USER MOD reduce.3.24.130724 H: found=0, std=0, add=1092, rem=0, adj=16 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 Set 1.1: A 47 CYS SG : rot -94:sc= 1.13 USER MOD Set 1.2: A 49 THR OG1 : rot 140:sc= 0.938 USER MOD Single : A 5 LYS NZ :NH3+ -158:sc=0.000347 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= -0.382 K(o=-0.38,f=-3.1!) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 102:sc= 0.854! USER MOD Single : A 23 GLN : amide:sc= -0.179 X(o=-0.18,f=0) USER MOD Single : A 28 TYR OH : rot -73:sc= -0.51 USER MOD Single : A 31 LYS NZ :NH3+ 158:sc=-0.00648 (180deg=-0.163) USER MOD Single : A 45 HIS : no HD1:sc= -0.198 K(o=-0.2,f=-1.1) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 HIS : no HD1:sc= -5.18! C(o=-5.2!,f=-11!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= -0.786 K(o=-0.79,f=-2.5!) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.117 USER MOD Single : A 76 LYS NZ :NH3+ -131:sc= -0.0103 (180deg=-1.22) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 160:sc= -0.983 USER MOD Single : A 127 GLN : amide:sc= -4.82! K(o=-4.8!,f=-5.3) USER MOD Single : A 129 GLN : amide:sc= -3.01 K(o=-3,f=-9.9!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N VAL A 2 10.384 -4.294 5.822 1.00 0.00 N ATOM 19 CA VAL A 2 9.713 -3.674 4.692 1.00 0.00 C ATOM 20 C VAL A 2 10.236 -4.290 3.393 1.00 0.00 C ATOM 21 O VAL A 2 11.429 -4.561 3.266 1.00 0.00 O ATOM 22 CB VAL A 2 9.892 -2.155 4.746 1.00 0.00 C ATOM 23 CG1 VAL A 2 9.040 -1.464 3.680 1.00 0.00 C ATOM 24 CG2 VAL A 2 9.570 -1.615 6.141 1.00 0.00 C ATOM 0 HA VAL A 2 8.641 -3.864 4.734 1.00 0.00 H new ATOM 0 HB VAL A 2 10.938 -1.933 4.534 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.186 -0.386 3.740 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.338 -1.816 2.692 1.00 0.00 H new ATOM 0 HG13 VAL A 2 7.989 -1.698 3.847 1.00 0.00 H new ATOM 0 HG21 VAL A 2 9.705 -0.533 6.153 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.537 -1.855 6.394 1.00 0.00 H new ATOM 0 HG23 VAL A 2 10.238 -2.072 6.871 1.00 0.00 H new ATOM 34 N PRO A 3 9.293 -4.500 2.435 1.00 0.00 N ATOM 35 CA PRO A 3 9.646 -5.079 1.151 1.00 0.00 C ATOM 36 C PRO A 3 10.366 -4.058 0.267 1.00 0.00 C ATOM 37 O PRO A 3 10.486 -2.890 0.634 1.00 0.00 O ATOM 38 CB PRO A 3 8.330 -5.554 0.558 1.00 0.00 C ATOM 39 CG PRO A 3 7.240 -4.811 1.314 1.00 0.00 C ATOM 40 CD PRO A 3 7.871 -4.191 2.550 1.00 0.00 C ATOM 0 HA PRO A 3 10.348 -5.907 1.243 1.00 0.00 H new ATOM 0 HB2 PRO A 3 8.282 -5.338 -0.509 1.00 0.00 H new ATOM 0 HB3 PRO A 3 8.218 -6.632 0.670 1.00 0.00 H new ATOM 0 HG2 PRO A 3 6.796 -4.040 0.684 1.00 0.00 H new ATOM 0 HG3 PRO A 3 6.438 -5.493 1.596 1.00 0.00 H new ATOM 0 HD2 PRO A 3 7.701 -3.115 2.584 1.00 0.00 H new ATOM 0 HD3 PRO A 3 7.447 -4.609 3.463 1.00 0.00 H new ATOM 48 N PRO A 4 10.838 -4.548 -0.910 1.00 0.00 N ATOM 49 CA PRO A 4 11.542 -3.691 -1.849 1.00 0.00 C ATOM 50 C PRO A 4 10.569 -2.766 -2.583 1.00 0.00 C ATOM 51 O PRO A 4 10.703 -1.545 -2.524 1.00 0.00 O ATOM 52 CB PRO A 4 12.273 -4.645 -2.780 1.00 0.00 C ATOM 53 CG PRO A 4 11.585 -5.991 -2.621 1.00 0.00 C ATOM 54 CD PRO A 4 10.713 -5.925 -1.378 1.00 0.00 C ATOM 0 HA PRO A 4 12.245 -3.017 -1.359 1.00 0.00 H new ATOM 0 HB2 PRO A 4 12.221 -4.299 -3.812 1.00 0.00 H new ATOM 0 HB3 PRO A 4 13.329 -4.713 -2.519 1.00 0.00 H new ATOM 0 HG2 PRO A 4 10.981 -6.217 -3.500 1.00 0.00 H new ATOM 0 HG3 PRO A 4 12.323 -6.788 -2.528 1.00 0.00 H new ATOM 0 HD2 PRO A 4 9.677 -6.173 -1.608 1.00 0.00 H new ATOM 0 HD3 PRO A 4 11.049 -6.633 -0.620 1.00 0.00 H new ATOM 62 N LYS A 5 9.612 -3.384 -3.259 1.00 0.00 N ATOM 63 CA LYS A 5 8.617 -2.631 -4.004 1.00 0.00 C ATOM 64 C LYS A 5 8.238 -1.375 -3.217 1.00 0.00 C ATOM 65 O LYS A 5 7.912 -0.345 -3.804 1.00 0.00 O ATOM 66 CB LYS A 5 7.422 -3.521 -4.353 1.00 0.00 C ATOM 67 CG LYS A 5 7.616 -4.190 -5.716 1.00 0.00 C ATOM 68 CD LYS A 5 7.827 -5.697 -5.562 1.00 0.00 C ATOM 69 CE LYS A 5 6.908 -6.479 -6.503 1.00 0.00 C ATOM 70 NZ LYS A 5 6.942 -7.923 -6.180 1.00 0.00 N ATOM 0 H LYS A 5 9.504 -4.397 -3.307 1.00 0.00 H new ATOM 0 HA LYS A 5 9.027 -2.298 -4.957 1.00 0.00 H new ATOM 0 HB2 LYS A 5 7.295 -4.283 -3.584 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.510 -2.924 -4.363 1.00 0.00 H new ATOM 0 HG2 LYS A 5 6.745 -4.004 -6.344 1.00 0.00 H new ATOM 0 HG3 LYS A 5 8.474 -3.749 -6.223 1.00 0.00 H new ATOM 0 HD2 LYS A 5 8.867 -5.946 -5.774 1.00 0.00 H new ATOM 0 HD3 LYS A 5 7.633 -5.991 -4.531 1.00 0.00 H new ATOM 0 HE2 LYS A 5 5.888 -6.105 -6.418 1.00 0.00 H new ATOM 0 HE3 LYS A 5 7.219 -6.324 -7.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 6.638 -8.472 -7.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 7.911 -8.198 -5.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 6.301 -8.116 -5.384 1.00 0.00 H new ATOM 84 N LEU A 6 8.295 -1.502 -1.899 1.00 0.00 N ATOM 85 CA LEU A 6 7.962 -0.390 -1.025 1.00 0.00 C ATOM 86 C LEU A 6 9.205 0.477 -0.815 1.00 0.00 C ATOM 87 O LEU A 6 9.259 1.614 -1.279 1.00 0.00 O ATOM 88 CB LEU A 6 7.340 -0.899 0.276 1.00 0.00 C ATOM 89 CG LEU A 6 6.445 0.091 1.024 1.00 0.00 C ATOM 90 CD1 LEU A 6 7.070 0.493 2.362 1.00 0.00 C ATOM 91 CD2 LEU A 6 6.125 1.308 0.153 1.00 0.00 C ATOM 0 H LEU A 6 8.567 -2.358 -1.415 1.00 0.00 H new ATOM 0 HA LEU A 6 7.205 0.244 -1.486 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.754 -1.790 0.051 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.144 -1.207 0.944 1.00 0.00 H new ATOM 0 HG LEU A 6 5.500 -0.404 1.246 1.00 0.00 H new ATOM 0 HD11 LEU A 6 6.414 1.197 2.873 1.00 0.00 H new ATOM 0 HD12 LEU A 6 7.204 -0.394 2.982 1.00 0.00 H new ATOM 0 HD13 LEU A 6 8.038 0.962 2.185 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.488 1.996 0.709 1.00 0.00 H new ATOM 0 HD22 LEU A 6 7.051 1.813 -0.121 1.00 0.00 H new ATOM 0 HD23 LEU A 6 5.608 0.983 -0.750 1.00 0.00 H new ATOM 103 N LYS A 7 10.174 -0.094 -0.114 1.00 0.00 N ATOM 104 CA LYS A 7 11.413 0.612 0.164 1.00 0.00 C ATOM 105 C LYS A 7 11.855 1.370 -1.089 1.00 0.00 C ATOM 106 O LYS A 7 12.478 2.426 -0.993 1.00 0.00 O ATOM 107 CB LYS A 7 12.470 -0.352 0.705 1.00 0.00 C ATOM 108 CG LYS A 7 13.634 0.410 1.342 1.00 0.00 C ATOM 109 CD LYS A 7 13.731 0.109 2.839 1.00 0.00 C ATOM 110 CE LYS A 7 14.966 0.772 3.452 1.00 0.00 C ATOM 111 NZ LYS A 7 15.466 -0.021 4.598 1.00 0.00 N ATOM 0 H LYS A 7 10.126 -1.038 0.270 1.00 0.00 H new ATOM 0 HA LYS A 7 11.261 1.353 0.948 1.00 0.00 H new ATOM 0 HB2 LYS A 7 12.018 -1.016 1.442 1.00 0.00 H new ATOM 0 HB3 LYS A 7 12.842 -0.981 -0.104 1.00 0.00 H new ATOM 0 HG2 LYS A 7 14.567 0.134 0.850 1.00 0.00 H new ATOM 0 HG3 LYS A 7 13.499 1.481 1.191 1.00 0.00 H new ATOM 0 HD2 LYS A 7 12.834 0.466 3.344 1.00 0.00 H new ATOM 0 HD3 LYS A 7 13.777 -0.969 2.995 1.00 0.00 H new ATOM 0 HE2 LYS A 7 15.748 0.865 2.698 1.00 0.00 H new ATOM 0 HE3 LYS A 7 14.719 1.781 3.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 16.304 0.443 5.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 14.724 -0.088 5.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 15.721 -0.976 4.274 1.00 0.00 H new ATOM 125 N GLN A 8 11.515 0.801 -2.236 1.00 0.00 N ATOM 126 CA GLN A 8 11.870 1.410 -3.507 1.00 0.00 C ATOM 127 C GLN A 8 11.135 2.741 -3.681 1.00 0.00 C ATOM 128 O GLN A 8 11.754 3.760 -3.983 1.00 0.00 O ATOM 129 CB GLN A 8 11.571 0.463 -4.671 1.00 0.00 C ATOM 130 CG GLN A 8 12.864 -0.095 -5.270 1.00 0.00 C ATOM 131 CD GLN A 8 13.058 0.396 -6.706 1.00 0.00 C ATOM 132 OE1 GLN A 8 12.185 0.999 -7.307 1.00 0.00 O ATOM 133 NE2 GLN A 8 14.249 0.103 -7.221 1.00 0.00 N ATOM 0 H GLN A 8 10.998 -0.075 -2.312 1.00 0.00 H new ATOM 0 HA GLN A 8 12.942 1.606 -3.507 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.943 -0.358 -4.325 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.009 0.992 -5.440 1.00 0.00 H new ATOM 0 HG2 GLN A 8 13.714 0.210 -4.659 1.00 0.00 H new ATOM 0 HG3 GLN A 8 12.836 -1.185 -5.255 1.00 0.00 H new ATOM 0 HE21 GLN A 8 14.935 -0.405 -6.663 1.00 0.00 H new ATOM 0 HE22 GLN A 8 14.476 0.386 -8.174 1.00 0.00 H new ATOM 142 N ALA A 9 9.826 2.688 -3.483 1.00 0.00 N ATOM 143 CA ALA A 9 9.001 3.877 -3.614 1.00 0.00 C ATOM 144 C ALA A 9 9.501 4.949 -2.644 1.00 0.00 C ATOM 145 O ALA A 9 9.739 6.089 -3.041 1.00 0.00 O ATOM 146 CB ALA A 9 7.535 3.511 -3.374 1.00 0.00 C ATOM 0 H ALA A 9 9.316 1.841 -3.233 1.00 0.00 H new ATOM 0 HA ALA A 9 9.074 4.285 -4.622 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.916 4.403 -3.472 1.00 0.00 H new ATOM 0 HB2 ALA A 9 7.221 2.769 -4.108 1.00 0.00 H new ATOM 0 HB3 ALA A 9 7.422 3.100 -2.371 1.00 0.00 H new ATOM 152 N LEU A 10 9.645 4.546 -1.390 1.00 0.00 N ATOM 153 CA LEU A 10 10.112 5.458 -0.359 1.00 0.00 C ATOM 154 C LEU A 10 11.494 5.989 -0.743 1.00 0.00 C ATOM 155 O LEU A 10 11.703 7.200 -0.801 1.00 0.00 O ATOM 156 CB LEU A 10 10.072 4.781 1.013 1.00 0.00 C ATOM 157 CG LEU A 10 8.680 4.474 1.569 1.00 0.00 C ATOM 158 CD1 LEU A 10 8.774 3.686 2.877 1.00 0.00 C ATOM 159 CD2 LEU A 10 7.858 5.754 1.728 1.00 0.00 C ATOM 0 H LEU A 10 9.446 3.600 -1.064 1.00 0.00 H new ATOM 0 HA LEU A 10 9.449 6.320 -0.283 1.00 0.00 H new ATOM 0 HB2 LEU A 10 10.631 3.847 0.952 1.00 0.00 H new ATOM 0 HB3 LEU A 10 10.594 5.419 1.726 1.00 0.00 H new ATOM 0 HG LEU A 10 8.157 3.843 0.850 1.00 0.00 H new ATOM 0 HD11 LEU A 10 7.771 3.481 3.251 1.00 0.00 H new ATOM 0 HD12 LEU A 10 9.294 2.745 2.698 1.00 0.00 H new ATOM 0 HD13 LEU A 10 9.324 4.270 3.615 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.873 5.507 2.125 1.00 0.00 H new ATOM 0 HD22 LEU A 10 8.367 6.430 2.415 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.747 6.238 0.758 1.00 0.00 H new ATOM 171 N GLU A 11 12.402 5.058 -0.995 1.00 0.00 N ATOM 172 CA GLU A 11 13.758 5.417 -1.372 1.00 0.00 C ATOM 173 C GLU A 11 13.742 6.380 -2.561 1.00 0.00 C ATOM 174 O GLU A 11 14.473 7.369 -2.574 1.00 0.00 O ATOM 175 CB GLU A 11 14.589 4.171 -1.686 1.00 0.00 C ATOM 176 CG GLU A 11 15.142 3.544 -0.405 1.00 0.00 C ATOM 177 CD GLU A 11 16.514 2.912 -0.653 1.00 0.00 C ATOM 178 OE1 GLU A 11 16.597 2.083 -1.585 1.00 0.00 O ATOM 179 OE2 GLU A 11 17.447 3.272 0.096 1.00 0.00 O ATOM 0 H GLU A 11 12.225 4.055 -0.945 1.00 0.00 H new ATOM 0 HA GLU A 11 14.227 5.922 -0.527 1.00 0.00 H new ATOM 0 HB2 GLU A 11 13.974 3.443 -2.215 1.00 0.00 H new ATOM 0 HB3 GLU A 11 15.412 4.436 -2.350 1.00 0.00 H new ATOM 0 HG2 GLU A 11 15.223 4.305 0.371 1.00 0.00 H new ATOM 0 HG3 GLU A 11 14.449 2.787 -0.038 1.00 0.00 H new ATOM 186 N LEU A 12 12.900 6.056 -3.531 1.00 0.00 N ATOM 187 CA LEU A 12 12.779 6.880 -4.722 1.00 0.00 C ATOM 188 C LEU A 12 12.160 8.227 -4.345 1.00 0.00 C ATOM 189 O LEU A 12 12.533 9.262 -4.895 1.00 0.00 O ATOM 190 CB LEU A 12 12.008 6.134 -5.813 1.00 0.00 C ATOM 191 CG LEU A 12 11.576 6.969 -7.020 1.00 0.00 C ATOM 192 CD1 LEU A 12 12.788 7.427 -7.833 1.00 0.00 C ATOM 193 CD2 LEU A 12 10.563 6.209 -7.879 1.00 0.00 C ATOM 0 H LEU A 12 12.295 5.235 -3.517 1.00 0.00 H new ATOM 0 HA LEU A 12 13.763 7.087 -5.143 1.00 0.00 H new ATOM 0 HB2 LEU A 12 12.627 5.310 -6.169 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.118 5.693 -5.364 1.00 0.00 H new ATOM 0 HG LEU A 12 11.078 7.866 -6.653 1.00 0.00 H new ATOM 0 HD11 LEU A 12 12.452 8.018 -8.685 1.00 0.00 H new ATOM 0 HD12 LEU A 12 13.440 8.034 -7.204 1.00 0.00 H new ATOM 0 HD13 LEU A 12 13.337 6.556 -8.190 1.00 0.00 H new ATOM 0 HD21 LEU A 12 10.273 6.825 -8.730 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.012 5.283 -8.238 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.681 5.977 -7.282 1.00 0.00 H new ATOM 205 N PHE A 13 11.225 8.171 -3.408 1.00 0.00 N ATOM 206 CA PHE A 13 10.551 9.374 -2.950 1.00 0.00 C ATOM 207 C PHE A 13 11.559 10.407 -2.440 1.00 0.00 C ATOM 208 O PHE A 13 11.682 11.492 -3.007 1.00 0.00 O ATOM 209 CB PHE A 13 9.634 8.962 -1.796 1.00 0.00 C ATOM 210 CG PHE A 13 8.528 9.974 -1.489 1.00 0.00 C ATOM 211 CD1 PHE A 13 7.616 10.296 -2.445 1.00 0.00 C ATOM 212 CD2 PHE A 13 8.457 10.550 -0.259 1.00 0.00 C ATOM 213 CE1 PHE A 13 6.590 11.234 -2.159 1.00 0.00 C ATOM 214 CE2 PHE A 13 7.431 11.489 0.026 1.00 0.00 C ATOM 215 CZ PHE A 13 6.519 11.811 -0.929 1.00 0.00 C ATOM 0 H PHE A 13 10.918 7.311 -2.953 1.00 0.00 H new ATOM 0 HA PHE A 13 9.994 9.824 -3.772 1.00 0.00 H new ATOM 0 HB2 PHE A 13 9.178 8.001 -2.033 1.00 0.00 H new ATOM 0 HB3 PHE A 13 10.238 8.816 -0.900 1.00 0.00 H new ATOM 0 HD1 PHE A 13 7.672 9.838 -3.422 1.00 0.00 H new ATOM 0 HD2 PHE A 13 9.181 10.293 0.500 1.00 0.00 H new ATOM 0 HE1 PHE A 13 5.865 11.490 -2.918 1.00 0.00 H new ATOM 0 HE2 PHE A 13 7.375 11.948 1.002 1.00 0.00 H new ATOM 0 HZ PHE A 13 5.738 12.525 -0.711 1.00 0.00 H new ATOM 225 N LYS A 14 12.254 10.033 -1.377 1.00 0.00 N ATOM 226 CA LYS A 14 13.248 10.913 -0.784 1.00 0.00 C ATOM 227 C LYS A 14 14.287 11.287 -1.843 1.00 0.00 C ATOM 228 O LYS A 14 14.953 12.315 -1.728 1.00 0.00 O ATOM 229 CB LYS A 14 13.849 10.275 0.469 1.00 0.00 C ATOM 230 CG LYS A 14 14.987 11.132 1.028 1.00 0.00 C ATOM 231 CD LYS A 14 15.880 10.315 1.964 1.00 0.00 C ATOM 232 CE LYS A 14 17.247 10.055 1.329 1.00 0.00 C ATOM 233 NZ LYS A 14 18.324 10.210 2.333 1.00 0.00 N ATOM 0 H LYS A 14 12.149 9.132 -0.910 1.00 0.00 H new ATOM 0 HA LYS A 14 12.785 11.841 -0.449 1.00 0.00 H new ATOM 0 HB2 LYS A 14 13.075 10.153 1.227 1.00 0.00 H new ATOM 0 HB3 LYS A 14 14.222 9.279 0.231 1.00 0.00 H new ATOM 0 HG2 LYS A 14 15.583 11.531 0.207 1.00 0.00 H new ATOM 0 HG3 LYS A 14 14.574 11.985 1.566 1.00 0.00 H new ATOM 0 HD2 LYS A 14 16.008 10.847 2.907 1.00 0.00 H new ATOM 0 HD3 LYS A 14 15.397 9.366 2.197 1.00 0.00 H new ATOM 0 HE2 LYS A 14 17.274 9.049 0.910 1.00 0.00 H new ATOM 0 HE3 LYS A 14 17.409 10.748 0.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 19.245 10.030 1.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 18.307 11.178 2.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 18.177 9.531 3.107 1.00 0.00 H new ATOM 247 N SER A 15 14.392 10.434 -2.851 1.00 0.00 N ATOM 248 CA SER A 15 15.339 10.662 -3.929 1.00 0.00 C ATOM 249 C SER A 15 14.720 11.583 -4.982 1.00 0.00 C ATOM 250 O SER A 15 15.437 12.251 -5.726 1.00 0.00 O ATOM 251 CB SER A 15 15.775 9.342 -4.568 1.00 0.00 C ATOM 252 OG SER A 15 17.024 9.463 -5.243 1.00 0.00 O ATOM 0 H SER A 15 13.837 9.583 -2.944 1.00 0.00 H new ATOM 0 HA SER A 15 16.224 11.141 -3.511 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.852 8.574 -3.798 1.00 0.00 H new ATOM 0 HB3 SER A 15 15.012 9.011 -5.273 1.00 0.00 H new ATOM 0 HG SER A 15 17.268 8.599 -5.636 1.00 0.00 H new ATOM 258 N LEU A 16 13.395 11.588 -5.013 1.00 0.00 N ATOM 259 CA LEU A 16 12.672 12.416 -5.963 1.00 0.00 C ATOM 260 C LEU A 16 12.718 13.874 -5.502 1.00 0.00 C ATOM 261 O LEU A 16 13.000 14.152 -4.337 1.00 0.00 O ATOM 262 CB LEU A 16 11.253 11.881 -6.168 1.00 0.00 C ATOM 263 CG LEU A 16 11.108 10.730 -7.166 1.00 0.00 C ATOM 264 CD1 LEU A 16 9.668 10.216 -7.204 1.00 0.00 C ATOM 265 CD2 LEU A 16 11.607 11.142 -8.553 1.00 0.00 C ATOM 0 H LEU A 16 12.804 11.032 -4.395 1.00 0.00 H new ATOM 0 HA LEU A 16 13.149 12.376 -6.942 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.868 11.550 -5.203 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.620 12.704 -6.499 1.00 0.00 H new ATOM 0 HG LEU A 16 11.735 9.904 -6.830 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.592 9.398 -7.921 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.383 9.858 -6.215 1.00 0.00 H new ATOM 0 HD13 LEU A 16 9.001 11.024 -7.504 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.493 10.306 -9.244 1.00 0.00 H new ATOM 0 HD22 LEU A 16 11.025 11.991 -8.912 1.00 0.00 H new ATOM 0 HD23 LEU A 16 12.659 11.422 -8.493 1.00 0.00 H new ATOM 277 N PRO A 17 12.431 14.791 -6.464 1.00 0.00 N ATOM 278 CA PRO A 17 12.437 16.213 -6.168 1.00 0.00 C ATOM 279 C PRO A 17 11.196 16.613 -5.369 1.00 0.00 C ATOM 280 O PRO A 17 10.098 16.125 -5.635 1.00 0.00 O ATOM 281 CB PRO A 17 12.516 16.896 -7.524 1.00 0.00 C ATOM 282 CG PRO A 17 12.083 15.854 -8.542 1.00 0.00 C ATOM 283 CD PRO A 17 12.094 14.498 -7.854 1.00 0.00 C ATOM 0 HA PRO A 17 13.276 16.508 -5.538 1.00 0.00 H new ATOM 0 HB2 PRO A 17 11.866 17.770 -7.559 1.00 0.00 H new ATOM 0 HB3 PRO A 17 13.529 17.244 -7.728 1.00 0.00 H new ATOM 0 HG2 PRO A 17 11.087 16.082 -8.921 1.00 0.00 H new ATOM 0 HG3 PRO A 17 12.758 15.853 -9.398 1.00 0.00 H new ATOM 0 HD2 PRO A 17 11.124 14.007 -7.931 1.00 0.00 H new ATOM 0 HD3 PRO A 17 12.827 13.830 -8.307 1.00 0.00 H new ATOM 291 N LYS A 18 11.411 17.496 -4.405 1.00 0.00 N ATOM 292 CA LYS A 18 10.323 17.966 -3.565 1.00 0.00 C ATOM 293 C LYS A 18 9.050 18.088 -4.406 1.00 0.00 C ATOM 294 O LYS A 18 8.103 17.326 -4.218 1.00 0.00 O ATOM 295 CB LYS A 18 10.716 19.263 -2.854 1.00 0.00 C ATOM 296 CG LYS A 18 9.548 19.817 -2.036 1.00 0.00 C ATOM 297 CD LYS A 18 10.019 20.915 -1.081 1.00 0.00 C ATOM 298 CE LYS A 18 9.436 20.711 0.319 1.00 0.00 C ATOM 299 NZ LYS A 18 8.352 21.685 0.575 1.00 0.00 N ATOM 0 H LYS A 18 12.323 17.898 -4.187 1.00 0.00 H new ATOM 0 HA LYS A 18 10.115 17.246 -2.774 1.00 0.00 H new ATOM 0 HB2 LYS A 18 11.568 19.079 -2.199 1.00 0.00 H new ATOM 0 HB3 LYS A 18 11.033 20.003 -3.589 1.00 0.00 H new ATOM 0 HG2 LYS A 18 8.787 20.215 -2.707 1.00 0.00 H new ATOM 0 HG3 LYS A 18 9.083 19.011 -1.468 1.00 0.00 H new ATOM 0 HD2 LYS A 18 11.108 20.914 -1.029 1.00 0.00 H new ATOM 0 HD3 LYS A 18 9.719 21.890 -1.465 1.00 0.00 H new ATOM 0 HE2 LYS A 18 9.051 19.696 0.415 1.00 0.00 H new ATOM 0 HE3 LYS A 18 10.221 20.826 1.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 7.967 21.533 1.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 8.730 22.651 0.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 7.596 21.556 -0.128 1.00 0.00 H new ATOM 313 N GLU A 19 9.070 19.052 -5.315 1.00 0.00 N ATOM 314 CA GLU A 19 7.930 19.283 -6.185 1.00 0.00 C ATOM 315 C GLU A 19 7.228 17.961 -6.503 1.00 0.00 C ATOM 316 O GLU A 19 6.008 17.858 -6.388 1.00 0.00 O ATOM 317 CB GLU A 19 8.355 20.000 -7.468 1.00 0.00 C ATOM 318 CG GLU A 19 7.422 19.648 -8.628 1.00 0.00 C ATOM 319 CD GLU A 19 5.992 20.109 -8.341 1.00 0.00 C ATOM 320 OE1 GLU A 19 5.642 20.158 -7.142 1.00 0.00 O ATOM 321 OE2 GLU A 19 5.281 20.401 -9.327 1.00 0.00 O ATOM 0 H GLU A 19 9.858 19.682 -5.468 1.00 0.00 H new ATOM 0 HA GLU A 19 7.225 19.930 -5.663 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.348 21.078 -7.306 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.378 19.722 -7.722 1.00 0.00 H new ATOM 0 HG2 GLU A 19 7.782 20.117 -9.544 1.00 0.00 H new ATOM 0 HG3 GLU A 19 7.434 18.571 -8.795 1.00 0.00 H new ATOM 328 N LEU A 20 8.030 16.982 -6.897 1.00 0.00 N ATOM 329 CA LEU A 20 7.501 15.671 -7.232 1.00 0.00 C ATOM 330 C LEU A 20 7.071 14.956 -5.950 1.00 0.00 C ATOM 331 O LEU A 20 5.964 14.425 -5.872 1.00 0.00 O ATOM 332 CB LEU A 20 8.513 14.882 -8.066 1.00 0.00 C ATOM 333 CG LEU A 20 8.533 15.191 -9.564 1.00 0.00 C ATOM 334 CD1 LEU A 20 8.742 16.686 -9.813 1.00 0.00 C ATOM 335 CD2 LEU A 20 9.578 14.338 -10.286 1.00 0.00 C ATOM 0 H LEU A 20 9.042 17.071 -6.992 1.00 0.00 H new ATOM 0 HA LEU A 20 6.613 15.767 -7.857 1.00 0.00 H new ATOM 0 HB2 LEU A 20 9.509 15.067 -7.664 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.310 13.819 -7.937 1.00 0.00 H new ATOM 0 HG LEU A 20 7.560 14.928 -9.980 1.00 0.00 H new ATOM 0 HD11 LEU A 20 8.752 16.878 -10.886 1.00 0.00 H new ATOM 0 HD12 LEU A 20 7.931 17.249 -9.351 1.00 0.00 H new ATOM 0 HD13 LEU A 20 9.692 16.998 -9.380 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.571 14.577 -11.349 1.00 0.00 H new ATOM 0 HD22 LEU A 20 10.565 14.546 -9.873 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.343 13.282 -10.150 1.00 0.00 H new ATOM 347 N ARG A 21 7.968 14.966 -4.975 1.00 0.00 N ATOM 348 CA ARG A 21 7.695 14.325 -3.700 1.00 0.00 C ATOM 349 C ARG A 21 6.234 14.540 -3.300 1.00 0.00 C ATOM 350 O ARG A 21 5.635 13.689 -2.643 1.00 0.00 O ATOM 351 CB ARG A 21 8.605 14.877 -2.600 1.00 0.00 C ATOM 352 CG ARG A 21 10.030 14.340 -2.747 1.00 0.00 C ATOM 353 CD ARG A 21 10.768 14.370 -1.407 1.00 0.00 C ATOM 354 NE ARG A 21 12.230 14.327 -1.633 1.00 0.00 N ATOM 355 CZ ARG A 21 13.140 14.745 -0.742 1.00 0.00 C ATOM 356 NH1 ARG A 21 12.745 15.239 0.439 1.00 0.00 N ATOM 357 NH2 ARG A 21 14.446 14.668 -1.033 1.00 0.00 N ATOM 0 H ARG A 21 8.885 15.408 -5.042 1.00 0.00 H new ATOM 0 HA ARG A 21 7.890 13.259 -3.816 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.616 15.966 -2.645 1.00 0.00 H new ATOM 0 HB3 ARG A 21 8.208 14.602 -1.623 1.00 0.00 H new ATOM 0 HG2 ARG A 21 10.000 13.319 -3.127 1.00 0.00 H new ATOM 0 HG3 ARG A 21 10.574 14.937 -3.479 1.00 0.00 H new ATOM 0 HD2 ARG A 21 10.503 15.273 -0.857 1.00 0.00 H new ATOM 0 HD3 ARG A 21 10.461 13.522 -0.795 1.00 0.00 H new ATOM 0 HE ARG A 21 12.566 13.956 -2.522 1.00 0.00 H new ATOM 0 HH11 ARG A 21 11.751 15.297 0.661 1.00 0.00 H new ATOM 0 HH12 ARG A 21 13.438 15.557 1.116 1.00 0.00 H new ATOM 0 HH21 ARG A 21 14.747 14.292 -1.932 1.00 0.00 H new ATOM 0 HH22 ARG A 21 15.139 14.986 -0.356 1.00 0.00 H new ATOM 371 N SER A 22 5.703 15.681 -3.712 1.00 0.00 N ATOM 372 CA SER A 22 4.323 16.019 -3.405 1.00 0.00 C ATOM 373 C SER A 22 3.401 15.515 -4.517 1.00 0.00 C ATOM 374 O SER A 22 2.327 14.982 -4.243 1.00 0.00 O ATOM 375 CB SER A 22 4.154 17.528 -3.218 1.00 0.00 C ATOM 376 OG SER A 22 3.349 17.838 -2.084 1.00 0.00 O ATOM 0 H SER A 22 6.203 16.384 -4.256 1.00 0.00 H new ATOM 0 HA SER A 22 4.052 15.532 -2.468 1.00 0.00 H new ATOM 0 HB2 SER A 22 5.134 17.991 -3.105 1.00 0.00 H new ATOM 0 HB3 SER A 22 3.701 17.956 -4.112 1.00 0.00 H new ATOM 0 HG SER A 22 3.924 18.113 -1.340 1.00 0.00 H new ATOM 382 N GLN A 23 3.855 15.701 -5.748 1.00 0.00 N ATOM 383 CA GLN A 23 3.084 15.272 -6.902 1.00 0.00 C ATOM 384 C GLN A 23 2.903 13.752 -6.884 1.00 0.00 C ATOM 385 O GLN A 23 1.783 13.256 -6.998 1.00 0.00 O ATOM 386 CB GLN A 23 3.745 15.730 -8.204 1.00 0.00 C ATOM 387 CG GLN A 23 4.085 17.221 -8.151 1.00 0.00 C ATOM 388 CD GLN A 23 3.160 18.026 -9.065 1.00 0.00 C ATOM 389 OE1 GLN A 23 2.053 18.392 -8.705 1.00 0.00 O ATOM 390 NE2 GLN A 23 3.674 18.282 -10.265 1.00 0.00 N ATOM 0 H GLN A 23 4.747 16.143 -5.971 1.00 0.00 H new ATOM 0 HA GLN A 23 2.099 15.736 -6.850 1.00 0.00 H new ATOM 0 HB2 GLN A 23 4.653 15.152 -8.378 1.00 0.00 H new ATOM 0 HB3 GLN A 23 3.077 15.535 -9.043 1.00 0.00 H new ATOM 0 HG2 GLN A 23 3.995 17.582 -7.127 1.00 0.00 H new ATOM 0 HG3 GLN A 23 5.122 17.372 -8.452 1.00 0.00 H new ATOM 0 HE21 GLN A 23 4.607 17.946 -10.502 1.00 0.00 H new ATOM 0 HE22 GLN A 23 3.135 18.814 -10.948 1.00 0.00 H new ATOM 399 N VAL A 24 4.021 13.056 -6.741 1.00 0.00 N ATOM 400 CA VAL A 24 4.000 11.604 -6.707 1.00 0.00 C ATOM 401 C VAL A 24 2.862 11.136 -5.798 1.00 0.00 C ATOM 402 O VAL A 24 2.026 10.332 -6.207 1.00 0.00 O ATOM 403 CB VAL A 24 5.367 11.070 -6.276 1.00 0.00 C ATOM 404 CG1 VAL A 24 5.267 9.615 -5.816 1.00 0.00 C ATOM 405 CG2 VAL A 24 6.394 11.221 -7.401 1.00 0.00 C ATOM 0 H VAL A 24 4.948 13.471 -6.647 1.00 0.00 H new ATOM 0 HA VAL A 24 3.808 11.202 -7.702 1.00 0.00 H new ATOM 0 HB VAL A 24 5.708 11.666 -5.429 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.253 9.260 -5.515 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.583 9.547 -4.970 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.894 8.999 -6.635 1.00 0.00 H new ATOM 0 HG21 VAL A 24 7.357 10.834 -7.069 1.00 0.00 H new ATOM 0 HG22 VAL A 24 6.060 10.662 -8.276 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.497 12.275 -7.661 1.00 0.00 H new ATOM 415 N LEU A 25 2.866 11.661 -4.581 1.00 0.00 N ATOM 416 CA LEU A 25 1.844 11.307 -3.610 1.00 0.00 C ATOM 417 C LEU A 25 0.465 11.417 -4.264 1.00 0.00 C ATOM 418 O LEU A 25 -0.372 10.530 -4.109 1.00 0.00 O ATOM 419 CB LEU A 25 1.993 12.152 -2.343 1.00 0.00 C ATOM 420 CG LEU A 25 3.243 11.884 -1.502 1.00 0.00 C ATOM 421 CD1 LEU A 25 3.213 12.692 -0.203 1.00 0.00 C ATOM 422 CD2 LEU A 25 3.420 10.387 -1.243 1.00 0.00 C ATOM 0 H LEU A 25 3.560 12.328 -4.245 1.00 0.00 H new ATOM 0 HA LEU A 25 1.964 10.272 -3.291 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.990 13.204 -2.629 1.00 0.00 H new ATOM 0 HB3 LEU A 25 1.116 11.990 -1.717 1.00 0.00 H new ATOM 0 HG LEU A 25 4.113 12.217 -2.068 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.113 12.483 0.376 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.171 13.756 -0.437 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.334 12.413 0.379 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.316 10.225 -0.643 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.551 10.005 -0.708 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.520 9.863 -2.193 1.00 0.00 H new ATOM 434 N LEU A 26 0.272 12.515 -4.981 1.00 0.00 N ATOM 435 CA LEU A 26 -0.991 12.753 -5.659 1.00 0.00 C ATOM 436 C LEU A 26 -1.253 11.620 -6.653 1.00 0.00 C ATOM 437 O LEU A 26 -2.266 10.928 -6.558 1.00 0.00 O ATOM 438 CB LEU A 26 -1.004 14.144 -6.295 1.00 0.00 C ATOM 439 CG LEU A 26 -1.680 15.249 -5.480 1.00 0.00 C ATOM 440 CD1 LEU A 26 -1.545 16.604 -6.176 1.00 0.00 C ATOM 441 CD2 LEU A 26 -3.139 14.897 -5.185 1.00 0.00 C ATOM 0 H LEU A 26 0.969 13.249 -5.107 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.814 12.747 -4.944 1.00 0.00 H new ATOM 0 HB2 LEU A 26 0.026 14.442 -6.490 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.504 14.075 -7.261 1.00 0.00 H new ATOM 0 HG LEU A 26 -1.168 15.329 -4.521 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.034 17.372 -5.576 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.489 16.851 -6.291 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -2.015 16.557 -7.158 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.596 15.698 -4.605 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.680 14.774 -6.123 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.181 13.968 -4.617 1.00 0.00 H new ATOM 453 N GLU A 27 -0.322 11.464 -7.583 1.00 0.00 N ATOM 454 CA GLU A 27 -0.440 10.427 -8.593 1.00 0.00 C ATOM 455 C GLU A 27 -0.816 9.093 -7.944 1.00 0.00 C ATOM 456 O GLU A 27 -1.806 8.471 -8.325 1.00 0.00 O ATOM 457 CB GLU A 27 0.854 10.298 -9.400 1.00 0.00 C ATOM 458 CG GLU A 27 1.375 11.672 -9.824 1.00 0.00 C ATOM 459 CD GLU A 27 1.627 11.721 -11.333 1.00 0.00 C ATOM 460 OE1 GLU A 27 2.520 10.971 -11.783 1.00 0.00 O ATOM 461 OE2 GLU A 27 0.922 12.507 -12.001 1.00 0.00 O ATOM 0 H GLU A 27 0.517 12.039 -7.658 1.00 0.00 H new ATOM 0 HA GLU A 27 -1.234 10.709 -9.284 1.00 0.00 H new ATOM 0 HB2 GLU A 27 1.610 9.787 -8.803 1.00 0.00 H new ATOM 0 HB3 GLU A 27 0.676 9.684 -10.283 1.00 0.00 H new ATOM 0 HG2 GLU A 27 0.653 12.440 -9.547 1.00 0.00 H new ATOM 0 HG3 GLU A 27 2.299 11.895 -9.290 1.00 0.00 H new ATOM 468 N TYR A 28 -0.006 8.695 -6.973 1.00 0.00 N ATOM 469 CA TYR A 28 -0.242 7.447 -6.267 1.00 0.00 C ATOM 470 C TYR A 28 -1.733 7.248 -5.988 1.00 0.00 C ATOM 471 O TYR A 28 -2.275 6.170 -6.228 1.00 0.00 O ATOM 472 CB TYR A 28 0.502 7.569 -4.936 1.00 0.00 C ATOM 473 CG TYR A 28 1.939 7.046 -4.976 1.00 0.00 C ATOM 474 CD1 TYR A 28 2.563 6.834 -6.189 1.00 0.00 C ATOM 475 CD2 TYR A 28 2.612 6.786 -3.800 1.00 0.00 C ATOM 476 CE1 TYR A 28 3.916 6.342 -6.228 1.00 0.00 C ATOM 477 CE2 TYR A 28 3.965 6.294 -3.838 1.00 0.00 C ATOM 478 CZ TYR A 28 4.550 6.096 -5.050 1.00 0.00 C ATOM 479 OH TYR A 28 5.828 5.632 -5.086 1.00 0.00 O ATOM 0 H TYR A 28 0.814 9.215 -6.659 1.00 0.00 H new ATOM 0 HA TYR A 28 0.100 6.599 -6.861 1.00 0.00 H new ATOM 0 HB2 TYR A 28 0.516 8.616 -4.634 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.051 7.024 -4.171 1.00 0.00 H new ATOM 0 HD1 TYR A 28 2.036 7.037 -7.110 1.00 0.00 H new ATOM 0 HD2 TYR A 28 2.124 6.951 -2.851 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.415 6.172 -7.170 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.503 6.087 -2.925 1.00 0.00 H new ATOM 0 HH TYR A 28 5.827 4.694 -5.368 1.00 0.00 H new ATOM 489 N ALA A 29 -2.355 8.305 -5.485 1.00 0.00 N ATOM 490 CA ALA A 29 -3.772 8.260 -5.171 1.00 0.00 C ATOM 491 C ALA A 29 -4.564 7.967 -6.447 1.00 0.00 C ATOM 492 O ALA A 29 -5.499 7.167 -6.432 1.00 0.00 O ATOM 493 CB ALA A 29 -4.192 9.576 -4.514 1.00 0.00 C ATOM 0 H ALA A 29 -1.903 9.198 -5.287 1.00 0.00 H new ATOM 0 HA ALA A 29 -3.982 7.460 -4.461 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -5.256 9.542 -4.278 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -3.622 9.723 -3.597 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -3.998 10.402 -5.198 1.00 0.00 H new ATOM 499 N ALA A 30 -4.161 8.629 -7.521 1.00 0.00 N ATOM 500 CA ALA A 30 -4.821 8.450 -8.803 1.00 0.00 C ATOM 501 C ALA A 30 -4.692 6.989 -9.238 1.00 0.00 C ATOM 502 O ALA A 30 -5.457 6.518 -10.078 1.00 0.00 O ATOM 503 CB ALA A 30 -4.223 9.418 -9.825 1.00 0.00 C ATOM 0 H ALA A 30 -3.385 9.291 -7.530 1.00 0.00 H new ATOM 0 HA ALA A 30 -5.884 8.677 -8.723 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -4.718 9.284 -10.787 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -4.367 10.443 -9.483 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -3.157 9.218 -9.935 1.00 0.00 H new ATOM 509 N LYS A 31 -3.718 6.313 -8.647 1.00 0.00 N ATOM 510 CA LYS A 31 -3.479 4.915 -8.963 1.00 0.00 C ATOM 511 C LYS A 31 -4.091 4.037 -7.870 1.00 0.00 C ATOM 512 O LYS A 31 -3.510 3.023 -7.485 1.00 0.00 O ATOM 513 CB LYS A 31 -1.986 4.664 -9.189 1.00 0.00 C ATOM 514 CG LYS A 31 -1.520 5.282 -10.509 1.00 0.00 C ATOM 515 CD LYS A 31 -0.792 6.606 -10.268 1.00 0.00 C ATOM 516 CE LYS A 31 0.599 6.590 -10.905 1.00 0.00 C ATOM 517 NZ LYS A 31 0.496 6.434 -12.373 1.00 0.00 N ATOM 0 H LYS A 31 -3.085 6.707 -7.951 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.969 4.647 -9.899 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.413 5.087 -8.363 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -1.791 3.592 -9.196 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.858 4.588 -11.026 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -2.378 5.448 -11.160 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -1.376 7.427 -10.683 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -0.703 6.787 -9.197 1.00 0.00 H new ATOM 0 HE2 LYS A 31 1.125 7.515 -10.668 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.187 5.773 -10.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 1.365 6.788 -12.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 0.370 5.429 -12.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -0.320 6.976 -12.723 1.00 0.00 H new ATOM 531 N VAL A 32 -5.255 4.459 -7.400 1.00 0.00 N ATOM 532 CA VAL A 32 -5.953 3.724 -6.358 1.00 0.00 C ATOM 533 C VAL A 32 -7.344 3.333 -6.860 1.00 0.00 C ATOM 534 O VAL A 32 -8.289 4.113 -6.752 1.00 0.00 O ATOM 535 CB VAL A 32 -5.991 4.550 -5.071 1.00 0.00 C ATOM 536 CG1 VAL A 32 -6.876 3.881 -4.017 1.00 0.00 C ATOM 537 CG2 VAL A 32 -4.580 4.790 -4.531 1.00 0.00 C ATOM 0 H VAL A 32 -5.733 5.301 -7.721 1.00 0.00 H new ATOM 0 HA VAL A 32 -5.423 2.802 -6.120 1.00 0.00 H new ATOM 0 HB VAL A 32 -6.427 5.520 -5.308 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -6.886 4.488 -3.112 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -7.891 3.786 -4.402 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -6.482 2.891 -3.786 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -4.636 5.380 -3.616 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -4.104 3.833 -4.317 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -3.993 5.329 -5.274 1.00 0.00 H new ATOM 547 N PRO A 33 -7.429 2.093 -7.412 1.00 0.00 N ATOM 548 CA PRO A 33 -8.689 1.589 -7.931 1.00 0.00 C ATOM 549 C PRO A 33 -9.628 1.184 -6.792 1.00 0.00 C ATOM 550 O PRO A 33 -9.179 0.911 -5.680 1.00 0.00 O ATOM 551 CB PRO A 33 -8.308 0.424 -8.829 1.00 0.00 C ATOM 552 CG PRO A 33 -6.899 0.025 -8.419 1.00 0.00 C ATOM 553 CD PRO A 33 -6.331 1.141 -7.557 1.00 0.00 C ATOM 0 HA PRO A 33 -9.244 2.341 -8.492 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.001 -0.408 -8.705 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -8.342 0.713 -9.879 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -6.914 -0.914 -7.866 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -6.275 -0.133 -9.299 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -6.003 0.765 -6.588 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -5.465 1.604 -8.029 1.00 0.00 H new ATOM 561 N PRO A 34 -10.948 1.157 -7.118 1.00 0.00 N ATOM 562 CA PRO A 34 -11.954 0.790 -6.136 1.00 0.00 C ATOM 563 C PRO A 34 -11.949 -0.720 -5.884 1.00 0.00 C ATOM 564 O PRO A 34 -11.521 -1.494 -6.739 1.00 0.00 O ATOM 565 CB PRO A 34 -13.268 1.292 -6.712 1.00 0.00 C ATOM 566 CG PRO A 34 -13.018 1.504 -8.196 1.00 0.00 C ATOM 567 CD PRO A 34 -11.516 1.474 -8.425 1.00 0.00 C ATOM 0 HA PRO A 34 -11.768 1.233 -5.158 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -14.067 0.569 -6.550 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -13.576 2.220 -6.231 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -13.509 0.726 -8.781 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -13.435 2.457 -8.521 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -11.244 0.724 -9.168 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -11.152 2.433 -8.793 1.00 0.00 H new ATOM 575 N PRO A 35 -12.443 -1.102 -4.676 1.00 0.00 N ATOM 576 CA PRO A 35 -12.499 -2.505 -4.301 1.00 0.00 C ATOM 577 C PRO A 35 -13.636 -3.222 -5.032 1.00 0.00 C ATOM 578 O PRO A 35 -14.489 -2.580 -5.643 1.00 0.00 O ATOM 579 CB PRO A 35 -12.673 -2.502 -2.791 1.00 0.00 C ATOM 580 CG PRO A 35 -13.171 -1.112 -2.432 1.00 0.00 C ATOM 581 CD PRO A 35 -12.958 -0.213 -3.639 1.00 0.00 C ATOM 0 HA PRO A 35 -11.600 -3.052 -4.584 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -13.386 -3.265 -2.478 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -11.731 -2.721 -2.289 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -14.226 -1.143 -2.161 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -12.631 -0.725 -1.568 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -13.889 0.260 -3.950 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -12.252 0.587 -3.417 1.00 0.00 H new ATOM 589 N PRO A 36 -13.611 -4.579 -4.943 1.00 0.00 N ATOM 590 CA PRO A 36 -14.629 -5.391 -5.588 1.00 0.00 C ATOM 591 C PRO A 36 -15.949 -5.330 -4.817 1.00 0.00 C ATOM 592 O PRO A 36 -15.964 -5.010 -3.629 1.00 0.00 O ATOM 593 CB PRO A 36 -14.038 -6.790 -5.646 1.00 0.00 C ATOM 594 CG PRO A 36 -12.915 -6.811 -4.622 1.00 0.00 C ATOM 595 CD PRO A 36 -12.616 -5.374 -4.228 1.00 0.00 C ATOM 0 HA PRO A 36 -14.878 -5.037 -6.588 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -14.792 -7.542 -5.414 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -13.661 -7.014 -6.644 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -13.206 -7.394 -3.748 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -12.027 -7.285 -5.039 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -12.697 -5.234 -3.150 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -11.603 -5.088 -4.511 1.00 0.00 H new ATOM 603 N PRO A 37 -17.054 -5.652 -5.542 1.00 0.00 N ATOM 604 CA PRO A 37 -18.375 -5.637 -4.938 1.00 0.00 C ATOM 605 C PRO A 37 -18.576 -6.851 -4.029 1.00 0.00 C ATOM 606 O PRO A 37 -18.637 -7.984 -4.504 1.00 0.00 O ATOM 607 CB PRO A 37 -19.343 -5.606 -6.110 1.00 0.00 C ATOM 608 CG PRO A 37 -18.548 -6.072 -7.319 1.00 0.00 C ATOM 609 CD PRO A 37 -17.074 -6.036 -6.950 1.00 0.00 C ATOM 0 HA PRO A 37 -18.530 -4.776 -4.287 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -20.197 -6.259 -5.929 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -19.737 -4.602 -6.265 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -18.845 -7.081 -7.605 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -18.743 -5.427 -8.176 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -16.604 -7.008 -7.102 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -16.529 -5.319 -7.564 1.00 0.00 H new ATOM 617 N GLY A 38 -18.673 -6.573 -2.737 1.00 0.00 N ATOM 618 CA GLY A 38 -18.866 -7.628 -1.757 1.00 0.00 C ATOM 619 C GLY A 38 -17.864 -7.500 -0.609 1.00 0.00 C ATOM 620 O GLY A 38 -18.255 -7.385 0.552 1.00 0.00 O ATOM 0 H GLY A 38 -18.622 -5.632 -2.346 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -19.882 -7.583 -1.364 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -18.752 -8.600 -2.237 1.00 0.00 H new ATOM 624 N VAL A 39 -16.590 -7.524 -0.972 1.00 0.00 N ATOM 625 CA VAL A 39 -15.528 -7.412 0.013 1.00 0.00 C ATOM 626 C VAL A 39 -15.923 -6.375 1.067 1.00 0.00 C ATOM 627 O VAL A 39 -16.526 -5.354 0.742 1.00 0.00 O ATOM 628 CB VAL A 39 -14.203 -7.085 -0.679 1.00 0.00 C ATOM 629 CG1 VAL A 39 -14.259 -5.710 -1.348 1.00 0.00 C ATOM 630 CG2 VAL A 39 -13.035 -7.170 0.304 1.00 0.00 C ATOM 0 H VAL A 39 -16.269 -7.619 -1.936 1.00 0.00 H new ATOM 0 HA VAL A 39 -15.384 -8.362 0.528 1.00 0.00 H new ATOM 0 HB VAL A 39 -14.039 -7.830 -1.458 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -13.305 -5.502 -1.832 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -15.054 -5.700 -2.093 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -14.458 -4.947 -0.595 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -12.106 -6.933 -0.214 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -13.190 -6.459 1.115 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -12.976 -8.179 0.712 1.00 0.00 H new ATOM 640 N GLU A 40 -15.568 -6.675 2.308 1.00 0.00 N ATOM 641 CA GLU A 40 -15.878 -5.781 3.411 1.00 0.00 C ATOM 642 C GLU A 40 -14.636 -4.983 3.813 1.00 0.00 C ATOM 643 O GLU A 40 -13.526 -5.513 3.810 1.00 0.00 O ATOM 644 CB GLU A 40 -16.441 -6.557 4.603 1.00 0.00 C ATOM 645 CG GLU A 40 -16.677 -5.631 5.798 1.00 0.00 C ATOM 646 CD GLU A 40 -17.791 -6.170 6.698 1.00 0.00 C ATOM 647 OE1 GLU A 40 -17.809 -7.404 6.901 1.00 0.00 O ATOM 648 OE2 GLU A 40 -18.598 -5.337 7.163 1.00 0.00 O ATOM 0 H GLU A 40 -15.069 -7.524 2.574 1.00 0.00 H new ATOM 0 HA GLU A 40 -16.645 -5.080 3.081 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -17.378 -7.037 4.319 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -15.749 -7.351 4.884 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -15.756 -5.532 6.373 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -16.941 -4.634 5.444 1.00 0.00 H new ATOM 655 N LEU A 41 -14.865 -3.723 4.150 1.00 0.00 N ATOM 656 CA LEU A 41 -13.778 -2.847 4.554 1.00 0.00 C ATOM 657 C LEU A 41 -14.098 -2.242 5.922 1.00 0.00 C ATOM 658 O LEU A 41 -15.257 -1.967 6.228 1.00 0.00 O ATOM 659 CB LEU A 41 -13.501 -1.803 3.470 1.00 0.00 C ATOM 660 CG LEU A 41 -13.237 -2.348 2.065 1.00 0.00 C ATOM 661 CD1 LEU A 41 -14.278 -1.828 1.071 1.00 0.00 C ATOM 662 CD2 LEU A 41 -11.809 -2.036 1.615 1.00 0.00 C ATOM 0 H LEU A 41 -15.787 -3.287 4.152 1.00 0.00 H new ATOM 0 HA LEU A 41 -12.853 -3.413 4.664 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -14.353 -1.125 3.421 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.639 -1.210 3.776 1.00 0.00 H new ATOM 0 HG LEU A 41 -13.335 -3.433 2.096 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -14.068 -2.230 0.080 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -15.272 -2.144 1.387 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -14.237 -0.739 1.037 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.648 -2.434 0.613 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -11.658 -0.956 1.605 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -11.101 -2.494 2.306 1.00 0.00 H new ATOM 674 N GLU A 42 -13.049 -2.053 6.710 1.00 0.00 N ATOM 675 CA GLU A 42 -13.203 -1.487 8.039 1.00 0.00 C ATOM 676 C GLU A 42 -12.846 0.001 8.026 1.00 0.00 C ATOM 677 O GLU A 42 -11.740 0.374 7.640 1.00 0.00 O ATOM 678 CB GLU A 42 -12.355 -2.246 9.061 1.00 0.00 C ATOM 679 CG GLU A 42 -13.128 -3.430 9.644 1.00 0.00 C ATOM 680 CD GLU A 42 -12.172 -4.523 10.130 1.00 0.00 C ATOM 681 OE1 GLU A 42 -11.501 -4.274 11.154 1.00 0.00 O ATOM 682 OE2 GLU A 42 -12.136 -5.581 9.466 1.00 0.00 O ATOM 0 H GLU A 42 -12.089 -2.282 6.453 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.247 -1.588 8.337 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.440 -2.602 8.587 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.056 -1.572 9.864 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -13.750 -3.091 10.473 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -13.799 -3.838 8.888 1.00 0.00 H new ATOM 689 N ARG A 43 -13.804 0.810 8.454 1.00 0.00 N ATOM 690 CA ARG A 43 -13.605 2.249 8.496 1.00 0.00 C ATOM 691 C ARG A 43 -12.432 2.595 9.416 1.00 0.00 C ATOM 692 O ARG A 43 -12.285 2.009 10.488 1.00 0.00 O ATOM 693 CB ARG A 43 -14.862 2.965 8.993 1.00 0.00 C ATOM 694 CG ARG A 43 -14.547 4.404 9.406 1.00 0.00 C ATOM 695 CD ARG A 43 -15.719 5.335 9.088 1.00 0.00 C ATOM 696 NE ARG A 43 -16.920 4.913 9.843 1.00 0.00 N ATOM 697 CZ ARG A 43 -17.999 5.685 10.030 1.00 0.00 C ATOM 698 NH1 ARG A 43 -18.035 6.923 9.518 1.00 0.00 N ATOM 699 NH2 ARG A 43 -19.043 5.219 10.729 1.00 0.00 N ATOM 0 H ARG A 43 -14.720 0.497 8.775 1.00 0.00 H new ATOM 0 HA ARG A 43 -13.388 2.584 7.482 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -15.619 2.966 8.208 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -15.282 2.423 9.841 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -14.328 4.440 10.473 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -13.653 4.748 8.886 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -15.459 6.362 9.346 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -15.927 5.318 8.018 1.00 0.00 H new ATOM 0 HE ARG A 43 -16.927 3.976 10.246 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -17.241 7.278 8.986 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -18.857 7.510 9.661 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -19.016 4.277 11.119 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -19.864 5.807 10.871 1.00 0.00 H new ATOM 713 N VAL A 44 -11.627 3.546 8.964 1.00 0.00 N ATOM 714 CA VAL A 44 -10.473 3.977 9.733 1.00 0.00 C ATOM 715 C VAL A 44 -10.891 5.093 10.692 1.00 0.00 C ATOM 716 O VAL A 44 -10.856 6.269 10.335 1.00 0.00 O ATOM 717 CB VAL A 44 -9.341 4.392 8.791 1.00 0.00 C ATOM 718 CG1 VAL A 44 -8.149 4.943 9.574 1.00 0.00 C ATOM 719 CG2 VAL A 44 -8.917 3.226 7.896 1.00 0.00 C ATOM 0 H VAL A 44 -11.752 4.030 8.075 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.090 3.155 10.338 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.716 5.189 8.149 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -7.359 5.230 8.880 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -8.462 5.815 10.148 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -7.774 4.177 10.253 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.111 3.548 7.236 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.570 2.399 8.516 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.767 2.899 7.297 1.00 0.00 H new ATOM 729 N HIS A 45 -11.279 4.684 11.892 1.00 0.00 N ATOM 730 CA HIS A 45 -11.704 5.635 12.905 1.00 0.00 C ATOM 731 C HIS A 45 -10.597 6.665 13.139 1.00 0.00 C ATOM 732 O HIS A 45 -10.859 7.866 13.174 1.00 0.00 O ATOM 733 CB HIS A 45 -12.123 4.912 14.187 1.00 0.00 C ATOM 734 CG HIS A 45 -13.483 4.261 14.108 1.00 0.00 C ATOM 735 ND1 HIS A 45 -14.391 4.541 13.103 1.00 0.00 N ATOM 736 CD2 HIS A 45 -14.078 3.339 14.919 1.00 0.00 C ATOM 737 CE1 HIS A 45 -15.481 3.817 13.310 1.00 0.00 C ATOM 738 NE2 HIS A 45 -15.285 3.073 14.436 1.00 0.00 N ATOM 0 H HIS A 45 -11.308 3.707 12.185 1.00 0.00 H new ATOM 0 HA HIS A 45 -12.585 6.174 12.557 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -11.380 4.150 14.422 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -12.120 5.625 15.012 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -13.641 2.900 15.804 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -16.369 3.816 12.695 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -15.956 2.420 14.840 1.00 0.00 H new ATOM 746 N GLU A 46 -9.383 6.156 13.294 1.00 0.00 N ATOM 747 CA GLU A 46 -8.235 7.017 13.524 1.00 0.00 C ATOM 748 C GLU A 46 -8.252 8.196 12.550 1.00 0.00 C ATOM 749 O GLU A 46 -7.683 9.249 12.834 1.00 0.00 O ATOM 750 CB GLU A 46 -6.928 6.229 13.410 1.00 0.00 C ATOM 751 CG GLU A 46 -5.775 6.981 14.078 1.00 0.00 C ATOM 752 CD GLU A 46 -5.287 6.240 15.325 1.00 0.00 C ATOM 753 OE1 GLU A 46 -6.025 6.277 16.333 1.00 0.00 O ATOM 754 OE2 GLU A 46 -4.186 5.654 15.241 1.00 0.00 O ATOM 0 H GLU A 46 -9.170 5.159 13.265 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.297 7.410 14.539 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.047 5.251 13.876 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.694 6.056 12.360 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.952 7.094 13.372 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.100 7.985 14.351 1.00 0.00 H new ATOM 761 N CYS A 47 -8.910 7.979 11.420 1.00 0.00 N ATOM 762 CA CYS A 47 -9.008 9.011 10.401 1.00 0.00 C ATOM 763 C CYS A 47 -10.486 9.350 10.202 1.00 0.00 C ATOM 764 O CYS A 47 -11.205 8.627 9.513 1.00 0.00 O ATOM 765 CB CYS A 47 -8.339 8.581 9.094 1.00 0.00 C ATOM 766 SG CYS A 47 -7.677 10.045 8.219 1.00 0.00 S ATOM 0 H CYS A 47 -9.380 7.104 11.188 1.00 0.00 H new ATOM 0 HA CYS A 47 -8.473 9.902 10.729 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -7.534 7.877 9.303 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -9.059 8.063 8.460 1.00 0.00 H new ATOM 0 HG CYS A 47 -8.554 10.470 7.359 1.00 0.00 H new ATOM 772 N GLN A 48 -10.897 10.449 10.817 1.00 0.00 N ATOM 773 CA GLN A 48 -12.277 10.893 10.715 1.00 0.00 C ATOM 774 C GLN A 48 -12.816 10.630 9.308 1.00 0.00 C ATOM 775 O GLN A 48 -13.949 10.177 9.148 1.00 0.00 O ATOM 776 CB GLN A 48 -12.406 12.372 11.085 1.00 0.00 C ATOM 777 CG GLN A 48 -11.623 12.688 12.361 1.00 0.00 C ATOM 778 CD GLN A 48 -12.197 13.920 13.064 1.00 0.00 C ATOM 779 OE1 GLN A 48 -12.835 13.834 14.101 1.00 0.00 O ATOM 780 NE2 GLN A 48 -11.936 15.068 12.445 1.00 0.00 N ATOM 0 H GLN A 48 -10.298 11.046 11.388 1.00 0.00 H new ATOM 0 HA GLN A 48 -12.876 10.322 11.425 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -12.037 12.989 10.266 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -13.457 12.625 11.227 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -11.657 11.832 13.034 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -10.575 12.860 12.116 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -11.396 15.070 11.580 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -12.276 15.947 12.836 1.00 0.00 H new ATOM 789 N THR A 49 -11.980 10.926 8.323 1.00 0.00 N ATOM 790 CA THR A 49 -12.359 10.728 6.935 1.00 0.00 C ATOM 791 C THR A 49 -12.858 9.298 6.717 1.00 0.00 C ATOM 792 O THR A 49 -12.382 8.365 7.362 1.00 0.00 O ATOM 793 CB THR A 49 -11.158 11.091 6.060 1.00 0.00 C ATOM 794 OG1 THR A 49 -10.084 10.334 6.612 1.00 0.00 O ATOM 795 CG2 THR A 49 -10.720 12.546 6.243 1.00 0.00 C ATOM 0 H THR A 49 -11.041 11.301 8.459 1.00 0.00 H new ATOM 0 HA THR A 49 -13.190 11.376 6.657 1.00 0.00 H new ATOM 0 HB THR A 49 -11.405 10.914 5.013 1.00 0.00 H new ATOM 0 HG1 THR A 49 -9.529 9.977 5.887 1.00 0.00 H new ATOM 0 HG21 THR A 49 -9.864 12.752 5.600 1.00 0.00 H new ATOM 0 HG22 THR A 49 -11.542 13.210 5.977 1.00 0.00 H new ATOM 0 HG23 THR A 49 -10.441 12.714 7.283 1.00 0.00 H new ATOM 803 N PRO A 50 -13.837 9.167 5.782 1.00 0.00 N ATOM 804 CA PRO A 50 -14.405 7.866 5.471 1.00 0.00 C ATOM 805 C PRO A 50 -13.439 7.032 4.627 1.00 0.00 C ATOM 806 O PRO A 50 -13.725 6.724 3.471 1.00 0.00 O ATOM 807 CB PRO A 50 -15.711 8.169 4.753 1.00 0.00 C ATOM 808 CG PRO A 50 -15.601 9.609 4.278 1.00 0.00 C ATOM 809 CD PRO A 50 -14.425 10.249 4.998 1.00 0.00 C ATOM 0 HA PRO A 50 -14.585 7.262 6.361 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -15.861 7.491 3.913 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -16.563 8.042 5.421 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -15.453 9.645 3.199 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -16.521 10.153 4.492 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -13.705 10.662 4.291 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -14.751 11.069 5.637 1.00 0.00 H new ATOM 817 N PHE A 51 -12.314 6.691 5.238 1.00 0.00 N ATOM 818 CA PHE A 51 -11.304 5.898 4.558 1.00 0.00 C ATOM 819 C PHE A 51 -11.300 4.457 5.070 1.00 0.00 C ATOM 820 O PHE A 51 -10.788 4.181 6.154 1.00 0.00 O ATOM 821 CB PHE A 51 -9.950 6.540 4.866 1.00 0.00 C ATOM 822 CG PHE A 51 -8.778 5.917 4.105 1.00 0.00 C ATOM 823 CD1 PHE A 51 -9.005 5.215 2.962 1.00 0.00 C ATOM 824 CD2 PHE A 51 -7.509 6.064 4.571 1.00 0.00 C ATOM 825 CE1 PHE A 51 -7.918 4.637 2.256 1.00 0.00 C ATOM 826 CE2 PHE A 51 -6.421 5.486 3.865 1.00 0.00 C ATOM 827 CZ PHE A 51 -6.649 4.785 2.722 1.00 0.00 C ATOM 0 H PHE A 51 -12.080 6.949 6.196 1.00 0.00 H new ATOM 0 HA PHE A 51 -11.509 5.873 3.488 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -10.001 7.602 4.628 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -9.758 6.462 5.936 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -10.013 5.098 2.592 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.329 6.621 5.479 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -8.099 4.080 1.349 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -5.413 5.603 4.235 1.00 0.00 H new ATOM 0 HZ PHE A 51 -5.822 4.346 2.184 1.00 0.00 H new ATOM 837 N PHE A 52 -11.878 3.576 4.267 1.00 0.00 N ATOM 838 CA PHE A 52 -11.949 2.169 4.625 1.00 0.00 C ATOM 839 C PHE A 52 -10.872 1.363 3.896 1.00 0.00 C ATOM 840 O PHE A 52 -10.469 1.718 2.789 1.00 0.00 O ATOM 841 CB PHE A 52 -13.327 1.666 4.193 1.00 0.00 C ATOM 842 CG PHE A 52 -14.446 2.696 4.358 1.00 0.00 C ATOM 843 CD1 PHE A 52 -14.737 3.553 3.343 1.00 0.00 C ATOM 844 CD2 PHE A 52 -15.150 2.754 5.521 1.00 0.00 C ATOM 845 CE1 PHE A 52 -15.776 4.509 3.497 1.00 0.00 C ATOM 846 CE2 PHE A 52 -16.189 3.711 5.674 1.00 0.00 C ATOM 847 CZ PHE A 52 -16.480 4.567 4.659 1.00 0.00 C ATOM 0 H PHE A 52 -12.302 3.809 3.369 1.00 0.00 H new ATOM 0 HA PHE A 52 -11.791 2.049 5.697 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -13.280 1.361 3.148 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -13.576 0.778 4.773 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -14.178 3.507 2.420 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -14.919 2.073 6.327 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -16.007 5.190 2.691 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -16.748 3.758 6.597 1.00 0.00 H new ATOM 0 HZ PHE A 52 -17.271 5.293 4.775 1.00 0.00 H new ATOM 857 N VAL A 53 -10.437 0.293 4.546 1.00 0.00 N ATOM 858 CA VAL A 53 -9.415 -0.566 3.973 1.00 0.00 C ATOM 859 C VAL A 53 -9.719 -2.022 4.332 1.00 0.00 C ATOM 860 O VAL A 53 -10.446 -2.290 5.287 1.00 0.00 O ATOM 861 CB VAL A 53 -8.030 -0.112 4.436 1.00 0.00 C ATOM 862 CG1 VAL A 53 -7.693 1.274 3.883 1.00 0.00 C ATOM 863 CG2 VAL A 53 -7.928 -0.133 5.963 1.00 0.00 C ATOM 0 H VAL A 53 -10.774 0.002 5.464 1.00 0.00 H new ATOM 0 HA VAL A 53 -9.419 -0.492 2.886 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.298 -0.817 4.041 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.703 1.572 4.228 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.704 1.244 2.793 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.432 1.995 4.233 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -6.933 0.194 6.266 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.675 0.538 6.387 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -8.103 -1.146 6.325 1.00 0.00 H new ATOM 873 N HIS A 54 -9.147 -2.923 3.547 1.00 0.00 N ATOM 874 CA HIS A 54 -9.348 -4.345 3.771 1.00 0.00 C ATOM 875 C HIS A 54 -8.105 -5.116 3.320 1.00 0.00 C ATOM 876 O HIS A 54 -7.618 -4.919 2.208 1.00 0.00 O ATOM 877 CB HIS A 54 -10.627 -4.828 3.084 1.00 0.00 C ATOM 878 CG HIS A 54 -10.895 -6.304 3.253 1.00 0.00 C ATOM 879 ND1 HIS A 54 -11.275 -6.863 4.461 1.00 0.00 N ATOM 880 CD2 HIS A 54 -10.835 -7.330 2.356 1.00 0.00 C ATOM 881 CE1 HIS A 54 -11.433 -8.167 4.287 1.00 0.00 C ATOM 882 NE2 HIS A 54 -11.159 -8.455 2.982 1.00 0.00 N ATOM 0 H HIS A 54 -8.545 -2.696 2.756 1.00 0.00 H new ATOM 0 HA HIS A 54 -9.484 -4.534 4.836 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -11.474 -4.268 3.480 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -10.564 -4.600 2.020 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -10.569 -7.242 1.313 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -11.727 -8.877 5.045 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -11.197 -9.382 2.557 1.00 0.00 H new ATOM 890 N ALA A 55 -7.628 -5.977 4.207 1.00 0.00 N ATOM 891 CA ALA A 55 -6.452 -6.778 3.914 1.00 0.00 C ATOM 892 C ALA A 55 -6.832 -8.260 3.934 1.00 0.00 C ATOM 893 O ALA A 55 -7.550 -8.709 4.826 1.00 0.00 O ATOM 894 CB ALA A 55 -5.346 -6.446 4.917 1.00 0.00 C ATOM 0 H ALA A 55 -8.035 -6.137 5.129 1.00 0.00 H new ATOM 0 HA ALA A 55 -6.069 -6.549 2.919 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -4.463 -7.047 4.698 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -5.093 -5.388 4.843 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.693 -6.666 5.927 1.00 0.00 H new ATOM 900 N ASP A 56 -6.333 -8.980 2.940 1.00 0.00 N ATOM 901 CA ASP A 56 -6.611 -10.402 2.832 1.00 0.00 C ATOM 902 C ASP A 56 -5.377 -11.118 2.278 1.00 0.00 C ATOM 903 O ASP A 56 -4.396 -10.475 1.909 1.00 0.00 O ATOM 904 CB ASP A 56 -7.778 -10.664 1.879 1.00 0.00 C ATOM 905 CG ASP A 56 -9.166 -10.415 2.472 1.00 0.00 C ATOM 906 OD1 ASP A 56 -9.217 -10.077 3.674 1.00 0.00 O ATOM 907 OD2 ASP A 56 -10.145 -10.568 1.709 1.00 0.00 O ATOM 0 H ASP A 56 -5.737 -8.605 2.202 1.00 0.00 H new ATOM 0 HA ASP A 56 -6.867 -10.772 3.825 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -7.657 -10.033 0.999 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -7.725 -11.698 1.539 1.00 0.00 H new ATOM 912 N VAL A 57 -5.468 -12.439 2.237 1.00 0.00 N ATOM 913 CA VAL A 57 -4.372 -13.249 1.734 1.00 0.00 C ATOM 914 C VAL A 57 -4.910 -14.245 0.705 1.00 0.00 C ATOM 915 O VAL A 57 -5.696 -15.129 1.043 1.00 0.00 O ATOM 916 CB VAL A 57 -3.644 -13.925 2.898 1.00 0.00 C ATOM 917 CG1 VAL A 57 -2.474 -14.773 2.394 1.00 0.00 C ATOM 918 CG2 VAL A 57 -3.172 -12.893 3.923 1.00 0.00 C ATOM 0 H VAL A 57 -6.284 -12.969 2.544 1.00 0.00 H new ATOM 0 HA VAL A 57 -3.636 -12.624 1.227 1.00 0.00 H new ATOM 0 HB VAL A 57 -4.351 -14.590 3.394 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -1.973 -15.242 3.241 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -2.847 -15.544 1.720 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -1.767 -14.137 1.861 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -2.658 -13.400 4.740 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -2.489 -12.191 3.445 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -4.032 -12.351 4.317 1.00 0.00 H new ATOM 928 N GLU A 58 -4.465 -14.069 -0.531 1.00 0.00 N ATOM 929 CA GLU A 58 -4.892 -14.942 -1.611 1.00 0.00 C ATOM 930 C GLU A 58 -3.699 -15.318 -2.493 1.00 0.00 C ATOM 931 O GLU A 58 -2.998 -14.443 -3.000 1.00 0.00 O ATOM 932 CB GLU A 58 -6.001 -14.288 -2.438 1.00 0.00 C ATOM 933 CG GLU A 58 -7.238 -15.186 -2.502 1.00 0.00 C ATOM 934 CD GLU A 58 -7.764 -15.293 -3.935 1.00 0.00 C ATOM 935 OE1 GLU A 58 -8.003 -14.222 -4.534 1.00 0.00 O ATOM 936 OE2 GLU A 58 -7.916 -16.443 -4.399 1.00 0.00 O ATOM 0 H GLU A 58 -3.813 -13.335 -0.808 1.00 0.00 H new ATOM 0 HA GLU A 58 -5.299 -15.855 -1.176 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.268 -13.326 -2.000 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -5.639 -14.089 -3.447 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -6.991 -16.179 -2.126 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -8.017 -14.785 -1.854 1.00 0.00 H new ATOM 943 N GLY A 59 -3.506 -16.619 -2.649 1.00 0.00 N ATOM 944 CA GLY A 59 -2.410 -17.121 -3.460 1.00 0.00 C ATOM 945 C GLY A 59 -1.059 -16.779 -2.830 1.00 0.00 C ATOM 946 O GLY A 59 -0.090 -16.511 -3.538 1.00 0.00 O ATOM 0 H GLY A 59 -4.090 -17.341 -2.227 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -2.500 -18.202 -3.571 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.467 -16.692 -4.460 1.00 0.00 H new ATOM 950 N GLY A 60 -1.039 -16.798 -1.505 1.00 0.00 N ATOM 951 CA GLY A 60 0.178 -16.493 -0.771 1.00 0.00 C ATOM 952 C GLY A 60 0.505 -15.001 -0.848 1.00 0.00 C ATOM 953 O GLY A 60 1.530 -14.559 -0.332 1.00 0.00 O ATOM 0 H GLY A 60 -1.845 -17.020 -0.921 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.062 -16.790 0.271 1.00 0.00 H new ATOM 0 HA3 GLY A 60 1.007 -17.072 -1.178 1.00 0.00 H new ATOM 957 N LYS A 61 -0.386 -14.265 -1.496 1.00 0.00 N ATOM 958 CA LYS A 61 -0.205 -12.831 -1.647 1.00 0.00 C ATOM 959 C LYS A 61 -1.307 -12.099 -0.879 1.00 0.00 C ATOM 960 O LYS A 61 -2.386 -12.647 -0.661 1.00 0.00 O ATOM 961 CB LYS A 61 -0.132 -12.453 -3.128 1.00 0.00 C ATOM 962 CG LYS A 61 1.145 -12.998 -3.770 1.00 0.00 C ATOM 963 CD LYS A 61 1.085 -12.883 -5.295 1.00 0.00 C ATOM 964 CE LYS A 61 1.722 -14.103 -5.963 1.00 0.00 C ATOM 965 NZ LYS A 61 2.085 -13.796 -7.364 1.00 0.00 N ATOM 0 H LYS A 61 -1.236 -14.635 -1.923 1.00 0.00 H new ATOM 0 HA LYS A 61 0.746 -12.519 -1.215 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.003 -12.847 -3.651 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -0.161 -11.368 -3.232 1.00 0.00 H new ATOM 0 HG2 LYS A 61 2.008 -12.449 -3.394 1.00 0.00 H new ATOM 0 HG3 LYS A 61 1.283 -14.041 -3.486 1.00 0.00 H new ATOM 0 HD2 LYS A 61 0.047 -12.789 -5.615 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.601 -11.978 -5.615 1.00 0.00 H new ATOM 0 HE2 LYS A 61 2.610 -14.406 -5.409 1.00 0.00 H new ATOM 0 HE3 LYS A 61 1.028 -14.943 -5.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.516 -14.635 -7.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 1.231 -13.529 -7.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 2.764 -13.008 -7.382 1.00 0.00 H new ATOM 979 N VAL A 62 -0.997 -10.870 -0.491 1.00 0.00 N ATOM 980 CA VAL A 62 -1.948 -10.057 0.248 1.00 0.00 C ATOM 981 C VAL A 62 -2.691 -9.138 -0.724 1.00 0.00 C ATOM 982 O VAL A 62 -2.067 -8.418 -1.502 1.00 0.00 O ATOM 983 CB VAL A 62 -1.229 -9.293 1.362 1.00 0.00 C ATOM 984 CG1 VAL A 62 0.024 -10.042 1.819 1.00 0.00 C ATOM 985 CG2 VAL A 62 -0.886 -7.870 0.917 1.00 0.00 C ATOM 0 H VAL A 62 -0.101 -10.418 -0.675 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.693 -10.687 0.733 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.907 -9.224 2.213 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.516 -9.478 2.611 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -0.257 -11.026 2.195 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.707 -10.157 0.977 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.376 -7.349 1.727 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.235 -7.909 0.044 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.802 -7.337 0.663 1.00 0.00 H new ATOM 995 N ARG A 63 -4.012 -9.193 -0.648 1.00 0.00 N ATOM 996 CA ARG A 63 -4.846 -8.375 -1.512 1.00 0.00 C ATOM 997 C ARG A 63 -5.211 -7.065 -0.811 1.00 0.00 C ATOM 998 O ARG A 63 -6.003 -7.060 0.130 1.00 0.00 O ATOM 999 CB ARG A 63 -6.129 -9.113 -1.899 1.00 0.00 C ATOM 1000 CG ARG A 63 -5.862 -10.133 -3.008 1.00 0.00 C ATOM 1001 CD ARG A 63 -5.506 -9.435 -4.321 1.00 0.00 C ATOM 1002 NE ARG A 63 -6.603 -9.609 -5.300 1.00 0.00 N ATOM 1003 CZ ARG A 63 -6.844 -10.749 -5.962 1.00 0.00 C ATOM 1004 NH1 ARG A 63 -6.069 -11.822 -5.754 1.00 0.00 N ATOM 1005 NH2 ARG A 63 -7.862 -10.816 -6.832 1.00 0.00 N ATOM 0 H ARG A 63 -4.526 -9.791 -0.001 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.277 -8.161 -2.417 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.539 -9.620 -1.025 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.879 -8.396 -2.233 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.048 -10.794 -2.711 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.743 -10.758 -3.152 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.331 -8.374 -4.143 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.580 -9.847 -4.722 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.213 -8.812 -5.482 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -5.295 -11.771 -5.091 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -6.253 -12.689 -6.258 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -8.453 -9.999 -6.990 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -8.046 -11.683 -7.336 1.00 0.00 H new ATOM 1019 N LEU A 64 -4.616 -5.985 -1.297 1.00 0.00 N ATOM 1020 CA LEU A 64 -4.868 -4.672 -0.729 1.00 0.00 C ATOM 1021 C LEU A 64 -6.164 -4.108 -1.316 1.00 0.00 C ATOM 1022 O LEU A 64 -6.375 -4.158 -2.527 1.00 0.00 O ATOM 1023 CB LEU A 64 -3.656 -3.760 -0.927 1.00 0.00 C ATOM 1024 CG LEU A 64 -2.578 -3.833 0.157 1.00 0.00 C ATOM 1025 CD1 LEU A 64 -1.714 -5.084 -0.013 1.00 0.00 C ATOM 1026 CD2 LEU A 64 -1.738 -2.555 0.181 1.00 0.00 C ATOM 0 H LEU A 64 -3.960 -5.993 -2.078 1.00 0.00 H new ATOM 0 HA LEU A 64 -5.010 -4.745 0.349 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -3.197 -4.002 -1.885 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -4.008 -2.730 -0.993 1.00 0.00 H new ATOM 0 HG LEU A 64 -3.072 -3.912 1.126 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.956 -5.112 0.770 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -2.342 -5.972 0.058 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.228 -5.061 -0.988 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -0.980 -2.633 0.960 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.253 -2.420 -0.786 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -2.382 -1.700 0.386 1.00 0.00 H new ATOM 1038 N TYR A 65 -6.998 -3.584 -0.430 1.00 0.00 N ATOM 1039 CA TYR A 65 -8.267 -3.011 -0.845 1.00 0.00 C ATOM 1040 C TYR A 65 -8.549 -1.705 -0.099 1.00 0.00 C ATOM 1041 O TYR A 65 -8.653 -1.696 1.126 1.00 0.00 O ATOM 1042 CB TYR A 65 -9.337 -4.039 -0.471 1.00 0.00 C ATOM 1043 CG TYR A 65 -9.296 -5.314 -1.315 1.00 0.00 C ATOM 1044 CD1 TYR A 65 -9.484 -5.244 -2.680 1.00 0.00 C ATOM 1045 CD2 TYR A 65 -9.072 -6.535 -0.711 1.00 0.00 C ATOM 1046 CE1 TYR A 65 -9.447 -6.444 -3.475 1.00 0.00 C ATOM 1047 CE2 TYR A 65 -9.034 -7.735 -1.506 1.00 0.00 C ATOM 1048 CZ TYR A 65 -9.223 -7.631 -2.848 1.00 0.00 C ATOM 1049 OH TYR A 65 -9.187 -8.764 -3.599 1.00 0.00 O ATOM 0 H TYR A 65 -6.820 -3.544 0.574 1.00 0.00 H new ATOM 0 HA TYR A 65 -8.256 -2.788 -1.912 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -9.218 -4.306 0.579 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -10.320 -3.579 -0.573 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -9.659 -4.289 -3.152 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -8.925 -6.590 0.358 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -9.594 -6.403 -4.544 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -8.859 -8.696 -1.046 1.00 0.00 H new ATOM 0 HH TYR A 65 -9.018 -9.536 -3.019 1.00 0.00 H new ATOM 1059 N PHE A 66 -8.666 -0.634 -0.871 1.00 0.00 N ATOM 1060 CA PHE A 66 -8.933 0.675 -0.298 1.00 0.00 C ATOM 1061 C PHE A 66 -10.270 1.228 -0.797 1.00 0.00 C ATOM 1062 O PHE A 66 -10.695 0.925 -1.911 1.00 0.00 O ATOM 1063 CB PHE A 66 -7.808 1.603 -0.758 1.00 0.00 C ATOM 1064 CG PHE A 66 -6.476 1.368 -0.043 1.00 0.00 C ATOM 1065 CD1 PHE A 66 -6.288 1.842 1.218 1.00 0.00 C ATOM 1066 CD2 PHE A 66 -5.480 0.685 -0.668 1.00 0.00 C ATOM 1067 CE1 PHE A 66 -5.052 1.624 1.881 1.00 0.00 C ATOM 1068 CE2 PHE A 66 -4.244 0.466 -0.004 1.00 0.00 C ATOM 1069 CZ PHE A 66 -4.056 0.941 1.257 1.00 0.00 C ATOM 0 H PHE A 66 -8.581 -0.646 -1.887 1.00 0.00 H new ATOM 0 HA PHE A 66 -8.982 0.603 0.789 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -7.661 1.475 -1.830 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -8.116 2.637 -0.600 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -7.079 2.384 1.715 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -5.629 0.309 -1.669 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -4.903 2.001 2.882 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -3.453 -0.078 -0.500 1.00 0.00 H new ATOM 0 HZ PHE A 66 -3.116 0.775 1.762 1.00 0.00 H new ATOM 1079 N HIS A 67 -10.896 2.029 0.053 1.00 0.00 N ATOM 1080 CA HIS A 67 -12.176 2.627 -0.287 1.00 0.00 C ATOM 1081 C HIS A 67 -12.272 4.021 0.334 1.00 0.00 C ATOM 1082 O HIS A 67 -12.303 4.160 1.556 1.00 0.00 O ATOM 1083 CB HIS A 67 -13.331 1.712 0.127 1.00 0.00 C ATOM 1084 CG HIS A 67 -14.676 2.142 -0.406 1.00 0.00 C ATOM 1085 ND1 HIS A 67 -15.062 3.469 -0.487 1.00 0.00 N ATOM 1086 CD2 HIS A 67 -15.721 1.408 -0.884 1.00 0.00 C ATOM 1087 CE1 HIS A 67 -16.286 3.519 -0.992 1.00 0.00 C ATOM 1088 NE2 HIS A 67 -16.693 2.241 -1.237 1.00 0.00 N ATOM 0 H HIS A 67 -10.541 2.278 0.976 1.00 0.00 H new ATOM 0 HA HIS A 67 -12.251 2.743 -1.368 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -13.121 0.700 -0.219 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -13.378 1.673 1.215 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -15.753 0.331 -0.962 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -16.860 4.415 -1.177 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -17.595 1.969 -1.627 1.00 0.00 H new ATOM 1096 N VAL A 68 -12.318 5.020 -0.535 1.00 0.00 N ATOM 1097 CA VAL A 68 -12.410 6.399 -0.087 1.00 0.00 C ATOM 1098 C VAL A 68 -13.392 7.157 -0.982 1.00 0.00 C ATOM 1099 O VAL A 68 -13.123 7.372 -2.163 1.00 0.00 O ATOM 1100 CB VAL A 68 -11.018 7.033 -0.055 1.00 0.00 C ATOM 1101 CG1 VAL A 68 -10.144 6.495 -1.191 1.00 0.00 C ATOM 1102 CG2 VAL A 68 -11.109 8.559 -0.110 1.00 0.00 C ATOM 0 H VAL A 68 -12.293 4.902 -1.548 1.00 0.00 H new ATOM 0 HA VAL A 68 -12.796 6.445 0.931 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.547 6.759 0.889 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -9.160 6.962 -1.145 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -10.038 5.415 -1.089 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.610 6.725 -2.149 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -10.106 8.984 -0.086 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -11.609 8.861 -1.030 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -11.677 8.921 0.747 1.00 0.00 H new ATOM 1112 N PRO A 69 -14.540 7.552 -0.370 1.00 0.00 N ATOM 1113 CA PRO A 69 -15.564 8.282 -1.098 1.00 0.00 C ATOM 1114 C PRO A 69 -15.144 9.736 -1.326 1.00 0.00 C ATOM 1115 O PRO A 69 -14.976 10.166 -2.466 1.00 0.00 O ATOM 1116 CB PRO A 69 -16.818 8.152 -0.250 1.00 0.00 C ATOM 1117 CG PRO A 69 -16.344 7.756 1.139 1.00 0.00 C ATOM 1118 CD PRO A 69 -14.893 7.316 1.027 1.00 0.00 C ATOM 0 HA PRO A 69 -15.733 7.884 -2.099 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -17.369 9.092 -0.221 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -17.491 7.400 -0.662 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -16.436 8.596 1.828 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -16.959 6.948 1.537 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -14.253 7.888 1.699 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -14.776 6.265 1.293 1.00 0.00 H new ATOM 1126 N ASP A 70 -14.987 10.452 -0.222 1.00 0.00 N ATOM 1127 CA ASP A 70 -14.590 11.849 -0.287 1.00 0.00 C ATOM 1128 C ASP A 70 -13.544 12.027 -1.389 1.00 0.00 C ATOM 1129 O ASP A 70 -13.443 13.097 -1.988 1.00 0.00 O ATOM 1130 CB ASP A 70 -13.967 12.306 1.034 1.00 0.00 C ATOM 1131 CG ASP A 70 -13.096 11.261 1.734 1.00 0.00 C ATOM 1132 OD1 ASP A 70 -13.524 10.086 1.753 1.00 0.00 O ATOM 1133 OD2 ASP A 70 -12.023 11.660 2.235 1.00 0.00 O ATOM 0 H ASP A 70 -15.127 10.092 0.722 1.00 0.00 H new ATOM 0 HA ASP A 70 -15.480 12.444 -0.491 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -13.363 13.193 0.846 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -14.767 12.603 1.712 1.00 0.00 H new ATOM 1138 N GLU A 71 -12.792 10.961 -1.625 1.00 0.00 N ATOM 1139 CA GLU A 71 -11.758 10.987 -2.645 1.00 0.00 C ATOM 1140 C GLU A 71 -10.629 11.934 -2.234 1.00 0.00 C ATOM 1141 O GLU A 71 -10.001 12.563 -3.084 1.00 0.00 O ATOM 1142 CB GLU A 71 -12.338 11.382 -4.005 1.00 0.00 C ATOM 1143 CG GLU A 71 -12.725 10.145 -4.817 1.00 0.00 C ATOM 1144 CD GLU A 71 -13.187 10.534 -6.223 1.00 0.00 C ATOM 1145 OE1 GLU A 71 -13.654 11.684 -6.368 1.00 0.00 O ATOM 1146 OE2 GLU A 71 -13.062 9.673 -7.120 1.00 0.00 O ATOM 0 H GLU A 71 -12.879 10.075 -1.127 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.346 9.983 -2.741 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.214 12.015 -3.861 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -11.607 11.971 -4.559 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.873 9.469 -4.885 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.521 9.604 -4.305 1.00 0.00 H new ATOM 1153 N ALA A 72 -10.406 12.007 -0.930 1.00 0.00 N ATOM 1154 CA ALA A 72 -9.364 12.867 -0.395 1.00 0.00 C ATOM 1155 C ALA A 72 -8.050 12.583 -1.125 1.00 0.00 C ATOM 1156 O ALA A 72 -7.684 11.425 -1.325 1.00 0.00 O ATOM 1157 CB ALA A 72 -9.250 12.653 1.115 1.00 0.00 C ATOM 0 H ALA A 72 -10.929 11.484 -0.228 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.611 13.916 -0.557 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -8.468 13.298 1.516 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.200 12.896 1.590 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -9.000 11.612 1.317 1.00 0.00 H new ATOM 1163 N PRO A 73 -7.358 13.687 -1.513 1.00 0.00 N ATOM 1164 CA PRO A 73 -6.092 13.568 -2.217 1.00 0.00 C ATOM 1165 C PRO A 73 -4.970 13.159 -1.261 1.00 0.00 C ATOM 1166 O PRO A 73 -3.872 12.816 -1.697 1.00 0.00 O ATOM 1167 CB PRO A 73 -5.864 14.931 -2.851 1.00 0.00 C ATOM 1168 CG PRO A 73 -6.769 15.896 -2.101 1.00 0.00 C ATOM 1169 CD PRO A 73 -7.760 15.073 -1.294 1.00 0.00 C ATOM 0 HA PRO A 73 -6.106 12.787 -2.977 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -4.819 15.231 -2.768 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.107 14.913 -3.913 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -6.182 16.538 -1.444 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.294 16.548 -2.799 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -7.722 15.334 -0.236 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -8.783 15.246 -1.628 1.00 0.00 H new ATOM 1177 N THR A 74 -5.284 13.207 0.025 1.00 0.00 N ATOM 1178 CA THR A 74 -4.316 12.846 1.047 1.00 0.00 C ATOM 1179 C THR A 74 -4.536 11.402 1.502 1.00 0.00 C ATOM 1180 O THR A 74 -3.612 10.590 1.471 1.00 0.00 O ATOM 1181 CB THR A 74 -4.425 13.864 2.183 1.00 0.00 C ATOM 1182 OG1 THR A 74 -5.804 14.223 2.197 1.00 0.00 O ATOM 1183 CG2 THR A 74 -3.702 15.175 1.867 1.00 0.00 C ATOM 0 H THR A 74 -6.196 13.491 0.383 1.00 0.00 H new ATOM 0 HA THR A 74 -3.298 12.880 0.658 1.00 0.00 H new ATOM 0 HB THR A 74 -4.013 13.434 3.096 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.964 14.880 2.907 1.00 0.00 H new ATOM 0 HG21 THR A 74 -3.811 15.862 2.706 1.00 0.00 H new ATOM 0 HG22 THR A 74 -2.644 14.975 1.696 1.00 0.00 H new ATOM 0 HG23 THR A 74 -4.135 15.623 0.973 1.00 0.00 H new ATOM 1191 N VAL A 75 -5.764 11.125 1.914 1.00 0.00 N ATOM 1192 CA VAL A 75 -6.116 9.793 2.375 1.00 0.00 C ATOM 1193 C VAL A 75 -5.747 8.771 1.298 1.00 0.00 C ATOM 1194 O VAL A 75 -5.092 7.770 1.585 1.00 0.00 O ATOM 1195 CB VAL A 75 -7.596 9.747 2.760 1.00 0.00 C ATOM 1196 CG1 VAL A 75 -7.961 10.917 3.676 1.00 0.00 C ATOM 1197 CG2 VAL A 75 -8.487 9.726 1.516 1.00 0.00 C ATOM 0 H VAL A 75 -6.528 11.800 1.938 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.552 9.538 3.272 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.769 8.823 3.311 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -9.018 10.861 3.935 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.362 10.868 4.585 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -7.763 11.857 3.162 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -9.534 9.693 1.819 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.308 10.624 0.925 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -8.255 8.845 0.917 1.00 0.00 H new ATOM 1207 N LYS A 76 -6.184 9.058 0.080 1.00 0.00 N ATOM 1208 CA LYS A 76 -5.908 8.177 -1.041 1.00 0.00 C ATOM 1209 C LYS A 76 -4.394 8.070 -1.240 1.00 0.00 C ATOM 1210 O LYS A 76 -3.865 6.976 -1.431 1.00 0.00 O ATOM 1211 CB LYS A 76 -6.660 8.645 -2.289 1.00 0.00 C ATOM 1212 CG LYS A 76 -7.408 7.483 -2.946 1.00 0.00 C ATOM 1213 CD LYS A 76 -8.675 7.974 -3.650 1.00 0.00 C ATOM 1214 CE LYS A 76 -9.093 7.011 -4.762 1.00 0.00 C ATOM 1215 NZ LYS A 76 -10.556 7.072 -4.978 1.00 0.00 N ATOM 0 H LYS A 76 -6.727 9.889 -0.154 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.275 7.172 -0.834 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -7.366 9.431 -2.019 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -5.957 9.078 -3.000 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -6.757 6.987 -3.666 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -7.671 6.742 -2.191 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -9.483 8.071 -2.925 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -8.502 8.965 -4.069 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -8.572 7.265 -5.685 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -8.800 5.994 -4.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -10.945 6.108 -4.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.998 7.613 -4.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -10.754 7.539 -5.886 1.00 0.00 H new ATOM 1229 N ALA A 77 -3.740 9.221 -1.188 1.00 0.00 N ATOM 1230 CA ALA A 77 -2.298 9.271 -1.360 1.00 0.00 C ATOM 1231 C ALA A 77 -1.668 8.040 -0.705 1.00 0.00 C ATOM 1232 O ALA A 77 -1.140 7.168 -1.394 1.00 0.00 O ATOM 1233 CB ALA A 77 -1.760 10.580 -0.779 1.00 0.00 C ATOM 0 H ALA A 77 -4.182 10.126 -1.029 1.00 0.00 H new ATOM 0 HA ALA A 77 -2.036 9.252 -2.418 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.678 10.618 -0.908 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -2.217 11.423 -1.297 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -2.001 10.633 0.283 1.00 0.00 H new ATOM 1239 N PHE A 78 -1.745 8.007 0.617 1.00 0.00 N ATOM 1240 CA PHE A 78 -1.189 6.898 1.372 1.00 0.00 C ATOM 1241 C PHE A 78 -1.572 5.558 0.740 1.00 0.00 C ATOM 1242 O PHE A 78 -0.705 4.739 0.440 1.00 0.00 O ATOM 1243 CB PHE A 78 -1.783 6.972 2.780 1.00 0.00 C ATOM 1244 CG PHE A 78 -0.805 6.580 3.889 1.00 0.00 C ATOM 1245 CD1 PHE A 78 0.481 7.019 3.848 1.00 0.00 C ATOM 1246 CD2 PHE A 78 -1.223 5.794 4.917 1.00 0.00 C ATOM 1247 CE1 PHE A 78 1.389 6.655 4.878 1.00 0.00 C ATOM 1248 CE2 PHE A 78 -0.315 5.430 5.947 1.00 0.00 C ATOM 1249 CZ PHE A 78 0.972 5.869 5.905 1.00 0.00 C ATOM 0 H PHE A 78 -2.185 8.731 1.185 1.00 0.00 H new ATOM 0 HA PHE A 78 -0.101 6.966 1.385 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -2.135 7.988 2.962 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -2.654 6.319 2.830 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.812 7.645 3.032 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.245 5.447 4.950 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.411 7.003 4.845 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.646 4.805 6.763 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.662 5.593 6.688 1.00 0.00 H new ATOM 1259 N ALA A 79 -2.871 5.376 0.556 1.00 0.00 N ATOM 1260 CA ALA A 79 -3.379 4.150 -0.035 1.00 0.00 C ATOM 1261 C ALA A 79 -2.461 3.723 -1.182 1.00 0.00 C ATOM 1262 O ALA A 79 -2.027 2.574 -1.239 1.00 0.00 O ATOM 1263 CB ALA A 79 -4.824 4.364 -0.493 1.00 0.00 C ATOM 0 H ALA A 79 -3.588 6.058 0.806 1.00 0.00 H new ATOM 0 HA ALA A 79 -3.386 3.344 0.699 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -5.205 3.444 -0.936 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -5.441 4.637 0.364 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -4.857 5.164 -1.233 1.00 0.00 H new ATOM 1269 N GLY A 80 -2.194 4.672 -2.068 1.00 0.00 N ATOM 1270 CA GLY A 80 -1.335 4.409 -3.210 1.00 0.00 C ATOM 1271 C GLY A 80 0.077 4.030 -2.759 1.00 0.00 C ATOM 1272 O GLY A 80 0.736 3.209 -3.395 1.00 0.00 O ATOM 0 H GLY A 80 -2.557 5.624 -2.018 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.758 3.603 -3.809 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.292 5.292 -3.848 1.00 0.00 H new ATOM 1276 N LEU A 81 0.499 4.647 -1.665 1.00 0.00 N ATOM 1277 CA LEU A 81 1.821 4.385 -1.122 1.00 0.00 C ATOM 1278 C LEU A 81 1.884 2.942 -0.619 1.00 0.00 C ATOM 1279 O LEU A 81 2.878 2.249 -0.833 1.00 0.00 O ATOM 1280 CB LEU A 81 2.178 5.424 -0.057 1.00 0.00 C ATOM 1281 CG LEU A 81 2.926 4.897 1.170 1.00 0.00 C ATOM 1282 CD1 LEU A 81 4.306 4.361 0.782 1.00 0.00 C ATOM 1283 CD2 LEU A 81 3.013 5.966 2.261 1.00 0.00 C ATOM 0 H LEU A 81 -0.051 5.327 -1.140 1.00 0.00 H new ATOM 0 HA LEU A 81 2.579 4.485 -1.899 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.786 6.199 -0.523 1.00 0.00 H new ATOM 0 HB3 LEU A 81 1.258 5.901 0.280 1.00 0.00 H new ATOM 0 HG LEU A 81 2.360 4.062 1.582 1.00 0.00 H new ATOM 0 HD11 LEU A 81 4.817 3.993 1.672 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.192 3.547 0.066 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.894 5.161 0.332 1.00 0.00 H new ATOM 0 HD21 LEU A 81 3.549 5.565 3.121 1.00 0.00 H new ATOM 0 HD22 LEU A 81 3.544 6.837 1.876 1.00 0.00 H new ATOM 0 HD23 LEU A 81 2.008 6.259 2.564 1.00 0.00 H new ATOM 1295 N LEU A 82 0.811 2.530 0.039 1.00 0.00 N ATOM 1296 CA LEU A 82 0.732 1.182 0.574 1.00 0.00 C ATOM 1297 C LEU A 82 0.696 0.180 -0.583 1.00 0.00 C ATOM 1298 O LEU A 82 1.547 -0.704 -0.668 1.00 0.00 O ATOM 1299 CB LEU A 82 -0.453 1.055 1.534 1.00 0.00 C ATOM 1300 CG LEU A 82 -0.335 1.826 2.850 1.00 0.00 C ATOM 1301 CD1 LEU A 82 0.939 1.437 3.601 1.00 0.00 C ATOM 1302 CD2 LEU A 82 -0.422 3.335 2.611 1.00 0.00 C ATOM 0 H LEU A 82 -0.012 3.107 0.214 1.00 0.00 H new ATOM 0 HA LEU A 82 1.618 0.955 1.166 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.351 1.393 1.017 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.596 -0.000 1.766 1.00 0.00 H new ATOM 0 HG LEU A 82 -1.178 1.551 3.484 1.00 0.00 H new ATOM 0 HD11 LEU A 82 0.998 2.000 4.533 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.920 0.370 3.822 1.00 0.00 H new ATOM 0 HD13 LEU A 82 1.809 1.664 2.984 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -0.335 3.860 3.562 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.387 3.646 1.950 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.380 3.576 2.150 1.00 0.00 H new ATOM 1314 N ARG A 83 -0.296 0.354 -1.443 1.00 0.00 N ATOM 1315 CA ARG A 83 -0.454 -0.524 -2.590 1.00 0.00 C ATOM 1316 C ARG A 83 0.739 -0.378 -3.537 1.00 0.00 C ATOM 1317 O ARG A 83 0.915 -1.185 -4.449 1.00 0.00 O ATOM 1318 CB ARG A 83 -1.742 -0.209 -3.352 1.00 0.00 C ATOM 1319 CG ARG A 83 -1.462 0.700 -4.551 1.00 0.00 C ATOM 1320 CD ARG A 83 -2.717 1.476 -4.956 1.00 0.00 C ATOM 1321 NE ARG A 83 -3.497 0.697 -5.943 1.00 0.00 N ATOM 1322 CZ ARG A 83 -3.106 0.478 -7.206 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -1.942 0.978 -7.643 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -3.878 -0.241 -8.032 1.00 0.00 N ATOM 0 H ARG A 83 -0.998 1.090 -1.369 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.506 -1.548 -2.219 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.202 -1.136 -3.694 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.455 0.274 -2.684 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -0.662 1.398 -4.304 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -1.113 0.101 -5.392 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.328 1.680 -4.077 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -2.437 2.440 -5.381 1.00 0.00 H new ATOM 0 HE ARG A 83 -4.388 0.302 -5.643 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -1.354 1.525 -7.014 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -1.644 0.811 -8.604 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -4.764 -0.622 -7.700 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -3.580 -0.407 -8.993 1.00 0.00 H new ATOM 1338 N GLU A 84 1.529 0.656 -3.288 1.00 0.00 N ATOM 1339 CA GLU A 84 2.700 0.917 -4.107 1.00 0.00 C ATOM 1340 C GLU A 84 3.782 -0.130 -3.836 1.00 0.00 C ATOM 1341 O GLU A 84 4.516 -0.519 -4.744 1.00 0.00 O ATOM 1342 CB GLU A 84 3.233 2.331 -3.866 1.00 0.00 C ATOM 1343 CG GLU A 84 2.848 3.266 -5.015 1.00 0.00 C ATOM 1344 CD GLU A 84 3.739 3.030 -6.236 1.00 0.00 C ATOM 1345 OE1 GLU A 84 4.944 2.776 -6.020 1.00 0.00 O ATOM 1346 OE2 GLU A 84 3.195 3.108 -7.359 1.00 0.00 O ATOM 0 H GLU A 84 1.381 1.323 -2.531 1.00 0.00 H new ATOM 0 HA GLU A 84 2.409 0.847 -5.155 1.00 0.00 H new ATOM 0 HB2 GLU A 84 2.835 2.719 -2.928 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.318 2.302 -3.764 1.00 0.00 H new ATOM 0 HG2 GLU A 84 1.804 3.105 -5.285 1.00 0.00 H new ATOM 0 HG3 GLU A 84 2.937 4.303 -4.690 1.00 0.00 H new ATOM 1353 N GLY A 85 3.847 -0.557 -2.584 1.00 0.00 N ATOM 1354 CA GLY A 85 4.826 -1.552 -2.182 1.00 0.00 C ATOM 1355 C GLY A 85 4.231 -2.530 -1.167 1.00 0.00 C ATOM 1356 O GLY A 85 4.849 -2.823 -0.145 1.00 0.00 O ATOM 0 H GLY A 85 3.237 -0.232 -1.834 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.174 -2.099 -3.058 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.695 -1.057 -1.749 1.00 0.00 H new ATOM 1360 N LEU A 86 3.036 -3.007 -1.484 1.00 0.00 N ATOM 1361 CA LEU A 86 2.349 -3.945 -0.612 1.00 0.00 C ATOM 1362 C LEU A 86 1.354 -4.765 -1.436 1.00 0.00 C ATOM 1363 O LEU A 86 1.274 -5.983 -1.286 1.00 0.00 O ATOM 1364 CB LEU A 86 1.712 -3.211 0.569 1.00 0.00 C ATOM 1365 CG LEU A 86 2.658 -2.361 1.420 1.00 0.00 C ATOM 1366 CD1 LEU A 86 1.876 -1.491 2.406 1.00 0.00 C ATOM 1367 CD2 LEU A 86 3.697 -3.235 2.125 1.00 0.00 C ATOM 0 H LEU A 86 2.526 -2.761 -2.333 1.00 0.00 H new ATOM 0 HA LEU A 86 3.058 -4.648 -0.175 1.00 0.00 H new ATOM 0 HB2 LEU A 86 0.921 -2.566 0.186 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.237 -3.948 1.216 1.00 0.00 H new ATOM 0 HG LEU A 86 3.201 -1.687 0.757 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.572 -0.897 2.998 1.00 0.00 H new ATOM 0 HD12 LEU A 86 1.209 -0.827 1.856 1.00 0.00 H new ATOM 0 HD13 LEU A 86 1.289 -2.128 3.067 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.356 -2.606 2.723 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.191 -3.950 2.774 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.285 -3.773 1.381 1.00 0.00 H new ATOM 1379 N GLU A 87 0.621 -4.064 -2.289 1.00 0.00 N ATOM 1380 CA GLU A 87 -0.365 -4.712 -3.136 1.00 0.00 C ATOM 1381 C GLU A 87 0.264 -5.896 -3.874 1.00 0.00 C ATOM 1382 O GLU A 87 1.109 -5.708 -4.748 1.00 0.00 O ATOM 1383 CB GLU A 87 -0.980 -3.716 -4.121 1.00 0.00 C ATOM 1384 CG GLU A 87 -1.928 -4.421 -5.094 1.00 0.00 C ATOM 1385 CD GLU A 87 -1.225 -4.733 -6.416 1.00 0.00 C ATOM 1386 OE1 GLU A 87 -0.346 -3.929 -6.795 1.00 0.00 O ATOM 1387 OE2 GLU A 87 -1.582 -5.768 -7.019 1.00 0.00 O ATOM 0 H GLU A 87 0.691 -3.054 -2.411 1.00 0.00 H new ATOM 0 HA GLU A 87 -1.168 -5.090 -2.503 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.522 -2.945 -3.573 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -0.189 -3.214 -4.678 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -2.294 -5.345 -4.646 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -2.798 -3.791 -5.280 1.00 0.00 H new ATOM 1394 N GLY A 88 -0.172 -7.088 -3.495 1.00 0.00 N ATOM 1395 CA GLY A 88 0.338 -8.302 -4.109 1.00 0.00 C ATOM 1396 C GLY A 88 1.498 -8.882 -3.298 1.00 0.00 C ATOM 1397 O GLY A 88 1.892 -10.028 -3.504 1.00 0.00 O ATOM 0 H GLY A 88 -0.873 -7.239 -2.770 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.462 -9.039 -4.185 1.00 0.00 H new ATOM 0 HA3 GLY A 88 0.671 -8.088 -5.125 1.00 0.00 H new ATOM 1401 N GLU A 89 2.012 -8.063 -2.392 1.00 0.00 N ATOM 1402 CA GLU A 89 3.119 -8.480 -1.548 1.00 0.00 C ATOM 1403 C GLU A 89 2.678 -9.607 -0.613 1.00 0.00 C ATOM 1404 O GLU A 89 1.545 -10.080 -0.696 1.00 0.00 O ATOM 1405 CB GLU A 89 3.681 -7.298 -0.756 1.00 0.00 C ATOM 1406 CG GLU A 89 4.219 -6.215 -1.694 1.00 0.00 C ATOM 1407 CD GLU A 89 5.237 -6.797 -2.676 1.00 0.00 C ATOM 1408 OE1 GLU A 89 4.784 -7.387 -3.680 1.00 0.00 O ATOM 1409 OE2 GLU A 89 6.446 -6.639 -2.400 1.00 0.00 O ATOM 0 H GLU A 89 1.682 -7.113 -2.224 1.00 0.00 H new ATOM 0 HA GLU A 89 3.916 -8.857 -2.188 1.00 0.00 H new ATOM 0 HB2 GLU A 89 2.902 -6.879 -0.120 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.478 -7.643 -0.098 1.00 0.00 H new ATOM 0 HG2 GLU A 89 3.394 -5.763 -2.245 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.685 -5.421 -1.110 1.00 0.00 H new ATOM 1416 N SER A 90 3.595 -10.005 0.256 1.00 0.00 N ATOM 1417 CA SER A 90 3.315 -11.068 1.207 1.00 0.00 C ATOM 1418 C SER A 90 2.805 -10.473 2.521 1.00 0.00 C ATOM 1419 O SER A 90 2.969 -9.281 2.772 1.00 0.00 O ATOM 1420 CB SER A 90 4.558 -11.923 1.459 1.00 0.00 C ATOM 1421 OG SER A 90 5.358 -12.061 0.287 1.00 0.00 O ATOM 0 H SER A 90 4.533 -9.610 0.322 1.00 0.00 H new ATOM 0 HA SER A 90 2.544 -11.712 0.783 1.00 0.00 H new ATOM 0 HB2 SER A 90 5.153 -11.472 2.253 1.00 0.00 H new ATOM 0 HB3 SER A 90 4.254 -12.910 1.809 1.00 0.00 H new ATOM 0 HG SER A 90 6.143 -12.612 0.490 1.00 0.00 H new ATOM 1427 N PRO A 91 2.179 -11.355 3.346 1.00 0.00 N ATOM 1428 CA PRO A 91 1.644 -10.930 4.628 1.00 0.00 C ATOM 1429 C PRO A 91 2.765 -10.718 5.648 1.00 0.00 C ATOM 1430 O PRO A 91 2.685 -9.822 6.487 1.00 0.00 O ATOM 1431 CB PRO A 91 0.673 -12.027 5.033 1.00 0.00 C ATOM 1432 CG PRO A 91 1.044 -13.241 4.197 1.00 0.00 C ATOM 1433 CD PRO A 91 1.966 -12.775 3.082 1.00 0.00 C ATOM 0 HA PRO A 91 1.136 -9.967 4.573 1.00 0.00 H new ATOM 0 HB2 PRO A 91 0.754 -12.246 6.098 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -0.358 -11.725 4.847 1.00 0.00 H new ATOM 0 HG2 PRO A 91 1.539 -13.992 4.813 1.00 0.00 H new ATOM 0 HG3 PRO A 91 0.150 -13.707 3.783 1.00 0.00 H new ATOM 0 HD2 PRO A 91 2.907 -13.325 3.091 1.00 0.00 H new ATOM 0 HD3 PRO A 91 1.514 -12.932 2.103 1.00 0.00 H new ATOM 1441 N GLU A 92 3.784 -11.557 5.541 1.00 0.00 N ATOM 1442 CA GLU A 92 4.920 -11.473 6.443 1.00 0.00 C ATOM 1443 C GLU A 92 5.746 -10.221 6.142 1.00 0.00 C ATOM 1444 O GLU A 92 6.289 -9.597 7.052 1.00 0.00 O ATOM 1445 CB GLU A 92 5.784 -12.733 6.357 1.00 0.00 C ATOM 1446 CG GLU A 92 4.926 -13.995 6.472 1.00 0.00 C ATOM 1447 CD GLU A 92 5.249 -14.762 7.756 1.00 0.00 C ATOM 1448 OE1 GLU A 92 5.503 -14.083 8.774 1.00 0.00 O ATOM 1449 OE2 GLU A 92 5.234 -16.010 7.690 1.00 0.00 O ATOM 0 H GLU A 92 3.847 -12.299 4.843 1.00 0.00 H new ATOM 0 HA GLU A 92 4.543 -11.400 7.463 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.326 -12.743 5.412 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.530 -12.722 7.152 1.00 0.00 H new ATOM 0 HG2 GLU A 92 3.870 -13.724 6.462 1.00 0.00 H new ATOM 0 HG3 GLU A 92 5.098 -14.636 5.608 1.00 0.00 H new ATOM 1456 N ALA A 93 5.815 -9.891 4.861 1.00 0.00 N ATOM 1457 CA ALA A 93 6.565 -8.724 4.428 1.00 0.00 C ATOM 1458 C ALA A 93 5.742 -7.463 4.702 1.00 0.00 C ATOM 1459 O ALA A 93 6.300 -6.398 4.959 1.00 0.00 O ATOM 1460 CB ALA A 93 6.931 -8.872 2.949 1.00 0.00 C ATOM 0 H ALA A 93 5.364 -10.411 4.109 1.00 0.00 H new ATOM 0 HA ALA A 93 7.497 -8.637 4.987 1.00 0.00 H new ATOM 0 HB1 ALA A 93 7.494 -7.997 2.624 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.540 -9.766 2.812 1.00 0.00 H new ATOM 0 HB3 ALA A 93 6.021 -8.959 2.356 1.00 0.00 H new ATOM 1466 N VAL A 94 4.429 -7.627 4.638 1.00 0.00 N ATOM 1467 CA VAL A 94 3.524 -6.515 4.876 1.00 0.00 C ATOM 1468 C VAL A 94 3.514 -6.183 6.370 1.00 0.00 C ATOM 1469 O VAL A 94 3.609 -5.017 6.750 1.00 0.00 O ATOM 1470 CB VAL A 94 2.135 -6.845 4.328 1.00 0.00 C ATOM 1471 CG1 VAL A 94 1.077 -5.909 4.916 1.00 0.00 C ATOM 1472 CG2 VAL A 94 2.122 -6.794 2.799 1.00 0.00 C ATOM 0 H VAL A 94 3.970 -8.513 4.425 1.00 0.00 H new ATOM 0 HA VAL A 94 3.864 -5.625 4.347 1.00 0.00 H new ATOM 0 HB VAL A 94 1.889 -7.863 4.631 1.00 0.00 H new ATOM 0 HG11 VAL A 94 0.098 -6.165 4.510 1.00 0.00 H new ATOM 0 HG12 VAL A 94 1.059 -6.016 6.001 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.319 -4.878 4.657 1.00 0.00 H new ATOM 0 HG21 VAL A 94 1.122 -7.033 2.435 1.00 0.00 H new ATOM 0 HG22 VAL A 94 2.400 -5.794 2.466 1.00 0.00 H new ATOM 0 HG23 VAL A 94 2.834 -7.519 2.405 1.00 0.00 H new ATOM 1482 N LEU A 95 3.398 -7.228 7.175 1.00 0.00 N ATOM 1483 CA LEU A 95 3.374 -7.062 8.619 1.00 0.00 C ATOM 1484 C LEU A 95 4.689 -6.427 9.076 1.00 0.00 C ATOM 1485 O LEU A 95 4.701 -5.608 9.994 1.00 0.00 O ATOM 1486 CB LEU A 95 3.061 -8.392 9.306 1.00 0.00 C ATOM 1487 CG LEU A 95 1.578 -8.719 9.489 1.00 0.00 C ATOM 1488 CD1 LEU A 95 0.910 -7.724 10.440 1.00 0.00 C ATOM 1489 CD2 LEU A 95 0.862 -8.792 8.139 1.00 0.00 C ATOM 0 H LEU A 95 3.320 -8.193 6.855 1.00 0.00 H new ATOM 0 HA LEU A 95 2.573 -6.383 8.912 1.00 0.00 H new ATOM 0 HB2 LEU A 95 3.521 -9.194 8.728 1.00 0.00 H new ATOM 0 HB3 LEU A 95 3.537 -8.392 10.287 1.00 0.00 H new ATOM 0 HG LEU A 95 1.500 -9.704 9.948 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.144 -7.979 10.552 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.399 -7.766 11.413 1.00 0.00 H new ATOM 0 HD13 LEU A 95 0.998 -6.717 10.033 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -0.191 -9.026 8.298 1.00 0.00 H new ATOM 0 HD22 LEU A 95 0.948 -7.832 7.629 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.318 -9.570 7.527 1.00 0.00 H new ATOM 1501 N GLU A 96 5.765 -6.830 8.416 1.00 0.00 N ATOM 1502 CA GLU A 96 7.082 -6.311 8.743 1.00 0.00 C ATOM 1503 C GLU A 96 7.098 -4.787 8.617 1.00 0.00 C ATOM 1504 O GLU A 96 7.999 -4.127 9.134 1.00 0.00 O ATOM 1505 CB GLU A 96 8.157 -6.946 7.859 1.00 0.00 C ATOM 1506 CG GLU A 96 8.342 -8.427 8.198 1.00 0.00 C ATOM 1507 CD GLU A 96 9.592 -8.641 9.055 1.00 0.00 C ATOM 1508 OE1 GLU A 96 9.677 -7.977 10.111 1.00 0.00 O ATOM 1509 OE2 GLU A 96 10.434 -9.463 8.635 1.00 0.00 O ATOM 0 H GLU A 96 5.751 -7.510 7.656 1.00 0.00 H new ATOM 0 HA GLU A 96 7.308 -6.573 9.777 1.00 0.00 H new ATOM 0 HB2 GLU A 96 7.879 -6.841 6.810 1.00 0.00 H new ATOM 0 HB3 GLU A 96 9.101 -6.418 7.993 1.00 0.00 H new ATOM 0 HG2 GLU A 96 7.465 -8.794 8.730 1.00 0.00 H new ATOM 0 HG3 GLU A 96 8.423 -9.007 7.279 1.00 0.00 H new ATOM 1516 N VAL A 97 6.091 -4.271 7.928 1.00 0.00 N ATOM 1517 CA VAL A 97 5.979 -2.836 7.728 1.00 0.00 C ATOM 1518 C VAL A 97 5.446 -2.187 9.007 1.00 0.00 C ATOM 1519 O VAL A 97 4.303 -2.422 9.397 1.00 0.00 O ATOM 1520 CB VAL A 97 5.109 -2.546 6.503 1.00 0.00 C ATOM 1521 CG1 VAL A 97 5.045 -1.043 6.220 1.00 0.00 C ATOM 1522 CG2 VAL A 97 5.611 -3.314 5.279 1.00 0.00 C ATOM 0 H VAL A 97 5.345 -4.821 7.501 1.00 0.00 H new ATOM 0 HA VAL A 97 6.958 -2.400 7.526 1.00 0.00 H new ATOM 0 HB VAL A 97 4.098 -2.889 6.721 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.421 -0.864 5.345 1.00 0.00 H new ATOM 0 HG12 VAL A 97 4.619 -0.528 7.081 1.00 0.00 H new ATOM 0 HG13 VAL A 97 6.050 -0.665 6.032 1.00 0.00 H new ATOM 0 HG21 VAL A 97 4.975 -3.090 4.423 1.00 0.00 H new ATOM 0 HG22 VAL A 97 6.636 -3.016 5.058 1.00 0.00 H new ATOM 0 HG23 VAL A 97 5.580 -4.384 5.483 1.00 0.00 H new ATOM 1532 N PRO A 98 6.322 -1.362 9.641 1.00 0.00 N ATOM 1533 CA PRO A 98 5.952 -0.678 10.868 1.00 0.00 C ATOM 1534 C PRO A 98 5.007 0.491 10.580 1.00 0.00 C ATOM 1535 O PRO A 98 4.805 0.860 9.424 1.00 0.00 O ATOM 1536 CB PRO A 98 7.269 -0.238 11.486 1.00 0.00 C ATOM 1537 CG PRO A 98 8.292 -0.281 10.362 1.00 0.00 C ATOM 1538 CD PRO A 98 7.684 -1.061 9.208 1.00 0.00 C ATOM 0 HA PRO A 98 5.399 -1.318 11.556 1.00 0.00 H new ATOM 0 HB2 PRO A 98 7.189 0.766 11.903 1.00 0.00 H new ATOM 0 HB3 PRO A 98 7.558 -0.900 12.302 1.00 0.00 H new ATOM 0 HG2 PRO A 98 8.553 0.729 10.045 1.00 0.00 H new ATOM 0 HG3 PRO A 98 9.212 -0.757 10.701 1.00 0.00 H new ATOM 0 HD2 PRO A 98 7.687 -0.475 8.289 1.00 0.00 H new ATOM 0 HD3 PRO A 98 8.246 -1.973 9.007 1.00 0.00 H new ATOM 1546 N PRO A 99 4.439 1.054 11.679 1.00 0.00 N ATOM 1547 CA PRO A 99 3.520 2.173 11.556 1.00 0.00 C ATOM 1548 C PRO A 99 4.271 3.467 11.239 1.00 0.00 C ATOM 1549 O PRO A 99 3.659 4.522 11.080 1.00 0.00 O ATOM 1550 CB PRO A 99 2.783 2.224 12.885 1.00 0.00 C ATOM 1551 CG PRO A 99 3.635 1.435 13.865 1.00 0.00 C ATOM 1552 CD PRO A 99 4.654 0.642 13.063 1.00 0.00 C ATOM 0 HA PRO A 99 2.818 2.053 10.731 1.00 0.00 H new ATOM 0 HB2 PRO A 99 2.654 3.253 13.221 1.00 0.00 H new ATOM 0 HB3 PRO A 99 1.787 1.790 12.796 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.137 2.107 14.562 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.013 0.766 14.459 1.00 0.00 H new ATOM 0 HD2 PRO A 99 5.671 0.861 13.388 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.505 -0.431 13.184 1.00 0.00 H new ATOM 1560 N GLY A 100 5.588 3.344 11.157 1.00 0.00 N ATOM 1561 CA GLY A 100 6.430 4.491 10.861 1.00 0.00 C ATOM 1562 C GLY A 100 7.518 4.127 9.850 1.00 0.00 C ATOM 1563 O GLY A 100 8.691 4.435 10.056 1.00 0.00 O ATOM 0 H GLY A 100 6.093 2.468 11.290 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.819 5.303 10.466 1.00 0.00 H new ATOM 0 HA3 GLY A 100 6.890 4.856 11.780 1.00 0.00 H new ATOM 1567 N PHE A 101 7.091 3.476 8.778 1.00 0.00 N ATOM 1568 CA PHE A 101 8.015 3.066 7.734 1.00 0.00 C ATOM 1569 C PHE A 101 8.381 4.246 6.831 1.00 0.00 C ATOM 1570 O PHE A 101 9.130 4.087 5.869 1.00 0.00 O ATOM 1571 CB PHE A 101 7.301 2.002 6.897 1.00 0.00 C ATOM 1572 CG PHE A 101 6.090 2.528 6.124 1.00 0.00 C ATOM 1573 CD1 PHE A 101 6.268 3.375 5.074 1.00 0.00 C ATOM 1574 CD2 PHE A 101 4.835 2.150 6.486 1.00 0.00 C ATOM 1575 CE1 PHE A 101 5.144 3.863 4.356 1.00 0.00 C ATOM 1576 CE2 PHE A 101 3.711 2.638 5.768 1.00 0.00 C ATOM 1577 CZ PHE A 101 3.889 3.484 4.719 1.00 0.00 C ATOM 0 H PHE A 101 6.117 3.222 8.610 1.00 0.00 H new ATOM 0 HA PHE A 101 8.934 2.685 8.180 1.00 0.00 H new ATOM 0 HB2 PHE A 101 8.012 1.573 6.191 1.00 0.00 H new ATOM 0 HB3 PHE A 101 6.977 1.195 7.554 1.00 0.00 H new ATOM 0 HD1 PHE A 101 7.264 3.676 4.786 1.00 0.00 H new ATOM 0 HD2 PHE A 101 4.693 1.478 7.320 1.00 0.00 H new ATOM 0 HE1 PHE A 101 5.286 4.535 3.522 1.00 0.00 H new ATOM 0 HE2 PHE A 101 2.714 2.337 6.056 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.034 3.855 4.174 1.00 0.00 H new ATOM 1587 N TYR A 102 7.836 5.404 7.175 1.00 0.00 N ATOM 1588 CA TYR A 102 8.097 6.610 6.409 1.00 0.00 C ATOM 1589 C TYR A 102 9.049 7.543 7.160 1.00 0.00 C ATOM 1590 O TYR A 102 9.885 8.206 6.549 1.00 0.00 O ATOM 1591 CB TYR A 102 6.744 7.306 6.245 1.00 0.00 C ATOM 1592 CG TYR A 102 6.052 7.640 7.568 1.00 0.00 C ATOM 1593 CD1 TYR A 102 6.299 8.847 8.190 1.00 0.00 C ATOM 1594 CD2 TYR A 102 5.180 6.735 8.138 1.00 0.00 C ATOM 1595 CE1 TYR A 102 5.648 9.161 9.436 1.00 0.00 C ATOM 1596 CE2 TYR A 102 4.529 7.049 9.383 1.00 0.00 C ATOM 1597 CZ TYR A 102 4.795 8.247 9.971 1.00 0.00 C ATOM 1598 OH TYR A 102 4.179 8.544 11.147 1.00 0.00 O ATOM 0 H TYR A 102 7.215 5.532 7.974 1.00 0.00 H new ATOM 0 HA TYR A 102 8.560 6.364 5.453 1.00 0.00 H new ATOM 0 HB2 TYR A 102 6.887 8.226 5.679 1.00 0.00 H new ATOM 0 HB3 TYR A 102 6.087 6.667 5.654 1.00 0.00 H new ATOM 0 HD1 TYR A 102 6.980 9.556 7.743 1.00 0.00 H new ATOM 0 HD2 TYR A 102 4.986 5.791 7.650 1.00 0.00 H new ATOM 0 HE1 TYR A 102 5.833 10.101 9.934 1.00 0.00 H new ATOM 0 HE2 TYR A 102 3.845 6.349 9.840 1.00 0.00 H new ATOM 0 HH TYR A 102 3.598 7.800 11.409 1.00 0.00 H new ATOM 1608 N ARG A 103 8.889 7.564 8.475 1.00 0.00 N ATOM 1609 CA ARG A 103 9.724 8.404 9.317 1.00 0.00 C ATOM 1610 C ARG A 103 11.154 8.444 8.774 1.00 0.00 C ATOM 1611 O ARG A 103 11.812 7.410 8.671 1.00 0.00 O ATOM 1612 CB ARG A 103 9.747 7.891 10.758 1.00 0.00 C ATOM 1613 CG ARG A 103 8.390 8.095 11.434 1.00 0.00 C ATOM 1614 CD ARG A 103 8.352 7.416 12.804 1.00 0.00 C ATOM 1615 NE ARG A 103 7.532 8.214 13.743 1.00 0.00 N ATOM 1616 CZ ARG A 103 7.991 9.268 14.431 1.00 0.00 C ATOM 1617 NH1 ARG A 103 9.265 9.657 14.291 1.00 0.00 N ATOM 1618 NH2 ARG A 103 7.175 9.933 15.261 1.00 0.00 N ATOM 0 H ARG A 103 8.194 7.013 8.978 1.00 0.00 H new ATOM 0 HA ARG A 103 9.300 9.408 9.308 1.00 0.00 H new ATOM 0 HB2 ARG A 103 10.006 6.832 10.767 1.00 0.00 H new ATOM 0 HB3 ARG A 103 10.520 8.413 11.321 1.00 0.00 H new ATOM 0 HG2 ARG A 103 8.193 9.161 11.547 1.00 0.00 H new ATOM 0 HG3 ARG A 103 7.600 7.690 10.801 1.00 0.00 H new ATOM 0 HD2 ARG A 103 7.938 6.412 12.710 1.00 0.00 H new ATOM 0 HD3 ARG A 103 9.364 7.308 13.194 1.00 0.00 H new ATOM 0 HE ARG A 103 6.557 7.945 13.874 1.00 0.00 H new ATOM 0 HH11 ARG A 103 9.886 9.151 13.660 1.00 0.00 H new ATOM 0 HH12 ARG A 103 9.614 10.460 14.815 1.00 0.00 H new ATOM 0 HH21 ARG A 103 6.205 9.636 15.369 1.00 0.00 H new ATOM 0 HH22 ARG A 103 7.524 10.735 15.785 1.00 0.00 H new ATOM 1632 N GLY A 104 11.594 9.649 8.442 1.00 0.00 N ATOM 1633 CA GLY A 104 12.934 9.838 7.913 1.00 0.00 C ATOM 1634 C GLY A 104 12.887 10.381 6.483 1.00 0.00 C ATOM 1635 O GLY A 104 13.253 11.530 6.240 1.00 0.00 O ATOM 0 H GLY A 104 11.046 10.505 8.529 1.00 0.00 H new ATOM 0 HA2 GLY A 104 13.486 10.529 8.550 1.00 0.00 H new ATOM 0 HA3 GLY A 104 13.472 8.890 7.929 1.00 0.00 H new ATOM 1639 N TYR A 105 12.435 9.530 5.575 1.00 0.00 N ATOM 1640 CA TYR A 105 12.336 9.910 4.176 1.00 0.00 C ATOM 1641 C TYR A 105 11.880 11.364 4.034 1.00 0.00 C ATOM 1642 O TYR A 105 12.705 12.266 3.900 1.00 0.00 O ATOM 1643 CB TYR A 105 11.275 8.993 3.564 1.00 0.00 C ATOM 1644 CG TYR A 105 11.752 7.558 3.331 1.00 0.00 C ATOM 1645 CD1 TYR A 105 12.756 7.304 2.419 1.00 0.00 C ATOM 1646 CD2 TYR A 105 11.177 6.518 4.032 1.00 0.00 C ATOM 1647 CE1 TYR A 105 13.205 5.954 2.200 1.00 0.00 C ATOM 1648 CE2 TYR A 105 11.626 5.167 3.813 1.00 0.00 C ATOM 1649 CZ TYR A 105 12.618 4.952 2.908 1.00 0.00 C ATOM 1650 OH TYR A 105 13.041 3.676 2.701 1.00 0.00 O ATOM 0 H TYR A 105 12.133 8.578 5.780 1.00 0.00 H new ATOM 0 HA TYR A 105 13.304 9.816 3.683 1.00 0.00 H new ATOM 0 HB2 TYR A 105 10.404 8.974 4.220 1.00 0.00 H new ATOM 0 HB3 TYR A 105 10.949 9.415 2.614 1.00 0.00 H new ATOM 0 HD1 TYR A 105 13.205 8.118 1.869 1.00 0.00 H new ATOM 0 HD2 TYR A 105 10.390 6.717 4.745 1.00 0.00 H new ATOM 0 HE1 TYR A 105 13.990 5.742 1.490 1.00 0.00 H new ATOM 0 HE2 TYR A 105 11.185 4.344 4.355 1.00 0.00 H new ATOM 0 HH TYR A 105 12.533 3.066 3.276 1.00 0.00 H new ATOM 1660 N GLY A 106 10.568 11.545 4.068 1.00 0.00 N ATOM 1661 CA GLY A 106 9.993 12.874 3.945 1.00 0.00 C ATOM 1662 C GLY A 106 8.534 12.799 3.491 1.00 0.00 C ATOM 1663 O GLY A 106 8.172 13.360 2.457 1.00 0.00 O ATOM 0 H GLY A 106 9.887 10.794 4.179 1.00 0.00 H new ATOM 0 HA2 GLY A 106 10.054 13.391 4.903 1.00 0.00 H new ATOM 0 HA3 GLY A 106 10.571 13.460 3.230 1.00 0.00 H new ATOM 1667 N LEU A 107 7.734 12.103 4.286 1.00 0.00 N ATOM 1668 CA LEU A 107 6.323 11.948 3.978 1.00 0.00 C ATOM 1669 C LEU A 107 5.510 12.924 4.831 1.00 0.00 C ATOM 1670 O LEU A 107 4.538 13.509 4.355 1.00 0.00 O ATOM 1671 CB LEU A 107 5.896 10.488 4.140 1.00 0.00 C ATOM 1672 CG LEU A 107 6.069 9.598 2.907 1.00 0.00 C ATOM 1673 CD1 LEU A 107 6.448 8.171 3.309 1.00 0.00 C ATOM 1674 CD2 LEU A 107 4.818 9.632 2.027 1.00 0.00 C ATOM 0 H LEU A 107 8.037 11.640 5.143 1.00 0.00 H new ATOM 0 HA LEU A 107 6.131 12.198 2.935 1.00 0.00 H new ATOM 0 HB2 LEU A 107 6.466 10.052 4.961 1.00 0.00 H new ATOM 0 HB3 LEU A 107 4.847 10.467 4.434 1.00 0.00 H new ATOM 0 HG LEU A 107 6.892 9.994 2.313 1.00 0.00 H new ATOM 0 HD11 LEU A 107 6.565 7.560 2.414 1.00 0.00 H new ATOM 0 HD12 LEU A 107 7.387 8.186 3.863 1.00 0.00 H new ATOM 0 HD13 LEU A 107 5.663 7.749 3.937 1.00 0.00 H new ATOM 0 HD21 LEU A 107 4.967 8.991 1.158 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.961 9.275 2.598 1.00 0.00 H new ATOM 0 HD23 LEU A 107 4.633 10.654 1.697 1.00 0.00 H new ATOM 1686 N GLU A 108 5.937 13.070 6.076 1.00 0.00 N ATOM 1687 CA GLU A 108 5.261 13.966 6.999 1.00 0.00 C ATOM 1688 C GLU A 108 5.250 15.392 6.444 1.00 0.00 C ATOM 1689 O GLU A 108 4.210 16.048 6.430 1.00 0.00 O ATOM 1690 CB GLU A 108 5.913 13.921 8.383 1.00 0.00 C ATOM 1691 CG GLU A 108 6.136 12.477 8.838 1.00 0.00 C ATOM 1692 CD GLU A 108 6.350 12.406 10.351 1.00 0.00 C ATOM 1693 OE1 GLU A 108 7.524 12.520 10.764 1.00 0.00 O ATOM 1694 OE2 GLU A 108 5.334 12.239 11.061 1.00 0.00 O ATOM 0 H GLU A 108 6.743 12.583 6.468 1.00 0.00 H new ATOM 0 HA GLU A 108 4.229 13.632 7.108 1.00 0.00 H new ATOM 0 HB2 GLU A 108 6.866 14.449 8.357 1.00 0.00 H new ATOM 0 HB3 GLU A 108 5.281 14.440 9.104 1.00 0.00 H new ATOM 0 HG2 GLU A 108 5.276 11.867 8.560 1.00 0.00 H new ATOM 0 HG3 GLU A 108 7.002 12.060 8.325 1.00 0.00 H new ATOM 1701 N GLU A 109 6.420 15.829 6.001 1.00 0.00 N ATOM 1702 CA GLU A 109 6.558 17.164 5.446 1.00 0.00 C ATOM 1703 C GLU A 109 5.354 17.500 4.564 1.00 0.00 C ATOM 1704 O GLU A 109 4.985 18.666 4.429 1.00 0.00 O ATOM 1705 CB GLU A 109 7.865 17.300 4.663 1.00 0.00 C ATOM 1706 CG GLU A 109 9.028 17.649 5.594 1.00 0.00 C ATOM 1707 CD GLU A 109 9.962 18.674 4.946 1.00 0.00 C ATOM 1708 OE1 GLU A 109 10.901 18.227 4.252 1.00 0.00 O ATOM 1709 OE2 GLU A 109 9.715 19.880 5.159 1.00 0.00 O ATOM 0 H GLU A 109 7.281 15.282 6.015 1.00 0.00 H new ATOM 0 HA GLU A 109 6.590 17.877 6.270 1.00 0.00 H new ATOM 0 HB2 GLU A 109 8.079 16.367 4.141 1.00 0.00 H new ATOM 0 HB3 GLU A 109 7.759 18.073 3.902 1.00 0.00 H new ATOM 0 HG2 GLU A 109 8.641 18.047 6.532 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.587 16.746 5.838 1.00 0.00 H new ATOM 1716 N PHE A 110 4.774 16.458 3.988 1.00 0.00 N ATOM 1717 CA PHE A 110 3.618 16.628 3.123 1.00 0.00 C ATOM 1718 C PHE A 110 2.332 16.206 3.837 1.00 0.00 C ATOM 1719 O PHE A 110 1.356 16.955 3.858 1.00 0.00 O ATOM 1720 CB PHE A 110 3.833 15.724 1.907 1.00 0.00 C ATOM 1721 CG PHE A 110 5.012 16.137 1.025 1.00 0.00 C ATOM 1722 CD1 PHE A 110 4.895 17.203 0.189 1.00 0.00 C ATOM 1723 CD2 PHE A 110 6.178 15.438 1.076 1.00 0.00 C ATOM 1724 CE1 PHE A 110 5.990 17.587 -0.630 1.00 0.00 C ATOM 1725 CE2 PHE A 110 7.272 15.821 0.257 1.00 0.00 C ATOM 1726 CZ PHE A 110 7.155 16.888 -0.579 1.00 0.00 C ATOM 0 H PHE A 110 5.082 15.493 4.103 1.00 0.00 H new ATOM 0 HA PHE A 110 3.517 17.675 2.839 1.00 0.00 H new ATOM 0 HB2 PHE A 110 3.990 14.702 2.251 1.00 0.00 H new ATOM 0 HB3 PHE A 110 2.925 15.721 1.304 1.00 0.00 H new ATOM 0 HD1 PHE A 110 3.969 17.758 0.148 1.00 0.00 H new ATOM 0 HD2 PHE A 110 6.271 14.591 1.740 1.00 0.00 H new ATOM 0 HE1 PHE A 110 5.897 18.434 -1.293 1.00 0.00 H new ATOM 0 HE2 PHE A 110 8.197 15.266 0.297 1.00 0.00 H new ATOM 0 HZ PHE A 110 7.988 17.180 -1.202 1.00 0.00 H new ATOM 1736 N PHE A 111 2.373 15.009 4.404 1.00 0.00 N ATOM 1737 CA PHE A 111 1.223 14.479 5.116 1.00 0.00 C ATOM 1738 C PHE A 111 1.090 15.124 6.498 1.00 0.00 C ATOM 1739 O PHE A 111 1.871 14.832 7.401 1.00 0.00 O ATOM 1740 CB PHE A 111 1.457 12.977 5.288 1.00 0.00 C ATOM 1741 CG PHE A 111 1.153 12.153 4.035 1.00 0.00 C ATOM 1742 CD1 PHE A 111 -0.134 11.858 3.711 1.00 0.00 C ATOM 1743 CD2 PHE A 111 2.171 11.714 3.247 1.00 0.00 C ATOM 1744 CE1 PHE A 111 -0.416 11.093 2.548 1.00 0.00 C ATOM 1745 CE2 PHE A 111 1.889 10.949 2.084 1.00 0.00 C ATOM 1746 CZ PHE A 111 0.601 10.655 1.759 1.00 0.00 C ATOM 0 H PHE A 111 3.185 14.391 4.385 1.00 0.00 H new ATOM 0 HA PHE A 111 0.310 14.687 4.557 1.00 0.00 H new ATOM 0 HB2 PHE A 111 2.495 12.812 5.576 1.00 0.00 H new ATOM 0 HB3 PHE A 111 0.837 12.615 6.108 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -0.942 12.205 4.338 1.00 0.00 H new ATOM 0 HD2 PHE A 111 3.193 11.947 3.506 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -1.438 10.859 2.290 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.697 10.601 1.458 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.386 10.074 0.874 1.00 0.00 H new ATOM 1756 N THR A 112 0.093 15.988 6.618 1.00 0.00 N ATOM 1757 CA THR A 112 -0.153 16.677 7.874 1.00 0.00 C ATOM 1758 C THR A 112 0.077 15.731 9.054 1.00 0.00 C ATOM 1759 O THR A 112 0.033 14.512 8.896 1.00 0.00 O ATOM 1760 CB THR A 112 -1.569 17.256 7.826 1.00 0.00 C ATOM 1761 OG1 THR A 112 -2.397 16.126 7.568 1.00 0.00 O ATOM 1762 CG2 THR A 112 -1.789 18.164 6.615 1.00 0.00 C ATOM 0 H THR A 112 -0.554 16.227 5.866 1.00 0.00 H new ATOM 0 HA THR A 112 0.546 17.501 8.017 1.00 0.00 H new ATOM 0 HB THR A 112 -1.763 17.817 8.740 1.00 0.00 H new ATOM 0 HG1 THR A 112 -3.319 16.329 7.832 1.00 0.00 H new ATOM 0 HG21 THR A 112 -2.809 18.548 6.629 1.00 0.00 H new ATOM 0 HG22 THR A 112 -1.087 18.997 6.652 1.00 0.00 H new ATOM 0 HG23 THR A 112 -1.628 17.595 5.699 1.00 0.00 H new ATOM 1770 N PRO A 113 0.324 16.345 10.242 1.00 0.00 N ATOM 1771 CA PRO A 113 0.562 15.571 11.449 1.00 0.00 C ATOM 1772 C PRO A 113 -0.743 14.980 11.987 1.00 0.00 C ATOM 1773 O PRO A 113 -0.727 14.173 12.915 1.00 0.00 O ATOM 1774 CB PRO A 113 1.216 16.543 12.417 1.00 0.00 C ATOM 1775 CG PRO A 113 0.900 17.933 11.890 1.00 0.00 C ATOM 1776 CD PRO A 113 0.384 17.786 10.468 1.00 0.00 C ATOM 0 HA PRO A 113 1.205 14.708 11.275 1.00 0.00 H new ATOM 0 HB2 PRO A 113 0.827 16.410 13.426 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.293 16.380 12.467 1.00 0.00 H new ATOM 0 HG2 PRO A 113 0.154 18.419 12.519 1.00 0.00 H new ATOM 0 HG3 PRO A 113 1.791 18.560 11.910 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -0.598 18.246 10.354 1.00 0.00 H new ATOM 0 HD3 PRO A 113 1.049 18.271 9.753 1.00 0.00 H new ATOM 1784 N LEU A 114 -1.842 15.404 11.380 1.00 0.00 N ATOM 1785 CA LEU A 114 -3.153 14.927 11.786 1.00 0.00 C ATOM 1786 C LEU A 114 -3.489 13.652 11.010 1.00 0.00 C ATOM 1787 O LEU A 114 -3.582 12.572 11.592 1.00 0.00 O ATOM 1788 CB LEU A 114 -4.197 16.034 11.633 1.00 0.00 C ATOM 1789 CG LEU A 114 -4.581 16.776 12.915 1.00 0.00 C ATOM 1790 CD1 LEU A 114 -5.117 15.807 13.970 1.00 0.00 C ATOM 1791 CD2 LEU A 114 -3.406 17.604 13.441 1.00 0.00 C ATOM 0 H LEU A 114 -1.851 16.073 10.610 1.00 0.00 H new ATOM 0 HA LEU A 114 -3.153 14.666 12.844 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -3.823 16.762 10.914 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -5.100 15.598 11.205 1.00 0.00 H new ATOM 0 HG LEU A 114 -5.386 17.472 12.679 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -5.382 16.360 14.871 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -6.000 15.299 13.582 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -4.351 15.070 14.210 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -3.705 18.122 14.353 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -2.565 16.946 13.657 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -3.111 18.335 12.689 1.00 0.00 H new ATOM 1803 N ARG A 115 -3.663 13.819 9.707 1.00 0.00 N ATOM 1804 CA ARG A 115 -3.988 12.695 8.845 1.00 0.00 C ATOM 1805 C ARG A 115 -3.039 11.526 9.118 1.00 0.00 C ATOM 1806 O ARG A 115 -3.470 10.376 9.188 1.00 0.00 O ATOM 1807 CB ARG A 115 -3.891 13.087 7.369 1.00 0.00 C ATOM 1808 CG ARG A 115 -5.091 13.938 6.949 1.00 0.00 C ATOM 1809 CD ARG A 115 -4.732 14.848 5.772 1.00 0.00 C ATOM 1810 NE ARG A 115 -5.885 15.712 5.431 1.00 0.00 N ATOM 1811 CZ ARG A 115 -5.786 16.863 4.752 1.00 0.00 C ATOM 1812 NH1 ARG A 115 -4.587 17.296 4.339 1.00 0.00 N ATOM 1813 NH2 ARG A 115 -6.885 17.581 4.487 1.00 0.00 N ATOM 0 H ARG A 115 -3.585 14.716 9.227 1.00 0.00 H new ATOM 0 HA ARG A 115 -5.013 12.395 9.063 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -2.969 13.642 7.196 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -3.844 12.189 6.753 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -5.922 13.290 6.672 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -5.426 14.543 7.792 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -3.869 15.463 6.027 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -4.450 14.246 4.908 1.00 0.00 H new ATOM 0 HE ARG A 115 -6.812 15.412 5.732 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -3.750 16.749 4.541 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -4.511 18.172 3.822 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -7.798 17.252 4.802 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -6.809 18.457 3.970 1.00 0.00 H new ATOM 1827 N LEU A 116 -1.766 11.860 9.265 1.00 0.00 N ATOM 1828 CA LEU A 116 -0.753 10.852 9.529 1.00 0.00 C ATOM 1829 C LEU A 116 -1.303 9.832 10.528 1.00 0.00 C ATOM 1830 O LEU A 116 -1.395 8.645 10.220 1.00 0.00 O ATOM 1831 CB LEU A 116 0.553 11.510 9.979 1.00 0.00 C ATOM 1832 CG LEU A 116 1.505 11.943 8.862 1.00 0.00 C ATOM 1833 CD1 LEU A 116 2.718 12.682 9.431 1.00 0.00 C ATOM 1834 CD2 LEU A 116 1.915 10.749 7.997 1.00 0.00 C ATOM 0 H LEU A 116 -1.412 12.815 9.206 1.00 0.00 H new ATOM 0 HA LEU A 116 -0.511 10.307 8.616 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.307 12.386 10.580 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.082 10.814 10.631 1.00 0.00 H new ATOM 0 HG LEU A 116 0.976 12.643 8.215 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.378 12.979 8.616 1.00 0.00 H new ATOM 0 HD12 LEU A 116 2.384 13.569 9.969 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.257 12.025 10.114 1.00 0.00 H new ATOM 0 HD21 LEU A 116 2.592 11.084 7.211 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.418 10.007 8.617 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.028 10.304 7.547 1.00 0.00 H new ATOM 1846 N ARG A 117 -1.654 10.332 11.703 1.00 0.00 N ATOM 1847 CA ARG A 117 -2.193 9.479 12.749 1.00 0.00 C ATOM 1848 C ARG A 117 -3.168 8.461 12.154 1.00 0.00 C ATOM 1849 O ARG A 117 -3.015 7.258 12.355 1.00 0.00 O ATOM 1850 CB ARG A 117 -2.916 10.304 13.816 1.00 0.00 C ATOM 1851 CG ARG A 117 -1.950 11.266 14.512 1.00 0.00 C ATOM 1852 CD ARG A 117 -2.382 11.525 15.957 1.00 0.00 C ATOM 1853 NE ARG A 117 -1.297 12.210 16.694 1.00 0.00 N ATOM 1854 CZ ARG A 117 -1.453 12.792 17.891 1.00 0.00 C ATOM 1855 NH1 ARG A 117 -2.650 12.777 18.492 1.00 0.00 N ATOM 1856 NH2 ARG A 117 -0.412 13.391 18.486 1.00 0.00 N ATOM 0 H ARG A 117 -1.576 11.317 11.954 1.00 0.00 H new ATOM 0 HA ARG A 117 -1.357 8.958 13.215 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -3.728 10.867 13.357 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -3.366 9.638 14.553 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -0.943 10.849 14.499 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -1.912 12.208 13.965 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -3.285 12.136 15.972 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -2.627 10.582 16.447 1.00 0.00 H new ATOM 0 HE ARG A 117 -0.373 12.241 16.264 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -3.443 12.323 18.039 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -2.769 13.220 19.403 1.00 0.00 H new ATOM 0 HH21 ARG A 117 0.499 13.404 18.028 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -0.531 13.834 19.397 1.00 0.00 H new ATOM 1870 N GLY A 118 -4.150 8.982 11.433 1.00 0.00 N ATOM 1871 CA GLY A 118 -5.151 8.134 10.807 1.00 0.00 C ATOM 1872 C GLY A 118 -4.515 7.220 9.757 1.00 0.00 C ATOM 1873 O GLY A 118 -4.645 5.999 9.832 1.00 0.00 O ATOM 0 H GLY A 118 -4.274 9.981 11.268 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -5.648 7.531 11.566 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -5.917 8.753 10.340 1.00 0.00 H new ATOM 1877 N LEU A 119 -3.842 7.846 8.803 1.00 0.00 N ATOM 1878 CA LEU A 119 -3.187 7.104 7.740 1.00 0.00 C ATOM 1879 C LEU A 119 -2.546 5.844 8.323 1.00 0.00 C ATOM 1880 O LEU A 119 -2.940 4.729 7.984 1.00 0.00 O ATOM 1881 CB LEU A 119 -2.203 8.003 6.988 1.00 0.00 C ATOM 1882 CG LEU A 119 -2.743 8.684 5.729 1.00 0.00 C ATOM 1883 CD1 LEU A 119 -4.255 8.897 5.828 1.00 0.00 C ATOM 1884 CD2 LEU A 119 -1.997 9.990 5.449 1.00 0.00 C ATOM 0 H LEU A 119 -3.736 8.859 8.744 1.00 0.00 H new ATOM 0 HA LEU A 119 -3.916 6.777 6.999 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -1.852 8.775 7.672 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -1.335 7.405 6.710 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.565 8.024 4.880 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -4.614 9.383 4.921 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -4.751 7.934 5.945 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -4.478 9.527 6.689 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.400 10.454 4.549 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -2.121 10.668 6.293 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -0.937 9.780 5.305 1.00 0.00 H new ATOM 1896 N GLU A 120 -1.569 6.062 9.192 1.00 0.00 N ATOM 1897 CA GLU A 120 -0.870 4.957 9.825 1.00 0.00 C ATOM 1898 C GLU A 120 -1.865 3.880 10.262 1.00 0.00 C ATOM 1899 O GLU A 120 -1.629 2.691 10.055 1.00 0.00 O ATOM 1900 CB GLU A 120 -0.035 5.445 11.011 1.00 0.00 C ATOM 1901 CG GLU A 120 0.972 6.509 10.571 1.00 0.00 C ATOM 1902 CD GLU A 120 1.542 6.186 9.189 1.00 0.00 C ATOM 1903 OE1 GLU A 120 2.000 5.036 9.018 1.00 0.00 O ATOM 1904 OE2 GLU A 120 1.507 7.097 8.334 1.00 0.00 O ATOM 0 H GLU A 120 -1.245 6.988 9.472 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.187 4.519 9.097 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.691 5.856 11.778 1.00 0.00 H new ATOM 0 HB3 GLU A 120 0.492 4.603 11.460 1.00 0.00 H new ATOM 0 HG2 GLU A 120 0.489 7.486 10.550 1.00 0.00 H new ATOM 0 HG3 GLU A 120 1.782 6.570 11.297 1.00 0.00 H new ATOM 1911 N ALA A 121 -2.958 4.335 10.858 1.00 0.00 N ATOM 1912 CA ALA A 121 -3.990 3.425 11.325 1.00 0.00 C ATOM 1913 C ALA A 121 -4.324 2.427 10.215 1.00 0.00 C ATOM 1914 O ALA A 121 -4.552 1.248 10.483 1.00 0.00 O ATOM 1915 CB ALA A 121 -5.212 4.227 11.776 1.00 0.00 C ATOM 0 H ALA A 121 -3.151 5.322 11.028 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.639 2.855 12.185 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.986 3.544 12.126 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -4.928 4.899 12.586 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -5.594 4.810 10.938 1.00 0.00 H new ATOM 1921 N ALA A 122 -4.344 2.936 8.991 1.00 0.00 N ATOM 1922 CA ALA A 122 -4.647 2.104 7.839 1.00 0.00 C ATOM 1923 C ALA A 122 -3.788 0.839 7.889 1.00 0.00 C ATOM 1924 O ALA A 122 -4.314 -0.273 7.893 1.00 0.00 O ATOM 1925 CB ALA A 122 -4.426 2.908 6.557 1.00 0.00 C ATOM 0 H ALA A 122 -4.155 3.914 8.773 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.692 1.794 7.854 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -4.653 2.284 5.693 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -5.080 3.780 6.557 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.387 3.234 6.506 1.00 0.00 H new ATOM 1931 N LEU A 123 -2.480 1.051 7.927 1.00 0.00 N ATOM 1932 CA LEU A 123 -1.544 -0.059 7.977 1.00 0.00 C ATOM 1933 C LEU A 123 -1.859 -0.933 9.193 1.00 0.00 C ATOM 1934 O LEU A 123 -2.041 -2.142 9.062 1.00 0.00 O ATOM 1935 CB LEU A 123 -0.103 0.455 7.946 1.00 0.00 C ATOM 1936 CG LEU A 123 0.990 -0.603 8.111 1.00 0.00 C ATOM 1937 CD1 LEU A 123 1.267 -1.317 6.786 1.00 0.00 C ATOM 1938 CD2 LEU A 123 2.259 0.007 8.709 1.00 0.00 C ATOM 0 H LEU A 123 -2.047 1.975 7.924 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.653 -0.690 7.095 1.00 0.00 H new ATOM 0 HB2 LEU A 123 0.058 0.970 6.999 1.00 0.00 H new ATOM 0 HB3 LEU A 123 0.014 1.196 8.736 1.00 0.00 H new ATOM 0 HG LEU A 123 0.633 -1.355 8.814 1.00 0.00 H new ATOM 0 HD11 LEU A 123 2.048 -2.064 6.931 1.00 0.00 H new ATOM 0 HD12 LEU A 123 0.357 -1.806 6.439 1.00 0.00 H new ATOM 0 HD13 LEU A 123 1.594 -0.590 6.042 1.00 0.00 H new ATOM 0 HD21 LEU A 123 3.019 -0.767 8.815 1.00 0.00 H new ATOM 0 HD22 LEU A 123 2.630 0.792 8.051 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.033 0.431 9.688 1.00 0.00 H new ATOM 1950 N LEU A 124 -1.915 -0.286 10.348 1.00 0.00 N ATOM 1951 CA LEU A 124 -2.205 -0.990 11.586 1.00 0.00 C ATOM 1952 C LEU A 124 -3.475 -1.824 11.407 1.00 0.00 C ATOM 1953 O LEU A 124 -3.560 -2.945 11.907 1.00 0.00 O ATOM 1954 CB LEU A 124 -2.274 -0.007 12.757 1.00 0.00 C ATOM 1955 CG LEU A 124 -0.989 0.767 13.060 1.00 0.00 C ATOM 1956 CD1 LEU A 124 -1.299 2.088 13.766 1.00 0.00 C ATOM 1957 CD2 LEU A 124 -0.007 -0.093 13.857 1.00 0.00 C ATOM 0 H LEU A 124 -1.765 0.717 10.453 1.00 0.00 H new ATOM 0 HA LEU A 124 -1.400 -1.683 11.829 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -3.069 0.712 12.556 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -2.562 -0.559 13.652 1.00 0.00 H new ATOM 0 HG LEU A 124 -0.507 1.013 12.114 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -0.369 2.619 13.970 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -1.934 2.702 13.127 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -1.815 1.887 14.705 1.00 0.00 H new ATOM 0 HD21 LEU A 124 0.898 0.480 14.059 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -0.466 -0.391 14.800 1.00 0.00 H new ATOM 0 HD23 LEU A 124 0.248 -0.982 13.281 1.00 0.00 H new ATOM 1969 N ARG A 125 -4.429 -1.246 10.694 1.00 0.00 N ATOM 1970 CA ARG A 125 -5.691 -1.922 10.443 1.00 0.00 C ATOM 1971 C ARG A 125 -5.468 -3.148 9.554 1.00 0.00 C ATOM 1972 O ARG A 125 -5.743 -4.274 9.964 1.00 0.00 O ATOM 1973 CB ARG A 125 -6.693 -0.985 9.767 1.00 0.00 C ATOM 1974 CG ARG A 125 -7.341 -0.047 10.787 1.00 0.00 C ATOM 1975 CD ARG A 125 -8.748 0.359 10.343 1.00 0.00 C ATOM 1976 NE ARG A 125 -9.731 -0.653 10.790 1.00 0.00 N ATOM 1977 CZ ARG A 125 -10.088 -0.841 12.068 1.00 0.00 C ATOM 1978 NH1 ARG A 125 -9.544 -0.087 13.033 1.00 0.00 N ATOM 1979 NH2 ARG A 125 -10.988 -1.783 12.382 1.00 0.00 N ATOM 0 H ARG A 125 -4.354 -0.316 10.281 1.00 0.00 H new ATOM 0 HA ARG A 125 -6.097 -2.235 11.405 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -6.188 -0.399 8.999 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -7.463 -1.571 9.266 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -7.390 -0.539 11.759 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -6.724 0.843 10.911 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -9.002 1.334 10.759 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -8.782 0.457 9.258 1.00 0.00 H new ATOM 0 HE ARG A 125 -10.164 -1.245 10.081 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -8.858 0.630 12.795 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -9.815 -0.230 14.006 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -11.402 -2.358 11.648 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -11.259 -1.925 13.355 1.00 0.00 H new ATOM 1993 N LEU A 126 -4.974 -2.886 8.353 1.00 0.00 N ATOM 1994 CA LEU A 126 -4.711 -3.953 7.403 1.00 0.00 C ATOM 1995 C LEU A 126 -3.900 -5.054 8.090 1.00 0.00 C ATOM 1996 O LEU A 126 -4.266 -6.227 8.032 1.00 0.00 O ATOM 1997 CB LEU A 126 -4.048 -3.397 6.142 1.00 0.00 C ATOM 1998 CG LEU A 126 -4.847 -2.342 5.373 1.00 0.00 C ATOM 1999 CD1 LEU A 126 -3.929 -1.238 4.844 1.00 0.00 C ATOM 2000 CD2 LEU A 126 -5.674 -2.985 4.258 1.00 0.00 C ATOM 0 H LEU A 126 -4.749 -1.950 8.016 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.645 -4.405 7.071 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -3.087 -2.964 6.421 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -3.839 -4.228 5.469 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.549 -1.874 6.063 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.521 -0.501 4.301 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.424 -0.754 5.680 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.187 -1.672 4.174 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.232 -2.213 3.728 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.010 -3.496 3.561 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.370 -3.704 4.690 1.00 0.00 H new ATOM 2012 N GLN A 127 -2.815 -4.636 8.724 1.00 0.00 N ATOM 2013 CA GLN A 127 -1.949 -5.572 9.421 1.00 0.00 C ATOM 2014 C GLN A 127 -2.765 -6.430 10.390 1.00 0.00 C ATOM 2015 O GLN A 127 -2.389 -7.562 10.691 1.00 0.00 O ATOM 2016 CB GLN A 127 -0.824 -4.838 10.153 1.00 0.00 C ATOM 2017 CG GLN A 127 0.168 -4.226 9.161 1.00 0.00 C ATOM 2018 CD GLN A 127 1.589 -4.239 9.728 1.00 0.00 C ATOM 2019 OE1 GLN A 127 1.808 -4.376 10.921 1.00 0.00 O ATOM 2020 NE2 GLN A 127 2.539 -4.088 8.810 1.00 0.00 N ATOM 0 H GLN A 127 -2.515 -3.662 8.770 1.00 0.00 H new ATOM 0 HA GLN A 127 -1.489 -6.229 8.683 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -1.246 -4.054 10.782 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -0.303 -5.531 10.814 1.00 0.00 H new ATOM 0 HG2 GLN A 127 0.141 -4.783 8.224 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -0.127 -3.202 8.932 1.00 0.00 H new ATOM 0 HE21 GLN A 127 2.286 -3.978 7.828 1.00 0.00 H new ATOM 0 HE22 GLN A 127 3.520 -4.082 9.088 1.00 0.00 H new ATOM 2029 N ALA A 128 -3.866 -5.857 10.853 1.00 0.00 N ATOM 2030 CA ALA A 128 -4.739 -6.554 11.783 1.00 0.00 C ATOM 2031 C ALA A 128 -5.682 -7.470 11.000 1.00 0.00 C ATOM 2032 O ALA A 128 -6.145 -8.483 11.523 1.00 0.00 O ATOM 2033 CB ALA A 128 -5.493 -5.535 12.638 1.00 0.00 C ATOM 0 H ALA A 128 -4.174 -4.918 10.602 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.157 -7.180 12.460 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -6.147 -6.058 13.335 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -4.779 -4.929 13.196 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -6.091 -4.890 11.993 1.00 0.00 H new ATOM 2039 N GLN A 129 -5.939 -7.081 9.760 1.00 0.00 N ATOM 2040 CA GLN A 129 -6.819 -7.855 8.900 1.00 0.00 C ATOM 2041 C GLN A 129 -6.053 -9.016 8.263 1.00 0.00 C ATOM 2042 O GLN A 129 -6.633 -10.060 7.968 1.00 0.00 O ATOM 2043 CB GLN A 129 -7.459 -6.967 7.830 1.00 0.00 C ATOM 2044 CG GLN A 129 -8.328 -5.881 8.467 1.00 0.00 C ATOM 2045 CD GLN A 129 -8.638 -4.768 7.464 1.00 0.00 C ATOM 2046 OE1 GLN A 129 -7.977 -4.610 6.450 1.00 0.00 O ATOM 2047 NE2 GLN A 129 -9.676 -4.009 7.801 1.00 0.00 N ATOM 0 H GLN A 129 -5.554 -6.240 9.330 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.622 -8.268 9.511 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.681 -6.505 7.222 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -8.066 -7.577 7.161 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.258 -6.320 8.828 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -7.816 -5.462 9.333 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.186 -4.196 8.664 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -9.963 -3.239 7.196 1.00 0.00 H new ATOM 2056 N VAL A 130 -4.761 -8.794 8.069 1.00 0.00 N ATOM 2057 CA VAL A 130 -3.909 -9.809 7.472 1.00 0.00 C ATOM 2058 C VAL A 130 -3.543 -10.849 8.533 1.00 0.00 C ATOM 2059 O VAL A 130 -3.779 -12.042 8.345 1.00 0.00 O ATOM 2060 CB VAL A 130 -2.685 -9.153 6.830 1.00 0.00 C ATOM 2061 CG1 VAL A 130 -1.753 -10.206 6.226 1.00 0.00 C ATOM 2062 CG2 VAL A 130 -3.103 -8.123 5.779 1.00 0.00 C ATOM 0 H VAL A 130 -4.284 -7.927 8.315 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.437 -10.331 6.674 1.00 0.00 H new ATOM 0 HB VAL A 130 -2.136 -8.629 7.612 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -0.891 -9.714 5.776 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.415 -10.885 7.009 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -2.288 -10.770 5.462 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -2.214 -7.672 5.338 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -3.685 -8.614 4.999 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -3.708 -7.348 6.250 1.00 0.00 H new ATOM 2072 N ARG A 131 -2.972 -10.360 9.623 1.00 0.00 N ATOM 2073 CA ARG A 131 -2.570 -11.232 10.714 1.00 0.00 C ATOM 2074 C ARG A 131 -3.656 -12.275 10.986 1.00 0.00 C ATOM 2075 O ARG A 131 -3.353 -13.420 11.320 1.00 0.00 O ATOM 2076 CB ARG A 131 -2.309 -10.432 11.992 1.00 0.00 C ATOM 2077 CG ARG A 131 -0.983 -9.674 11.903 1.00 0.00 C ATOM 2078 CD ARG A 131 -0.932 -8.538 12.926 1.00 0.00 C ATOM 2079 NE ARG A 131 0.323 -8.617 13.707 1.00 0.00 N ATOM 2080 CZ ARG A 131 0.768 -7.644 14.514 1.00 0.00 C ATOM 2081 NH1 ARG A 131 0.063 -6.512 14.650 1.00 0.00 N ATOM 2082 NH2 ARG A 131 1.917 -7.802 15.184 1.00 0.00 N ATOM 0 H ARG A 131 -2.778 -9.370 9.775 1.00 0.00 H new ATOM 0 HA ARG A 131 -1.647 -11.731 10.417 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -3.124 -9.728 12.157 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -2.290 -11.105 12.849 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -0.155 -10.361 12.076 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -0.858 -9.270 10.899 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -0.994 -7.576 12.417 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -1.791 -8.600 13.594 1.00 0.00 H new ATOM 0 HE ARG A 131 0.884 -9.465 13.626 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -0.812 -6.392 14.139 1.00 0.00 H new ATOM 0 HH12 ARG A 131 0.401 -5.771 15.264 1.00 0.00 H new ATOM 0 HH21 ARG A 131 2.454 -8.663 15.080 1.00 0.00 H new ATOM 0 HH22 ARG A 131 2.255 -7.061 15.798 1.00 0.00 H new ATOM 2096 N LYS A 132 -4.899 -11.843 10.833 1.00 0.00 N ATOM 2097 CA LYS A 132 -6.032 -12.725 11.059 1.00 0.00 C ATOM 2098 C LYS A 132 -5.981 -13.879 10.056 1.00 0.00 C ATOM 2099 O LYS A 132 -6.183 -15.035 10.424 1.00 0.00 O ATOM 2100 CB LYS A 132 -7.342 -11.935 11.022 1.00 0.00 C ATOM 2101 CG LYS A 132 -8.431 -12.713 10.281 1.00 0.00 C ATOM 2102 CD LYS A 132 -8.431 -12.370 8.790 1.00 0.00 C ATOM 2103 CE LYS A 132 -8.893 -13.565 7.953 1.00 0.00 C ATOM 2104 NZ LYS A 132 -10.367 -13.567 7.821 1.00 0.00 N ATOM 0 H LYS A 132 -5.147 -10.893 10.555 1.00 0.00 H new ATOM 0 HA LYS A 132 -5.980 -13.165 12.055 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -7.671 -11.721 12.039 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -7.178 -10.975 10.532 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -8.271 -13.783 10.412 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -9.405 -12.481 10.711 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -9.087 -11.519 8.609 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -7.429 -12.071 8.482 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -8.434 -13.524 6.965 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -8.563 -14.493 8.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -10.663 -14.384 7.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -10.800 -13.628 8.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -10.675 -12.690 7.355 1.00 0.00 H new ATOM 2118 N ALA A 133 -5.711 -13.525 8.808 1.00 0.00 N ATOM 2119 CA ALA A 133 -5.631 -14.517 7.749 1.00 0.00 C ATOM 2120 C ALA A 133 -4.628 -15.602 8.147 1.00 0.00 C ATOM 2121 O ALA A 133 -4.922 -16.791 8.045 1.00 0.00 O ATOM 2122 CB ALA A 133 -5.257 -13.831 6.434 1.00 0.00 C ATOM 0 H ALA A 133 -5.545 -12.565 8.506 1.00 0.00 H new ATOM 0 HA ALA A 133 -6.597 -15.000 7.601 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -5.197 -14.575 5.640 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -6.016 -13.091 6.181 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -4.291 -13.338 6.543 1.00 0.00 H new ATOM 2128 N LEU A 134 -3.464 -15.152 8.592 1.00 0.00 N ATOM 2129 CA LEU A 134 -2.416 -16.069 9.006 1.00 0.00 C ATOM 2130 C LEU A 134 -3.022 -17.168 9.881 1.00 0.00 C ATOM 2131 O LEU A 134 -2.817 -18.353 9.626 1.00 0.00 O ATOM 2132 CB LEU A 134 -1.272 -15.308 9.678 1.00 0.00 C ATOM 2133 CG LEU A 134 -0.374 -14.488 8.749 1.00 0.00 C ATOM 2134 CD1 LEU A 134 -1.169 -13.379 8.056 1.00 0.00 C ATOM 2135 CD2 LEU A 134 0.839 -13.938 9.502 1.00 0.00 C ATOM 0 H LEU A 134 -3.224 -14.164 8.675 1.00 0.00 H new ATOM 0 HA LEU A 134 -1.975 -16.559 8.138 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -1.697 -14.637 10.424 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -0.649 -16.026 10.212 1.00 0.00 H new ATOM 0 HG LEU A 134 0.004 -15.149 7.969 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -0.507 -12.811 7.402 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -1.971 -13.821 7.465 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -1.595 -12.713 8.807 1.00 0.00 H new ATOM 0 HD21 LEU A 134 1.460 -13.359 8.818 1.00 0.00 H new ATOM 0 HD22 LEU A 134 0.502 -13.297 10.316 1.00 0.00 H new ATOM 0 HD23 LEU A 134 1.421 -14.765 9.909 1.00 0.00 H new ATOM 2147 N THR A 135 -3.755 -16.734 10.896 1.00 0.00 N ATOM 2148 CA THR A 135 -4.393 -17.666 11.811 1.00 0.00 C ATOM 2149 C THR A 135 -5.611 -18.314 11.150 1.00 0.00 C ATOM 2150 O THR A 135 -6.008 -19.417 11.520 1.00 0.00 O ATOM 2151 CB THR A 135 -4.730 -16.909 13.097 1.00 0.00 C ATOM 2152 OG1 THR A 135 -5.168 -17.926 13.994 1.00 0.00 O ATOM 2153 CG2 THR A 135 -5.951 -16.001 12.939 1.00 0.00 C ATOM 0 H THR A 135 -3.921 -15.750 11.105 1.00 0.00 H new ATOM 0 HA THR A 135 -3.726 -18.489 12.066 1.00 0.00 H new ATOM 0 HB THR A 135 -3.871 -16.312 13.402 1.00 0.00 H new ATOM 0 HG1 THR A 135 -5.406 -17.523 14.855 1.00 0.00 H new ATOM 0 HG21 THR A 135 -6.147 -15.487 13.880 1.00 0.00 H new ATOM 0 HG22 THR A 135 -5.759 -15.266 12.158 1.00 0.00 H new ATOM 0 HG23 THR A 135 -6.819 -16.602 12.666 1.00 0.00 H new ATOM 2161 N SER A 136 -6.169 -17.600 10.183 1.00 0.00 N ATOM 2162 CA SER A 136 -7.333 -18.092 9.466 1.00 0.00 C ATOM 2163 C SER A 136 -6.914 -18.644 8.102 1.00 0.00 C ATOM 2164 O SER A 136 -7.743 -18.783 7.204 1.00 0.00 O ATOM 2165 CB SER A 136 -8.380 -16.990 9.294 1.00 0.00 C ATOM 2166 OG SER A 136 -9.706 -17.511 9.275 1.00 0.00 O ATOM 0 H SER A 136 -5.836 -16.685 9.879 1.00 0.00 H new ATOM 0 HA SER A 136 -7.782 -18.894 10.052 1.00 0.00 H new ATOM 0 HB2 SER A 136 -8.285 -16.270 10.107 1.00 0.00 H new ATOM 0 HB3 SER A 136 -8.189 -16.450 8.366 1.00 0.00 H new ATOM 0 HG SER A 136 -10.345 -16.776 9.165 1.00 0.00 H new