USER MOD reduce.3.24.130724 H: found=0, std=0, add=1092, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1090 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 153:sc= 1.28 (180deg=-0.0672) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= -2.48! C(o=-2.5!,f=-2.9!) USER MOD Single : A 28 TYR OH : rot 28:sc= -3.3! USER MOD Single : A 31 LYS NZ :NH3+ 159:sc=-0.00434 (180deg=-0.159) USER MOD Single : A 45 HIS : no HD1:sc= -2.92 X(o=-2.9,f=-3.1!) USER MOD Single : A 47 CYS SG : rot -150:sc= -0.686 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 THR OG1 : rot -139:sc= 0.00994 USER MOD Single : A 54 HIS :FLIP no HE2:sc= 0.314 F(o=-1.6,f=0.31) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 180:sc= 0.00115 USER MOD Single : A 67 HIS : no HE2:sc= -3.76! C(o=-3.8!,f=-9.7!) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0634 USER MOD Single : A 76 LYS NZ :NH3+ 162:sc= 1.28 (180deg=0.768) USER MOD Single : A 90 SER OG : rot 180:sc= 0.0154 USER MOD Single : A 102 TYR OH : rot -174:sc= -1.78 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 130:sc= -1.13! USER MOD Single : A 127 GLN : amide:sc= -0.0276 K(o=-0.028,f=-2.8) USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot -37:sc= 0.706 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N VAL A 2 10.620 -3.914 5.703 1.00 0.00 N ATOM 19 CA VAL A 2 9.976 -3.301 4.553 1.00 0.00 C ATOM 20 C VAL A 2 10.531 -3.925 3.271 1.00 0.00 C ATOM 21 O VAL A 2 11.725 -4.204 3.179 1.00 0.00 O ATOM 22 CB VAL A 2 10.152 -1.782 4.603 1.00 0.00 C ATOM 23 CG1 VAL A 2 9.322 -1.098 3.514 1.00 0.00 C ATOM 24 CG2 VAL A 2 9.798 -1.235 5.987 1.00 0.00 C ATOM 0 HA VAL A 2 8.903 -3.491 4.569 1.00 0.00 H new ATOM 0 HB VAL A 2 11.202 -1.559 4.413 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.465 -0.019 3.571 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.642 -1.455 2.535 1.00 0.00 H new ATOM 0 HG13 VAL A 2 8.267 -1.333 3.659 1.00 0.00 H new ATOM 0 HG21 VAL A 2 9.932 -0.153 5.996 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.760 -1.474 6.218 1.00 0.00 H new ATOM 0 HG23 VAL A 2 10.450 -1.687 6.735 1.00 0.00 H new ATOM 34 N PRO A 3 9.614 -4.130 2.288 1.00 0.00 N ATOM 35 CA PRO A 3 9.999 -4.716 1.015 1.00 0.00 C ATOM 36 C PRO A 3 10.750 -3.702 0.150 1.00 0.00 C ATOM 37 O PRO A 3 10.895 -2.541 0.532 1.00 0.00 O ATOM 38 CB PRO A 3 8.696 -5.183 0.387 1.00 0.00 C ATOM 39 CG PRO A 3 7.591 -4.431 1.110 1.00 0.00 C ATOM 40 CD PRO A 3 8.191 -3.812 2.362 1.00 0.00 C ATOM 0 HA PRO A 3 10.692 -5.549 1.128 1.00 0.00 H new ATOM 0 HB2 PRO A 3 8.679 -4.969 -0.682 1.00 0.00 H new ATOM 0 HB3 PRO A 3 8.573 -6.260 0.499 1.00 0.00 H new ATOM 0 HG2 PRO A 3 7.170 -3.659 0.466 1.00 0.00 H new ATOM 0 HG3 PRO A 3 6.777 -5.107 1.371 1.00 0.00 H new ATOM 0 HD2 PRO A 3 8.027 -2.735 2.389 1.00 0.00 H new ATOM 0 HD3 PRO A 3 7.739 -4.226 3.264 1.00 0.00 H new ATOM 48 N PRO A 4 11.220 -4.189 -1.029 1.00 0.00 N ATOM 49 CA PRO A 4 11.953 -3.338 -1.952 1.00 0.00 C ATOM 50 C PRO A 4 11.008 -2.382 -2.683 1.00 0.00 C ATOM 51 O PRO A 4 11.266 -1.181 -2.752 1.00 0.00 O ATOM 52 CB PRO A 4 12.668 -4.298 -2.888 1.00 0.00 C ATOM 53 CG PRO A 4 11.948 -5.630 -2.751 1.00 0.00 C ATOM 54 CD PRO A 4 11.067 -5.558 -1.514 1.00 0.00 C ATOM 0 HA PRO A 4 12.668 -2.688 -1.448 1.00 0.00 H new ATOM 0 HB2 PRO A 4 12.633 -3.939 -3.917 1.00 0.00 H new ATOM 0 HB3 PRO A 4 13.720 -4.394 -2.620 1.00 0.00 H new ATOM 0 HG2 PRO A 4 11.346 -5.832 -3.637 1.00 0.00 H new ATOM 0 HG3 PRO A 4 12.666 -6.445 -2.661 1.00 0.00 H new ATOM 0 HD2 PRO A 4 10.027 -5.779 -1.755 1.00 0.00 H new ATOM 0 HD3 PRO A 4 11.381 -6.282 -0.762 1.00 0.00 H new ATOM 62 N LYS A 5 9.934 -2.951 -3.212 1.00 0.00 N ATOM 63 CA LYS A 5 8.950 -2.164 -3.935 1.00 0.00 C ATOM 64 C LYS A 5 8.542 -0.959 -3.085 1.00 0.00 C ATOM 65 O LYS A 5 8.405 0.150 -3.600 1.00 0.00 O ATOM 66 CB LYS A 5 7.773 -3.042 -4.364 1.00 0.00 C ATOM 67 CG LYS A 5 8.263 -4.328 -5.033 1.00 0.00 C ATOM 68 CD LYS A 5 7.357 -4.717 -6.203 1.00 0.00 C ATOM 69 CE LYS A 5 6.744 -6.101 -5.985 1.00 0.00 C ATOM 70 NZ LYS A 5 6.550 -6.792 -7.280 1.00 0.00 N ATOM 0 H LYS A 5 9.724 -3.948 -3.154 1.00 0.00 H new ATOM 0 HA LYS A 5 9.378 -1.772 -4.858 1.00 0.00 H new ATOM 0 HB2 LYS A 5 7.164 -3.290 -3.495 1.00 0.00 H new ATOM 0 HB3 LYS A 5 7.135 -2.489 -5.054 1.00 0.00 H new ATOM 0 HG2 LYS A 5 9.284 -4.191 -5.389 1.00 0.00 H new ATOM 0 HG3 LYS A 5 8.286 -5.136 -4.302 1.00 0.00 H new ATOM 0 HD2 LYS A 5 6.564 -3.978 -6.315 1.00 0.00 H new ATOM 0 HD3 LYS A 5 7.931 -4.711 -7.130 1.00 0.00 H new ATOM 0 HE2 LYS A 5 7.393 -6.696 -5.342 1.00 0.00 H new ATOM 0 HE3 LYS A 5 5.788 -6.005 -5.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 6.133 -7.730 -7.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 5.913 -6.231 -7.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 7.468 -6.901 -7.756 1.00 0.00 H new ATOM 84 N LEU A 6 8.359 -1.218 -1.799 1.00 0.00 N ATOM 85 CA LEU A 6 7.969 -0.168 -0.873 1.00 0.00 C ATOM 86 C LEU A 6 9.181 0.714 -0.569 1.00 0.00 C ATOM 87 O LEU A 6 9.176 1.907 -0.870 1.00 0.00 O ATOM 88 CB LEU A 6 7.318 -0.769 0.374 1.00 0.00 C ATOM 89 CG LEU A 6 6.277 0.106 1.076 1.00 0.00 C ATOM 90 CD1 LEU A 6 6.794 0.592 2.431 1.00 0.00 C ATOM 91 CD2 LEU A 6 5.842 1.267 0.178 1.00 0.00 C ATOM 0 H LEU A 6 8.473 -2.139 -1.376 1.00 0.00 H new ATOM 0 HA LEU A 6 7.212 0.474 -1.322 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.844 -1.710 0.094 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.104 -1.009 1.090 1.00 0.00 H new ATOM 0 HG LEU A 6 5.393 -0.502 1.268 1.00 0.00 H new ATOM 0 HD11 LEU A 6 6.035 1.212 2.909 1.00 0.00 H new ATOM 0 HD12 LEU A 6 7.014 -0.266 3.066 1.00 0.00 H new ATOM 0 HD13 LEU A 6 7.702 1.178 2.285 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.102 1.873 0.700 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.708 1.882 -0.067 1.00 0.00 H new ATOM 0 HD23 LEU A 6 5.406 0.873 -0.740 1.00 0.00 H new ATOM 103 N LYS A 7 10.191 0.094 0.024 1.00 0.00 N ATOM 104 CA LYS A 7 11.407 0.809 0.372 1.00 0.00 C ATOM 105 C LYS A 7 11.863 1.644 -0.826 1.00 0.00 C ATOM 106 O LYS A 7 12.492 2.687 -0.656 1.00 0.00 O ATOM 107 CB LYS A 7 12.471 -0.164 0.886 1.00 0.00 C ATOM 108 CG LYS A 7 13.597 0.584 1.602 1.00 0.00 C ATOM 109 CD LYS A 7 13.596 0.273 3.100 1.00 0.00 C ATOM 110 CE LYS A 7 14.987 0.478 3.703 1.00 0.00 C ATOM 111 NZ LYS A 7 15.560 -0.816 4.137 1.00 0.00 N ATOM 0 H LYS A 7 10.192 -0.895 0.272 1.00 0.00 H new ATOM 0 HA LYS A 7 11.221 1.503 1.191 1.00 0.00 H new ATOM 0 HB2 LYS A 7 12.014 -0.881 1.568 1.00 0.00 H new ATOM 0 HB3 LYS A 7 12.881 -0.734 0.052 1.00 0.00 H new ATOM 0 HG2 LYS A 7 14.557 0.303 1.169 1.00 0.00 H new ATOM 0 HG3 LYS A 7 13.480 1.657 1.450 1.00 0.00 H new ATOM 0 HD2 LYS A 7 12.877 0.916 3.608 1.00 0.00 H new ATOM 0 HD3 LYS A 7 13.274 -0.756 3.261 1.00 0.00 H new ATOM 0 HE2 LYS A 7 15.643 0.945 2.968 1.00 0.00 H new ATOM 0 HE3 LYS A 7 14.925 1.158 4.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 16.504 -0.659 4.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 14.942 -1.247 4.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 15.637 -1.453 3.319 1.00 0.00 H new ATOM 125 N GLN A 8 11.529 1.153 -2.010 1.00 0.00 N ATOM 126 CA GLN A 8 11.897 1.841 -3.236 1.00 0.00 C ATOM 127 C GLN A 8 11.170 3.184 -3.330 1.00 0.00 C ATOM 128 O GLN A 8 11.795 4.217 -3.562 1.00 0.00 O ATOM 129 CB GLN A 8 11.604 0.972 -4.461 1.00 0.00 C ATOM 130 CG GLN A 8 12.821 0.123 -4.834 1.00 0.00 C ATOM 131 CD GLN A 8 12.754 -0.318 -6.298 1.00 0.00 C ATOM 132 OE1 GLN A 8 11.694 -0.554 -6.854 1.00 0.00 O ATOM 133 NE2 GLN A 8 13.941 -0.415 -6.889 1.00 0.00 N ATOM 0 H GLN A 8 11.008 0.287 -2.147 1.00 0.00 H new ATOM 0 HA GLN A 8 12.970 2.032 -3.215 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.752 0.323 -4.256 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.326 1.606 -5.303 1.00 0.00 H new ATOM 0 HG2 GLN A 8 13.733 0.694 -4.664 1.00 0.00 H new ATOM 0 HG3 GLN A 8 12.869 -0.754 -4.188 1.00 0.00 H new ATOM 0 HE21 GLN A 8 14.790 -0.203 -6.365 1.00 0.00 H new ATOM 0 HE22 GLN A 8 14.002 -0.702 -7.866 1.00 0.00 H new ATOM 142 N ALA A 9 9.860 3.125 -3.144 1.00 0.00 N ATOM 143 CA ALA A 9 9.041 4.324 -3.204 1.00 0.00 C ATOM 144 C ALA A 9 9.553 5.338 -2.179 1.00 0.00 C ATOM 145 O ALA A 9 9.828 6.487 -2.522 1.00 0.00 O ATOM 146 CB ALA A 9 7.574 3.953 -2.975 1.00 0.00 C ATOM 0 H ALA A 9 9.345 2.266 -2.952 1.00 0.00 H new ATOM 0 HA ALA A 9 9.110 4.787 -4.188 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.960 4.852 -3.020 1.00 0.00 H new ATOM 0 HB2 ALA A 9 7.251 3.254 -3.746 1.00 0.00 H new ATOM 0 HB3 ALA A 9 7.465 3.488 -1.995 1.00 0.00 H new ATOM 152 N LEU A 10 9.665 4.877 -0.943 1.00 0.00 N ATOM 153 CA LEU A 10 10.139 5.729 0.134 1.00 0.00 C ATOM 154 C LEU A 10 11.442 6.406 -0.293 1.00 0.00 C ATOM 155 O LEU A 10 11.472 7.614 -0.524 1.00 0.00 O ATOM 156 CB LEU A 10 10.257 4.933 1.436 1.00 0.00 C ATOM 157 CG LEU A 10 8.983 4.230 1.910 1.00 0.00 C ATOM 158 CD1 LEU A 10 9.280 3.285 3.075 1.00 0.00 C ATOM 159 CD2 LEU A 10 7.894 5.247 2.260 1.00 0.00 C ATOM 0 H LEU A 10 9.436 3.923 -0.663 1.00 0.00 H new ATOM 0 HA LEU A 10 9.419 6.522 0.337 1.00 0.00 H new ATOM 0 HB2 LEU A 10 11.037 4.182 1.310 1.00 0.00 H new ATOM 0 HB3 LEU A 10 10.589 5.609 2.223 1.00 0.00 H new ATOM 0 HG LEU A 10 8.603 3.621 1.090 1.00 0.00 H new ATOM 0 HD11 LEU A 10 8.358 2.798 3.393 1.00 0.00 H new ATOM 0 HD12 LEU A 10 9.998 2.529 2.757 1.00 0.00 H new ATOM 0 HD13 LEU A 10 9.696 3.853 3.907 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.999 4.722 2.594 1.00 0.00 H new ATOM 0 HD22 LEU A 10 8.249 5.901 3.056 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.657 5.844 1.379 1.00 0.00 H new ATOM 171 N GLU A 11 12.488 5.598 -0.385 1.00 0.00 N ATOM 172 CA GLU A 11 13.792 6.104 -0.781 1.00 0.00 C ATOM 173 C GLU A 11 13.666 6.976 -2.032 1.00 0.00 C ATOM 174 O GLU A 11 14.188 8.089 -2.073 1.00 0.00 O ATOM 175 CB GLU A 11 14.779 4.958 -1.009 1.00 0.00 C ATOM 176 CG GLU A 11 15.231 4.351 0.321 1.00 0.00 C ATOM 177 CD GLU A 11 16.605 3.692 0.184 1.00 0.00 C ATOM 178 OE1 GLU A 11 16.702 2.744 -0.625 1.00 0.00 O ATOM 179 OE2 GLU A 11 17.528 4.152 0.891 1.00 0.00 O ATOM 0 H GLU A 11 12.459 4.597 -0.192 1.00 0.00 H new ATOM 0 HA GLU A 11 14.182 6.720 0.029 1.00 0.00 H new ATOM 0 HB2 GLU A 11 14.313 4.189 -1.624 1.00 0.00 H new ATOM 0 HB3 GLU A 11 15.646 5.324 -1.559 1.00 0.00 H new ATOM 0 HG2 GLU A 11 15.271 5.128 1.085 1.00 0.00 H new ATOM 0 HG3 GLU A 11 14.501 3.613 0.655 1.00 0.00 H new ATOM 186 N LEU A 12 12.969 6.437 -3.022 1.00 0.00 N ATOM 187 CA LEU A 12 12.768 7.152 -4.271 1.00 0.00 C ATOM 188 C LEU A 12 12.144 8.518 -3.977 1.00 0.00 C ATOM 189 O LEU A 12 12.598 9.536 -4.496 1.00 0.00 O ATOM 190 CB LEU A 12 11.954 6.303 -5.249 1.00 0.00 C ATOM 191 CG LEU A 12 11.490 7.008 -6.525 1.00 0.00 C ATOM 192 CD1 LEU A 12 12.683 7.541 -7.322 1.00 0.00 C ATOM 193 CD2 LEU A 12 10.602 6.090 -7.368 1.00 0.00 C ATOM 0 H LEU A 12 12.537 5.514 -2.984 1.00 0.00 H new ATOM 0 HA LEU A 12 13.723 7.336 -4.762 1.00 0.00 H new ATOM 0 HB2 LEU A 12 12.553 5.438 -5.533 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.075 5.925 -4.727 1.00 0.00 H new ATOM 0 HG LEU A 12 10.884 7.867 -6.238 1.00 0.00 H new ATOM 0 HD11 LEU A 12 12.325 8.037 -8.224 1.00 0.00 H new ATOM 0 HD12 LEU A 12 13.239 8.253 -6.712 1.00 0.00 H new ATOM 0 HD13 LEU A 12 13.335 6.713 -7.598 1.00 0.00 H new ATOM 0 HD21 LEU A 12 10.286 6.616 -8.269 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.162 5.197 -7.647 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.724 5.802 -6.790 1.00 0.00 H new ATOM 205 N PHE A 13 11.114 8.495 -3.144 1.00 0.00 N ATOM 206 CA PHE A 13 10.423 9.719 -2.775 1.00 0.00 C ATOM 207 C PHE A 13 11.411 10.777 -2.277 1.00 0.00 C ATOM 208 O PHE A 13 11.535 11.845 -2.875 1.00 0.00 O ATOM 209 CB PHE A 13 9.460 9.365 -1.641 1.00 0.00 C ATOM 210 CG PHE A 13 8.341 10.388 -1.431 1.00 0.00 C ATOM 211 CD1 PHE A 13 8.648 11.689 -1.182 1.00 0.00 C ATOM 212 CD2 PHE A 13 7.041 9.996 -1.494 1.00 0.00 C ATOM 213 CE1 PHE A 13 7.611 12.639 -0.988 1.00 0.00 C ATOM 214 CE2 PHE A 13 6.003 10.945 -1.300 1.00 0.00 C ATOM 215 CZ PHE A 13 6.310 12.247 -1.051 1.00 0.00 C ATOM 0 H PHE A 13 10.741 7.648 -2.714 1.00 0.00 H new ATOM 0 HA PHE A 13 9.900 10.126 -3.640 1.00 0.00 H new ATOM 0 HB2 PHE A 13 9.014 8.392 -1.847 1.00 0.00 H new ATOM 0 HB3 PHE A 13 10.026 9.266 -0.715 1.00 0.00 H new ATOM 0 HD1 PHE A 13 9.681 12.000 -1.132 1.00 0.00 H new ATOM 0 HD2 PHE A 13 6.798 8.962 -1.692 1.00 0.00 H new ATOM 0 HE1 PHE A 13 7.855 13.672 -0.791 1.00 0.00 H new ATOM 0 HE2 PHE A 13 4.970 10.634 -1.350 1.00 0.00 H new ATOM 0 HZ PHE A 13 5.521 12.969 -0.903 1.00 0.00 H new ATOM 225 N LYS A 14 12.087 10.443 -1.188 1.00 0.00 N ATOM 226 CA LYS A 14 13.059 11.351 -0.603 1.00 0.00 C ATOM 227 C LYS A 14 14.155 11.647 -1.629 1.00 0.00 C ATOM 228 O LYS A 14 14.919 12.597 -1.469 1.00 0.00 O ATOM 229 CB LYS A 14 13.589 10.790 0.718 1.00 0.00 C ATOM 230 CG LYS A 14 14.321 11.869 1.518 1.00 0.00 C ATOM 231 CD LYS A 14 14.842 11.311 2.843 1.00 0.00 C ATOM 232 CE LYS A 14 16.359 11.113 2.797 1.00 0.00 C ATOM 233 NZ LYS A 14 16.997 11.714 3.989 1.00 0.00 N ATOM 0 H LYS A 14 11.981 9.556 -0.695 1.00 0.00 H new ATOM 0 HA LYS A 14 12.590 12.302 -0.353 1.00 0.00 H new ATOM 0 HB2 LYS A 14 12.762 10.394 1.307 1.00 0.00 H new ATOM 0 HB3 LYS A 14 14.265 9.959 0.519 1.00 0.00 H new ATOM 0 HG2 LYS A 14 15.153 12.260 0.932 1.00 0.00 H new ATOM 0 HG3 LYS A 14 13.647 12.704 1.711 1.00 0.00 H new ATOM 0 HD2 LYS A 14 14.585 11.992 3.654 1.00 0.00 H new ATOM 0 HD3 LYS A 14 14.354 10.360 3.058 1.00 0.00 H new ATOM 0 HE2 LYS A 14 16.591 10.049 2.750 1.00 0.00 H new ATOM 0 HE3 LYS A 14 16.764 11.568 1.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 18.026 11.571 3.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 16.790 12.733 4.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 16.624 11.262 4.848 1.00 0.00 H new ATOM 247 N SER A 15 14.198 10.815 -2.659 1.00 0.00 N ATOM 248 CA SER A 15 15.188 10.975 -3.710 1.00 0.00 C ATOM 249 C SER A 15 14.602 11.798 -4.860 1.00 0.00 C ATOM 250 O SER A 15 15.340 12.330 -5.687 1.00 0.00 O ATOM 251 CB SER A 15 15.672 9.618 -4.223 1.00 0.00 C ATOM 252 OG SER A 15 16.923 9.718 -4.899 1.00 0.00 O ATOM 0 H SER A 15 13.563 10.028 -2.788 1.00 0.00 H new ATOM 0 HA SER A 15 16.046 11.503 -3.293 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.767 8.927 -3.386 1.00 0.00 H new ATOM 0 HB3 SER A 15 14.927 9.199 -4.899 1.00 0.00 H new ATOM 0 HG SER A 15 17.199 8.830 -5.210 1.00 0.00 H new ATOM 258 N LEU A 16 13.279 11.877 -4.874 1.00 0.00 N ATOM 259 CA LEU A 16 12.585 12.626 -5.908 1.00 0.00 C ATOM 260 C LEU A 16 12.602 14.114 -5.552 1.00 0.00 C ATOM 261 O LEU A 16 12.776 14.476 -4.390 1.00 0.00 O ATOM 262 CB LEU A 16 11.180 12.062 -6.127 1.00 0.00 C ATOM 263 CG LEU A 16 11.095 10.774 -6.948 1.00 0.00 C ATOM 264 CD1 LEU A 16 9.652 10.274 -7.035 1.00 0.00 C ATOM 265 CD2 LEU A 16 11.720 10.963 -8.331 1.00 0.00 C ATOM 0 H LEU A 16 12.670 11.435 -4.186 1.00 0.00 H new ATOM 0 HA LEU A 16 13.098 12.521 -6.864 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.728 11.879 -5.152 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.577 12.824 -6.620 1.00 0.00 H new ATOM 0 HG LEU A 16 11.673 10.004 -6.436 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.619 9.357 -7.624 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.275 10.074 -6.032 1.00 0.00 H new ATOM 0 HD13 LEU A 16 9.032 11.033 -7.511 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.646 10.032 -8.894 1.00 0.00 H new ATOM 0 HD22 LEU A 16 11.191 11.753 -8.865 1.00 0.00 H new ATOM 0 HD23 LEU A 16 12.769 11.239 -8.222 1.00 0.00 H new ATOM 277 N PRO A 17 12.415 14.958 -6.602 1.00 0.00 N ATOM 278 CA PRO A 17 12.407 16.399 -6.412 1.00 0.00 C ATOM 279 C PRO A 17 11.100 16.859 -5.764 1.00 0.00 C ATOM 280 O PRO A 17 10.021 16.409 -6.146 1.00 0.00 O ATOM 281 CB PRO A 17 12.619 16.980 -7.800 1.00 0.00 C ATOM 282 CG PRO A 17 12.273 15.866 -8.775 1.00 0.00 C ATOM 283 CD PRO A 17 12.207 14.565 -7.993 1.00 0.00 C ATOM 0 HA PRO A 17 13.187 16.738 -5.730 1.00 0.00 H new ATOM 0 HB2 PRO A 17 11.983 17.851 -7.960 1.00 0.00 H new ATOM 0 HB3 PRO A 17 13.650 17.309 -7.933 1.00 0.00 H new ATOM 0 HG2 PRO A 17 11.319 16.068 -9.262 1.00 0.00 H new ATOM 0 HG3 PRO A 17 13.024 15.801 -9.562 1.00 0.00 H new ATOM 0 HD2 PRO A 17 11.244 14.072 -8.125 1.00 0.00 H new ATOM 0 HD3 PRO A 17 12.973 13.864 -8.325 1.00 0.00 H new ATOM 291 N LYS A 18 11.239 17.751 -4.794 1.00 0.00 N ATOM 292 CA LYS A 18 10.083 18.277 -4.089 1.00 0.00 C ATOM 293 C LYS A 18 8.918 18.425 -5.069 1.00 0.00 C ATOM 294 O LYS A 18 7.932 17.694 -4.982 1.00 0.00 O ATOM 295 CB LYS A 18 10.443 19.574 -3.362 1.00 0.00 C ATOM 296 CG LYS A 18 9.218 20.172 -2.668 1.00 0.00 C ATOM 297 CD LYS A 18 8.889 19.410 -1.382 1.00 0.00 C ATOM 298 CE LYS A 18 9.646 19.995 -0.189 1.00 0.00 C ATOM 299 NZ LYS A 18 8.705 20.363 0.892 1.00 0.00 N ATOM 0 H LYS A 18 12.135 18.123 -4.480 1.00 0.00 H new ATOM 0 HA LYS A 18 9.762 17.582 -3.313 1.00 0.00 H new ATOM 0 HB2 LYS A 18 11.223 19.378 -2.626 1.00 0.00 H new ATOM 0 HB3 LYS A 18 10.849 20.293 -4.073 1.00 0.00 H new ATOM 0 HG2 LYS A 18 9.403 21.221 -2.436 1.00 0.00 H new ATOM 0 HG3 LYS A 18 8.362 20.141 -3.342 1.00 0.00 H new ATOM 0 HD2 LYS A 18 7.816 19.454 -1.193 1.00 0.00 H new ATOM 0 HD3 LYS A 18 9.149 18.358 -1.502 1.00 0.00 H new ATOM 0 HE2 LYS A 18 10.369 19.269 0.182 1.00 0.00 H new ATOM 0 HE3 LYS A 18 10.209 20.874 -0.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 9.194 20.317 1.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 8.356 21.330 0.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 7.903 19.701 0.894 1.00 0.00 H new ATOM 313 N GLU A 19 9.069 19.375 -5.980 1.00 0.00 N ATOM 314 CA GLU A 19 8.041 19.628 -6.975 1.00 0.00 C ATOM 315 C GLU A 19 7.382 18.315 -7.403 1.00 0.00 C ATOM 316 O GLU A 19 6.160 18.239 -7.518 1.00 0.00 O ATOM 317 CB GLU A 19 8.618 20.370 -8.182 1.00 0.00 C ATOM 318 CG GLU A 19 9.251 19.394 -9.176 1.00 0.00 C ATOM 319 CD GLU A 19 9.822 20.136 -10.386 1.00 0.00 C ATOM 320 OE1 GLU A 19 10.308 21.269 -10.179 1.00 0.00 O ATOM 321 OE2 GLU A 19 9.761 19.553 -11.490 1.00 0.00 O ATOM 0 H GLU A 19 9.888 19.979 -6.050 1.00 0.00 H new ATOM 0 HA GLU A 19 7.279 20.266 -6.528 1.00 0.00 H new ATOM 0 HB2 GLU A 19 7.829 20.937 -8.676 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.365 21.089 -7.848 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.044 18.831 -8.683 1.00 0.00 H new ATOM 0 HG3 GLU A 19 8.505 18.672 -9.507 1.00 0.00 H new ATOM 328 N LEU A 20 8.221 17.314 -7.627 1.00 0.00 N ATOM 329 CA LEU A 20 7.735 16.008 -8.039 1.00 0.00 C ATOM 330 C LEU A 20 7.095 15.305 -6.840 1.00 0.00 C ATOM 331 O LEU A 20 5.981 14.793 -6.939 1.00 0.00 O ATOM 332 CB LEU A 20 8.856 15.203 -8.698 1.00 0.00 C ATOM 333 CG LEU A 20 9.149 15.534 -10.163 1.00 0.00 C ATOM 334 CD1 LEU A 20 10.138 14.534 -10.764 1.00 0.00 C ATOM 335 CD2 LEU A 20 7.855 15.618 -10.975 1.00 0.00 C ATOM 0 H LEU A 20 9.234 17.381 -7.531 1.00 0.00 H new ATOM 0 HA LEU A 20 6.960 16.112 -8.798 1.00 0.00 H new ATOM 0 HB2 LEU A 20 9.770 15.352 -8.123 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.605 14.145 -8.629 1.00 0.00 H new ATOM 0 HG LEU A 20 9.620 16.516 -10.204 1.00 0.00 H new ATOM 0 HD11 LEU A 20 10.329 14.792 -11.806 1.00 0.00 H new ATOM 0 HD12 LEU A 20 11.073 14.566 -10.205 1.00 0.00 H new ATOM 0 HD13 LEU A 20 9.718 13.530 -10.710 1.00 0.00 H new ATOM 0 HD21 LEU A 20 8.091 15.854 -12.013 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.335 14.661 -10.930 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.216 16.398 -10.562 1.00 0.00 H new ATOM 347 N ARG A 21 7.827 15.303 -5.736 1.00 0.00 N ATOM 348 CA ARG A 21 7.345 14.671 -4.520 1.00 0.00 C ATOM 349 C ARG A 21 5.843 14.913 -4.355 1.00 0.00 C ATOM 350 O ARG A 21 5.136 14.083 -3.787 1.00 0.00 O ATOM 351 CB ARG A 21 8.079 15.211 -3.290 1.00 0.00 C ATOM 352 CG ARG A 21 9.526 14.717 -3.255 1.00 0.00 C ATOM 353 CD ARG A 21 10.195 15.073 -1.926 1.00 0.00 C ATOM 354 NE ARG A 21 11.615 15.422 -2.151 1.00 0.00 N ATOM 355 CZ ARG A 21 12.540 15.468 -1.183 1.00 0.00 C ATOM 356 NH1 ARG A 21 12.200 15.187 0.083 1.00 0.00 N ATOM 357 NH2 ARG A 21 13.806 15.794 -1.480 1.00 0.00 N ATOM 0 H ARG A 21 8.750 15.729 -5.658 1.00 0.00 H new ATOM 0 HA ARG A 21 7.537 13.601 -4.604 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.063 16.301 -3.302 1.00 0.00 H new ATOM 0 HB3 ARG A 21 7.561 14.895 -2.385 1.00 0.00 H new ATOM 0 HG2 ARG A 21 9.549 13.637 -3.400 1.00 0.00 H new ATOM 0 HG3 ARG A 21 10.086 15.161 -4.078 1.00 0.00 H new ATOM 0 HD2 ARG A 21 9.675 15.911 -1.461 1.00 0.00 H new ATOM 0 HD3 ARG A 21 10.124 14.232 -1.237 1.00 0.00 H new ATOM 0 HE ARG A 21 11.908 15.641 -3.103 1.00 0.00 H new ATOM 0 HH11 ARG A 21 11.237 14.938 0.309 1.00 0.00 H new ATOM 0 HH12 ARG A 21 12.904 15.222 0.820 1.00 0.00 H new ATOM 0 HH21 ARG A 21 14.065 16.007 -2.443 1.00 0.00 H new ATOM 0 HH22 ARG A 21 14.510 15.829 -0.743 1.00 0.00 H new ATOM 371 N SER A 22 5.400 16.053 -4.864 1.00 0.00 N ATOM 372 CA SER A 22 3.995 16.414 -4.781 1.00 0.00 C ATOM 373 C SER A 22 3.157 15.450 -5.622 1.00 0.00 C ATOM 374 O SER A 22 2.189 14.871 -5.129 1.00 0.00 O ATOM 375 CB SER A 22 3.769 17.855 -5.242 1.00 0.00 C ATOM 376 OG SER A 22 2.631 18.443 -4.618 1.00 0.00 O ATOM 0 H SER A 22 5.989 16.739 -5.336 1.00 0.00 H new ATOM 0 HA SER A 22 3.684 16.341 -3.739 1.00 0.00 H new ATOM 0 HB2 SER A 22 4.654 18.451 -5.017 1.00 0.00 H new ATOM 0 HB3 SER A 22 3.639 17.873 -6.324 1.00 0.00 H new ATOM 0 HG SER A 22 2.522 19.363 -4.937 1.00 0.00 H new ATOM 382 N GLN A 23 3.557 15.307 -6.876 1.00 0.00 N ATOM 383 CA GLN A 23 2.855 14.422 -7.790 1.00 0.00 C ATOM 384 C GLN A 23 2.916 12.979 -7.284 1.00 0.00 C ATOM 385 O GLN A 23 1.947 12.232 -7.411 1.00 0.00 O ATOM 386 CB GLN A 23 3.424 14.531 -9.206 1.00 0.00 C ATOM 387 CG GLN A 23 4.531 13.500 -9.433 1.00 0.00 C ATOM 388 CD GLN A 23 5.133 13.640 -10.832 1.00 0.00 C ATOM 389 OE1 GLN A 23 4.781 14.519 -11.602 1.00 0.00 O ATOM 390 NE2 GLN A 23 6.058 12.728 -11.117 1.00 0.00 N ATOM 0 H GLN A 23 4.359 15.789 -7.281 1.00 0.00 H new ATOM 0 HA GLN A 23 1.810 14.729 -7.830 1.00 0.00 H new ATOM 0 HB2 GLN A 23 2.627 14.381 -9.934 1.00 0.00 H new ATOM 0 HB3 GLN A 23 3.818 15.534 -9.367 1.00 0.00 H new ATOM 0 HG2 GLN A 23 5.311 13.628 -8.683 1.00 0.00 H new ATOM 0 HG3 GLN A 23 4.128 12.495 -9.305 1.00 0.00 H new ATOM 0 HE21 GLN A 23 6.306 12.020 -10.426 1.00 0.00 H new ATOM 0 HE22 GLN A 23 6.520 12.737 -12.026 1.00 0.00 H new ATOM 399 N VAL A 24 4.064 12.631 -6.722 1.00 0.00 N ATOM 400 CA VAL A 24 4.264 11.291 -6.197 1.00 0.00 C ATOM 401 C VAL A 24 3.037 10.880 -5.380 1.00 0.00 C ATOM 402 O VAL A 24 2.523 9.774 -5.540 1.00 0.00 O ATOM 403 CB VAL A 24 5.564 11.233 -5.393 1.00 0.00 C ATOM 404 CG1 VAL A 24 5.719 9.878 -4.699 1.00 0.00 C ATOM 405 CG2 VAL A 24 6.772 11.535 -6.283 1.00 0.00 C ATOM 0 H VAL A 24 4.865 13.254 -6.619 1.00 0.00 H new ATOM 0 HA VAL A 24 4.368 10.573 -7.011 1.00 0.00 H new ATOM 0 HB VAL A 24 5.516 12.001 -4.621 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.651 9.863 -4.134 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.881 9.719 -4.020 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.735 9.086 -5.447 1.00 0.00 H new ATOM 0 HG21 VAL A 24 7.684 11.487 -5.687 1.00 0.00 H new ATOM 0 HG22 VAL A 24 6.825 10.800 -7.086 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.669 12.533 -6.710 1.00 0.00 H new ATOM 415 N LEU A 25 2.604 11.792 -4.522 1.00 0.00 N ATOM 416 CA LEU A 25 1.448 11.538 -3.680 1.00 0.00 C ATOM 417 C LEU A 25 0.210 11.357 -4.561 1.00 0.00 C ATOM 418 O LEU A 25 -0.547 10.404 -4.386 1.00 0.00 O ATOM 419 CB LEU A 25 1.299 12.640 -2.629 1.00 0.00 C ATOM 420 CG LEU A 25 2.448 12.772 -1.628 1.00 0.00 C ATOM 421 CD1 LEU A 25 2.168 13.884 -0.615 1.00 0.00 C ATOM 422 CD2 LEU A 25 2.736 11.433 -0.944 1.00 0.00 C ATOM 0 H LEU A 25 3.033 12.708 -4.392 1.00 0.00 H new ATOM 0 HA LEU A 25 1.580 10.611 -3.121 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.182 13.593 -3.145 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.378 12.463 -2.073 1.00 0.00 H new ATOM 0 HG LEU A 25 3.347 13.054 -2.176 1.00 0.00 H new ATOM 0 HD11 LEU A 25 3.000 13.957 0.085 1.00 0.00 H new ATOM 0 HD12 LEU A 25 2.051 14.833 -1.139 1.00 0.00 H new ATOM 0 HD13 LEU A 25 1.253 13.656 -0.068 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.557 11.555 -0.237 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.846 11.097 -0.412 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.010 10.692 -1.695 1.00 0.00 H new ATOM 434 N LEU A 26 0.043 12.287 -5.490 1.00 0.00 N ATOM 435 CA LEU A 26 -1.089 12.243 -6.399 1.00 0.00 C ATOM 436 C LEU A 26 -1.078 10.913 -7.155 1.00 0.00 C ATOM 437 O LEU A 26 -2.056 10.167 -7.121 1.00 0.00 O ATOM 438 CB LEU A 26 -1.092 13.470 -7.312 1.00 0.00 C ATOM 439 CG LEU A 26 -2.060 14.590 -6.927 1.00 0.00 C ATOM 440 CD1 LEU A 26 -3.442 14.028 -6.586 1.00 0.00 C ATOM 441 CD2 LEU A 26 -1.490 15.440 -5.790 1.00 0.00 C ATOM 0 H LEU A 26 0.674 13.076 -5.633 1.00 0.00 H new ATOM 0 HA LEU A 26 -2.026 12.287 -5.843 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -0.083 13.882 -7.338 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.329 13.144 -8.325 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.184 15.246 -7.789 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -4.111 14.845 -6.316 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -3.844 13.501 -7.451 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -3.357 13.337 -5.748 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.198 16.229 -5.536 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.318 14.811 -4.916 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.547 15.886 -6.107 1.00 0.00 H new ATOM 453 N GLU A 27 0.038 10.656 -7.821 1.00 0.00 N ATOM 454 CA GLU A 27 0.190 9.430 -8.585 1.00 0.00 C ATOM 455 C GLU A 27 -0.376 8.244 -7.801 1.00 0.00 C ATOM 456 O GLU A 27 -1.384 7.659 -8.195 1.00 0.00 O ATOM 457 CB GLU A 27 1.655 9.192 -8.957 1.00 0.00 C ATOM 458 CG GLU A 27 2.275 10.449 -9.570 1.00 0.00 C ATOM 459 CD GLU A 27 2.887 10.147 -10.939 1.00 0.00 C ATOM 460 OE1 GLU A 27 3.513 9.071 -11.056 1.00 0.00 O ATOM 461 OE2 GLU A 27 2.716 10.998 -11.838 1.00 0.00 O ATOM 0 H GLU A 27 0.847 11.277 -7.847 1.00 0.00 H new ATOM 0 HA GLU A 27 -0.373 9.531 -9.513 1.00 0.00 H new ATOM 0 HB2 GLU A 27 2.217 8.901 -8.070 1.00 0.00 H new ATOM 0 HB3 GLU A 27 1.725 8.365 -9.664 1.00 0.00 H new ATOM 0 HG2 GLU A 27 1.513 11.222 -9.671 1.00 0.00 H new ATOM 0 HG3 GLU A 27 3.042 10.842 -8.903 1.00 0.00 H new ATOM 468 N TYR A 28 0.297 7.924 -6.706 1.00 0.00 N ATOM 469 CA TYR A 28 -0.126 6.818 -5.864 1.00 0.00 C ATOM 470 C TYR A 28 -1.652 6.716 -5.817 1.00 0.00 C ATOM 471 O TYR A 28 -2.224 5.713 -6.240 1.00 0.00 O ATOM 472 CB TYR A 28 0.395 7.133 -4.460 1.00 0.00 C ATOM 473 CG TYR A 28 1.898 6.903 -4.288 1.00 0.00 C ATOM 474 CD1 TYR A 28 2.492 5.784 -4.836 1.00 0.00 C ATOM 475 CD2 TYR A 28 2.659 7.814 -3.585 1.00 0.00 C ATOM 476 CE1 TYR A 28 3.906 5.568 -4.674 1.00 0.00 C ATOM 477 CE2 TYR A 28 4.074 7.598 -3.423 1.00 0.00 C ATOM 478 CZ TYR A 28 4.628 6.485 -3.976 1.00 0.00 C ATOM 479 OH TYR A 28 5.963 6.281 -3.823 1.00 0.00 O ATOM 0 H TYR A 28 1.133 8.411 -6.382 1.00 0.00 H new ATOM 0 HA TYR A 28 0.258 5.874 -6.251 1.00 0.00 H new ATOM 0 HB2 TYR A 28 0.168 8.173 -4.224 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.141 6.517 -3.738 1.00 0.00 H new ATOM 0 HD1 TYR A 28 1.896 5.071 -5.386 1.00 0.00 H new ATOM 0 HD2 TYR A 28 2.194 8.689 -3.156 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.383 4.697 -5.098 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.681 8.303 -2.875 1.00 0.00 H new ATOM 0 HH TYR A 28 6.303 5.758 -4.579 1.00 0.00 H new ATOM 489 N ALA A 29 -2.268 7.769 -5.300 1.00 0.00 N ATOM 490 CA ALA A 29 -3.716 7.812 -5.193 1.00 0.00 C ATOM 491 C ALA A 29 -4.334 7.324 -6.505 1.00 0.00 C ATOM 492 O ALA A 29 -5.109 6.368 -6.512 1.00 0.00 O ATOM 493 CB ALA A 29 -4.160 9.230 -4.831 1.00 0.00 C ATOM 0 H ALA A 29 -1.790 8.599 -4.950 1.00 0.00 H new ATOM 0 HA ALA A 29 -4.062 7.150 -4.399 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -5.247 9.262 -4.751 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -3.717 9.518 -3.877 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -3.833 9.923 -5.606 1.00 0.00 H new ATOM 499 N ALA A 30 -3.969 8.003 -7.582 1.00 0.00 N ATOM 500 CA ALA A 30 -4.479 7.651 -8.897 1.00 0.00 C ATOM 501 C ALA A 30 -4.280 6.152 -9.131 1.00 0.00 C ATOM 502 O ALA A 30 -5.036 5.531 -9.877 1.00 0.00 O ATOM 503 CB ALA A 30 -3.784 8.504 -9.959 1.00 0.00 C ATOM 0 H ALA A 30 -3.326 8.795 -7.572 1.00 0.00 H new ATOM 0 HA ALA A 30 -5.548 7.856 -8.962 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -4.166 8.240 -10.945 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -3.980 9.558 -9.764 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -2.710 8.322 -9.926 1.00 0.00 H new ATOM 509 N LYS A 31 -3.259 5.614 -8.481 1.00 0.00 N ATOM 510 CA LYS A 31 -2.951 4.200 -8.609 1.00 0.00 C ATOM 511 C LYS A 31 -3.665 3.424 -7.500 1.00 0.00 C ATOM 512 O LYS A 31 -3.124 2.457 -6.966 1.00 0.00 O ATOM 513 CB LYS A 31 -1.437 3.981 -8.636 1.00 0.00 C ATOM 514 CG LYS A 31 -0.812 4.626 -9.875 1.00 0.00 C ATOM 515 CD LYS A 31 0.061 5.822 -9.489 1.00 0.00 C ATOM 516 CE LYS A 31 1.509 5.609 -9.934 1.00 0.00 C ATOM 517 NZ LYS A 31 1.595 5.555 -11.411 1.00 0.00 N ATOM 0 H LYS A 31 -2.634 6.132 -7.864 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.322 3.814 -9.558 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -0.989 4.403 -7.737 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -1.220 2.913 -8.629 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.211 3.890 -10.409 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.598 4.950 -10.557 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -0.335 6.729 -9.947 1.00 0.00 H new ATOM 0 HD3 LYS A 31 0.026 5.969 -8.410 1.00 0.00 H new ATOM 0 HE2 LYS A 31 2.134 6.418 -9.557 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.894 4.683 -9.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.568 5.767 -11.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 1.331 4.604 -11.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 0.946 6.256 -11.822 1.00 0.00 H new ATOM 531 N VAL A 32 -4.870 3.878 -7.185 1.00 0.00 N ATOM 532 CA VAL A 32 -5.663 3.239 -6.150 1.00 0.00 C ATOM 533 C VAL A 32 -7.119 3.146 -6.612 1.00 0.00 C ATOM 534 O VAL A 32 -7.900 4.073 -6.402 1.00 0.00 O ATOM 535 CB VAL A 32 -5.502 3.992 -4.828 1.00 0.00 C ATOM 536 CG1 VAL A 32 -6.229 3.269 -3.692 1.00 0.00 C ATOM 537 CG2 VAL A 32 -4.024 4.197 -4.490 1.00 0.00 C ATOM 0 H VAL A 32 -5.316 4.681 -7.629 1.00 0.00 H new ATOM 0 HA VAL A 32 -5.313 2.222 -5.974 1.00 0.00 H new ATOM 0 HB VAL A 32 -5.958 4.975 -4.945 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -6.098 3.826 -2.764 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -7.291 3.199 -3.926 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -5.816 2.267 -3.575 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -3.938 4.735 -3.546 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -3.533 3.228 -4.402 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -3.547 4.775 -5.281 1.00 0.00 H new ATOM 547 N PRO A 33 -7.447 1.990 -7.248 1.00 0.00 N ATOM 548 CA PRO A 33 -8.795 1.765 -7.742 1.00 0.00 C ATOM 549 C PRO A 33 -9.754 1.445 -6.593 1.00 0.00 C ATOM 550 O PRO A 33 -9.324 1.022 -5.521 1.00 0.00 O ATOM 551 CB PRO A 33 -8.663 0.626 -8.740 1.00 0.00 C ATOM 552 CG PRO A 33 -7.339 -0.051 -8.427 1.00 0.00 C ATOM 553 CD PRO A 33 -6.548 0.871 -7.514 1.00 0.00 C ATOM 0 HA PRO A 33 -9.221 2.648 -8.219 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.492 -0.075 -8.645 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -8.678 1.000 -9.764 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.507 -1.014 -7.944 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -6.784 -0.247 -9.345 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -6.262 0.365 -6.592 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -5.628 1.207 -7.992 1.00 0.00 H new ATOM 561 N PRO A 34 -11.068 1.666 -6.863 1.00 0.00 N ATOM 562 CA PRO A 34 -12.091 1.406 -5.864 1.00 0.00 C ATOM 563 C PRO A 34 -12.339 -0.096 -5.711 1.00 0.00 C ATOM 564 O PRO A 34 -12.132 -0.862 -6.651 1.00 0.00 O ATOM 565 CB PRO A 34 -13.316 2.163 -6.350 1.00 0.00 C ATOM 566 CG PRO A 34 -13.080 2.435 -7.827 1.00 0.00 C ATOM 567 CD PRO A 34 -11.614 2.166 -8.121 1.00 0.00 C ATOM 0 HA PRO A 34 -11.801 1.741 -4.868 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -14.222 1.576 -6.201 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -13.445 3.094 -5.797 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -13.716 1.796 -8.439 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -13.335 3.466 -8.071 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -11.499 1.435 -8.921 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -11.102 3.073 -8.442 1.00 0.00 H new ATOM 575 N PRO A 35 -12.790 -0.482 -4.488 1.00 0.00 N ATOM 576 CA PRO A 35 -13.068 -1.879 -4.199 1.00 0.00 C ATOM 577 C PRO A 35 -14.373 -2.326 -4.860 1.00 0.00 C ATOM 578 O PRO A 35 -15.207 -1.496 -5.220 1.00 0.00 O ATOM 579 CB PRO A 35 -13.109 -1.967 -2.682 1.00 0.00 C ATOM 580 CG PRO A 35 -13.315 -0.544 -2.188 1.00 0.00 C ATOM 581 CD PRO A 35 -13.046 0.397 -3.351 1.00 0.00 C ATOM 0 HA PRO A 35 -12.311 -2.551 -4.603 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -13.919 -2.617 -2.350 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -12.183 -2.386 -2.290 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -14.332 -0.412 -1.818 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -12.643 -0.327 -1.358 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -13.899 1.049 -3.539 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -12.191 1.042 -3.149 1.00 0.00 H new ATOM 589 N PRO A 36 -14.515 -3.671 -5.002 1.00 0.00 N ATOM 590 CA PRO A 36 -15.705 -4.238 -5.612 1.00 0.00 C ATOM 591 C PRO A 36 -16.895 -4.180 -4.652 1.00 0.00 C ATOM 592 O PRO A 36 -16.732 -3.863 -3.475 1.00 0.00 O ATOM 593 CB PRO A 36 -15.315 -5.658 -5.989 1.00 0.00 C ATOM 594 CG PRO A 36 -14.082 -5.985 -5.163 1.00 0.00 C ATOM 595 CD PRO A 36 -13.549 -4.684 -4.586 1.00 0.00 C ATOM 0 HA PRO A 36 -16.033 -3.682 -6.490 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -16.125 -6.355 -5.775 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -15.102 -5.735 -7.055 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -14.332 -6.683 -4.364 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -13.325 -6.467 -5.782 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -13.471 -4.735 -3.500 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -12.552 -4.461 -4.967 1.00 0.00 H new ATOM 603 N PRO A 37 -18.096 -4.498 -5.205 1.00 0.00 N ATOM 604 CA PRO A 37 -19.312 -4.485 -4.411 1.00 0.00 C ATOM 605 C PRO A 37 -19.377 -5.702 -3.486 1.00 0.00 C ATOM 606 O PRO A 37 -20.173 -5.732 -2.549 1.00 0.00 O ATOM 607 CB PRO A 37 -20.444 -4.450 -5.426 1.00 0.00 C ATOM 608 CG PRO A 37 -19.839 -4.912 -6.741 1.00 0.00 C ATOM 609 CD PRO A 37 -18.326 -4.878 -6.596 1.00 0.00 C ATOM 0 HA PRO A 37 -19.367 -3.627 -3.741 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -21.262 -5.103 -5.122 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -20.856 -3.445 -5.517 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -20.177 -5.920 -6.983 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -20.159 -4.264 -7.557 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -17.885 -5.849 -6.819 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -17.878 -4.159 -7.282 1.00 0.00 H new ATOM 617 N GLY A 38 -18.528 -6.676 -3.782 1.00 0.00 N ATOM 618 CA GLY A 38 -18.479 -7.892 -2.989 1.00 0.00 C ATOM 619 C GLY A 38 -17.295 -7.867 -2.020 1.00 0.00 C ATOM 620 O GLY A 38 -16.464 -8.774 -2.025 1.00 0.00 O ATOM 0 H GLY A 38 -17.869 -6.647 -4.560 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -19.408 -8.004 -2.431 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -18.397 -8.757 -3.647 1.00 0.00 H new ATOM 624 N VAL A 39 -17.255 -6.818 -1.212 1.00 0.00 N ATOM 625 CA VAL A 39 -16.187 -6.662 -0.239 1.00 0.00 C ATOM 626 C VAL A 39 -16.625 -5.668 0.838 1.00 0.00 C ATOM 627 O VAL A 39 -17.415 -4.764 0.569 1.00 0.00 O ATOM 628 CB VAL A 39 -14.894 -6.250 -0.944 1.00 0.00 C ATOM 629 CG1 VAL A 39 -15.123 -5.033 -1.843 1.00 0.00 C ATOM 630 CG2 VAL A 39 -13.779 -5.980 0.069 1.00 0.00 C ATOM 0 H VAL A 39 -17.945 -6.067 -1.211 1.00 0.00 H new ATOM 0 HA VAL A 39 -15.982 -7.610 0.259 1.00 0.00 H new ATOM 0 HB VAL A 39 -14.579 -7.080 -1.577 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -14.188 -4.761 -2.332 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -15.871 -5.274 -2.598 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -15.474 -4.196 -1.240 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -12.871 -5.689 -0.459 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -14.083 -5.176 0.739 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -13.588 -6.883 0.649 1.00 0.00 H new ATOM 640 N GLU A 40 -16.092 -5.868 2.035 1.00 0.00 N ATOM 641 CA GLU A 40 -16.417 -5.000 3.153 1.00 0.00 C ATOM 642 C GLU A 40 -15.139 -4.446 3.785 1.00 0.00 C ATOM 643 O GLU A 40 -14.360 -5.193 4.376 1.00 0.00 O ATOM 644 CB GLU A 40 -17.267 -5.737 4.190 1.00 0.00 C ATOM 645 CG GLU A 40 -17.123 -5.097 5.573 1.00 0.00 C ATOM 646 CD GLU A 40 -18.428 -5.201 6.364 1.00 0.00 C ATOM 647 OE1 GLU A 40 -18.642 -6.275 6.967 1.00 0.00 O ATOM 648 OE2 GLU A 40 -19.182 -4.204 6.349 1.00 0.00 O ATOM 0 H GLU A 40 -15.437 -6.619 2.254 1.00 0.00 H new ATOM 0 HA GLU A 40 -17.005 -4.162 2.778 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -18.313 -5.721 3.885 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -16.964 -6.783 4.236 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -16.320 -5.588 6.123 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -16.841 -4.050 5.465 1.00 0.00 H new ATOM 655 N LEU A 41 -14.961 -3.141 3.639 1.00 0.00 N ATOM 656 CA LEU A 41 -13.791 -2.479 4.189 1.00 0.00 C ATOM 657 C LEU A 41 -14.011 -2.215 5.679 1.00 0.00 C ATOM 658 O LEU A 41 -15.127 -2.351 6.179 1.00 0.00 O ATOM 659 CB LEU A 41 -13.460 -1.221 3.384 1.00 0.00 C ATOM 660 CG LEU A 41 -13.265 -1.419 1.879 1.00 0.00 C ATOM 661 CD1 LEU A 41 -11.871 -0.964 1.442 1.00 0.00 C ATOM 662 CD2 LEU A 41 -13.547 -2.868 1.476 1.00 0.00 C ATOM 0 H LEU A 41 -15.608 -2.524 3.147 1.00 0.00 H new ATOM 0 HA LEU A 41 -12.916 -3.123 4.106 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -14.260 -0.497 3.534 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.551 -0.781 3.793 1.00 0.00 H new ATOM 0 HG LEU A 41 -13.987 -0.792 1.356 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -11.759 -1.116 0.368 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -11.744 0.093 1.674 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -11.116 -1.545 1.971 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -13.401 -2.982 0.402 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -12.866 -3.533 2.007 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.575 -3.123 1.732 1.00 0.00 H new ATOM 674 N GLU A 42 -12.930 -1.842 6.348 1.00 0.00 N ATOM 675 CA GLU A 42 -12.992 -1.557 7.772 1.00 0.00 C ATOM 676 C GLU A 42 -12.673 -0.084 8.033 1.00 0.00 C ATOM 677 O GLU A 42 -11.507 0.310 8.040 1.00 0.00 O ATOM 678 CB GLU A 42 -12.047 -2.471 8.555 1.00 0.00 C ATOM 679 CG GLU A 42 -12.248 -2.304 10.063 1.00 0.00 C ATOM 680 CD GLU A 42 -11.533 -3.414 10.837 1.00 0.00 C ATOM 681 OE1 GLU A 42 -11.912 -4.587 10.627 1.00 0.00 O ATOM 682 OE2 GLU A 42 -10.624 -3.064 11.620 1.00 0.00 O ATOM 0 H GLU A 42 -12.006 -1.730 5.931 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.006 -1.755 8.119 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -12.223 -3.509 8.274 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -11.014 -2.241 8.294 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -11.868 -1.332 10.379 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -13.313 -2.321 10.296 1.00 0.00 H new ATOM 689 N ARG A 43 -13.728 0.690 8.241 1.00 0.00 N ATOM 690 CA ARG A 43 -13.574 2.111 8.502 1.00 0.00 C ATOM 691 C ARG A 43 -12.528 2.340 9.595 1.00 0.00 C ATOM 692 O ARG A 43 -12.613 1.754 10.673 1.00 0.00 O ATOM 693 CB ARG A 43 -14.901 2.738 8.936 1.00 0.00 C ATOM 694 CG ARG A 43 -14.672 4.091 9.613 1.00 0.00 C ATOM 695 CD ARG A 43 -15.671 5.133 9.106 1.00 0.00 C ATOM 696 NE ARG A 43 -17.051 4.717 9.443 1.00 0.00 N ATOM 697 CZ ARG A 43 -17.593 4.832 10.663 1.00 0.00 C ATOM 698 NH1 ARG A 43 -16.876 5.350 11.669 1.00 0.00 N ATOM 699 NH2 ARG A 43 -18.853 4.428 10.876 1.00 0.00 N ATOM 0 H ARG A 43 -14.693 0.360 8.234 1.00 0.00 H new ATOM 0 HA ARG A 43 -13.247 2.585 7.576 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -15.548 2.866 8.068 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -15.417 2.067 9.622 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -14.771 3.983 10.693 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -13.655 4.432 9.418 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -15.455 6.103 9.553 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -15.571 5.250 8.027 1.00 0.00 H new ATOM 0 HE ARG A 43 -17.625 4.318 8.700 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -15.917 5.657 11.506 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -17.289 5.437 12.598 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -19.398 4.033 10.110 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -19.266 4.515 11.804 1.00 0.00 H new ATOM 713 N VAL A 44 -11.566 3.194 9.279 1.00 0.00 N ATOM 714 CA VAL A 44 -10.504 3.507 10.220 1.00 0.00 C ATOM 715 C VAL A 44 -10.925 4.703 11.077 1.00 0.00 C ATOM 716 O VAL A 44 -10.845 5.847 10.634 1.00 0.00 O ATOM 717 CB VAL A 44 -9.192 3.742 9.470 1.00 0.00 C ATOM 718 CG1 VAL A 44 -8.052 4.049 10.443 1.00 0.00 C ATOM 719 CG2 VAL A 44 -8.846 2.545 8.582 1.00 0.00 C ATOM 0 H VAL A 44 -11.500 3.679 8.384 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.331 2.668 10.894 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.326 4.610 8.825 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -7.131 4.212 9.884 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -8.293 4.945 11.015 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -7.919 3.209 11.125 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -7.909 2.738 8.060 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.741 1.653 9.199 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.642 2.390 7.853 1.00 0.00 H new ATOM 729 N HIS A 45 -11.365 4.396 12.289 1.00 0.00 N ATOM 730 CA HIS A 45 -11.799 5.431 13.211 1.00 0.00 C ATOM 731 C HIS A 45 -10.623 6.355 13.537 1.00 0.00 C ATOM 732 O HIS A 45 -10.799 7.564 13.678 1.00 0.00 O ATOM 733 CB HIS A 45 -12.432 4.815 14.460 1.00 0.00 C ATOM 734 CG HIS A 45 -13.654 3.973 14.178 1.00 0.00 C ATOM 735 ND1 HIS A 45 -14.516 4.232 13.127 1.00 0.00 N ATOM 736 CD2 HIS A 45 -14.147 2.875 14.819 1.00 0.00 C ATOM 737 CE1 HIS A 45 -15.482 3.325 13.145 1.00 0.00 C ATOM 738 NE2 HIS A 45 -15.251 2.485 14.195 1.00 0.00 N ATOM 0 H HIS A 45 -11.430 3.445 12.653 1.00 0.00 H new ATOM 0 HA HIS A 45 -12.574 6.038 12.743 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -11.688 4.199 14.966 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -12.705 5.615 15.148 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -13.712 2.403 15.688 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -16.307 3.262 12.451 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -15.832 1.688 14.457 1.00 0.00 H new ATOM 746 N GLU A 46 -9.450 5.749 13.646 1.00 0.00 N ATOM 747 CA GLU A 46 -8.245 6.502 13.952 1.00 0.00 C ATOM 748 C GLU A 46 -8.142 7.730 13.046 1.00 0.00 C ATOM 749 O GLU A 46 -7.713 8.796 13.485 1.00 0.00 O ATOM 750 CB GLU A 46 -7.001 5.621 13.824 1.00 0.00 C ATOM 751 CG GLU A 46 -6.031 5.870 14.981 1.00 0.00 C ATOM 752 CD GLU A 46 -5.631 4.556 15.654 1.00 0.00 C ATOM 753 OE1 GLU A 46 -6.533 3.707 15.822 1.00 0.00 O ATOM 754 OE2 GLU A 46 -4.432 4.431 15.986 1.00 0.00 O ATOM 0 H GLU A 46 -9.308 4.746 13.528 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.305 6.842 14.986 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.294 4.571 13.810 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.502 5.825 12.876 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.141 6.379 14.611 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.495 6.531 15.713 1.00 0.00 H new ATOM 761 N CYS A 47 -8.543 7.540 11.797 1.00 0.00 N ATOM 762 CA CYS A 47 -8.501 8.620 10.825 1.00 0.00 C ATOM 763 C CYS A 47 -9.875 9.292 10.795 1.00 0.00 C ATOM 764 O CYS A 47 -10.862 8.676 10.396 1.00 0.00 O ATOM 765 CB CYS A 47 -8.079 8.120 9.442 1.00 0.00 C ATOM 766 SG CYS A 47 -6.661 9.100 8.828 1.00 0.00 S ATOM 0 H CYS A 47 -8.898 6.655 11.436 1.00 0.00 H new ATOM 0 HA CYS A 47 -7.747 9.350 11.120 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -7.807 7.066 9.495 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -8.915 8.199 8.747 1.00 0.00 H new ATOM 0 HG CYS A 47 -6.698 9.151 7.530 1.00 0.00 H new ATOM 772 N GLN A 48 -9.895 10.546 11.221 1.00 0.00 N ATOM 773 CA GLN A 48 -11.131 11.309 11.247 1.00 0.00 C ATOM 774 C GLN A 48 -11.968 11.006 10.003 1.00 0.00 C ATOM 775 O GLN A 48 -13.116 10.576 10.111 1.00 0.00 O ATOM 776 CB GLN A 48 -10.849 12.808 11.366 1.00 0.00 C ATOM 777 CG GLN A 48 -9.888 13.095 12.522 1.00 0.00 C ATOM 778 CD GLN A 48 -10.404 14.243 13.391 1.00 0.00 C ATOM 779 OE1 GLN A 48 -11.327 14.097 14.175 1.00 0.00 O ATOM 780 NE2 GLN A 48 -9.758 15.392 13.209 1.00 0.00 N ATOM 0 H GLN A 48 -9.074 11.053 11.551 1.00 0.00 H new ATOM 0 HA GLN A 48 -11.701 11.009 12.127 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -10.422 13.177 10.433 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -11.784 13.346 11.523 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.768 12.199 13.131 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -8.904 13.347 12.127 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -8.993 15.446 12.536 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -10.027 16.219 13.742 1.00 0.00 H new ATOM 789 N THR A 49 -11.361 11.242 8.849 1.00 0.00 N ATOM 790 CA THR A 49 -12.036 10.999 7.585 1.00 0.00 C ATOM 791 C THR A 49 -12.446 9.530 7.472 1.00 0.00 C ATOM 792 O THR A 49 -11.841 8.663 8.102 1.00 0.00 O ATOM 793 CB THR A 49 -11.110 11.460 6.458 1.00 0.00 C ATOM 794 OG1 THR A 49 -9.894 10.757 6.699 1.00 0.00 O ATOM 795 CG2 THR A 49 -10.719 12.934 6.587 1.00 0.00 C ATOM 0 H THR A 49 -10.409 11.599 8.763 1.00 0.00 H new ATOM 0 HA THR A 49 -12.963 11.568 7.517 1.00 0.00 H new ATOM 0 HB THR A 49 -11.598 11.297 5.497 1.00 0.00 H new ATOM 0 HG1 THR A 49 -9.134 11.355 6.541 1.00 0.00 H new ATOM 0 HG21 THR A 49 -10.062 13.210 5.762 1.00 0.00 H new ATOM 0 HG22 THR A 49 -11.616 13.552 6.558 1.00 0.00 H new ATOM 0 HG23 THR A 49 -10.200 13.091 7.533 1.00 0.00 H new ATOM 803 N PRO A 50 -13.498 9.288 6.645 1.00 0.00 N ATOM 804 CA PRO A 50 -13.995 7.938 6.442 1.00 0.00 C ATOM 805 C PRO A 50 -13.056 7.137 5.538 1.00 0.00 C ATOM 806 O PRO A 50 -13.393 6.842 4.392 1.00 0.00 O ATOM 807 CB PRO A 50 -15.383 8.115 5.847 1.00 0.00 C ATOM 808 CG PRO A 50 -15.428 9.536 5.310 1.00 0.00 C ATOM 809 CD PRO A 50 -14.239 10.289 5.884 1.00 0.00 C ATOM 0 HA PRO A 50 -14.042 7.364 7.368 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -15.562 7.391 5.052 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -16.154 7.958 6.601 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -15.389 9.534 4.221 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -16.361 10.022 5.594 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -13.625 10.720 5.094 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -14.562 11.112 6.522 1.00 0.00 H new ATOM 817 N PHE A 51 -11.895 6.810 6.087 1.00 0.00 N ATOM 818 CA PHE A 51 -10.904 6.049 5.344 1.00 0.00 C ATOM 819 C PHE A 51 -11.075 4.547 5.582 1.00 0.00 C ATOM 820 O PHE A 51 -10.723 4.040 6.645 1.00 0.00 O ATOM 821 CB PHE A 51 -9.530 6.482 5.859 1.00 0.00 C ATOM 822 CG PHE A 51 -8.357 5.868 5.093 1.00 0.00 C ATOM 823 CD1 PHE A 51 -8.506 5.515 3.788 1.00 0.00 C ATOM 824 CD2 PHE A 51 -7.164 5.675 5.718 1.00 0.00 C ATOM 825 CE1 PHE A 51 -7.417 4.945 3.078 1.00 0.00 C ATOM 826 CE2 PHE A 51 -6.075 5.104 5.007 1.00 0.00 C ATOM 827 CZ PHE A 51 -6.225 4.751 3.702 1.00 0.00 C ATOM 0 H PHE A 51 -11.618 7.058 7.037 1.00 0.00 H new ATOM 0 HA PHE A 51 -11.015 6.235 4.276 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -9.458 7.568 5.803 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -9.446 6.210 6.911 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -9.453 5.668 3.292 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.045 5.956 6.754 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -7.536 4.665 2.042 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -5.128 4.950 5.503 1.00 0.00 H new ATOM 0 HZ PHE A 51 -5.397 4.317 3.162 1.00 0.00 H new ATOM 837 N PHE A 52 -11.614 3.879 4.573 1.00 0.00 N ATOM 838 CA PHE A 52 -11.836 2.445 4.658 1.00 0.00 C ATOM 839 C PHE A 52 -10.685 1.673 4.010 1.00 0.00 C ATOM 840 O PHE A 52 -10.167 2.081 2.971 1.00 0.00 O ATOM 841 CB PHE A 52 -13.128 2.146 3.897 1.00 0.00 C ATOM 842 CG PHE A 52 -14.392 2.662 4.588 1.00 0.00 C ATOM 843 CD1 PHE A 52 -14.526 3.988 4.858 1.00 0.00 C ATOM 844 CD2 PHE A 52 -15.381 1.794 4.934 1.00 0.00 C ATOM 845 CE1 PHE A 52 -15.699 4.467 5.500 1.00 0.00 C ATOM 846 CE2 PHE A 52 -16.553 2.273 5.576 1.00 0.00 C ATOM 847 CZ PHE A 52 -16.688 3.600 5.845 1.00 0.00 C ATOM 0 H PHE A 52 -11.904 4.304 3.692 1.00 0.00 H new ATOM 0 HA PHE A 52 -11.900 2.140 5.702 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -13.063 2.589 2.903 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -13.216 1.068 3.760 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -13.741 4.677 4.584 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -15.274 0.741 4.720 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -15.805 5.520 5.714 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -17.338 1.584 5.851 1.00 0.00 H new ATOM 0 HZ PHE A 52 -17.580 3.964 6.332 1.00 0.00 H new ATOM 857 N VAL A 53 -10.319 0.572 4.649 1.00 0.00 N ATOM 858 CA VAL A 53 -9.240 -0.261 4.148 1.00 0.00 C ATOM 859 C VAL A 53 -9.651 -1.732 4.239 1.00 0.00 C ATOM 860 O VAL A 53 -10.566 -2.079 4.984 1.00 0.00 O ATOM 861 CB VAL A 53 -7.946 0.046 4.905 1.00 0.00 C ATOM 862 CG1 VAL A 53 -7.429 1.444 4.562 1.00 0.00 C ATOM 863 CG2 VAL A 53 -8.145 -0.110 6.414 1.00 0.00 C ATOM 0 H VAL A 53 -10.751 0.237 5.510 1.00 0.00 H new ATOM 0 HA VAL A 53 -9.046 -0.042 3.098 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.193 -0.676 4.589 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.509 1.637 5.113 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.231 1.506 3.492 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.179 2.186 4.836 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -7.211 0.114 6.929 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.920 0.578 6.752 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -8.446 -1.133 6.637 1.00 0.00 H new ATOM 873 N HIS A 54 -8.955 -2.557 3.471 1.00 0.00 N ATOM 874 CA HIS A 54 -9.237 -3.982 3.456 1.00 0.00 C ATOM 875 C HIS A 54 -8.009 -4.743 2.951 1.00 0.00 C ATOM 876 O HIS A 54 -7.466 -4.422 1.895 1.00 0.00 O ATOM 877 CB HIS A 54 -10.495 -4.279 2.638 1.00 0.00 C ATOM 878 CG HIS A 54 -10.774 -5.751 2.452 1.00 0.00 C ATOM 879 ND1 HIS A 54 -10.849 -6.508 1.319 1.00 0.00 N flip ATOM 880 CD2 HIS A 54 -11.014 -6.609 3.511 1.00 0.00 C flip ATOM 881 CE1 HIS A 54 -11.119 -7.760 1.668 1.00 0.00 C flip ATOM 882 NE2 HIS A 54 -11.222 -7.824 3.027 1.00 0.00 N flip ATOM 0 H HIS A 54 -8.196 -2.266 2.855 1.00 0.00 H new ATOM 0 HA HIS A 54 -9.444 -4.325 4.470 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -11.352 -3.816 3.128 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -10.397 -3.812 1.658 1.00 0.00 H new ATOM 0 HD1 HIS A 54 -10.720 -6.169 0.366 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -11.029 -6.334 4.555 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -11.238 -8.591 0.988 1.00 0.00 H new ATOM 890 N ALA A 55 -7.607 -5.736 3.730 1.00 0.00 N ATOM 891 CA ALA A 55 -6.453 -6.545 3.376 1.00 0.00 C ATOM 892 C ALA A 55 -6.842 -8.024 3.410 1.00 0.00 C ATOM 893 O ALA A 55 -7.390 -8.503 4.402 1.00 0.00 O ATOM 894 CB ALA A 55 -5.294 -6.225 4.323 1.00 0.00 C ATOM 0 H ALA A 55 -8.060 -5.999 4.605 1.00 0.00 H new ATOM 0 HA ALA A 55 -6.120 -6.315 2.364 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -4.429 -6.832 4.057 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -5.036 -5.169 4.239 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.591 -6.445 5.348 1.00 0.00 H new ATOM 900 N ASP A 56 -6.544 -8.707 2.314 1.00 0.00 N ATOM 901 CA ASP A 56 -6.856 -10.122 2.207 1.00 0.00 C ATOM 902 C ASP A 56 -5.613 -10.880 1.737 1.00 0.00 C ATOM 903 O ASP A 56 -4.585 -10.272 1.443 1.00 0.00 O ATOM 904 CB ASP A 56 -7.971 -10.364 1.187 1.00 0.00 C ATOM 905 CG ASP A 56 -9.185 -11.125 1.724 1.00 0.00 C ATOM 906 OD1 ASP A 56 -9.089 -11.607 2.874 1.00 0.00 O ATOM 907 OD2 ASP A 56 -10.181 -11.207 0.974 1.00 0.00 O ATOM 0 H ASP A 56 -6.090 -8.307 1.493 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.181 -10.471 3.187 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -8.306 -9.401 0.802 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -7.558 -10.918 0.344 1.00 0.00 H new ATOM 912 N VAL A 57 -5.748 -12.197 1.680 1.00 0.00 N ATOM 913 CA VAL A 57 -4.648 -13.044 1.251 1.00 0.00 C ATOM 914 C VAL A 57 -5.161 -14.057 0.226 1.00 0.00 C ATOM 915 O VAL A 57 -5.760 -15.067 0.591 1.00 0.00 O ATOM 916 CB VAL A 57 -3.991 -13.703 2.466 1.00 0.00 C ATOM 917 CG1 VAL A 57 -2.841 -14.618 2.037 1.00 0.00 C ATOM 918 CG2 VAL A 57 -3.511 -12.651 3.468 1.00 0.00 C ATOM 0 H VAL A 57 -6.602 -12.698 1.924 1.00 0.00 H new ATOM 0 HA VAL A 57 -3.875 -12.450 0.763 1.00 0.00 H new ATOM 0 HB VAL A 57 -4.742 -14.318 2.961 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -2.391 -15.074 2.919 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -3.223 -15.399 1.380 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -2.089 -14.033 1.507 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -3.048 -13.146 4.322 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -2.782 -11.998 2.988 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -4.360 -12.059 3.809 1.00 0.00 H new ATOM 928 N GLU A 58 -4.906 -13.752 -1.038 1.00 0.00 N ATOM 929 CA GLU A 58 -5.334 -14.623 -2.120 1.00 0.00 C ATOM 930 C GLU A 58 -4.188 -15.542 -2.547 1.00 0.00 C ATOM 931 O GLU A 58 -3.284 -15.119 -3.265 1.00 0.00 O ATOM 932 CB GLU A 58 -5.856 -13.809 -3.306 1.00 0.00 C ATOM 933 CG GLU A 58 -7.052 -14.501 -3.962 1.00 0.00 C ATOM 934 CD GLU A 58 -8.333 -14.258 -3.160 1.00 0.00 C ATOM 935 OE1 GLU A 58 -8.558 -13.085 -2.791 1.00 0.00 O ATOM 936 OE2 GLU A 58 -9.058 -15.251 -2.934 1.00 0.00 O ATOM 0 H GLU A 58 -4.408 -12.914 -1.337 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.155 -15.243 -1.758 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.147 -12.814 -2.969 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -5.060 -13.677 -4.039 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -7.179 -14.129 -4.979 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -6.862 -15.572 -4.035 1.00 0.00 H new ATOM 943 N GLY A 59 -4.263 -16.782 -2.086 1.00 0.00 N ATOM 944 CA GLY A 59 -3.243 -17.764 -2.411 1.00 0.00 C ATOM 945 C GLY A 59 -2.043 -17.641 -1.469 1.00 0.00 C ATOM 946 O GLY A 59 -2.003 -18.287 -0.423 1.00 0.00 O ATOM 0 H GLY A 59 -5.015 -17.129 -1.490 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -3.664 -18.767 -2.341 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.916 -17.627 -3.442 1.00 0.00 H new ATOM 950 N GLY A 60 -1.096 -16.808 -1.874 1.00 0.00 N ATOM 951 CA GLY A 60 0.101 -16.593 -1.079 1.00 0.00 C ATOM 952 C GLY A 60 0.501 -15.116 -1.079 1.00 0.00 C ATOM 953 O GLY A 60 1.562 -14.757 -0.572 1.00 0.00 O ATOM 0 H GLY A 60 -1.133 -16.274 -2.742 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -0.073 -16.926 -0.056 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.919 -17.195 -1.476 1.00 0.00 H new ATOM 957 N LYS A 61 -0.371 -14.300 -1.653 1.00 0.00 N ATOM 958 CA LYS A 61 -0.122 -12.870 -1.726 1.00 0.00 C ATOM 959 C LYS A 61 -1.120 -12.137 -0.828 1.00 0.00 C ATOM 960 O LYS A 61 -2.028 -12.752 -0.271 1.00 0.00 O ATOM 961 CB LYS A 61 -0.140 -12.397 -3.181 1.00 0.00 C ATOM 962 CG LYS A 61 -1.561 -12.048 -3.626 1.00 0.00 C ATOM 963 CD LYS A 61 -1.601 -11.711 -5.118 1.00 0.00 C ATOM 964 CE LYS A 61 -1.664 -12.984 -5.966 1.00 0.00 C ATOM 965 NZ LYS A 61 -1.349 -12.680 -7.380 1.00 0.00 N ATOM 0 H LYS A 61 -1.251 -14.602 -2.072 1.00 0.00 H new ATOM 0 HA LYS A 61 0.875 -12.637 -1.352 1.00 0.00 H new ATOM 0 HB2 LYS A 61 0.504 -11.525 -3.292 1.00 0.00 H new ATOM 0 HB3 LYS A 61 0.266 -13.177 -3.826 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -2.226 -12.887 -3.421 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -1.929 -11.200 -3.048 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -2.468 -11.085 -5.330 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -0.717 -11.133 -5.388 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -0.959 -13.720 -5.580 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -2.658 -13.426 -5.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -1.396 -13.554 -7.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -2.038 -11.994 -7.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -0.392 -12.279 -7.444 1.00 0.00 H new ATOM 979 N VAL A 62 -0.919 -10.832 -0.716 1.00 0.00 N ATOM 980 CA VAL A 62 -1.790 -10.008 0.104 1.00 0.00 C ATOM 981 C VAL A 62 -2.635 -9.108 -0.800 1.00 0.00 C ATOM 982 O VAL A 62 -2.097 -8.371 -1.625 1.00 0.00 O ATOM 983 CB VAL A 62 -0.961 -9.222 1.122 1.00 0.00 C ATOM 984 CG1 VAL A 62 0.390 -9.898 1.367 1.00 0.00 C ATOM 985 CG2 VAL A 62 -0.776 -7.771 0.675 1.00 0.00 C ATOM 0 H VAL A 62 -0.165 -10.325 -1.180 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.477 -10.632 0.676 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.507 -9.214 2.065 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.960 -9.320 2.094 1.00 0.00 H new ATOM 0 HG12 VAL A 62 0.229 -10.905 1.751 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.945 -9.951 0.431 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.183 -7.235 1.416 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.262 -7.749 -0.286 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.751 -7.294 0.576 1.00 0.00 H new ATOM 995 N ARG A 63 -3.944 -9.198 -0.615 1.00 0.00 N ATOM 996 CA ARG A 63 -4.868 -8.402 -1.404 1.00 0.00 C ATOM 997 C ARG A 63 -5.085 -7.036 -0.749 1.00 0.00 C ATOM 998 O ARG A 63 -5.503 -6.957 0.405 1.00 0.00 O ATOM 999 CB ARG A 63 -6.217 -9.109 -1.552 1.00 0.00 C ATOM 1000 CG ARG A 63 -6.400 -9.648 -2.972 1.00 0.00 C ATOM 1001 CD ARG A 63 -6.065 -8.577 -4.013 1.00 0.00 C ATOM 1002 NE ARG A 63 -7.165 -8.466 -4.997 1.00 0.00 N ATOM 1003 CZ ARG A 63 -7.126 -7.683 -6.083 1.00 0.00 C ATOM 1004 NH1 ARG A 63 -6.041 -6.937 -6.332 1.00 0.00 N ATOM 1005 NH2 ARG A 63 -8.171 -7.645 -6.921 1.00 0.00 N ATOM 0 H ARG A 63 -4.386 -9.810 0.070 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.430 -8.269 -2.393 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.282 -9.929 -0.837 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -7.023 -8.415 -1.316 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.759 -10.517 -3.120 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.428 -9.983 -3.108 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.908 -7.617 -3.521 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -5.135 -8.831 -4.522 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.006 -9.021 -4.838 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -5.245 -6.966 -5.695 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -6.011 -6.341 -7.159 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -8.997 -8.213 -6.732 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -8.140 -7.048 -7.748 1.00 0.00 H new ATOM 1019 N LEU A 64 -4.791 -5.995 -1.513 1.00 0.00 N ATOM 1020 CA LEU A 64 -4.949 -4.637 -1.021 1.00 0.00 C ATOM 1021 C LEU A 64 -6.291 -4.079 -1.500 1.00 0.00 C ATOM 1022 O LEU A 64 -6.617 -4.166 -2.683 1.00 0.00 O ATOM 1023 CB LEU A 64 -3.748 -3.779 -1.423 1.00 0.00 C ATOM 1024 CG LEU A 64 -2.396 -4.207 -0.848 1.00 0.00 C ATOM 1025 CD1 LEU A 64 -1.956 -5.553 -1.427 1.00 0.00 C ATOM 1026 CD2 LEU A 64 -1.341 -3.120 -1.060 1.00 0.00 C ATOM 0 H LEU A 64 -4.444 -6.064 -2.470 1.00 0.00 H new ATOM 0 HA LEU A 64 -4.969 -4.626 0.069 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -3.674 -3.779 -2.511 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.942 -2.751 -1.116 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.509 -4.340 0.228 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.992 -5.834 -1.002 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -2.697 -6.314 -1.182 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.865 -5.471 -2.510 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -0.390 -3.450 -0.642 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.223 -2.931 -2.127 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.658 -2.204 -0.562 1.00 0.00 H new ATOM 1038 N TYR A 65 -7.032 -3.517 -0.556 1.00 0.00 N ATOM 1039 CA TYR A 65 -8.331 -2.945 -0.867 1.00 0.00 C ATOM 1040 C TYR A 65 -8.575 -1.668 -0.060 1.00 0.00 C ATOM 1041 O TYR A 65 -8.581 -1.698 1.170 1.00 0.00 O ATOM 1042 CB TYR A 65 -9.364 -3.997 -0.458 1.00 0.00 C ATOM 1043 CG TYR A 65 -9.571 -5.102 -1.496 1.00 0.00 C ATOM 1044 CD1 TYR A 65 -8.583 -6.041 -1.710 1.00 0.00 C ATOM 1045 CD2 TYR A 65 -10.745 -5.159 -2.218 1.00 0.00 C ATOM 1046 CE1 TYR A 65 -8.777 -7.081 -2.687 1.00 0.00 C ATOM 1047 CE2 TYR A 65 -10.940 -6.199 -3.195 1.00 0.00 C ATOM 1048 CZ TYR A 65 -9.946 -7.109 -3.381 1.00 0.00 C ATOM 1049 OH TYR A 65 -10.130 -8.091 -4.304 1.00 0.00 O ATOM 0 H TYR A 65 -6.758 -3.446 0.424 1.00 0.00 H new ATOM 0 HA TYR A 65 -8.393 -2.686 -1.924 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -9.053 -4.450 0.483 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -10.318 -3.502 -0.274 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -7.664 -5.996 -1.145 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -11.518 -4.424 -2.051 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -8.011 -7.822 -2.864 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -11.854 -6.255 -3.767 1.00 0.00 H new ATOM 0 HH TYR A 65 -11.011 -7.987 -4.721 1.00 0.00 H new ATOM 1059 N PHE A 66 -8.770 -0.576 -0.784 1.00 0.00 N ATOM 1060 CA PHE A 66 -9.013 0.709 -0.151 1.00 0.00 C ATOM 1061 C PHE A 66 -10.320 1.328 -0.652 1.00 0.00 C ATOM 1062 O PHE A 66 -10.520 1.474 -1.856 1.00 0.00 O ATOM 1063 CB PHE A 66 -7.849 1.624 -0.535 1.00 0.00 C ATOM 1064 CG PHE A 66 -6.500 1.191 0.042 1.00 0.00 C ATOM 1065 CD1 PHE A 66 -6.302 1.198 1.388 1.00 0.00 C ATOM 1066 CD2 PHE A 66 -5.498 0.799 -0.790 1.00 0.00 C ATOM 1067 CE1 PHE A 66 -5.050 0.796 1.924 1.00 0.00 C ATOM 1068 CE2 PHE A 66 -4.246 0.397 -0.254 1.00 0.00 C ATOM 1069 CZ PHE A 66 -4.049 0.404 1.091 1.00 0.00 C ATOM 0 H PHE A 66 -8.765 -0.555 -1.804 1.00 0.00 H new ATOM 0 HA PHE A 66 -9.092 0.583 0.929 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -7.773 1.661 -1.622 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -8.069 2.636 -0.196 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -7.097 1.509 2.049 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -5.655 0.793 -1.859 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -4.893 0.802 2.992 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -3.450 0.086 -0.915 1.00 0.00 H new ATOM 0 HZ PHE A 66 -3.097 0.098 1.498 1.00 0.00 H new ATOM 1079 N HIS A 67 -11.175 1.675 0.299 1.00 0.00 N ATOM 1080 CA HIS A 67 -12.457 2.275 -0.030 1.00 0.00 C ATOM 1081 C HIS A 67 -12.464 3.742 0.407 1.00 0.00 C ATOM 1082 O HIS A 67 -12.234 4.046 1.576 1.00 0.00 O ATOM 1083 CB HIS A 67 -13.606 1.469 0.579 1.00 0.00 C ATOM 1084 CG HIS A 67 -14.866 2.271 0.805 1.00 0.00 C ATOM 1085 ND1 HIS A 67 -14.884 3.451 1.527 1.00 0.00 N ATOM 1086 CD2 HIS A 67 -16.148 2.050 0.396 1.00 0.00 C ATOM 1087 CE1 HIS A 67 -16.126 3.911 1.547 1.00 0.00 C ATOM 1088 NE2 HIS A 67 -16.908 3.041 0.845 1.00 0.00 N ATOM 0 H HIS A 67 -11.005 1.552 1.297 1.00 0.00 H new ATOM 0 HA HIS A 67 -12.607 2.253 -1.109 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -13.835 0.629 -0.077 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -13.278 1.050 1.531 1.00 0.00 H new ATOM 0 HD1 HIS A 67 -14.077 3.892 1.969 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -16.487 1.211 -0.193 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -16.461 4.815 2.033 1.00 0.00 H new ATOM 1096 N VAL A 68 -12.731 4.611 -0.557 1.00 0.00 N ATOM 1097 CA VAL A 68 -12.771 6.038 -0.287 1.00 0.00 C ATOM 1098 C VAL A 68 -14.018 6.641 -0.937 1.00 0.00 C ATOM 1099 O VAL A 68 -14.124 6.684 -2.162 1.00 0.00 O ATOM 1100 CB VAL A 68 -11.473 6.697 -0.757 1.00 0.00 C ATOM 1101 CG1 VAL A 68 -11.136 7.919 0.099 1.00 0.00 C ATOM 1102 CG2 VAL A 68 -10.318 5.694 -0.760 1.00 0.00 C ATOM 0 H VAL A 68 -12.922 4.354 -1.526 1.00 0.00 H new ATOM 0 HA VAL A 68 -12.842 6.222 0.785 1.00 0.00 H new ATOM 0 HB VAL A 68 -11.623 7.038 -1.781 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.209 8.368 -0.257 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -11.943 8.648 0.027 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -11.015 7.613 1.138 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -9.407 6.189 -1.098 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -10.168 5.308 0.248 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -10.554 4.869 -1.432 1.00 0.00 H new ATOM 1112 N PRO A 69 -14.955 7.103 -0.066 1.00 0.00 N ATOM 1113 CA PRO A 69 -16.190 7.701 -0.543 1.00 0.00 C ATOM 1114 C PRO A 69 -15.944 9.112 -1.081 1.00 0.00 C ATOM 1115 O PRO A 69 -16.151 9.375 -2.264 1.00 0.00 O ATOM 1116 CB PRO A 69 -17.127 7.676 0.653 1.00 0.00 C ATOM 1117 CG PRO A 69 -16.240 7.495 1.874 1.00 0.00 C ATOM 1118 CD PRO A 69 -14.863 7.068 1.391 1.00 0.00 C ATOM 0 HA PRO A 69 -16.623 7.158 -1.383 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -17.700 8.601 0.720 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -17.846 6.861 0.569 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -16.175 8.424 2.440 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -16.660 6.744 2.543 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -14.088 7.743 1.755 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -14.610 6.070 1.748 1.00 0.00 H new ATOM 1126 N ASP A 70 -15.505 9.984 -0.185 1.00 0.00 N ATOM 1127 CA ASP A 70 -15.228 11.362 -0.554 1.00 0.00 C ATOM 1128 C ASP A 70 -14.133 11.389 -1.621 1.00 0.00 C ATOM 1129 O ASP A 70 -14.133 12.256 -2.494 1.00 0.00 O ATOM 1130 CB ASP A 70 -14.735 12.166 0.650 1.00 0.00 C ATOM 1131 CG ASP A 70 -15.387 13.540 0.821 1.00 0.00 C ATOM 1132 OD1 ASP A 70 -14.878 14.492 0.190 1.00 0.00 O ATOM 1133 OD2 ASP A 70 -16.379 13.608 1.579 1.00 0.00 O ATOM 0 H ASP A 70 -15.334 9.763 0.796 1.00 0.00 H new ATOM 0 HA ASP A 70 -16.152 11.803 -0.928 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.910 11.582 1.554 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -13.657 12.301 0.561 1.00 0.00 H new ATOM 1138 N GLU A 71 -13.225 10.430 -1.516 1.00 0.00 N ATOM 1139 CA GLU A 71 -12.126 10.333 -2.462 1.00 0.00 C ATOM 1140 C GLU A 71 -11.157 11.502 -2.271 1.00 0.00 C ATOM 1141 O GLU A 71 -11.036 12.362 -3.142 1.00 0.00 O ATOM 1142 CB GLU A 71 -12.643 10.280 -3.901 1.00 0.00 C ATOM 1143 CG GLU A 71 -12.607 8.850 -4.443 1.00 0.00 C ATOM 1144 CD GLU A 71 -11.983 8.809 -5.840 1.00 0.00 C ATOM 1145 OE1 GLU A 71 -10.740 8.688 -5.903 1.00 0.00 O ATOM 1146 OE2 GLU A 71 -12.762 8.900 -6.813 1.00 0.00 O ATOM 0 H GLU A 71 -13.228 9.713 -0.790 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.588 9.405 -2.270 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.663 10.662 -3.939 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.036 10.928 -4.533 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.035 8.215 -3.766 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.619 8.446 -4.481 1.00 0.00 H new ATOM 1153 N ALA A 72 -10.490 11.496 -1.126 1.00 0.00 N ATOM 1154 CA ALA A 72 -9.536 12.544 -0.809 1.00 0.00 C ATOM 1155 C ALA A 72 -8.172 12.181 -1.399 1.00 0.00 C ATOM 1156 O ALA A 72 -7.704 11.054 -1.244 1.00 0.00 O ATOM 1157 CB ALA A 72 -9.481 12.745 0.706 1.00 0.00 C ATOM 0 H ALA A 72 -10.592 10.781 -0.406 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.846 13.491 -1.251 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -8.765 13.532 0.943 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.468 13.030 1.071 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -9.171 11.816 1.185 1.00 0.00 H new ATOM 1163 N PRO A 73 -7.556 13.183 -2.082 1.00 0.00 N ATOM 1164 CA PRO A 73 -6.254 12.981 -2.696 1.00 0.00 C ATOM 1165 C PRO A 73 -5.146 12.971 -1.641 1.00 0.00 C ATOM 1166 O PRO A 73 -3.986 12.709 -1.956 1.00 0.00 O ATOM 1167 CB PRO A 73 -6.111 14.115 -3.697 1.00 0.00 C ATOM 1168 CG PRO A 73 -7.123 15.170 -3.281 1.00 0.00 C ATOM 1169 CD PRO A 73 -8.079 14.531 -2.286 1.00 0.00 C ATOM 0 HA PRO A 73 -6.169 12.015 -3.194 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -5.099 14.519 -3.687 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.305 13.767 -4.712 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -6.620 16.026 -2.831 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.667 15.541 -4.150 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -8.109 15.090 -1.351 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -9.097 14.506 -2.675 1.00 0.00 H new ATOM 1177 N THR A 74 -5.542 13.259 -0.410 1.00 0.00 N ATOM 1178 CA THR A 74 -4.597 13.287 0.693 1.00 0.00 C ATOM 1179 C THR A 74 -4.613 11.953 1.443 1.00 0.00 C ATOM 1180 O THR A 74 -3.566 11.453 1.850 1.00 0.00 O ATOM 1181 CB THR A 74 -4.939 14.486 1.579 1.00 0.00 C ATOM 1182 OG1 THR A 74 -6.352 14.616 1.457 1.00 0.00 O ATOM 1183 CG2 THR A 74 -4.394 15.802 1.019 1.00 0.00 C ATOM 0 H THR A 74 -6.505 13.475 -0.152 1.00 0.00 H new ATOM 0 HA THR A 74 -3.575 13.411 0.335 1.00 0.00 H new ATOM 0 HB THR A 74 -4.539 14.324 2.580 1.00 0.00 H new ATOM 0 HG1 THR A 74 -6.659 15.370 2.002 1.00 0.00 H new ATOM 0 HG21 THR A 74 -4.665 16.621 1.686 1.00 0.00 H new ATOM 0 HG22 THR A 74 -3.309 15.742 0.940 1.00 0.00 H new ATOM 0 HG23 THR A 74 -4.820 15.982 0.032 1.00 0.00 H new ATOM 1191 N VAL A 75 -5.814 11.416 1.604 1.00 0.00 N ATOM 1192 CA VAL A 75 -5.980 10.150 2.298 1.00 0.00 C ATOM 1193 C VAL A 75 -5.681 9.001 1.333 1.00 0.00 C ATOM 1194 O VAL A 75 -5.016 8.034 1.701 1.00 0.00 O ATOM 1195 CB VAL A 75 -7.381 10.069 2.908 1.00 0.00 C ATOM 1196 CG1 VAL A 75 -7.716 8.634 3.322 1.00 0.00 C ATOM 1197 CG2 VAL A 75 -7.520 11.028 4.092 1.00 0.00 C ATOM 0 H VAL A 75 -6.681 11.834 1.266 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.274 10.072 3.125 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.097 10.374 2.145 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -8.717 8.604 3.753 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.677 7.985 2.447 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.993 8.290 4.061 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -8.525 10.950 4.507 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.790 10.768 4.858 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.344 12.050 3.755 1.00 0.00 H new ATOM 1207 N LYS A 76 -6.186 9.146 0.116 1.00 0.00 N ATOM 1208 CA LYS A 76 -5.981 8.132 -0.904 1.00 0.00 C ATOM 1209 C LYS A 76 -4.488 8.029 -1.223 1.00 0.00 C ATOM 1210 O LYS A 76 -3.971 6.936 -1.446 1.00 0.00 O ATOM 1211 CB LYS A 76 -6.853 8.420 -2.128 1.00 0.00 C ATOM 1212 CG LYS A 76 -7.271 7.122 -2.822 1.00 0.00 C ATOM 1213 CD LYS A 76 -8.204 7.405 -4.000 1.00 0.00 C ATOM 1214 CE LYS A 76 -8.279 6.202 -4.942 1.00 0.00 C ATOM 1215 NZ LYS A 76 -9.589 6.163 -5.630 1.00 0.00 N ATOM 0 H LYS A 76 -6.736 9.950 -0.186 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.297 7.155 -0.539 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -7.740 8.976 -1.824 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -6.306 9.051 -2.828 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -6.386 6.592 -3.174 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -7.770 6.468 -2.107 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -9.201 7.644 -3.630 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -7.850 8.278 -4.547 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -7.477 6.258 -5.678 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -8.130 5.281 -4.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -9.523 5.549 -6.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.311 5.788 -4.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -9.855 7.124 -5.926 1.00 0.00 H new ATOM 1229 N ALA A 77 -3.838 9.183 -1.233 1.00 0.00 N ATOM 1230 CA ALA A 77 -2.414 9.237 -1.520 1.00 0.00 C ATOM 1231 C ALA A 77 -1.711 8.079 -0.810 1.00 0.00 C ATOM 1232 O ALA A 77 -1.219 7.156 -1.458 1.00 0.00 O ATOM 1233 CB ALA A 77 -1.860 10.600 -1.101 1.00 0.00 C ATOM 0 H ALA A 77 -4.270 10.088 -1.047 1.00 0.00 H new ATOM 0 HA ALA A 77 -2.234 9.126 -2.589 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.792 10.641 -1.316 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -2.372 11.387 -1.655 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -2.021 10.745 -0.033 1.00 0.00 H new ATOM 1239 N PHE A 78 -1.685 8.165 0.512 1.00 0.00 N ATOM 1240 CA PHE A 78 -1.050 7.135 1.317 1.00 0.00 C ATOM 1241 C PHE A 78 -1.462 5.739 0.845 1.00 0.00 C ATOM 1242 O PHE A 78 -0.609 4.890 0.589 1.00 0.00 O ATOM 1243 CB PHE A 78 -1.527 7.336 2.757 1.00 0.00 C ATOM 1244 CG PHE A 78 -0.452 7.067 3.811 1.00 0.00 C ATOM 1245 CD1 PHE A 78 0.789 7.607 3.671 1.00 0.00 C ATOM 1246 CD2 PHE A 78 -0.736 6.288 4.889 1.00 0.00 C ATOM 1247 CE1 PHE A 78 1.787 7.358 4.649 1.00 0.00 C ATOM 1248 CE2 PHE A 78 0.262 6.039 5.868 1.00 0.00 C ATOM 1249 CZ PHE A 78 1.502 6.579 5.728 1.00 0.00 C ATOM 0 H PHE A 78 -2.093 8.932 1.046 1.00 0.00 H new ATOM 0 HA PHE A 78 0.034 7.212 1.233 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -1.885 8.359 2.871 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -2.376 6.678 2.943 1.00 0.00 H new ATOM 0 HD1 PHE A 78 1.015 8.226 2.815 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -1.721 5.859 5.000 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.772 7.786 4.537 1.00 0.00 H new ATOM 0 HE2 PHE A 78 0.036 5.421 6.724 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.261 6.390 6.473 1.00 0.00 H new ATOM 1259 N ALA A 79 -2.769 5.545 0.745 1.00 0.00 N ATOM 1260 CA ALA A 79 -3.304 4.266 0.309 1.00 0.00 C ATOM 1261 C ALA A 79 -2.497 3.762 -0.889 1.00 0.00 C ATOM 1262 O ALA A 79 -2.091 2.602 -0.925 1.00 0.00 O ATOM 1263 CB ALA A 79 -4.792 4.418 -0.013 1.00 0.00 C ATOM 0 H ALA A 79 -3.473 6.252 0.958 1.00 0.00 H new ATOM 0 HA ALA A 79 -3.216 3.523 1.102 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -5.193 3.459 -0.340 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -5.325 4.750 0.878 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -4.919 5.154 -0.807 1.00 0.00 H new ATOM 1269 N GLY A 80 -2.288 4.660 -1.841 1.00 0.00 N ATOM 1270 CA GLY A 80 -1.537 4.321 -3.038 1.00 0.00 C ATOM 1271 C GLY A 80 -0.071 4.038 -2.703 1.00 0.00 C ATOM 1272 O GLY A 80 0.505 3.068 -3.193 1.00 0.00 O ATOM 0 H GLY A 80 -2.626 5.622 -1.808 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.980 3.447 -3.514 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.599 5.140 -3.755 1.00 0.00 H new ATOM 1276 N LEU A 81 0.490 4.903 -1.871 1.00 0.00 N ATOM 1277 CA LEU A 81 1.878 4.758 -1.465 1.00 0.00 C ATOM 1278 C LEU A 81 2.066 3.402 -0.782 1.00 0.00 C ATOM 1279 O LEU A 81 3.173 2.867 -0.751 1.00 0.00 O ATOM 1280 CB LEU A 81 2.311 5.946 -0.603 1.00 0.00 C ATOM 1281 CG LEU A 81 3.264 5.625 0.551 1.00 0.00 C ATOM 1282 CD1 LEU A 81 4.634 5.192 0.026 1.00 0.00 C ATOM 1283 CD2 LEU A 81 3.368 6.805 1.519 1.00 0.00 C ATOM 0 H LEU A 81 0.009 5.707 -1.467 1.00 0.00 H new ATOM 0 HA LEU A 81 2.533 4.770 -2.336 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.789 6.683 -1.249 1.00 0.00 H new ATOM 0 HB3 LEU A 81 1.418 6.415 -0.191 1.00 0.00 H new ATOM 0 HG LEU A 81 2.853 4.784 1.110 1.00 0.00 H new ATOM 0 HD11 LEU A 81 5.292 4.970 0.866 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.522 4.301 -0.592 1.00 0.00 H new ATOM 0 HD13 LEU A 81 5.066 5.996 -0.570 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.051 6.551 2.330 1.00 0.00 H new ATOM 0 HD22 LEU A 81 3.744 7.679 0.988 1.00 0.00 H new ATOM 0 HD23 LEU A 81 2.383 7.026 1.930 1.00 0.00 H new ATOM 1295 N LEU A 82 0.968 2.885 -0.252 1.00 0.00 N ATOM 1296 CA LEU A 82 0.998 1.601 0.429 1.00 0.00 C ATOM 1297 C LEU A 82 0.908 0.478 -0.606 1.00 0.00 C ATOM 1298 O LEU A 82 1.661 -0.493 -0.540 1.00 0.00 O ATOM 1299 CB LEU A 82 -0.092 1.537 1.501 1.00 0.00 C ATOM 1300 CG LEU A 82 -0.002 2.586 2.612 1.00 0.00 C ATOM 1301 CD1 LEU A 82 -1.314 2.669 3.395 1.00 0.00 C ATOM 1302 CD2 LEU A 82 1.195 2.316 3.525 1.00 0.00 C ATOM 0 H LEU A 82 0.051 3.332 -0.280 1.00 0.00 H new ATOM 0 HA LEU A 82 1.942 1.473 0.959 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.061 1.636 1.012 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.066 0.548 1.959 1.00 0.00 H new ATOM 0 HG LEU A 82 0.159 3.560 2.150 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -1.223 3.422 4.178 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -2.124 2.944 2.720 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -1.531 1.700 3.846 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.236 3.076 4.306 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.090 1.332 3.982 1.00 0.00 H new ATOM 0 HD23 LEU A 82 2.114 2.348 2.939 1.00 0.00 H new ATOM 1314 N ARG A 83 -0.018 0.647 -1.538 1.00 0.00 N ATOM 1315 CA ARG A 83 -0.216 -0.340 -2.585 1.00 0.00 C ATOM 1316 C ARG A 83 0.919 -0.263 -3.609 1.00 0.00 C ATOM 1317 O ARG A 83 1.162 -1.218 -4.345 1.00 0.00 O ATOM 1318 CB ARG A 83 -1.552 -0.126 -3.299 1.00 0.00 C ATOM 1319 CG ARG A 83 -1.835 -1.262 -4.284 1.00 0.00 C ATOM 1320 CD ARG A 83 -2.924 -0.863 -5.282 1.00 0.00 C ATOM 1321 NE ARG A 83 -3.909 -1.959 -5.421 1.00 0.00 N ATOM 1322 CZ ARG A 83 -4.714 -2.116 -6.481 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -4.655 -1.249 -7.501 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -5.577 -3.140 -6.521 1.00 0.00 N ATOM 0 H ARG A 83 -0.640 1.454 -1.590 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.221 -1.324 -2.116 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.356 -0.068 -2.565 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -1.536 0.826 -3.830 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -0.922 -1.519 -4.820 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.146 -2.153 -3.738 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.423 0.045 -4.944 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -2.477 -0.640 -6.251 1.00 0.00 H new ATOM 0 HE ARG A 83 -3.980 -2.637 -4.663 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.998 -0.470 -7.471 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -5.268 -1.368 -8.308 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -5.621 -3.800 -5.745 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -6.190 -3.259 -7.328 1.00 0.00 H new ATOM 1338 N GLU A 84 1.584 0.883 -3.622 1.00 0.00 N ATOM 1339 CA GLU A 84 2.687 1.098 -4.543 1.00 0.00 C ATOM 1340 C GLU A 84 3.768 0.035 -4.333 1.00 0.00 C ATOM 1341 O GLU A 84 4.369 -0.442 -5.294 1.00 0.00 O ATOM 1342 CB GLU A 84 3.265 2.506 -4.387 1.00 0.00 C ATOM 1343 CG GLU A 84 4.368 2.532 -3.327 1.00 0.00 C ATOM 1344 CD GLU A 84 5.688 2.006 -3.896 1.00 0.00 C ATOM 1345 OE1 GLU A 84 6.056 2.469 -4.997 1.00 0.00 O ATOM 1346 OE2 GLU A 84 6.299 1.153 -3.216 1.00 0.00 O ATOM 0 H GLU A 84 1.380 1.673 -3.009 1.00 0.00 H new ATOM 0 HA GLU A 84 2.308 1.007 -5.561 1.00 0.00 H new ATOM 0 HB2 GLU A 84 3.665 2.846 -5.342 1.00 0.00 H new ATOM 0 HB3 GLU A 84 2.472 3.200 -4.109 1.00 0.00 H new ATOM 0 HG2 GLU A 84 4.505 3.551 -2.964 1.00 0.00 H new ATOM 0 HG3 GLU A 84 4.070 1.926 -2.471 1.00 0.00 H new ATOM 1353 N GLY A 85 3.982 -0.304 -3.070 1.00 0.00 N ATOM 1354 CA GLY A 85 4.980 -1.301 -2.722 1.00 0.00 C ATOM 1355 C GLY A 85 4.417 -2.314 -1.723 1.00 0.00 C ATOM 1356 O GLY A 85 4.983 -2.513 -0.649 1.00 0.00 O ATOM 0 H GLY A 85 3.481 0.094 -2.275 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.312 -1.818 -3.622 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.855 -0.811 -2.295 1.00 0.00 H new ATOM 1360 N LEU A 86 3.309 -2.929 -2.113 1.00 0.00 N ATOM 1361 CA LEU A 86 2.664 -3.916 -1.265 1.00 0.00 C ATOM 1362 C LEU A 86 1.820 -4.853 -2.131 1.00 0.00 C ATOM 1363 O LEU A 86 1.838 -6.067 -1.939 1.00 0.00 O ATOM 1364 CB LEU A 86 1.872 -3.230 -0.150 1.00 0.00 C ATOM 1365 CG LEU A 86 2.692 -2.402 0.843 1.00 0.00 C ATOM 1366 CD1 LEU A 86 1.779 -1.618 1.787 1.00 0.00 C ATOM 1367 CD2 LEU A 86 3.683 -3.284 1.605 1.00 0.00 C ATOM 0 H LEU A 86 2.843 -2.762 -3.005 1.00 0.00 H new ATOM 0 HA LEU A 86 3.410 -4.531 -0.762 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.127 -2.579 -0.608 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.329 -3.994 0.406 1.00 0.00 H new ATOM 0 HG LEU A 86 3.276 -1.673 0.281 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.386 -1.038 2.482 1.00 0.00 H new ATOM 0 HD12 LEU A 86 1.148 -0.944 1.207 1.00 0.00 H new ATOM 0 HD13 LEU A 86 1.151 -2.312 2.345 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.253 -2.671 2.304 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.139 -4.051 2.156 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.365 -3.759 0.899 1.00 0.00 H new ATOM 1379 N GLU A 87 1.100 -4.252 -3.068 1.00 0.00 N ATOM 1380 CA GLU A 87 0.250 -5.017 -3.965 1.00 0.00 C ATOM 1381 C GLU A 87 1.011 -6.226 -4.513 1.00 0.00 C ATOM 1382 O GLU A 87 1.996 -6.070 -5.233 1.00 0.00 O ATOM 1383 CB GLU A 87 -0.278 -4.139 -5.101 1.00 0.00 C ATOM 1384 CG GLU A 87 -0.797 -4.995 -6.258 1.00 0.00 C ATOM 1385 CD GLU A 87 -1.968 -5.871 -5.810 1.00 0.00 C ATOM 1386 OE1 GLU A 87 -3.071 -5.305 -5.649 1.00 0.00 O ATOM 1387 OE2 GLU A 87 -1.734 -7.087 -5.639 1.00 0.00 O ATOM 0 H GLU A 87 1.088 -3.244 -3.225 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.610 -5.379 -3.401 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.078 -3.499 -4.729 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.516 -3.482 -5.457 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -1.113 -4.351 -7.078 1.00 0.00 H new ATOM 0 HG3 GLU A 87 0.007 -5.624 -6.639 1.00 0.00 H new ATOM 1394 N GLY A 88 0.524 -7.404 -4.153 1.00 0.00 N ATOM 1395 CA GLY A 88 1.145 -8.639 -4.600 1.00 0.00 C ATOM 1396 C GLY A 88 2.132 -9.166 -3.556 1.00 0.00 C ATOM 1397 O GLY A 88 2.368 -10.370 -3.472 1.00 0.00 O ATOM 0 H GLY A 88 -0.294 -7.530 -3.557 1.00 0.00 H new ATOM 0 HA2 GLY A 88 0.377 -9.388 -4.790 1.00 0.00 H new ATOM 0 HA3 GLY A 88 1.664 -8.468 -5.543 1.00 0.00 H new ATOM 1401 N GLU A 89 2.683 -8.238 -2.788 1.00 0.00 N ATOM 1402 CA GLU A 89 3.639 -8.593 -1.753 1.00 0.00 C ATOM 1403 C GLU A 89 3.088 -9.730 -0.890 1.00 0.00 C ATOM 1404 O GLU A 89 1.998 -10.238 -1.147 1.00 0.00 O ATOM 1405 CB GLU A 89 3.997 -7.377 -0.896 1.00 0.00 C ATOM 1406 CG GLU A 89 4.704 -6.308 -1.730 1.00 0.00 C ATOM 1407 CD GLU A 89 5.799 -6.927 -2.601 1.00 0.00 C ATOM 1408 OE1 GLU A 89 5.453 -7.370 -3.718 1.00 0.00 O ATOM 1409 OE2 GLU A 89 6.957 -6.943 -2.131 1.00 0.00 O ATOM 0 H GLU A 89 2.486 -7.240 -2.862 1.00 0.00 H new ATOM 0 HA GLU A 89 4.554 -8.938 -2.234 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.092 -6.959 -0.455 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.641 -7.685 -0.072 1.00 0.00 H new ATOM 0 HG2 GLU A 89 3.978 -5.796 -2.362 1.00 0.00 H new ATOM 0 HG3 GLU A 89 5.140 -5.557 -1.071 1.00 0.00 H new ATOM 1416 N SER A 90 3.867 -10.096 0.118 1.00 0.00 N ATOM 1417 CA SER A 90 3.471 -11.163 1.021 1.00 0.00 C ATOM 1418 C SER A 90 2.919 -10.572 2.319 1.00 0.00 C ATOM 1419 O SER A 90 3.162 -9.407 2.627 1.00 0.00 O ATOM 1420 CB SER A 90 4.646 -12.097 1.319 1.00 0.00 C ATOM 1421 OG SER A 90 5.882 -11.391 1.394 1.00 0.00 O ATOM 0 H SER A 90 4.771 -9.672 0.329 1.00 0.00 H new ATOM 0 HA SER A 90 2.690 -11.749 0.536 1.00 0.00 H new ATOM 0 HB2 SER A 90 4.467 -12.616 2.261 1.00 0.00 H new ATOM 0 HB3 SER A 90 4.710 -12.859 0.542 1.00 0.00 H new ATOM 0 HG SER A 90 6.607 -12.021 1.587 1.00 0.00 H new ATOM 1427 N PRO A 91 2.167 -11.425 3.065 1.00 0.00 N ATOM 1428 CA PRO A 91 1.578 -10.999 4.323 1.00 0.00 C ATOM 1429 C PRO A 91 2.638 -10.917 5.424 1.00 0.00 C ATOM 1430 O PRO A 91 2.360 -10.441 6.524 1.00 0.00 O ATOM 1431 CB PRO A 91 0.495 -12.024 4.617 1.00 0.00 C ATOM 1432 CG PRO A 91 0.824 -13.237 3.762 1.00 0.00 C ATOM 1433 CD PRO A 91 1.858 -12.813 2.731 1.00 0.00 C ATOM 0 HA PRO A 91 1.155 -9.996 4.271 1.00 0.00 H new ATOM 0 HB2 PRO A 91 0.481 -12.285 5.675 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -0.492 -11.630 4.373 1.00 0.00 H new ATOM 0 HG2 PRO A 91 1.211 -14.047 4.381 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -0.074 -13.613 3.271 1.00 0.00 H new ATOM 0 HD2 PRO A 91 2.748 -13.440 2.782 1.00 0.00 H new ATOM 0 HD3 PRO A 91 1.465 -12.899 1.718 1.00 0.00 H new ATOM 1441 N GLU A 92 3.830 -11.387 5.089 1.00 0.00 N ATOM 1442 CA GLU A 92 4.933 -11.373 6.036 1.00 0.00 C ATOM 1443 C GLU A 92 5.672 -10.035 5.969 1.00 0.00 C ATOM 1444 O GLU A 92 6.096 -9.504 6.994 1.00 0.00 O ATOM 1445 CB GLU A 92 5.889 -12.540 5.782 1.00 0.00 C ATOM 1446 CG GLU A 92 5.118 -13.849 5.594 1.00 0.00 C ATOM 1447 CD GLU A 92 5.534 -14.885 6.640 1.00 0.00 C ATOM 1448 OE1 GLU A 92 6.720 -15.280 6.607 1.00 0.00 O ATOM 1449 OE2 GLU A 92 4.657 -15.259 7.448 1.00 0.00 O ATOM 0 H GLU A 92 4.057 -11.780 4.175 1.00 0.00 H new ATOM 0 HA GLU A 92 4.526 -11.492 7.040 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.489 -12.337 4.895 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.580 -12.638 6.619 1.00 0.00 H new ATOM 0 HG2 GLU A 92 4.047 -13.659 5.671 1.00 0.00 H new ATOM 0 HG3 GLU A 92 5.301 -14.243 4.594 1.00 0.00 H new ATOM 1456 N ALA A 93 5.804 -9.528 4.752 1.00 0.00 N ATOM 1457 CA ALA A 93 6.485 -8.262 4.538 1.00 0.00 C ATOM 1458 C ALA A 93 5.495 -7.114 4.749 1.00 0.00 C ATOM 1459 O ALA A 93 5.861 -6.064 5.275 1.00 0.00 O ATOM 1460 CB ALA A 93 7.106 -8.247 3.140 1.00 0.00 C ATOM 0 H ALA A 93 5.451 -9.971 3.904 1.00 0.00 H new ATOM 0 HA ALA A 93 7.295 -8.135 5.256 1.00 0.00 H new ATOM 0 HB1 ALA A 93 7.617 -7.298 2.979 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.822 -9.064 3.051 1.00 0.00 H new ATOM 0 HB3 ALA A 93 6.322 -8.369 2.392 1.00 0.00 H new ATOM 1466 N VAL A 94 4.262 -7.353 4.327 1.00 0.00 N ATOM 1467 CA VAL A 94 3.218 -6.352 4.464 1.00 0.00 C ATOM 1468 C VAL A 94 2.891 -6.161 5.946 1.00 0.00 C ATOM 1469 O VAL A 94 2.281 -5.163 6.327 1.00 0.00 O ATOM 1470 CB VAL A 94 1.998 -6.752 3.630 1.00 0.00 C ATOM 1471 CG1 VAL A 94 0.800 -5.854 3.946 1.00 0.00 C ATOM 1472 CG2 VAL A 94 2.324 -6.725 2.135 1.00 0.00 C ATOM 0 H VAL A 94 3.963 -8.225 3.890 1.00 0.00 H new ATOM 0 HA VAL A 94 3.558 -5.390 4.080 1.00 0.00 H new ATOM 0 HB VAL A 94 1.730 -7.774 3.896 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -0.053 -6.159 3.340 1.00 0.00 H new ATOM 0 HG12 VAL A 94 0.546 -5.944 5.002 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.053 -4.818 3.721 1.00 0.00 H new ATOM 0 HG21 VAL A 94 1.441 -7.013 1.565 1.00 0.00 H new ATOM 0 HG22 VAL A 94 2.630 -5.719 1.847 1.00 0.00 H new ATOM 0 HG23 VAL A 94 3.134 -7.424 1.927 1.00 0.00 H new ATOM 1482 N LEU A 95 3.312 -7.132 6.742 1.00 0.00 N ATOM 1483 CA LEU A 95 3.072 -7.083 8.175 1.00 0.00 C ATOM 1484 C LEU A 95 4.286 -6.463 8.870 1.00 0.00 C ATOM 1485 O LEU A 95 4.136 -5.626 9.758 1.00 0.00 O ATOM 1486 CB LEU A 95 2.702 -8.470 8.704 1.00 0.00 C ATOM 1487 CG LEU A 95 1.212 -8.814 8.699 1.00 0.00 C ATOM 1488 CD1 LEU A 95 0.998 -10.328 8.766 1.00 0.00 C ATOM 1489 CD2 LEU A 95 0.475 -8.081 9.822 1.00 0.00 C ATOM 0 H LEU A 95 3.818 -7.958 6.422 1.00 0.00 H new ATOM 0 HA LEU A 95 2.217 -6.444 8.397 1.00 0.00 H new ATOM 0 HB2 LEU A 95 3.229 -9.216 8.109 1.00 0.00 H new ATOM 0 HB3 LEU A 95 3.071 -8.558 9.726 1.00 0.00 H new ATOM 0 HG LEU A 95 0.786 -8.470 7.757 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.070 -10.545 8.761 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.468 -10.800 7.904 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.443 -10.718 9.681 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -0.583 -8.344 9.795 1.00 0.00 H new ATOM 0 HD22 LEU A 95 0.897 -8.371 10.784 1.00 0.00 H new ATOM 0 HD23 LEU A 95 0.585 -7.005 9.688 1.00 0.00 H new ATOM 1501 N GLU A 96 5.461 -6.898 8.439 1.00 0.00 N ATOM 1502 CA GLU A 96 6.700 -6.396 9.008 1.00 0.00 C ATOM 1503 C GLU A 96 6.784 -4.878 8.841 1.00 0.00 C ATOM 1504 O GLU A 96 7.566 -4.217 9.522 1.00 0.00 O ATOM 1505 CB GLU A 96 7.912 -7.086 8.379 1.00 0.00 C ATOM 1506 CG GLU A 96 8.460 -6.269 7.207 1.00 0.00 C ATOM 1507 CD GLU A 96 9.553 -7.040 6.465 1.00 0.00 C ATOM 1508 OE1 GLU A 96 10.381 -7.665 7.163 1.00 0.00 O ATOM 1509 OE2 GLU A 96 9.536 -6.988 5.216 1.00 0.00 O ATOM 0 H GLU A 96 5.581 -7.593 7.702 1.00 0.00 H new ATOM 0 HA GLU A 96 6.707 -6.625 10.074 1.00 0.00 H new ATOM 0 HB2 GLU A 96 8.690 -7.218 9.130 1.00 0.00 H new ATOM 0 HB3 GLU A 96 7.630 -8.081 8.034 1.00 0.00 H new ATOM 0 HG2 GLU A 96 7.651 -6.026 6.519 1.00 0.00 H new ATOM 0 HG3 GLU A 96 8.861 -5.324 7.574 1.00 0.00 H new ATOM 1516 N VAL A 97 5.968 -4.369 7.929 1.00 0.00 N ATOM 1517 CA VAL A 97 5.941 -2.941 7.664 1.00 0.00 C ATOM 1518 C VAL A 97 5.535 -2.197 8.937 1.00 0.00 C ATOM 1519 O VAL A 97 4.464 -2.442 9.489 1.00 0.00 O ATOM 1520 CB VAL A 97 5.018 -2.646 6.480 1.00 0.00 C ATOM 1521 CG1 VAL A 97 4.835 -1.139 6.288 1.00 0.00 C ATOM 1522 CG2 VAL A 97 5.540 -3.302 5.200 1.00 0.00 C ATOM 0 H VAL A 97 5.321 -4.920 7.365 1.00 0.00 H new ATOM 0 HA VAL A 97 6.933 -2.587 7.383 1.00 0.00 H new ATOM 0 HB VAL A 97 4.042 -3.076 6.703 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.175 -0.958 5.440 1.00 0.00 H new ATOM 0 HG12 VAL A 97 4.396 -0.708 7.188 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.804 -0.676 6.099 1.00 0.00 H new ATOM 0 HG21 VAL A 97 4.865 -3.076 4.374 1.00 0.00 H new ATOM 0 HG22 VAL A 97 6.534 -2.916 4.972 1.00 0.00 H new ATOM 0 HG23 VAL A 97 5.593 -4.382 5.340 1.00 0.00 H new ATOM 1532 N PRO A 98 6.437 -1.279 9.379 1.00 0.00 N ATOM 1533 CA PRO A 98 6.184 -0.498 10.577 1.00 0.00 C ATOM 1534 C PRO A 98 5.148 0.597 10.310 1.00 0.00 C ATOM 1535 O PRO A 98 4.908 0.961 9.160 1.00 0.00 O ATOM 1536 CB PRO A 98 7.541 0.055 10.981 1.00 0.00 C ATOM 1537 CG PRO A 98 8.418 -0.051 9.744 1.00 0.00 C ATOM 1538 CD PRO A 98 7.716 -0.962 8.751 1.00 0.00 C ATOM 0 HA PRO A 98 5.755 -1.093 11.383 1.00 0.00 H new ATOM 0 HB2 PRO A 98 7.458 1.090 11.314 1.00 0.00 H new ATOM 0 HB3 PRO A 98 7.964 -0.513 11.810 1.00 0.00 H new ATOM 0 HG2 PRO A 98 8.583 0.934 9.308 1.00 0.00 H new ATOM 0 HG3 PRO A 98 9.397 -0.453 10.004 1.00 0.00 H new ATOM 0 HD2 PRO A 98 7.574 -0.466 7.791 1.00 0.00 H new ATOM 0 HD3 PRO A 98 8.298 -1.864 8.561 1.00 0.00 H new ATOM 1546 N PRO A 99 4.548 1.103 11.420 1.00 0.00 N ATOM 1547 CA PRO A 99 3.544 2.149 11.317 1.00 0.00 C ATOM 1548 C PRO A 99 4.190 3.501 11.007 1.00 0.00 C ATOM 1549 O PRO A 99 3.495 4.502 10.844 1.00 0.00 O ATOM 1550 CB PRO A 99 2.818 2.130 12.652 1.00 0.00 C ATOM 1551 CG PRO A 99 3.737 1.399 13.617 1.00 0.00 C ATOM 1552 CD PRO A 99 4.808 0.696 12.798 1.00 0.00 C ATOM 0 HA PRO A 99 2.846 1.983 10.497 1.00 0.00 H new ATOM 0 HB2 PRO A 99 2.613 3.143 12.999 1.00 0.00 H new ATOM 0 HB3 PRO A 99 1.858 1.622 12.567 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.191 2.100 14.317 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.173 0.677 14.208 1.00 0.00 H new ATOM 0 HD2 PRO A 99 5.808 0.992 13.116 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.745 -0.386 12.910 1.00 0.00 H new ATOM 1560 N GLY A 100 5.513 3.486 10.935 1.00 0.00 N ATOM 1561 CA GLY A 100 6.261 4.698 10.647 1.00 0.00 C ATOM 1562 C GLY A 100 7.190 4.498 9.448 1.00 0.00 C ATOM 1563 O GLY A 100 8.276 5.072 9.398 1.00 0.00 O ATOM 0 H GLY A 100 6.086 2.653 11.071 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.570 5.516 10.444 1.00 0.00 H new ATOM 0 HA3 GLY A 100 6.846 4.985 11.521 1.00 0.00 H new ATOM 1567 N PHE A 101 6.728 3.681 8.512 1.00 0.00 N ATOM 1568 CA PHE A 101 7.504 3.398 7.317 1.00 0.00 C ATOM 1569 C PHE A 101 7.678 4.657 6.465 1.00 0.00 C ATOM 1570 O PHE A 101 8.524 4.695 5.573 1.00 0.00 O ATOM 1571 CB PHE A 101 6.724 2.356 6.513 1.00 0.00 C ATOM 1572 CG PHE A 101 5.524 2.927 5.755 1.00 0.00 C ATOM 1573 CD1 PHE A 101 4.344 3.128 6.400 1.00 0.00 C ATOM 1574 CD2 PHE A 101 5.637 3.233 4.434 1.00 0.00 C ATOM 1575 CE1 PHE A 101 3.230 3.658 5.696 1.00 0.00 C ATOM 1576 CE2 PHE A 101 4.524 3.763 3.730 1.00 0.00 C ATOM 1577 CZ PHE A 101 3.344 3.964 4.376 1.00 0.00 C ATOM 0 H PHE A 101 5.826 3.206 8.557 1.00 0.00 H new ATOM 0 HA PHE A 101 8.495 3.039 7.594 1.00 0.00 H new ATOM 0 HB2 PHE A 101 7.399 1.882 5.800 1.00 0.00 H new ATOM 0 HB3 PHE A 101 6.376 1.576 7.190 1.00 0.00 H new ATOM 0 HD1 PHE A 101 4.254 2.884 7.448 1.00 0.00 H new ATOM 0 HD2 PHE A 101 6.574 3.073 3.921 1.00 0.00 H new ATOM 0 HE1 PHE A 101 2.293 3.818 6.209 1.00 0.00 H new ATOM 0 HE2 PHE A 101 4.614 4.007 2.682 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.497 4.367 3.840 1.00 0.00 H new ATOM 1587 N TYR A 102 6.863 5.657 6.770 1.00 0.00 N ATOM 1588 CA TYR A 102 6.916 6.914 6.044 1.00 0.00 C ATOM 1589 C TYR A 102 7.764 7.944 6.792 1.00 0.00 C ATOM 1590 O TYR A 102 8.333 8.847 6.181 1.00 0.00 O ATOM 1591 CB TYR A 102 5.474 7.417 5.966 1.00 0.00 C ATOM 1592 CG TYR A 102 4.911 7.904 7.303 1.00 0.00 C ATOM 1593 CD1 TYR A 102 4.352 7.003 8.186 1.00 0.00 C ATOM 1594 CD2 TYR A 102 4.963 9.245 7.626 1.00 0.00 C ATOM 1595 CE1 TYR A 102 3.823 7.461 9.444 1.00 0.00 C ATOM 1596 CE2 TYR A 102 4.435 9.703 8.884 1.00 0.00 C ATOM 1597 CZ TYR A 102 3.890 8.789 9.731 1.00 0.00 C ATOM 1598 OH TYR A 102 3.391 9.222 10.920 1.00 0.00 O ATOM 0 H TYR A 102 6.162 5.622 7.510 1.00 0.00 H new ATOM 0 HA TYR A 102 7.362 6.770 5.060 1.00 0.00 H new ATOM 0 HB2 TYR A 102 5.423 8.232 5.244 1.00 0.00 H new ATOM 0 HB3 TYR A 102 4.840 6.615 5.587 1.00 0.00 H new ATOM 0 HD1 TYR A 102 4.311 5.954 7.933 1.00 0.00 H new ATOM 0 HD2 TYR A 102 5.400 9.950 6.935 1.00 0.00 H new ATOM 0 HE1 TYR A 102 3.383 6.766 10.144 1.00 0.00 H new ATOM 0 HE2 TYR A 102 4.471 10.749 9.150 1.00 0.00 H new ATOM 0 HH TYR A 102 3.420 10.201 10.950 1.00 0.00 H new ATOM 1608 N ARG A 103 7.820 7.776 8.105 1.00 0.00 N ATOM 1609 CA ARG A 103 8.588 8.680 8.944 1.00 0.00 C ATOM 1610 C ARG A 103 9.993 8.872 8.369 1.00 0.00 C ATOM 1611 O ARG A 103 10.706 7.899 8.124 1.00 0.00 O ATOM 1612 CB ARG A 103 8.698 8.147 10.374 1.00 0.00 C ATOM 1613 CG ARG A 103 7.371 8.301 11.119 1.00 0.00 C ATOM 1614 CD ARG A 103 7.596 8.835 12.535 1.00 0.00 C ATOM 1615 NE ARG A 103 6.548 9.823 12.876 1.00 0.00 N ATOM 1616 CZ ARG A 103 5.269 9.508 13.119 1.00 0.00 C ATOM 1617 NH1 ARG A 103 4.871 8.230 13.059 1.00 0.00 N ATOM 1618 NH2 ARG A 103 4.387 10.471 13.421 1.00 0.00 N ATOM 0 H ARG A 103 7.346 7.027 8.609 1.00 0.00 H new ATOM 0 HA ARG A 103 8.066 9.636 8.965 1.00 0.00 H new ATOM 0 HB2 ARG A 103 8.988 7.096 10.353 1.00 0.00 H new ATOM 0 HB3 ARG A 103 9.483 8.684 10.907 1.00 0.00 H new ATOM 0 HG2 ARG A 103 6.718 8.980 10.570 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.862 7.338 11.166 1.00 0.00 H new ATOM 0 HD2 ARG A 103 7.578 8.012 13.250 1.00 0.00 H new ATOM 0 HD3 ARG A 103 8.580 9.298 12.606 1.00 0.00 H new ATOM 0 HE ARG A 103 6.817 10.806 12.929 1.00 0.00 H new ATOM 0 HH11 ARG A 103 5.542 7.497 12.828 1.00 0.00 H new ATOM 0 HH12 ARG A 103 3.897 7.990 13.244 1.00 0.00 H new ATOM 0 HH21 ARG A 103 4.690 11.444 13.466 1.00 0.00 H new ATOM 0 HH22 ARG A 103 3.413 10.231 13.606 1.00 0.00 H new ATOM 1632 N GLY A 104 10.350 10.132 8.171 1.00 0.00 N ATOM 1633 CA GLY A 104 11.657 10.464 7.631 1.00 0.00 C ATOM 1634 C GLY A 104 11.742 10.109 6.145 1.00 0.00 C ATOM 1635 O GLY A 104 12.332 9.094 5.778 1.00 0.00 O ATOM 0 H GLY A 104 9.756 10.936 8.375 1.00 0.00 H new ATOM 0 HA2 GLY A 104 11.851 11.528 7.766 1.00 0.00 H new ATOM 0 HA3 GLY A 104 12.429 9.927 8.182 1.00 0.00 H new ATOM 1639 N TYR A 105 11.144 10.965 5.330 1.00 0.00 N ATOM 1640 CA TYR A 105 11.144 10.755 3.892 1.00 0.00 C ATOM 1641 C TYR A 105 10.574 11.971 3.160 1.00 0.00 C ATOM 1642 O TYR A 105 11.148 12.433 2.175 1.00 0.00 O ATOM 1643 CB TYR A 105 10.233 9.551 3.642 1.00 0.00 C ATOM 1644 CG TYR A 105 10.945 8.201 3.746 1.00 0.00 C ATOM 1645 CD1 TYR A 105 12.121 7.985 3.057 1.00 0.00 C ATOM 1646 CD2 TYR A 105 10.410 7.197 4.529 1.00 0.00 C ATOM 1647 CE1 TYR A 105 12.791 6.714 3.155 1.00 0.00 C ATOM 1648 CE2 TYR A 105 11.080 5.926 4.627 1.00 0.00 C ATOM 1649 CZ TYR A 105 12.237 5.747 3.935 1.00 0.00 C ATOM 1650 OH TYR A 105 12.869 4.547 4.027 1.00 0.00 O ATOM 0 H TYR A 105 10.656 11.806 5.638 1.00 0.00 H new ATOM 0 HA TYR A 105 12.159 10.595 3.528 1.00 0.00 H new ATOM 0 HB2 TYR A 105 9.413 9.574 4.359 1.00 0.00 H new ATOM 0 HB3 TYR A 105 9.792 9.642 2.650 1.00 0.00 H new ATOM 0 HD1 TYR A 105 12.539 8.770 2.444 1.00 0.00 H new ATOM 0 HD2 TYR A 105 9.489 7.365 5.068 1.00 0.00 H new ATOM 0 HE1 TYR A 105 13.712 6.533 2.621 1.00 0.00 H new ATOM 0 HE2 TYR A 105 10.673 5.133 5.236 1.00 0.00 H new ATOM 0 HH TYR A 105 12.361 3.954 4.619 1.00 0.00 H new ATOM 1660 N GLY A 106 9.451 12.456 3.669 1.00 0.00 N ATOM 1661 CA GLY A 106 8.797 13.610 3.076 1.00 0.00 C ATOM 1662 C GLY A 106 7.293 13.592 3.356 1.00 0.00 C ATOM 1663 O GLY A 106 6.685 14.640 3.567 1.00 0.00 O ATOM 0 H GLY A 106 8.977 12.071 4.486 1.00 0.00 H new ATOM 0 HA2 GLY A 106 9.234 14.525 3.475 1.00 0.00 H new ATOM 0 HA3 GLY A 106 8.970 13.617 2.000 1.00 0.00 H new ATOM 1667 N LEU A 107 6.737 12.390 3.349 1.00 0.00 N ATOM 1668 CA LEU A 107 5.315 12.221 3.600 1.00 0.00 C ATOM 1669 C LEU A 107 4.879 13.185 4.706 1.00 0.00 C ATOM 1670 O LEU A 107 4.031 14.048 4.483 1.00 0.00 O ATOM 1671 CB LEU A 107 4.994 10.756 3.900 1.00 0.00 C ATOM 1672 CG LEU A 107 5.428 9.743 2.838 1.00 0.00 C ATOM 1673 CD1 LEU A 107 5.579 10.413 1.471 1.00 0.00 C ATOM 1674 CD2 LEU A 107 6.705 9.016 3.264 1.00 0.00 C ATOM 0 H LEU A 107 7.245 11.523 3.173 1.00 0.00 H new ATOM 0 HA LEU A 107 4.738 12.474 2.710 1.00 0.00 H new ATOM 0 HB2 LEU A 107 5.467 10.487 4.845 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.918 10.663 4.044 1.00 0.00 H new ATOM 0 HG LEU A 107 4.645 8.990 2.743 1.00 0.00 H new ATOM 0 HD11 LEU A 107 5.888 9.671 0.734 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.625 10.847 1.171 1.00 0.00 H new ATOM 0 HD13 LEU A 107 6.332 11.199 1.532 1.00 0.00 H new ATOM 0 HD21 LEU A 107 6.992 8.302 2.492 1.00 0.00 H new ATOM 0 HD22 LEU A 107 7.507 9.741 3.404 1.00 0.00 H new ATOM 0 HD23 LEU A 107 6.527 8.486 4.200 1.00 0.00 H new ATOM 1686 N GLU A 108 5.479 13.006 5.873 1.00 0.00 N ATOM 1687 CA GLU A 108 5.163 13.848 7.014 1.00 0.00 C ATOM 1688 C GLU A 108 5.247 15.325 6.622 1.00 0.00 C ATOM 1689 O GLU A 108 4.420 16.131 7.045 1.00 0.00 O ATOM 1690 CB GLU A 108 6.086 13.541 8.195 1.00 0.00 C ATOM 1691 CG GLU A 108 5.320 13.598 9.518 1.00 0.00 C ATOM 1692 CD GLU A 108 6.270 13.851 10.691 1.00 0.00 C ATOM 1693 OE1 GLU A 108 7.261 13.096 10.791 1.00 0.00 O ATOM 1694 OE2 GLU A 108 5.982 14.793 11.461 1.00 0.00 O ATOM 0 H GLU A 108 6.183 12.290 6.053 1.00 0.00 H new ATOM 0 HA GLU A 108 4.142 13.632 7.328 1.00 0.00 H new ATOM 0 HB2 GLU A 108 6.528 12.553 8.069 1.00 0.00 H new ATOM 0 HB3 GLU A 108 6.907 14.257 8.215 1.00 0.00 H new ATOM 0 HG2 GLU A 108 4.571 14.389 9.475 1.00 0.00 H new ATOM 0 HG3 GLU A 108 4.786 12.661 9.674 1.00 0.00 H new ATOM 1701 N GLU A 109 6.255 15.635 5.819 1.00 0.00 N ATOM 1702 CA GLU A 109 6.458 17.000 5.366 1.00 0.00 C ATOM 1703 C GLU A 109 5.207 17.513 4.648 1.00 0.00 C ATOM 1704 O GLU A 109 4.854 18.685 4.768 1.00 0.00 O ATOM 1705 CB GLU A 109 7.689 17.101 4.463 1.00 0.00 C ATOM 1706 CG GLU A 109 8.672 18.148 4.992 1.00 0.00 C ATOM 1707 CD GLU A 109 9.746 18.466 3.950 1.00 0.00 C ATOM 1708 OE1 GLU A 109 10.678 17.642 3.826 1.00 0.00 O ATOM 1709 OE2 GLU A 109 9.611 19.525 3.301 1.00 0.00 O ATOM 0 H GLU A 109 6.940 14.964 5.471 1.00 0.00 H new ATOM 0 HA GLU A 109 6.636 17.629 6.238 1.00 0.00 H new ATOM 0 HB2 GLU A 109 8.182 16.131 4.404 1.00 0.00 H new ATOM 0 HB3 GLU A 109 7.382 17.364 3.451 1.00 0.00 H new ATOM 0 HG2 GLU A 109 8.133 19.059 5.254 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.142 17.782 5.905 1.00 0.00 H new ATOM 1716 N PHE A 110 4.572 16.609 3.917 1.00 0.00 N ATOM 1717 CA PHE A 110 3.369 16.955 3.179 1.00 0.00 C ATOM 1718 C PHE A 110 2.117 16.707 4.024 1.00 0.00 C ATOM 1719 O PHE A 110 1.219 17.546 4.069 1.00 0.00 O ATOM 1720 CB PHE A 110 3.324 16.049 1.946 1.00 0.00 C ATOM 1721 CG PHE A 110 4.374 16.389 0.887 1.00 0.00 C ATOM 1722 CD1 PHE A 110 4.118 17.351 -0.040 1.00 0.00 C ATOM 1723 CD2 PHE A 110 5.563 15.729 0.871 1.00 0.00 C ATOM 1724 CE1 PHE A 110 5.093 17.667 -1.024 1.00 0.00 C ATOM 1725 CE2 PHE A 110 6.537 16.044 -0.113 1.00 0.00 C ATOM 1726 CZ PHE A 110 6.282 17.006 -1.039 1.00 0.00 C ATOM 0 H PHE A 110 4.868 15.638 3.820 1.00 0.00 H new ATOM 0 HA PHE A 110 3.390 18.011 2.908 1.00 0.00 H new ATOM 0 HB2 PHE A 110 3.463 15.015 2.262 1.00 0.00 H new ATOM 0 HB3 PHE A 110 2.334 16.114 1.495 1.00 0.00 H new ATOM 0 HD1 PHE A 110 3.174 17.875 -0.028 1.00 0.00 H new ATOM 0 HD2 PHE A 110 5.766 14.965 1.607 1.00 0.00 H new ATOM 0 HE1 PHE A 110 4.890 18.431 -1.760 1.00 0.00 H new ATOM 0 HE2 PHE A 110 7.481 15.519 -0.126 1.00 0.00 H new ATOM 0 HZ PHE A 110 7.023 17.246 -1.787 1.00 0.00 H new ATOM 1736 N PHE A 111 2.099 15.552 4.673 1.00 0.00 N ATOM 1737 CA PHE A 111 0.973 15.184 5.515 1.00 0.00 C ATOM 1738 C PHE A 111 1.245 15.534 6.979 1.00 0.00 C ATOM 1739 O PHE A 111 2.235 15.084 7.555 1.00 0.00 O ATOM 1740 CB PHE A 111 0.797 13.670 5.388 1.00 0.00 C ATOM 1741 CG PHE A 111 0.628 13.181 3.949 1.00 0.00 C ATOM 1742 CD1 PHE A 111 -0.515 13.457 3.266 1.00 0.00 C ATOM 1743 CD2 PHE A 111 1.622 12.470 3.351 1.00 0.00 C ATOM 1744 CE1 PHE A 111 -0.672 13.003 1.930 1.00 0.00 C ATOM 1745 CE2 PHE A 111 1.466 12.016 2.015 1.00 0.00 C ATOM 1746 CZ PHE A 111 0.322 12.292 1.332 1.00 0.00 C ATOM 0 H PHE A 111 2.846 14.859 4.633 1.00 0.00 H new ATOM 0 HA PHE A 111 0.081 15.725 5.201 1.00 0.00 H new ATOM 0 HB2 PHE A 111 1.663 13.176 5.829 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -0.074 13.366 5.969 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -1.304 14.022 3.740 1.00 0.00 H new ATOM 0 HD2 PHE A 111 2.530 12.251 3.893 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -1.580 13.222 1.388 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.255 11.452 1.541 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.203 11.947 0.316 1.00 0.00 H new ATOM 1756 N THR A 112 0.350 16.333 7.540 1.00 0.00 N ATOM 1757 CA THR A 112 0.481 16.748 8.926 1.00 0.00 C ATOM 1758 C THR A 112 0.709 15.533 9.827 1.00 0.00 C ATOM 1759 O THR A 112 0.331 14.417 9.477 1.00 0.00 O ATOM 1760 CB THR A 112 -0.765 17.555 9.298 1.00 0.00 C ATOM 1761 OG1 THR A 112 -0.902 17.355 10.702 1.00 0.00 O ATOM 1762 CG2 THR A 112 -2.046 16.959 8.710 1.00 0.00 C ATOM 0 H THR A 112 -0.470 16.704 7.059 1.00 0.00 H new ATOM 0 HA THR A 112 1.353 17.386 9.067 1.00 0.00 H new ATOM 0 HB THR A 112 -0.649 18.582 8.950 1.00 0.00 H new ATOM 0 HG1 THR A 112 -1.012 18.221 11.147 1.00 0.00 H new ATOM 0 HG21 THR A 112 -2.900 17.570 9.004 1.00 0.00 H new ATOM 0 HG22 THR A 112 -1.972 16.938 7.623 1.00 0.00 H new ATOM 0 HG23 THR A 112 -2.180 15.944 9.084 1.00 0.00 H new ATOM 1770 N PRO A 113 1.344 15.799 11.000 1.00 0.00 N ATOM 1771 CA PRO A 113 1.628 14.741 11.954 1.00 0.00 C ATOM 1772 C PRO A 113 0.358 14.317 12.697 1.00 0.00 C ATOM 1773 O PRO A 113 0.388 13.391 13.505 1.00 0.00 O ATOM 1774 CB PRO A 113 2.691 15.316 12.876 1.00 0.00 C ATOM 1775 CG PRO A 113 2.628 16.824 12.695 1.00 0.00 C ATOM 1776 CD PRO A 113 1.807 17.110 11.448 1.00 0.00 C ATOM 0 HA PRO A 113 1.986 13.829 11.476 1.00 0.00 H new ATOM 0 HB2 PRO A 113 2.500 15.039 13.913 1.00 0.00 H new ATOM 0 HB3 PRO A 113 3.679 14.933 12.620 1.00 0.00 H new ATOM 0 HG2 PRO A 113 2.174 17.294 13.567 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.631 17.239 12.595 1.00 0.00 H new ATOM 0 HD2 PRO A 113 0.969 17.772 11.669 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.408 17.601 10.682 1.00 0.00 H new ATOM 1784 N LEU A 114 -0.726 15.017 12.396 1.00 0.00 N ATOM 1785 CA LEU A 114 -2.003 14.726 13.025 1.00 0.00 C ATOM 1786 C LEU A 114 -2.766 13.710 12.173 1.00 0.00 C ATOM 1787 O LEU A 114 -3.343 12.760 12.700 1.00 0.00 O ATOM 1788 CB LEU A 114 -2.780 16.018 13.285 1.00 0.00 C ATOM 1789 CG LEU A 114 -3.465 16.126 14.649 1.00 0.00 C ATOM 1790 CD1 LEU A 114 -4.344 14.903 14.919 1.00 0.00 C ATOM 1791 CD2 LEU A 114 -2.440 16.352 15.761 1.00 0.00 C ATOM 0 H LEU A 114 -0.746 15.785 11.725 1.00 0.00 H new ATOM 0 HA LEU A 114 -1.851 14.272 14.004 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -2.095 16.859 13.177 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -3.539 16.124 12.510 1.00 0.00 H new ATOM 0 HG LEU A 114 -4.120 16.997 14.634 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -4.819 15.005 15.895 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -5.111 14.829 14.148 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -3.729 14.003 14.907 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -2.953 16.425 16.720 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -1.741 15.516 15.787 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -1.894 17.276 15.570 1.00 0.00 H new ATOM 1803 N ARG A 115 -2.744 13.944 10.869 1.00 0.00 N ATOM 1804 CA ARG A 115 -3.427 13.062 9.938 1.00 0.00 C ATOM 1805 C ARG A 115 -2.729 11.701 9.887 1.00 0.00 C ATOM 1806 O ARG A 115 -3.386 10.665 9.799 1.00 0.00 O ATOM 1807 CB ARG A 115 -3.460 13.663 8.532 1.00 0.00 C ATOM 1808 CG ARG A 115 -4.617 14.654 8.386 1.00 0.00 C ATOM 1809 CD ARG A 115 -4.904 14.949 6.913 1.00 0.00 C ATOM 1810 NE ARG A 115 -6.357 15.146 6.710 1.00 0.00 N ATOM 1811 CZ ARG A 115 -6.890 15.764 5.647 1.00 0.00 C ATOM 1812 NH1 ARG A 115 -6.094 16.248 4.684 1.00 0.00 N ATOM 1813 NH2 ARG A 115 -8.220 15.897 5.547 1.00 0.00 N ATOM 0 H ARG A 115 -2.264 14.732 10.435 1.00 0.00 H new ATOM 0 HA ARG A 115 -4.451 12.937 10.291 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -2.516 14.168 8.326 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -3.563 12.867 7.795 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -5.511 14.248 8.860 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -4.374 15.581 8.906 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -4.361 15.840 6.599 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -4.550 14.125 6.293 1.00 0.00 H new ATOM 0 HE ARG A 115 -6.992 14.789 7.424 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -5.082 16.146 4.760 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -6.500 16.718 3.875 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -8.826 15.528 6.280 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -8.626 16.367 4.738 1.00 0.00 H new ATOM 1827 N LEU A 116 -1.406 11.748 9.945 1.00 0.00 N ATOM 1828 CA LEU A 116 -0.611 10.533 9.907 1.00 0.00 C ATOM 1829 C LEU A 116 -1.074 9.591 11.020 1.00 0.00 C ATOM 1830 O LEU A 116 -1.333 8.413 10.775 1.00 0.00 O ATOM 1831 CB LEU A 116 0.881 10.866 9.964 1.00 0.00 C ATOM 1832 CG LEU A 116 1.570 11.088 8.616 1.00 0.00 C ATOM 1833 CD1 LEU A 116 1.752 9.765 7.869 1.00 0.00 C ATOM 1834 CD2 LEU A 116 0.815 12.121 7.777 1.00 0.00 C ATOM 0 H LEU A 116 -0.865 12.609 10.018 1.00 0.00 H new ATOM 0 HA LEU A 116 -0.761 10.010 8.963 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.010 11.764 10.568 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.394 10.057 10.483 1.00 0.00 H new ATOM 0 HG LEU A 116 2.565 11.492 8.804 1.00 0.00 H new ATOM 0 HD11 LEU A 116 2.244 9.951 6.914 1.00 0.00 H new ATOM 0 HD12 LEU A 116 2.364 9.091 8.467 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.777 9.310 7.692 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.326 12.260 6.824 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -0.201 11.770 7.596 1.00 0.00 H new ATOM 0 HD23 LEU A 116 0.781 13.070 8.312 1.00 0.00 H new ATOM 1846 N ARG A 117 -1.164 10.144 12.221 1.00 0.00 N ATOM 1847 CA ARG A 117 -1.592 9.369 13.372 1.00 0.00 C ATOM 1848 C ARG A 117 -2.700 8.392 12.973 1.00 0.00 C ATOM 1849 O ARG A 117 -2.821 7.314 13.554 1.00 0.00 O ATOM 1850 CB ARG A 117 -2.102 10.279 14.491 1.00 0.00 C ATOM 1851 CG ARG A 117 -0.948 11.034 15.154 1.00 0.00 C ATOM 1852 CD ARG A 117 -1.103 11.046 16.676 1.00 0.00 C ATOM 1853 NE ARG A 117 0.038 11.757 17.295 1.00 0.00 N ATOM 1854 CZ ARG A 117 0.133 12.030 18.603 1.00 0.00 C ATOM 1855 NH1 ARG A 117 -0.846 11.654 19.438 1.00 0.00 N ATOM 1856 NH2 ARG A 117 1.205 12.680 19.076 1.00 0.00 N ATOM 0 H ARG A 117 -0.947 11.120 12.421 1.00 0.00 H new ATOM 0 HA ARG A 117 -0.728 8.814 13.737 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -2.822 10.991 14.086 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -2.628 9.684 15.237 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -0.001 10.566 14.885 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -0.916 12.057 14.780 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -2.038 11.534 16.951 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -1.153 10.024 17.053 1.00 0.00 H new ATOM 0 HE ARG A 117 0.800 12.058 16.687 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -1.662 11.160 19.077 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -0.774 11.861 20.434 1.00 0.00 H new ATOM 0 HH21 ARG A 117 1.949 12.967 18.440 1.00 0.00 H new ATOM 0 HH22 ARG A 117 1.277 12.888 20.072 1.00 0.00 H new ATOM 1870 N GLY A 118 -3.480 8.804 11.985 1.00 0.00 N ATOM 1871 CA GLY A 118 -4.574 7.979 11.501 1.00 0.00 C ATOM 1872 C GLY A 118 -4.119 7.089 10.343 1.00 0.00 C ATOM 1873 O GLY A 118 -4.256 5.868 10.402 1.00 0.00 O ATOM 0 H GLY A 118 -3.376 9.699 11.506 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -4.954 7.359 12.313 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -5.397 8.615 11.174 1.00 0.00 H new ATOM 1877 N LEU A 119 -3.587 7.735 9.316 1.00 0.00 N ATOM 1878 CA LEU A 119 -3.111 7.018 8.145 1.00 0.00 C ATOM 1879 C LEU A 119 -2.431 5.721 8.589 1.00 0.00 C ATOM 1880 O LEU A 119 -2.640 4.669 7.987 1.00 0.00 O ATOM 1881 CB LEU A 119 -2.218 7.919 7.290 1.00 0.00 C ATOM 1882 CG LEU A 119 -2.844 8.454 6.000 1.00 0.00 C ATOM 1883 CD1 LEU A 119 -4.239 9.023 6.262 1.00 0.00 C ATOM 1884 CD2 LEU A 119 -1.925 9.475 5.328 1.00 0.00 C ATOM 0 H LEU A 119 -3.475 8.748 9.270 1.00 0.00 H new ATOM 0 HA LEU A 119 -3.947 6.738 7.504 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -1.904 8.768 7.897 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -1.317 7.363 7.030 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.962 7.621 5.307 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -4.661 9.396 5.329 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -4.882 8.240 6.663 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -4.170 9.839 6.981 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.393 9.840 4.414 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -1.753 10.311 6.006 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -0.973 9.003 5.085 1.00 0.00 H new ATOM 1896 N GLU A 120 -1.630 5.840 9.638 1.00 0.00 N ATOM 1897 CA GLU A 120 -0.918 4.690 10.169 1.00 0.00 C ATOM 1898 C GLU A 120 -1.901 3.568 10.512 1.00 0.00 C ATOM 1899 O GLU A 120 -1.768 2.450 10.017 1.00 0.00 O ATOM 1900 CB GLU A 120 -0.083 5.079 11.391 1.00 0.00 C ATOM 1901 CG GLU A 120 0.933 6.167 11.037 1.00 0.00 C ATOM 1902 CD GLU A 120 1.590 6.735 12.297 1.00 0.00 C ATOM 1903 OE1 GLU A 120 2.375 5.983 12.915 1.00 0.00 O ATOM 1904 OE2 GLU A 120 1.292 7.907 12.613 1.00 0.00 O ATOM 0 H GLU A 120 -1.458 6.715 10.134 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.234 4.325 9.403 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.739 5.434 12.186 1.00 0.00 H new ATOM 0 HB3 GLU A 120 0.437 4.201 11.775 1.00 0.00 H new ATOM 0 HG2 GLU A 120 1.697 5.755 10.378 1.00 0.00 H new ATOM 0 HG3 GLU A 120 0.437 6.968 10.488 1.00 0.00 H new ATOM 1911 N ALA A 121 -2.865 3.906 11.356 1.00 0.00 N ATOM 1912 CA ALA A 121 -3.869 2.942 11.770 1.00 0.00 C ATOM 1913 C ALA A 121 -4.252 2.066 10.575 1.00 0.00 C ATOM 1914 O ALA A 121 -4.523 0.877 10.734 1.00 0.00 O ATOM 1915 CB ALA A 121 -5.072 3.679 12.361 1.00 0.00 C ATOM 0 H ALA A 121 -2.972 4.835 11.764 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.474 2.287 12.547 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.825 2.955 12.672 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -4.753 4.263 13.224 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -5.496 4.344 11.609 1.00 0.00 H new ATOM 1921 N ALA A 122 -4.262 2.688 9.405 1.00 0.00 N ATOM 1922 CA ALA A 122 -4.608 1.980 8.184 1.00 0.00 C ATOM 1923 C ALA A 122 -3.748 0.720 8.070 1.00 0.00 C ATOM 1924 O ALA A 122 -4.274 -0.386 7.957 1.00 0.00 O ATOM 1925 CB ALA A 122 -4.434 2.915 6.985 1.00 0.00 C ATOM 0 H ALA A 122 -4.036 3.674 9.277 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.652 1.667 8.204 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -4.693 2.384 6.069 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -5.087 3.780 7.100 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.397 3.248 6.930 1.00 0.00 H new ATOM 1931 N LEU A 123 -2.440 0.929 8.103 1.00 0.00 N ATOM 1932 CA LEU A 123 -1.503 -0.177 8.005 1.00 0.00 C ATOM 1933 C LEU A 123 -1.743 -1.148 9.163 1.00 0.00 C ATOM 1934 O LEU A 123 -2.072 -2.312 8.943 1.00 0.00 O ATOM 1935 CB LEU A 123 -0.066 0.344 7.926 1.00 0.00 C ATOM 1936 CG LEU A 123 1.033 -0.720 7.911 1.00 0.00 C ATOM 1937 CD1 LEU A 123 1.203 -1.313 6.511 1.00 0.00 C ATOM 1938 CD2 LEU A 123 2.346 -0.159 8.460 1.00 0.00 C ATOM 0 H LEU A 123 -2.007 1.848 8.196 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.667 -0.735 7.083 1.00 0.00 H new ATOM 0 HB2 LEU A 123 0.031 0.950 7.025 1.00 0.00 H new ATOM 0 HB3 LEU A 123 0.107 1.005 8.775 1.00 0.00 H new ATOM 0 HG LEU A 123 0.730 -1.534 8.570 1.00 0.00 H new ATOM 0 HD11 LEU A 123 1.990 -2.067 6.528 1.00 0.00 H new ATOM 0 HD12 LEU A 123 0.267 -1.773 6.195 1.00 0.00 H new ATOM 0 HD13 LEU A 123 1.473 -0.522 5.811 1.00 0.00 H new ATOM 0 HD21 LEU A 123 3.111 -0.935 8.438 1.00 0.00 H new ATOM 0 HD22 LEU A 123 2.667 0.683 7.847 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.198 0.176 9.487 1.00 0.00 H new ATOM 1950 N LEU A 124 -1.568 -0.632 10.371 1.00 0.00 N ATOM 1951 CA LEU A 124 -1.761 -1.439 11.564 1.00 0.00 C ATOM 1952 C LEU A 124 -3.057 -2.242 11.427 1.00 0.00 C ATOM 1953 O LEU A 124 -3.061 -3.457 11.616 1.00 0.00 O ATOM 1954 CB LEU A 124 -1.710 -0.563 12.817 1.00 0.00 C ATOM 1955 CG LEU A 124 -0.424 0.239 13.023 1.00 0.00 C ATOM 1956 CD1 LEU A 124 0.801 -0.568 12.587 1.00 0.00 C ATOM 1957 CD2 LEU A 124 -0.501 1.592 12.312 1.00 0.00 C ATOM 0 H LEU A 124 -1.295 0.334 10.549 1.00 0.00 H new ATOM 0 HA LEU A 124 -0.950 -2.159 11.673 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -2.548 0.134 12.783 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -1.860 -1.201 13.688 1.00 0.00 H new ATOM 0 HG LEU A 124 -0.315 0.441 14.089 1.00 0.00 H new ATOM 0 HD11 LEU A 124 1.702 0.025 12.744 1.00 0.00 H new ATOM 0 HD12 LEU A 124 0.862 -1.483 13.176 1.00 0.00 H new ATOM 0 HD13 LEU A 124 0.713 -0.821 11.531 1.00 0.00 H new ATOM 0 HD21 LEU A 124 0.426 2.142 12.475 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -0.646 1.434 11.243 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -1.338 2.166 12.711 1.00 0.00 H new ATOM 1969 N ARG A 125 -4.125 -1.530 11.099 1.00 0.00 N ATOM 1970 CA ARG A 125 -5.423 -2.161 10.934 1.00 0.00 C ATOM 1971 C ARG A 125 -5.329 -3.318 9.938 1.00 0.00 C ATOM 1972 O ARG A 125 -5.536 -4.474 10.303 1.00 0.00 O ATOM 1973 CB ARG A 125 -6.465 -1.156 10.440 1.00 0.00 C ATOM 1974 CG ARG A 125 -7.120 -0.423 11.613 1.00 0.00 C ATOM 1975 CD ARG A 125 -7.916 0.790 11.126 1.00 0.00 C ATOM 1976 NE ARG A 125 -8.842 1.246 12.187 1.00 0.00 N ATOM 1977 CZ ARG A 125 -9.905 0.547 12.608 1.00 0.00 C ATOM 1978 NH1 ARG A 125 -10.182 -0.645 12.062 1.00 0.00 N ATOM 1979 NH2 ARG A 125 -10.690 1.039 13.576 1.00 0.00 N ATOM 0 H ARG A 125 -4.118 -0.522 10.943 1.00 0.00 H new ATOM 0 HA ARG A 125 -5.733 -2.540 11.908 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -5.992 -0.434 9.774 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -7.228 -1.674 9.859 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -7.780 -1.104 12.149 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -6.354 -0.101 12.318 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -7.235 1.597 10.854 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -8.477 0.531 10.228 1.00 0.00 H new ATOM 0 HE ARG A 125 -8.660 2.149 12.625 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -9.584 -1.020 11.326 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -10.991 -1.177 12.382 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -10.479 1.946 13.993 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -11.499 0.507 13.896 1.00 0.00 H new ATOM 1993 N LEU A 126 -5.015 -2.967 8.700 1.00 0.00 N ATOM 1994 CA LEU A 126 -4.891 -3.963 7.649 1.00 0.00 C ATOM 1995 C LEU A 126 -4.016 -5.115 8.145 1.00 0.00 C ATOM 1996 O LEU A 126 -4.391 -6.281 8.024 1.00 0.00 O ATOM 1997 CB LEU A 126 -4.383 -3.317 6.357 1.00 0.00 C ATOM 1998 CG LEU A 126 -5.295 -2.259 5.733 1.00 0.00 C ATOM 1999 CD1 LEU A 126 -4.475 -1.145 5.080 1.00 0.00 C ATOM 2000 CD2 LEU A 126 -6.281 -2.895 4.751 1.00 0.00 C ATOM 0 H LEU A 126 -4.843 -2.007 8.401 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.866 -4.385 7.406 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -3.414 -2.860 6.559 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -4.217 -4.104 5.622 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.883 -1.802 6.529 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -5.147 -0.406 4.644 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.848 -0.666 5.832 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.845 -1.568 4.298 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.917 -2.121 4.322 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.730 -3.395 3.954 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.899 -3.623 5.276 1.00 0.00 H new ATOM 2012 N GLN A 127 -2.866 -4.750 8.694 1.00 0.00 N ATOM 2013 CA GLN A 127 -1.935 -5.739 9.209 1.00 0.00 C ATOM 2014 C GLN A 127 -2.626 -6.631 10.242 1.00 0.00 C ATOM 2015 O GLN A 127 -2.250 -7.789 10.419 1.00 0.00 O ATOM 2016 CB GLN A 127 -0.696 -5.068 9.805 1.00 0.00 C ATOM 2017 CG GLN A 127 0.252 -4.591 8.703 1.00 0.00 C ATOM 2018 CD GLN A 127 1.545 -4.029 9.298 1.00 0.00 C ATOM 2019 OE1 GLN A 127 1.678 -3.844 10.497 1.00 0.00 O ATOM 2020 NE2 GLN A 127 2.487 -3.768 8.396 1.00 0.00 N ATOM 0 H GLN A 127 -2.558 -3.783 8.793 1.00 0.00 H new ATOM 0 HA GLN A 127 -1.605 -6.365 8.380 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -0.998 -4.221 10.422 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -0.177 -5.769 10.458 1.00 0.00 H new ATOM 0 HG2 GLN A 127 0.485 -5.420 8.035 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -0.239 -3.826 8.102 1.00 0.00 H new ATOM 0 HE21 GLN A 127 2.310 -3.946 7.407 1.00 0.00 H new ATOM 0 HE22 GLN A 127 3.386 -3.389 8.693 1.00 0.00 H new ATOM 2029 N ALA A 128 -3.624 -6.058 10.899 1.00 0.00 N ATOM 2030 CA ALA A 128 -4.371 -6.786 11.910 1.00 0.00 C ATOM 2031 C ALA A 128 -5.431 -7.654 11.228 1.00 0.00 C ATOM 2032 O ALA A 128 -5.854 -8.670 11.778 1.00 0.00 O ATOM 2033 CB ALA A 128 -4.980 -5.798 12.906 1.00 0.00 C ATOM 0 H ALA A 128 -3.933 -5.097 10.750 1.00 0.00 H new ATOM 0 HA ALA A 128 -3.712 -7.449 12.471 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.540 -6.345 13.664 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -4.184 -5.227 13.384 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -5.650 -5.118 12.380 1.00 0.00 H new ATOM 2039 N GLN A 129 -5.830 -7.223 10.041 1.00 0.00 N ATOM 2040 CA GLN A 129 -6.832 -7.948 9.279 1.00 0.00 C ATOM 2041 C GLN A 129 -6.206 -9.173 8.609 1.00 0.00 C ATOM 2042 O GLN A 129 -6.841 -10.221 8.507 1.00 0.00 O ATOM 2043 CB GLN A 129 -7.498 -7.038 8.245 1.00 0.00 C ATOM 2044 CG GLN A 129 -8.706 -6.317 8.846 1.00 0.00 C ATOM 2045 CD GLN A 129 -9.753 -6.012 7.773 1.00 0.00 C ATOM 2046 OE1 GLN A 129 -10.600 -6.827 7.446 1.00 0.00 O ATOM 2047 NE2 GLN A 129 -9.648 -4.796 7.244 1.00 0.00 N ATOM 0 H GLN A 129 -5.477 -6.380 9.588 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.606 -8.290 9.966 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.777 -6.306 7.882 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.813 -7.629 7.385 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.150 -6.934 9.627 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -8.382 -5.389 9.317 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -8.915 -4.162 7.563 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -10.300 -4.497 6.519 1.00 0.00 H new ATOM 2056 N VAL A 130 -4.968 -8.999 8.170 1.00 0.00 N ATOM 2057 CA VAL A 130 -4.249 -10.078 7.513 1.00 0.00 C ATOM 2058 C VAL A 130 -4.003 -11.206 8.516 1.00 0.00 C ATOM 2059 O VAL A 130 -4.210 -12.377 8.202 1.00 0.00 O ATOM 2060 CB VAL A 130 -2.960 -9.542 6.887 1.00 0.00 C ATOM 2061 CG1 VAL A 130 -2.141 -10.675 6.264 1.00 0.00 C ATOM 2062 CG2 VAL A 130 -3.262 -8.453 5.856 1.00 0.00 C ATOM 0 H VAL A 130 -4.445 -8.128 8.256 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.842 -10.492 6.698 1.00 0.00 H new ATOM 0 HB VAL A 130 -2.363 -9.094 7.681 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -1.230 -10.267 5.826 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.880 -11.401 7.034 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -2.729 -11.165 5.488 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -2.328 -8.090 5.427 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -3.889 -8.865 5.065 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -3.784 -7.628 6.341 1.00 0.00 H new ATOM 2072 N ARG A 131 -3.564 -10.814 9.703 1.00 0.00 N ATOM 2073 CA ARG A 131 -3.287 -11.778 10.754 1.00 0.00 C ATOM 2074 C ARG A 131 -4.448 -12.765 10.889 1.00 0.00 C ATOM 2075 O ARG A 131 -4.260 -13.893 11.343 1.00 0.00 O ATOM 2076 CB ARG A 131 -3.062 -11.080 12.097 1.00 0.00 C ATOM 2077 CG ARG A 131 -1.585 -10.731 12.293 1.00 0.00 C ATOM 2078 CD ARG A 131 -1.384 -9.887 13.554 1.00 0.00 C ATOM 2079 NE ARG A 131 0.048 -9.546 13.711 1.00 0.00 N ATOM 2080 CZ ARG A 131 0.948 -10.339 14.308 1.00 0.00 C ATOM 2081 NH1 ARG A 131 0.570 -11.523 14.808 1.00 0.00 N ATOM 2082 NH2 ARG A 131 2.226 -9.947 14.406 1.00 0.00 N ATOM 0 H ARG A 131 -3.393 -9.842 9.960 1.00 0.00 H new ATOM 0 HA ARG A 131 -2.379 -12.315 10.480 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -3.663 -10.172 12.144 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -3.397 -11.727 12.908 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -0.998 -11.646 12.366 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -1.218 -10.186 11.424 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -1.979 -8.976 13.490 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -1.734 -10.436 14.429 1.00 0.00 H new ATOM 0 HE ARG A 131 0.370 -8.651 13.342 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -0.403 -11.821 14.734 1.00 0.00 H new ATOM 0 HH12 ARG A 131 1.255 -12.127 15.262 1.00 0.00 H new ATOM 0 HH21 ARG A 131 2.513 -9.045 14.026 1.00 0.00 H new ATOM 0 HH22 ARG A 131 2.911 -10.551 14.860 1.00 0.00 H new ATOM 2096 N LYS A 132 -5.624 -12.305 10.486 1.00 0.00 N ATOM 2097 CA LYS A 132 -6.815 -13.133 10.556 1.00 0.00 C ATOM 2098 C LYS A 132 -6.858 -14.062 9.341 1.00 0.00 C ATOM 2099 O LYS A 132 -7.273 -15.214 9.451 1.00 0.00 O ATOM 2100 CB LYS A 132 -8.064 -12.263 10.709 1.00 0.00 C ATOM 2101 CG LYS A 132 -7.781 -11.048 11.595 1.00 0.00 C ATOM 2102 CD LYS A 132 -7.175 -11.475 12.933 1.00 0.00 C ATOM 2103 CE LYS A 132 -8.078 -12.482 13.648 1.00 0.00 C ATOM 2104 NZ LYS A 132 -7.533 -12.811 14.984 1.00 0.00 N ATOM 0 H LYS A 132 -5.777 -11.369 10.110 1.00 0.00 H new ATOM 0 HA LYS A 132 -6.786 -13.768 11.442 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -8.403 -11.931 9.728 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -8.872 -12.853 11.142 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -7.098 -10.370 11.082 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -8.705 -10.497 11.769 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -6.192 -11.916 12.767 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -7.028 -10.600 13.566 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -9.082 -12.070 13.750 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -8.165 -13.390 13.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -8.158 -13.496 15.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -6.584 -13.224 14.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -7.473 -11.945 15.557 1.00 0.00 H new ATOM 2118 N ALA A 133 -6.422 -13.525 8.211 1.00 0.00 N ATOM 2119 CA ALA A 133 -6.405 -14.291 6.976 1.00 0.00 C ATOM 2120 C ALA A 133 -5.386 -15.426 7.100 1.00 0.00 C ATOM 2121 O ALA A 133 -5.605 -16.521 6.583 1.00 0.00 O ATOM 2122 CB ALA A 133 -6.102 -13.360 5.801 1.00 0.00 C ATOM 0 H ALA A 133 -6.078 -12.569 8.125 1.00 0.00 H new ATOM 0 HA ALA A 133 -7.380 -14.742 6.790 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -6.089 -13.935 4.875 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -6.871 -12.590 5.739 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -5.130 -12.891 5.950 1.00 0.00 H new ATOM 2128 N LEU A 134 -4.294 -15.125 7.786 1.00 0.00 N ATOM 2129 CA LEU A 134 -3.240 -16.106 7.984 1.00 0.00 C ATOM 2130 C LEU A 134 -3.828 -17.354 8.646 1.00 0.00 C ATOM 2131 O LEU A 134 -3.537 -18.475 8.234 1.00 0.00 O ATOM 2132 CB LEU A 134 -2.074 -15.491 8.759 1.00 0.00 C ATOM 2133 CG LEU A 134 -1.567 -14.141 8.248 1.00 0.00 C ATOM 2134 CD1 LEU A 134 -0.229 -13.777 8.895 1.00 0.00 C ATOM 2135 CD2 LEU A 134 -1.487 -14.127 6.720 1.00 0.00 C ATOM 0 H LEU A 134 -4.116 -14.216 8.212 1.00 0.00 H new ATOM 0 HA LEU A 134 -2.826 -16.418 7.025 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -2.377 -15.373 9.799 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -1.243 -16.197 8.747 1.00 0.00 H new ATOM 0 HG LEU A 134 -2.285 -13.375 8.540 1.00 0.00 H new ATOM 0 HD11 LEU A 134 0.109 -12.813 8.514 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -0.352 -13.717 9.976 1.00 0.00 H new ATOM 0 HD13 LEU A 134 0.511 -14.541 8.656 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -1.124 -13.156 6.384 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -0.803 -14.906 6.384 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -2.477 -14.309 6.302 1.00 0.00 H new ATOM 2147 N THR A 135 -4.646 -17.116 9.661 1.00 0.00 N ATOM 2148 CA THR A 135 -5.278 -18.207 10.384 1.00 0.00 C ATOM 2149 C THR A 135 -6.438 -18.784 9.571 1.00 0.00 C ATOM 2150 O THR A 135 -7.100 -19.724 10.009 1.00 0.00 O ATOM 2151 CB THR A 135 -5.700 -17.681 11.757 1.00 0.00 C ATOM 2152 OG1 THR A 135 -6.171 -18.839 12.442 1.00 0.00 O ATOM 2153 CG2 THR A 135 -6.926 -16.768 11.683 1.00 0.00 C ATOM 0 H THR A 135 -4.886 -16.184 10.000 1.00 0.00 H new ATOM 0 HA THR A 135 -4.586 -19.035 10.536 1.00 0.00 H new ATOM 0 HB THR A 135 -4.870 -17.138 12.209 1.00 0.00 H new ATOM 0 HG1 THR A 135 -6.651 -19.418 11.814 1.00 0.00 H new ATOM 0 HG21 THR A 135 -7.183 -16.422 12.684 1.00 0.00 H new ATOM 0 HG22 THR A 135 -6.703 -15.910 11.049 1.00 0.00 H new ATOM 0 HG23 THR A 135 -7.766 -17.321 11.263 1.00 0.00 H new ATOM 2161 N SER A 136 -6.648 -18.198 8.402 1.00 0.00 N ATOM 2162 CA SER A 136 -7.717 -18.643 7.523 1.00 0.00 C ATOM 2163 C SER A 136 -7.200 -19.728 6.577 1.00 0.00 C ATOM 2164 O SER A 136 -7.963 -20.583 6.131 1.00 0.00 O ATOM 2165 CB SER A 136 -8.295 -17.474 6.724 1.00 0.00 C ATOM 2166 OG SER A 136 -9.677 -17.659 6.429 1.00 0.00 O ATOM 0 H SER A 136 -6.097 -17.419 8.042 1.00 0.00 H new ATOM 0 HA SER A 136 -8.515 -19.058 8.139 1.00 0.00 H new ATOM 0 HB2 SER A 136 -8.165 -16.550 7.288 1.00 0.00 H new ATOM 0 HB3 SER A 136 -7.738 -17.360 5.794 1.00 0.00 H new ATOM 0 HG SER A 136 -10.009 -16.890 5.920 1.00 0.00 H new