 N ASN A 113 8.824 -16.380 0.482 1.00 0.00 N ATOM 1493 CA ASN A 113 9.341 -17.664 0.943 1.00 0.00 C ATOM 1494 C ASN A 113 10.710 -17.934 0.334 1.00 0.00 C ATOM 1495 O ASN A 113 11.475 -18.720 0.916 1.00 0.00 O ATOM 1496 CB ASN A 113 8.369 -18.801 0.595 1.00 0.00 C ATOM 1497 CG ASN A 113 8.344 -19.124 -0.888 1.00 0.00 C ATOM 1498 OD1 ASN A 113 9.053 -20.017 -1.359 1.00 0.00 O ATOM 1499 ND2 ASN A 113 7.523 -18.405 -1.634 1.00 0.00 N ATOM 1500 OXT ASN A 113 11.017 -17.347 -0.724 1.00 0.00 O ATOM 0 H ASN A 113 8.215 -16.443 -0.334 1.00 0.00 H new ATOM 0 HA ASN A 113 9.442 -17.621 2.027 1.00 0.00 H new ATOM 0 HB2 ASN A 113 8.650 -19.695 1.152 1.00 0.00 H new ATOM 0 HB3 ASN A 113 7.365 -18.526 0.919 1.00 0.00 H new ATOM 0 HD21 ASN A 113 7.460 -18.580 -2.637 1.00 0.00 H new ATOM 0 HD22 ASN A 113 6.953 -17.675 -1.207 1.00 0.00 H new TER 1507 ASN A 113 HETATM 1508 O1 FLN A 114 4.507 5.963 4.622 1.00 20.00 O HETATM 1509 C8A FLN A 114 5.108 7.165 4.274 1.00 20.00 C HETATM 1510 C4A FLN A 114 5.354 7.513 2.932 1.00 20.00 C HETATM 1511 C4 FLN A 114 4.952 6.556 1.861 1.00 20.00 C HETATM 1512 C3 FLN A 114 4.326 5.312 2.306 1.00 20.00 C HETATM 1513 C2 FLN A 114 4.124 5.065 3.628 1.00 20.00 C HETATM 1514 C1' FLN A 114 3.512 3.878 4.316 1.00 20.00 C HETATM 1515 C2' FLN A 114 2.258 3.986 4.923 1.00 20.00 C HETATM 1516 C3' FLN A 114 1.698 2.876 5.558 1.00 20.00 C HETATM 1517 C4' FLN A 114 2.342 1.632 5.619 1.00 20.00 C HETATM 1518 C5' FLN A 114 3.595 1.571 4.997 1.00 20.00 C HETATM 1519 C6' FLN A 114 4.177 2.658 4.357 1.00 20.00 C HETATM 1520 O4 FLN A 114 5.145 6.811 0.666 1.00 20.00 O HETATM 1521 C5 FLN A 114 5.974 8.756 2.645 1.00 20.00 C HETATM 1522 C6 FLN A 114 6.332 9.616 3.698 1.00 20.00 C HETATM 1523 C7 FLN A 114 6.068 9.232 5.031 1.00 20.00 C HETATM 1524 C8 FLN A 114 5.457 8.011 5.321 1.00 20.00 C HETATM 0 H8 FLN A 114 5.256 7.725 6.353 1.00 20.00 H new HETATM 0 H7 FLN A 114 6.346 9.900 5.846 1.00 20.00 H new HETATM 0 H6' FLN A 114 5.155 2.554 3.887 1.00 20.00 H new HETATM 0 H6 FLN A 114 6.810 10.573 3.487 1.00 20.00 H new HETATM 0 H5' FLN A 114 4.139 0.627 5.016 1.00 20.00 H new HETATM 0 H5 FLN A 114 6.172 9.043 1.612 1.00 20.00 H new HETATM 0 H4' FLN A 114 1.897 0.770 6.117 1.00 20.00 H new HETATM 0 H3' FLN A 114 0.719 2.981 6.026 1.00 20.00 H new HETATM 0 H3 FLN A 114 4.017 4.572 1.568 1.00 20.00 H new HETATM 0 H2' FLN A 114 1.719 4.933 4.901 1.00 20.00 H new