USER MOD reduce.3.24.130724 H: found=0, std=0, add=630, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 629 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 22 THR OG1 : rot 180:sc= 0.869 USER MOD Set 1.2: A 25 ASN : amide:sc= 1.17 X(o=2,f=2.1) USER MOD Set 2.1: A 6 LYS NZ :NH3+ -159:sc= 1.17 (180deg=-0.973) USER MOD Set 2.2: A 12 THR OG1 : rot -176:sc= 0.851 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 164:sc= 1.21 (180deg=1.17) USER MOD Single : A 2 GLN : amide:sc= -0.0536 X(o=-0.054,f=-0.054) USER MOD Single : A 7 THR OG1 : rot -60:sc= 0.321 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ -156:sc= 1.04 (180deg=0.425) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0994 USER MOD Single : A 27 LYS NZ :NH3+ 166:sc= 0.842 (180deg=0.701) USER MOD Single : A 29 LYS NZ :NH3+ -176:sc= 1.06 (180deg=0.996) USER MOD Single : A 31 GLN : amide:sc= -1.33! K(o=-1.3!,f=-0.03) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.395 K(o=-0.4,f=-3.4!) USER MOD Single : A 41 GLN : amide:sc= 0.731 K(o=0.73,f=-5.8!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 1.02 K(o=1,f=-4.8!) USER MOD Single : A 55 THR OG1 : rot 160:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 30:sc= 0.789 USER MOD Single : A 60 ASN : amide:sc= -0.119 X(o=-0.12,f=-0.12) USER MOD Single : A 62 GLN : amide:sc= -0.325 X(o=-0.32,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 90:sc= 1.2 USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.0162 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.213 31.648 15.633 1.00 0.00 N ATOM 2 CA MET A 1 14.223 31.562 17.099 1.00 0.00 C ATOM 3 C MET A 1 15.614 31.938 17.629 1.00 0.00 C ATOM 4 O MET A 1 16.594 31.716 16.937 1.00 0.00 O ATOM 5 CB MET A 1 13.649 30.225 17.585 1.00 0.00 C ATOM 6 CG MET A 1 14.420 28.934 17.319 1.00 0.00 C ATOM 7 SD MET A 1 13.513 27.416 17.696 1.00 0.00 S ATOM 8 CE MET A 1 14.806 26.254 18.193 1.00 0.00 C ATOM 0 H1 MET A 1 13.382 31.145 15.261 1.00 0.00 H new ATOM 0 H2 MET A 1 14.171 32.646 15.344 1.00 0.00 H new ATOM 0 H3 MET A 1 15.079 31.214 15.254 1.00 0.00 H new ATOM 0 HA MET A 1 13.545 32.296 17.534 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.506 30.304 18.663 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.661 30.113 17.139 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.715 28.913 16.270 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.337 28.948 17.907 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.355 25.294 18.444 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.510 26.120 17.372 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.333 26.646 19.063 1.00 0.00 H new ATOM 20 N GLN A 2 15.661 32.388 18.880 1.00 0.00 N ATOM 21 CA GLN A 2 16.832 32.740 19.651 1.00 0.00 C ATOM 22 C GLN A 2 17.195 31.636 20.649 1.00 0.00 C ATOM 23 O GLN A 2 16.378 31.024 21.338 1.00 0.00 O ATOM 24 CB GLN A 2 16.636 34.112 20.302 1.00 0.00 C ATOM 25 CG GLN A 2 16.756 35.240 19.280 1.00 0.00 C ATOM 26 CD GLN A 2 15.580 35.524 18.352 1.00 0.00 C ATOM 27 OE1 GLN A 2 15.706 35.745 17.159 1.00 0.00 O ATOM 28 NE2 GLN A 2 14.363 35.648 18.867 1.00 0.00 N ATOM 0 H GLN A 2 14.805 32.524 19.418 1.00 0.00 H new ATOM 0 HA GLN A 2 17.691 32.824 18.985 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.656 34.153 20.777 1.00 0.00 H new ATOM 0 HB3 GLN A 2 17.378 34.252 21.088 1.00 0.00 H new ATOM 0 HG2 GLN A 2 16.973 36.158 19.827 1.00 0.00 H new ATOM 0 HG3 GLN A 2 17.624 35.028 18.656 1.00 0.00 H new ATOM 0 HE21 GLN A 2 14.209 35.473 19.860 1.00 0.00 H new ATOM 0 HE22 GLN A 2 13.582 35.918 18.270 1.00 0.00 H new ATOM 37 N ILE A 3 18.510 31.485 20.732 1.00 0.00 N ATOM 38 CA ILE A 3 19.233 30.780 21.771 1.00 0.00 C ATOM 39 C ILE A 3 20.398 31.654 22.221 1.00 0.00 C ATOM 40 O ILE A 3 20.850 32.443 21.389 1.00 0.00 O ATOM 41 CB ILE A 3 19.681 29.378 21.345 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.313 29.329 19.953 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.541 28.371 21.401 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.254 28.148 19.763 1.00 0.00 C ATOM 0 H ILE A 3 19.136 31.878 20.029 1.00 0.00 H new ATOM 0 HA ILE A 3 18.563 30.606 22.613 1.00 0.00 H new ATOM 0 HB ILE A 3 20.447 29.108 22.071 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.523 29.280 19.204 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.862 30.254 19.777 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.905 27.392 21.091 1.00 0.00 H new ATOM 0 HG22 ILE A 3 18.159 28.310 22.420 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.741 28.689 20.732 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.669 28.172 18.755 1.00 0.00 H new ATOM 0 HD12 ILE A 3 22.064 28.207 20.490 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.704 27.218 19.908 1.00 0.00 H new ATOM 56 N PHE A 4 20.777 31.661 23.497 1.00 0.00 N ATOM 57 CA PHE A 4 21.953 32.355 23.984 1.00 0.00 C ATOM 58 C PHE A 4 23.056 31.299 23.971 1.00 0.00 C ATOM 59 O PHE A 4 22.768 30.186 24.428 1.00 0.00 O ATOM 60 CB PHE A 4 21.659 32.972 25.346 1.00 0.00 C ATOM 61 CG PHE A 4 20.382 33.782 25.439 1.00 0.00 C ATOM 62 CD1 PHE A 4 20.308 35.021 24.798 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.236 33.303 26.087 1.00 0.00 C ATOM 64 CE1 PHE A 4 19.106 35.720 24.717 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.035 34.022 26.037 1.00 0.00 C ATOM 66 CZ PHE A 4 17.943 35.218 25.319 1.00 0.00 C ATOM 0 H PHE A 4 20.262 31.174 24.230 1.00 0.00 H new ATOM 0 HA PHE A 4 22.265 33.203 23.375 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.614 32.172 26.085 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.496 33.614 25.622 1.00 0.00 H new ATOM 0 HD1 PHE A 4 21.199 35.444 24.357 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.279 32.371 26.630 1.00 0.00 H new ATOM 0 HE1 PHE A 4 19.069 36.659 24.185 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.168 33.647 26.560 1.00 0.00 H new ATOM 0 HZ PHE A 4 17.002 35.741 25.230 1.00 0.00 H new ATOM 76 N VAL A 5 24.301 31.561 23.613 1.00 0.00 N ATOM 77 CA VAL A 5 25.397 30.620 23.794 1.00 0.00 C ATOM 78 C VAL A 5 26.401 31.348 24.679 1.00 0.00 C ATOM 79 O VAL A 5 26.741 32.477 24.330 1.00 0.00 O ATOM 80 CB VAL A 5 25.941 30.156 22.436 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.244 29.374 22.546 1.00 0.00 C ATOM 82 CG2 VAL A 5 24.939 29.380 21.593 1.00 0.00 C ATOM 0 H VAL A 5 24.584 32.442 23.184 1.00 0.00 H new ATOM 0 HA VAL A 5 25.102 29.689 24.279 1.00 0.00 H new ATOM 0 HB VAL A 5 26.145 31.090 21.913 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.574 29.076 21.551 1.00 0.00 H new ATOM 0 HG12 VAL A 5 28.006 30.001 23.009 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.085 28.486 23.157 1.00 0.00 H new ATOM 0 HG21 VAL A 5 25.404 29.090 20.651 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.624 28.487 22.133 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.070 30.007 21.391 1.00 0.00 H new ATOM 92 N LYS A 6 26.807 30.852 25.846 1.00 0.00 N ATOM 93 CA LYS A 6 27.800 31.439 26.720 1.00 0.00 C ATOM 94 C LYS A 6 29.154 30.883 26.291 1.00 0.00 C ATOM 95 O LYS A 6 29.347 29.687 26.145 1.00 0.00 O ATOM 96 CB LYS A 6 27.599 31.243 28.224 1.00 0.00 C ATOM 97 CG LYS A 6 26.665 32.314 28.791 1.00 0.00 C ATOM 98 CD LYS A 6 26.605 32.237 30.321 1.00 0.00 C ATOM 99 CE LYS A 6 25.734 33.361 30.873 1.00 0.00 C ATOM 100 NZ LYS A 6 26.259 34.645 30.385 1.00 0.00 N ATOM 0 H LYS A 6 26.427 29.983 26.220 1.00 0.00 H new ATOM 0 HA LYS A 6 27.716 32.519 26.602 1.00 0.00 H new ATOM 0 HB2 LYS A 6 27.183 30.254 28.414 1.00 0.00 H new ATOM 0 HB3 LYS A 6 28.562 31.287 28.733 1.00 0.00 H new ATOM 0 HG2 LYS A 6 27.011 33.302 28.486 1.00 0.00 H new ATOM 0 HG3 LYS A 6 25.665 32.185 28.377 1.00 0.00 H new ATOM 0 HD2 LYS A 6 26.203 31.272 30.628 1.00 0.00 H new ATOM 0 HD3 LYS A 6 27.611 32.310 30.735 1.00 0.00 H new ATOM 0 HE2 LYS A 6 24.700 33.230 30.554 1.00 0.00 H new ATOM 0 HE3 LYS A 6 25.737 33.341 31.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 25.929 35.413 31.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 27.299 34.619 30.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 25.921 34.812 29.416 1.00 0.00 H new ATOM 114 N THR A 7 30.138 31.725 25.967 1.00 0.00 N ATOM 115 CA THR A 7 31.405 31.311 25.408 1.00 0.00 C ATOM 116 C THR A 7 32.556 31.229 26.419 1.00 0.00 C ATOM 117 O THR A 7 32.315 31.422 27.605 1.00 0.00 O ATOM 118 CB THR A 7 31.599 32.094 24.111 1.00 0.00 C ATOM 119 OG1 THR A 7 31.633 33.494 24.295 1.00 0.00 O ATOM 120 CG2 THR A 7 30.564 31.859 23.012 1.00 0.00 C ATOM 0 H THR A 7 30.064 32.734 26.093 1.00 0.00 H new ATOM 0 HA THR A 7 31.404 30.257 25.130 1.00 0.00 H new ATOM 0 HB THR A 7 32.561 31.694 23.790 1.00 0.00 H new ATOM 0 HG1 THR A 7 30.790 33.792 24.696 1.00 0.00 H new ATOM 0 HG21 THR A 7 30.810 32.470 22.144 1.00 0.00 H new ATOM 0 HG22 THR A 7 30.568 30.807 22.728 1.00 0.00 H new ATOM 0 HG23 THR A 7 29.575 32.132 23.379 1.00 0.00 H new ATOM 128 N LEU A 8 33.806 31.118 25.975 1.00 0.00 N ATOM 129 CA LEU A 8 35.025 30.982 26.747 1.00 0.00 C ATOM 130 C LEU A 8 35.236 31.851 27.994 1.00 0.00 C ATOM 131 O LEU A 8 36.056 31.558 28.855 1.00 0.00 O ATOM 132 CB LEU A 8 36.166 31.080 25.741 1.00 0.00 C ATOM 133 CG LEU A 8 36.504 29.976 24.741 1.00 0.00 C ATOM 134 CD1 LEU A 8 35.353 29.808 23.744 1.00 0.00 C ATOM 135 CD2 LEU A 8 37.810 30.321 24.025 1.00 0.00 C ATOM 0 H LEU A 8 34.002 31.122 24.974 1.00 0.00 H new ATOM 0 HA LEU A 8 34.965 30.018 27.253 1.00 0.00 H new ATOM 0 HB2 LEU A 8 35.982 31.980 25.154 1.00 0.00 H new ATOM 0 HB3 LEU A 8 37.072 31.257 26.321 1.00 0.00 H new ATOM 0 HG LEU A 8 36.638 29.030 25.265 1.00 0.00 H new ATOM 0 HD11 LEU A 8 35.600 29.019 23.033 1.00 0.00 H new ATOM 0 HD12 LEU A 8 34.443 29.541 24.281 1.00 0.00 H new ATOM 0 HD13 LEU A 8 35.197 30.744 23.208 1.00 0.00 H new ATOM 0 HD21 LEU A 8 38.052 29.534 23.311 1.00 0.00 H new ATOM 0 HD22 LEU A 8 37.696 31.268 23.497 1.00 0.00 H new ATOM 0 HD23 LEU A 8 38.614 30.408 24.756 1.00 0.00 H new ATOM 147 N THR A 9 34.724 33.087 27.969 1.00 0.00 N ATOM 148 CA THR A 9 34.818 34.094 29.005 1.00 0.00 C ATOM 149 C THR A 9 33.474 34.357 29.690 1.00 0.00 C ATOM 150 O THR A 9 33.345 35.179 30.596 1.00 0.00 O ATOM 151 CB THR A 9 35.320 35.436 28.478 1.00 0.00 C ATOM 152 OG1 THR A 9 34.383 36.065 27.631 1.00 0.00 O ATOM 153 CG2 THR A 9 36.736 35.611 27.930 1.00 0.00 C ATOM 0 H THR A 9 34.198 33.423 27.162 1.00 0.00 H new ATOM 0 HA THR A 9 35.532 33.681 29.718 1.00 0.00 H new ATOM 0 HB THR A 9 35.424 35.936 29.441 1.00 0.00 H new ATOM 0 HG1 THR A 9 34.746 36.920 27.319 1.00 0.00 H new ATOM 0 HG21 THR A 9 36.878 36.644 27.611 1.00 0.00 H new ATOM 0 HG22 THR A 9 37.460 35.369 28.708 1.00 0.00 H new ATOM 0 HG23 THR A 9 36.882 34.945 27.079 1.00 0.00 H new ATOM 161 N GLY A 10 32.440 33.709 29.168 1.00 0.00 N ATOM 162 CA GLY A 10 31.113 33.869 29.736 1.00 0.00 C ATOM 163 C GLY A 10 30.222 34.936 29.081 1.00 0.00 C ATOM 164 O GLY A 10 29.077 35.102 29.511 1.00 0.00 O ATOM 0 H GLY A 10 32.494 33.080 28.367 1.00 0.00 H new ATOM 0 HA2 GLY A 10 30.598 32.910 29.680 1.00 0.00 H new ATOM 0 HA3 GLY A 10 31.219 34.112 30.793 1.00 0.00 H new ATOM 168 N LYS A 11 30.754 35.635 28.085 1.00 0.00 N ATOM 169 CA LYS A 11 30.128 36.599 27.204 1.00 0.00 C ATOM 170 C LYS A 11 29.078 35.792 26.431 1.00 0.00 C ATOM 171 O LYS A 11 29.415 34.751 25.876 1.00 0.00 O ATOM 172 CB LYS A 11 31.259 37.131 26.333 1.00 0.00 C ATOM 173 CG LYS A 11 30.865 38.245 25.368 1.00 0.00 C ATOM 174 CD LYS A 11 32.060 38.813 24.597 1.00 0.00 C ATOM 175 CE LYS A 11 32.476 37.752 23.567 1.00 0.00 C ATOM 176 NZ LYS A 11 33.264 38.411 22.517 1.00 0.00 N ATOM 0 H LYS A 11 31.742 35.524 27.855 1.00 0.00 H new ATOM 0 HA LYS A 11 29.634 37.449 27.675 1.00 0.00 H new ATOM 0 HB2 LYS A 11 32.054 37.498 26.982 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.674 36.303 25.758 1.00 0.00 H new ATOM 0 HG2 LYS A 11 30.130 37.863 24.660 1.00 0.00 H new ATOM 0 HG3 LYS A 11 30.383 39.048 25.925 1.00 0.00 H new ATOM 0 HD2 LYS A 11 31.791 39.746 24.102 1.00 0.00 H new ATOM 0 HD3 LYS A 11 32.884 39.037 25.274 1.00 0.00 H new ATOM 0 HE2 LYS A 11 33.062 36.968 24.046 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.595 37.274 23.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 33.213 37.852 21.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 32.883 39.363 22.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 34.255 38.486 22.822 1.00 0.00 H new ATOM 190 N THR A 12 27.841 36.281 26.447 1.00 0.00 N ATOM 191 CA THR A 12 26.721 35.654 25.777 1.00 0.00 C ATOM 192 C THR A 12 26.627 36.228 24.363 1.00 0.00 C ATOM 193 O THR A 12 26.812 37.435 24.187 1.00 0.00 O ATOM 194 CB THR A 12 25.437 35.982 26.530 1.00 0.00 C ATOM 195 OG1 THR A 12 25.418 35.123 27.658 1.00 0.00 O ATOM 196 CG2 THR A 12 24.153 35.933 25.692 1.00 0.00 C ATOM 0 H THR A 12 27.591 37.140 26.937 1.00 0.00 H new ATOM 0 HA THR A 12 26.859 34.573 25.743 1.00 0.00 H new ATOM 0 HB THR A 12 25.447 37.030 26.831 1.00 0.00 H new ATOM 0 HG1 THR A 12 24.579 35.247 28.149 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.298 36.182 26.321 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.224 36.652 24.875 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.023 34.931 25.283 1.00 0.00 H new ATOM 204 N ILE A 13 26.494 35.351 23.366 1.00 0.00 N ATOM 205 CA ILE A 13 26.190 35.726 22.001 1.00 0.00 C ATOM 206 C ILE A 13 24.848 35.097 21.654 1.00 0.00 C ATOM 207 O ILE A 13 24.471 34.009 22.087 1.00 0.00 O ATOM 208 CB ILE A 13 27.273 35.231 21.030 1.00 0.00 C ATOM 209 CG1 ILE A 13 27.664 33.764 21.244 1.00 0.00 C ATOM 210 CG2 ILE A 13 28.406 36.247 20.962 1.00 0.00 C ATOM 211 CD1 ILE A 13 28.464 33.080 20.136 1.00 0.00 C ATOM 0 H ILE A 13 26.598 34.345 23.496 1.00 0.00 H new ATOM 0 HA ILE A 13 26.154 36.812 21.911 1.00 0.00 H new ATOM 0 HB ILE A 13 26.865 35.186 20.020 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.243 33.701 22.165 1.00 0.00 H new ATOM 0 HG13 ILE A 13 26.750 33.192 21.402 1.00 0.00 H new ATOM 0 HG21 ILE A 13 29.172 35.892 20.272 1.00 0.00 H new ATOM 0 HG22 ILE A 13 28.017 37.203 20.612 1.00 0.00 H new ATOM 0 HG23 ILE A 13 28.841 36.374 21.953 1.00 0.00 H new ATOM 0 HD11 ILE A 13 28.671 32.048 20.420 1.00 0.00 H new ATOM 0 HD12 ILE A 13 27.888 33.093 19.210 1.00 0.00 H new ATOM 0 HD13 ILE A 13 29.404 33.610 19.986 1.00 0.00 H new ATOM 223 N THR A 14 24.002 35.896 21.005 1.00 0.00 N ATOM 224 CA THR A 14 22.670 35.536 20.563 1.00 0.00 C ATOM 225 C THR A 14 22.694 34.924 19.159 1.00 0.00 C ATOM 226 O THR A 14 23.120 35.692 18.309 1.00 0.00 O ATOM 227 CB THR A 14 21.718 36.729 20.522 1.00 0.00 C ATOM 228 OG1 THR A 14 21.773 37.370 21.782 1.00 0.00 O ATOM 229 CG2 THR A 14 20.241 36.370 20.382 1.00 0.00 C ATOM 0 H THR A 14 24.246 36.857 20.765 1.00 0.00 H new ATOM 0 HA THR A 14 22.312 34.813 21.296 1.00 0.00 H new ATOM 0 HB THR A 14 22.036 37.317 19.661 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.170 38.143 21.782 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.645 37.282 20.362 1.00 0.00 H new ATOM 0 HG22 THR A 14 20.087 35.816 19.456 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.934 35.755 21.228 1.00 0.00 H new ATOM 237 N LEU A 15 22.391 33.633 19.024 1.00 0.00 N ATOM 238 CA LEU A 15 22.479 32.978 17.741 1.00 0.00 C ATOM 239 C LEU A 15 21.007 32.902 17.329 1.00 0.00 C ATOM 240 O LEU A 15 20.187 32.341 18.057 1.00 0.00 O ATOM 241 CB LEU A 15 22.977 31.547 17.931 1.00 0.00 C ATOM 242 CG LEU A 15 24.492 31.398 18.120 1.00 0.00 C ATOM 243 CD1 LEU A 15 25.336 31.826 16.914 1.00 0.00 C ATOM 244 CD2 LEU A 15 24.976 32.091 19.393 1.00 0.00 C ATOM 0 H LEU A 15 22.085 33.032 19.789 1.00 0.00 H new ATOM 0 HA LEU A 15 23.139 33.483 17.036 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.476 31.118 18.799 1.00 0.00 H new ATOM 0 HB3 LEU A 15 22.676 30.957 17.065 1.00 0.00 H new ATOM 0 HG LEU A 15 24.648 30.324 18.219 1.00 0.00 H new ATOM 0 HD11 LEU A 15 26.393 31.685 17.141 1.00 0.00 H new ATOM 0 HD12 LEU A 15 25.067 31.221 16.048 1.00 0.00 H new ATOM 0 HD13 LEU A 15 25.149 32.877 16.694 1.00 0.00 H new ATOM 0 HD21 LEU A 15 26.054 31.962 19.490 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.741 33.154 19.340 1.00 0.00 H new ATOM 0 HD23 LEU A 15 24.479 31.652 20.258 1.00 0.00 H new ATOM 256 N GLU A 16 20.559 33.315 16.142 1.00 0.00 N ATOM 257 CA GLU A 16 19.314 33.081 15.431 1.00 0.00 C ATOM 258 C GLU A 16 19.526 31.729 14.754 1.00 0.00 C ATOM 259 O GLU A 16 20.506 31.468 14.072 1.00 0.00 O ATOM 260 CB GLU A 16 19.156 34.142 14.334 1.00 0.00 C ATOM 261 CG GLU A 16 17.755 34.235 13.742 1.00 0.00 C ATOM 262 CD GLU A 16 17.412 35.539 13.046 1.00 0.00 C ATOM 263 OE1 GLU A 16 18.040 36.572 13.378 1.00 0.00 O ATOM 264 OE2 GLU A 16 16.586 35.550 12.115 1.00 0.00 O ATOM 0 H GLU A 16 21.162 33.914 15.578 1.00 0.00 H new ATOM 0 HA GLU A 16 18.442 33.113 16.084 1.00 0.00 H new ATOM 0 HB2 GLU A 16 19.429 35.114 14.745 1.00 0.00 H new ATOM 0 HB3 GLU A 16 19.862 33.925 13.532 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.629 33.421 13.028 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.033 34.072 14.542 1.00 0.00 H new ATOM 271 N VAL A 17 18.461 30.960 14.941 1.00 0.00 N ATOM 272 CA VAL A 17 18.354 29.579 14.487 1.00 0.00 C ATOM 273 C VAL A 17 16.916 29.314 14.067 1.00 0.00 C ATOM 274 O VAL A 17 15.999 30.011 14.499 1.00 0.00 O ATOM 275 CB VAL A 17 18.940 28.607 15.514 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.430 28.811 15.794 1.00 0.00 C ATOM 277 CG2 VAL A 17 18.196 28.539 16.846 1.00 0.00 C ATOM 0 H VAL A 17 17.626 31.288 15.425 1.00 0.00 H new ATOM 0 HA VAL A 17 18.967 29.406 13.602 1.00 0.00 H new ATOM 0 HB VAL A 17 18.803 27.652 15.007 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.765 28.082 16.532 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.995 28.679 14.871 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.593 29.818 16.178 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.690 27.823 17.503 1.00 0.00 H new ATOM 0 HG22 VAL A 17 18.199 29.523 17.315 1.00 0.00 H new ATOM 0 HG23 VAL A 17 17.167 28.223 16.673 1.00 0.00 H new ATOM 287 N GLU A 18 16.756 28.154 13.419 1.00 0.00 N ATOM 288 CA GLU A 18 15.441 27.619 13.140 1.00 0.00 C ATOM 289 C GLU A 18 15.381 26.168 13.634 1.00 0.00 C ATOM 290 O GLU A 18 16.401 25.514 13.840 1.00 0.00 O ATOM 291 CB GLU A 18 14.971 27.803 11.702 1.00 0.00 C ATOM 292 CG GLU A 18 14.775 29.275 11.345 1.00 0.00 C ATOM 293 CD GLU A 18 13.361 29.706 11.718 1.00 0.00 C ATOM 294 OE1 GLU A 18 12.713 29.119 12.618 1.00 0.00 O ATOM 295 OE2 GLU A 18 12.798 30.599 11.041 1.00 0.00 O ATOM 0 H GLU A 18 17.527 27.577 13.083 1.00 0.00 H new ATOM 0 HA GLU A 18 14.713 28.210 13.696 1.00 0.00 H new ATOM 0 HB2 GLU A 18 15.700 27.360 11.023 1.00 0.00 H new ATOM 0 HB3 GLU A 18 14.033 27.267 11.556 1.00 0.00 H new ATOM 0 HG2 GLU A 18 15.505 29.888 11.874 1.00 0.00 H new ATOM 0 HG3 GLU A 18 14.943 29.427 10.279 1.00 0.00 H new ATOM 302 N PRO A 19 14.198 25.626 13.899 1.00 0.00 N ATOM 303 CA PRO A 19 13.993 24.310 14.475 1.00 0.00 C ATOM 304 C PRO A 19 14.354 23.139 13.556 1.00 0.00 C ATOM 305 O PRO A 19 14.290 21.986 13.961 1.00 0.00 O ATOM 306 CB PRO A 19 12.543 24.201 14.941 1.00 0.00 C ATOM 307 CG PRO A 19 11.844 25.484 14.490 1.00 0.00 C ATOM 308 CD PRO A 19 12.963 26.377 13.964 1.00 0.00 C ATOM 0 HA PRO A 19 14.686 24.224 15.312 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.061 23.324 14.508 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.491 24.091 16.024 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.105 25.280 13.716 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.316 25.958 15.317 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.704 26.756 12.975 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.087 27.243 14.615 1.00 0.00 H new ATOM 316 N SER A 20 14.683 23.409 12.294 1.00 0.00 N ATOM 317 CA SER A 20 15.292 22.549 11.312 1.00 0.00 C ATOM 318 C SER A 20 16.827 22.548 11.391 1.00 0.00 C ATOM 319 O SER A 20 17.404 21.553 10.974 1.00 0.00 O ATOM 320 CB SER A 20 14.723 23.103 10.007 1.00 0.00 C ATOM 321 OG SER A 20 14.988 24.485 9.882 1.00 0.00 O ATOM 0 H SER A 20 14.506 24.336 11.906 1.00 0.00 H new ATOM 0 HA SER A 20 15.068 21.491 11.446 1.00 0.00 H new ATOM 0 HB2 SER A 20 15.157 22.569 9.162 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.647 22.932 9.974 1.00 0.00 H new ATOM 0 HG SER A 20 14.615 24.815 9.038 1.00 0.00 H new ATOM 327 N ASP A 21 17.507 23.455 12.092 1.00 0.00 N ATOM 328 CA ASP A 21 18.939 23.561 12.223 1.00 0.00 C ATOM 329 C ASP A 21 19.604 22.437 13.035 1.00 0.00 C ATOM 330 O ASP A 21 19.164 22.207 14.162 1.00 0.00 O ATOM 331 CB ASP A 21 19.298 24.853 12.954 1.00 0.00 C ATOM 332 CG ASP A 21 19.262 26.108 12.095 1.00 0.00 C ATOM 333 OD1 ASP A 21 18.976 26.027 10.877 1.00 0.00 O ATOM 334 OD2 ASP A 21 19.606 27.192 12.618 1.00 0.00 O ATOM 0 H ASP A 21 17.024 24.184 12.618 1.00 0.00 H new ATOM 0 HA ASP A 21 19.304 23.514 11.197 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.611 24.983 13.790 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.297 24.748 13.376 1.00 0.00 H new ATOM 339 N THR A 22 20.667 21.863 12.495 1.00 0.00 N ATOM 340 CA THR A 22 21.543 20.905 13.144 1.00 0.00 C ATOM 341 C THR A 22 22.733 21.557 13.854 1.00 0.00 C ATOM 342 O THR A 22 22.994 22.735 13.637 1.00 0.00 O ATOM 343 CB THR A 22 21.889 19.830 12.105 1.00 0.00 C ATOM 344 OG1 THR A 22 22.674 20.227 11.007 1.00 0.00 O ATOM 345 CG2 THR A 22 20.626 19.150 11.593 1.00 0.00 C ATOM 0 H THR A 22 20.957 22.066 11.538 1.00 0.00 H new ATOM 0 HA THR A 22 21.039 20.418 13.979 1.00 0.00 H new ATOM 0 HB THR A 22 22.524 19.145 12.667 1.00 0.00 H new ATOM 0 HG1 THR A 22 22.827 19.458 10.419 1.00 0.00 H new ATOM 0 HG21 THR A 22 20.894 18.391 10.857 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.103 18.679 12.426 1.00 0.00 H new ATOM 0 HG23 THR A 22 19.976 19.892 11.129 1.00 0.00 H new ATOM 353 N ILE A 23 23.489 20.827 14.664 1.00 0.00 N ATOM 354 CA ILE A 23 24.651 21.337 15.357 1.00 0.00 C ATOM 355 C ILE A 23 25.793 21.556 14.360 1.00 0.00 C ATOM 356 O ILE A 23 26.502 22.548 14.518 1.00 0.00 O ATOM 357 CB ILE A 23 25.055 20.338 16.448 1.00 0.00 C ATOM 358 CG1 ILE A 23 24.483 20.691 17.821 1.00 0.00 C ATOM 359 CG2 ILE A 23 26.540 19.987 16.601 1.00 0.00 C ATOM 360 CD1 ILE A 23 23.069 20.185 18.053 1.00 0.00 C ATOM 0 H ILE A 23 23.302 19.843 14.857 1.00 0.00 H new ATOM 0 HA ILE A 23 24.422 22.295 15.823 1.00 0.00 H new ATOM 0 HB ILE A 23 24.597 19.432 16.051 1.00 0.00 H new ATOM 0 HG12 ILE A 23 25.135 20.280 18.591 1.00 0.00 H new ATOM 0 HG13 ILE A 23 24.494 21.774 17.939 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.663 19.270 17.413 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.908 19.551 15.673 1.00 0.00 H new ATOM 0 HG23 ILE A 23 27.106 20.891 16.827 1.00 0.00 H new ATOM 0 HD11 ILE A 23 22.737 20.477 19.049 1.00 0.00 H new ATOM 0 HD12 ILE A 23 22.401 20.616 17.307 1.00 0.00 H new ATOM 0 HD13 ILE A 23 23.053 19.098 17.969 1.00 0.00 H new ATOM 372 N GLU A 24 25.780 20.979 13.163 1.00 0.00 N ATOM 373 CA GLU A 24 26.580 21.426 12.037 1.00 0.00 C ATOM 374 C GLU A 24 26.226 22.838 11.586 1.00 0.00 C ATOM 375 O GLU A 24 27.072 23.662 11.276 1.00 0.00 O ATOM 376 CB GLU A 24 26.483 20.426 10.896 1.00 0.00 C ATOM 377 CG GLU A 24 27.492 20.674 9.769 1.00 0.00 C ATOM 378 CD GLU A 24 27.565 19.507 8.802 1.00 0.00 C ATOM 379 OE1 GLU A 24 26.664 18.641 8.828 1.00 0.00 O ATOM 380 OE2 GLU A 24 28.451 19.465 7.925 1.00 0.00 O ATOM 0 H GLU A 24 25.198 20.169 12.948 1.00 0.00 H new ATOM 0 HA GLU A 24 27.617 21.474 12.369 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.634 19.422 11.292 1.00 0.00 H new ATOM 0 HB3 GLU A 24 25.475 20.458 10.482 1.00 0.00 H new ATOM 0 HG2 GLU A 24 27.214 21.577 9.226 1.00 0.00 H new ATOM 0 HG3 GLU A 24 28.478 20.851 10.198 1.00 0.00 H new ATOM 387 N ASN A 25 24.920 23.068 11.453 1.00 0.00 N ATOM 388 CA ASN A 25 24.439 24.353 11.000 1.00 0.00 C ATOM 389 C ASN A 25 24.665 25.428 12.072 1.00 0.00 C ATOM 390 O ASN A 25 24.925 26.594 11.782 1.00 0.00 O ATOM 391 CB ASN A 25 22.934 24.340 10.775 1.00 0.00 C ATOM 392 CG ASN A 25 22.507 23.669 9.476 1.00 0.00 C ATOM 393 OD1 ASN A 25 22.111 24.312 8.507 1.00 0.00 O ATOM 394 ND2 ASN A 25 22.426 22.341 9.412 1.00 0.00 N ATOM 0 H ASN A 25 24.191 22.383 11.652 1.00 0.00 H new ATOM 0 HA ASN A 25 24.982 24.564 10.078 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.457 23.828 11.610 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.568 25.367 10.779 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.045 21.893 8.579 1.00 0.00 H new ATOM 0 HD22 ASN A 25 22.745 21.772 10.196 1.00 0.00 H new ATOM 401 N VAL A 26 24.726 25.038 13.339 1.00 0.00 N ATOM 402 CA VAL A 26 24.775 26.092 14.341 1.00 0.00 C ATOM 403 C VAL A 26 26.245 26.413 14.594 1.00 0.00 C ATOM 404 O VAL A 26 26.459 27.620 14.727 1.00 0.00 O ATOM 405 CB VAL A 26 23.983 25.546 15.533 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.410 26.089 16.896 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.472 25.494 15.338 1.00 0.00 C ATOM 0 H VAL A 26 24.742 24.077 13.680 1.00 0.00 H new ATOM 0 HA VAL A 26 24.324 27.044 14.062 1.00 0.00 H new ATOM 0 HB VAL A 26 24.284 24.499 15.555 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.791 25.644 17.675 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.456 25.839 17.076 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.288 27.172 16.911 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.003 25.093 16.237 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.095 26.499 15.149 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.237 24.852 14.489 1.00 0.00 H new ATOM 417 N LYS A 27 27.187 25.488 14.535 1.00 0.00 N ATOM 418 CA LYS A 27 28.634 25.560 14.505 1.00 0.00 C ATOM 419 C LYS A 27 29.156 26.660 13.573 1.00 0.00 C ATOM 420 O LYS A 27 30.123 27.320 13.921 1.00 0.00 O ATOM 421 CB LYS A 27 29.174 24.164 14.156 1.00 0.00 C ATOM 422 CG LYS A 27 29.506 23.295 15.371 1.00 0.00 C ATOM 423 CD LYS A 27 30.129 21.954 15.013 1.00 0.00 C ATOM 424 CE LYS A 27 30.829 21.334 16.231 1.00 0.00 C ATOM 425 NZ LYS A 27 31.524 20.087 15.891 1.00 0.00 N ATOM 0 H LYS A 27 26.901 24.510 14.502 1.00 0.00 H new ATOM 0 HA LYS A 27 29.004 25.850 15.488 1.00 0.00 H new ATOM 0 HB2 LYS A 27 28.437 23.645 13.543 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.072 24.276 13.548 1.00 0.00 H new ATOM 0 HG2 LYS A 27 30.190 23.841 16.021 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.594 23.121 15.942 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.358 21.276 14.647 1.00 0.00 H new ATOM 0 HD3 LYS A 27 30.847 22.086 14.204 1.00 0.00 H new ATOM 0 HE2 LYS A 27 31.544 22.048 16.640 1.00 0.00 H new ATOM 0 HE3 LYS A 27 30.093 21.138 17.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 32.170 19.828 16.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.827 19.328 15.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 32.068 20.221 15.015 1.00 0.00 H new ATOM 439 N ALA A 28 28.542 26.714 12.388 1.00 0.00 N ATOM 440 CA ALA A 28 28.798 27.667 11.323 1.00 0.00 C ATOM 441 C ALA A 28 28.170 29.043 11.502 1.00 0.00 C ATOM 442 O ALA A 28 28.825 29.974 11.034 1.00 0.00 O ATOM 443 CB ALA A 28 28.198 27.118 10.026 1.00 0.00 C ATOM 0 H ALA A 28 27.809 26.050 12.139 1.00 0.00 H new ATOM 0 HA ALA A 28 29.881 27.790 11.319 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.381 27.822 9.214 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.661 26.161 9.788 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.124 26.980 10.152 1.00 0.00 H new ATOM 449 N LYS A 29 27.175 29.249 12.367 1.00 0.00 N ATOM 450 CA LYS A 29 26.697 30.596 12.650 1.00 0.00 C ATOM 451 C LYS A 29 27.504 31.133 13.838 1.00 0.00 C ATOM 452 O LYS A 29 27.692 32.347 13.953 1.00 0.00 O ATOM 453 CB LYS A 29 25.231 30.484 13.059 1.00 0.00 C ATOM 454 CG LYS A 29 24.271 30.052 11.953 1.00 0.00 C ATOM 455 CD LYS A 29 22.809 29.819 12.303 1.00 0.00 C ATOM 456 CE LYS A 29 21.948 29.648 11.043 1.00 0.00 C ATOM 457 NZ LYS A 29 20.572 29.423 11.530 1.00 0.00 N ATOM 0 H LYS A 29 26.692 28.508 12.876 1.00 0.00 H new ATOM 0 HA LYS A 29 26.805 31.254 11.788 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.155 29.772 13.881 1.00 0.00 H new ATOM 0 HB3 LYS A 29 24.904 31.450 13.443 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.307 30.810 11.170 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.658 29.129 11.521 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.721 28.931 12.928 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.436 30.659 12.889 1.00 0.00 H new ATOM 0 HE2 LYS A 29 22.000 30.534 10.410 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.294 28.806 10.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 19.945 29.231 10.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.562 28.609 12.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.239 30.270 12.033 1.00 0.00 H new ATOM 471 N ILE A 30 28.067 30.233 14.628 1.00 0.00 N ATOM 472 CA ILE A 30 28.901 30.619 15.753 1.00 0.00 C ATOM 473 C ILE A 30 30.174 31.268 15.210 1.00 0.00 C ATOM 474 O ILE A 30 30.726 32.195 15.802 1.00 0.00 O ATOM 475 CB ILE A 30 29.166 29.458 16.704 1.00 0.00 C ATOM 476 CG1 ILE A 30 27.861 29.154 17.440 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.302 29.625 17.718 1.00 0.00 C ATOM 478 CD1 ILE A 30 27.763 27.744 18.027 1.00 0.00 C ATOM 0 H ILE A 30 27.960 29.226 14.509 1.00 0.00 H new ATOM 0 HA ILE A 30 28.376 31.351 16.367 1.00 0.00 H new ATOM 0 HB ILE A 30 29.514 28.641 16.072 1.00 0.00 H new ATOM 0 HG12 ILE A 30 27.740 29.877 18.247 1.00 0.00 H new ATOM 0 HG13 ILE A 30 27.030 29.303 16.751 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.379 28.726 18.329 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.241 29.786 17.189 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.095 30.482 18.358 1.00 0.00 H new ATOM 0 HD11 ILE A 30 26.803 27.625 18.529 1.00 0.00 H new ATOM 0 HD12 ILE A 30 27.848 27.010 17.226 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.569 27.592 18.745 1.00 0.00 H new ATOM 490 N GLN A 31 30.693 30.740 14.105 1.00 0.00 N ATOM 491 CA GLN A 31 31.753 31.260 13.268 1.00 0.00 C ATOM 492 C GLN A 31 31.560 32.709 12.829 1.00 0.00 C ATOM 493 O GLN A 31 32.567 33.419 12.751 1.00 0.00 O ATOM 494 CB GLN A 31 32.006 30.257 12.139 1.00 0.00 C ATOM 495 CG GLN A 31 33.323 30.412 11.388 1.00 0.00 C ATOM 496 CD GLN A 31 33.386 31.238 10.107 1.00 0.00 C ATOM 497 OE1 GLN A 31 34.459 31.476 9.547 1.00 0.00 O ATOM 498 NE2 GLN A 31 32.228 31.625 9.586 1.00 0.00 N ATOM 0 H GLN A 31 30.343 29.852 13.745 1.00 0.00 H new ATOM 0 HA GLN A 31 32.667 31.346 13.856 1.00 0.00 H new ATOM 0 HB2 GLN A 31 31.966 29.251 12.558 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.190 30.336 11.421 1.00 0.00 H new ATOM 0 HG2 GLN A 31 34.043 30.841 12.085 1.00 0.00 H new ATOM 0 HG3 GLN A 31 33.675 29.410 11.143 1.00 0.00 H new ATOM 0 HE21 GLN A 31 31.355 31.415 10.070 1.00 0.00 H new ATOM 0 HE22 GLN A 31 32.211 32.132 8.701 1.00 0.00 H new ATOM 507 N ASP A 32 30.358 33.108 12.431 1.00 0.00 N ATOM 508 CA ASP A 32 29.957 34.496 12.310 1.00 0.00 C ATOM 509 C ASP A 32 29.923 35.334 13.583 1.00 0.00 C ATOM 510 O ASP A 32 30.723 36.260 13.726 1.00 0.00 O ATOM 511 CB ASP A 32 28.603 34.517 11.596 1.00 0.00 C ATOM 512 CG ASP A 32 28.228 35.940 11.222 1.00 0.00 C ATOM 513 OD1 ASP A 32 29.042 36.653 10.594 1.00 0.00 O ATOM 514 OD2 ASP A 32 27.068 36.339 11.468 1.00 0.00 O ATOM 0 H ASP A 32 29.618 32.453 12.178 1.00 0.00 H new ATOM 0 HA ASP A 32 30.747 34.990 11.743 1.00 0.00 H new ATOM 0 HB2 ASP A 32 28.647 33.898 10.700 1.00 0.00 H new ATOM 0 HB3 ASP A 32 27.836 34.089 12.242 1.00 0.00 H new ATOM 519 N LYS A 33 29.174 34.844 14.568 1.00 0.00 N ATOM 520 CA LYS A 33 28.854 35.575 15.775 1.00 0.00 C ATOM 521 C LYS A 33 29.935 35.592 16.870 1.00 0.00 C ATOM 522 O LYS A 33 29.857 36.338 17.832 1.00 0.00 O ATOM 523 CB LYS A 33 27.593 34.980 16.414 1.00 0.00 C ATOM 524 CG LYS A 33 26.275 35.375 15.757 1.00 0.00 C ATOM 525 CD LYS A 33 25.814 36.819 15.919 1.00 0.00 C ATOM 526 CE LYS A 33 24.461 37.092 15.264 1.00 0.00 C ATOM 527 NZ LYS A 33 23.816 38.380 15.564 1.00 0.00 N ATOM 0 H LYS A 33 28.768 33.909 14.542 1.00 0.00 H new ATOM 0 HA LYS A 33 28.736 36.603 15.432 1.00 0.00 H new ATOM 0 HB2 LYS A 33 27.676 33.893 16.397 1.00 0.00 H new ATOM 0 HB3 LYS A 33 27.561 35.280 17.461 1.00 0.00 H new ATOM 0 HG2 LYS A 33 26.354 35.165 14.690 1.00 0.00 H new ATOM 0 HG3 LYS A 33 25.494 34.726 16.153 1.00 0.00 H new ATOM 0 HD2 LYS A 33 25.752 37.058 16.981 1.00 0.00 H new ATOM 0 HD3 LYS A 33 26.562 37.484 15.486 1.00 0.00 H new ATOM 0 HE2 LYS A 33 24.588 37.022 14.184 1.00 0.00 H new ATOM 0 HE3 LYS A 33 23.777 36.295 15.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 22.909 38.440 15.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 23.648 38.454 16.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 24.434 39.158 15.257 1.00 0.00 H new ATOM 541 N GLU A 34 30.910 34.689 16.840 1.00 0.00 N ATOM 542 CA GLU A 34 32.099 34.643 17.664 1.00 0.00 C ATOM 543 C GLU A 34 33.473 34.344 17.070 1.00 0.00 C ATOM 544 O GLU A 34 34.476 34.485 17.778 1.00 0.00 O ATOM 545 CB GLU A 34 31.852 33.969 19.017 1.00 0.00 C ATOM 546 CG GLU A 34 32.833 34.123 20.186 1.00 0.00 C ATOM 547 CD GLU A 34 33.322 35.465 20.693 1.00 0.00 C ATOM 548 OE1 GLU A 34 32.606 36.488 20.584 1.00 0.00 O ATOM 549 OE2 GLU A 34 34.366 35.469 21.393 1.00 0.00 O ATOM 0 H GLU A 34 30.880 33.910 16.183 1.00 0.00 H new ATOM 0 HA GLU A 34 32.246 35.715 17.797 1.00 0.00 H new ATOM 0 HB2 GLU A 34 30.882 34.318 19.371 1.00 0.00 H new ATOM 0 HB3 GLU A 34 31.756 32.900 18.824 1.00 0.00 H new ATOM 0 HG2 GLU A 34 32.377 33.620 21.039 1.00 0.00 H new ATOM 0 HG3 GLU A 34 33.723 33.553 19.918 1.00 0.00 H new ATOM 556 N GLY A 35 33.680 33.947 15.827 1.00 0.00 N ATOM 557 CA GLY A 35 34.934 33.749 15.116 1.00 0.00 C ATOM 558 C GLY A 35 35.574 32.361 15.199 1.00 0.00 C ATOM 559 O GLY A 35 36.638 32.167 14.612 1.00 0.00 O ATOM 0 H GLY A 35 32.886 33.731 15.224 1.00 0.00 H new ATOM 0 HA2 GLY A 35 34.766 33.981 14.064 1.00 0.00 H new ATOM 0 HA3 GLY A 35 35.654 34.476 15.492 1.00 0.00 H new ATOM 563 N ILE A 36 34.906 31.372 15.768 1.00 0.00 N ATOM 564 CA ILE A 36 35.343 30.033 16.127 1.00 0.00 C ATOM 565 C ILE A 36 35.037 29.140 14.927 1.00 0.00 C ATOM 566 O ILE A 36 33.908 29.049 14.443 1.00 0.00 O ATOM 567 CB ILE A 36 34.667 29.546 17.411 1.00 0.00 C ATOM 568 CG1 ILE A 36 34.324 30.533 18.536 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.402 28.338 17.984 1.00 0.00 C ATOM 570 CD1 ILE A 36 35.517 31.273 19.141 1.00 0.00 C ATOM 0 H ILE A 36 33.926 31.505 16.019 1.00 0.00 H new ATOM 0 HA ILE A 36 36.410 30.012 16.347 1.00 0.00 H new ATOM 0 HB ILE A 36 33.675 29.306 17.029 1.00 0.00 H new ATOM 0 HG12 ILE A 36 33.619 31.269 18.149 1.00 0.00 H new ATOM 0 HG13 ILE A 36 33.813 29.989 19.331 1.00 0.00 H new ATOM 0 HG21 ILE A 36 34.905 28.008 18.896 1.00 0.00 H new ATOM 0 HG22 ILE A 36 35.395 27.528 17.254 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.432 28.613 18.211 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.169 31.945 19.926 1.00 0.00 H new ATOM 0 HD12 ILE A 36 36.216 30.552 19.565 1.00 0.00 H new ATOM 0 HD13 ILE A 36 36.018 31.851 18.365 1.00 0.00 H new ATOM 582 N PRO A 37 35.997 28.430 14.340 1.00 0.00 N ATOM 583 CA PRO A 37 35.857 27.401 13.323 1.00 0.00 C ATOM 584 C PRO A 37 35.154 26.181 13.917 1.00 0.00 C ATOM 585 O PRO A 37 35.409 25.938 15.089 1.00 0.00 O ATOM 586 CB PRO A 37 37.180 27.106 12.611 1.00 0.00 C ATOM 587 CG PRO A 37 38.119 27.448 13.775 1.00 0.00 C ATOM 588 CD PRO A 37 37.424 28.559 14.563 1.00 0.00 C ATOM 0 HA PRO A 37 35.214 27.765 12.522 1.00 0.00 H new ATOM 0 HB2 PRO A 37 37.266 26.070 12.283 1.00 0.00 H new ATOM 0 HB3 PRO A 37 37.342 27.733 11.734 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.295 26.575 14.404 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.091 27.779 13.408 1.00 0.00 H new ATOM 0 HD2 PRO A 37 37.654 28.476 15.625 1.00 0.00 H new ATOM 0 HD3 PRO A 37 37.775 29.538 14.236 1.00 0.00 H new ATOM 596 N PRO A 38 34.457 25.342 13.148 1.00 0.00 N ATOM 597 CA PRO A 38 33.501 24.366 13.627 1.00 0.00 C ATOM 598 C PRO A 38 34.076 23.228 14.466 1.00 0.00 C ATOM 599 O PRO A 38 33.336 22.602 15.217 1.00 0.00 O ATOM 600 CB PRO A 38 32.782 23.843 12.381 1.00 0.00 C ATOM 601 CG PRO A 38 33.678 24.193 11.190 1.00 0.00 C ATOM 602 CD PRO A 38 34.519 25.362 11.702 1.00 0.00 C ATOM 0 HA PRO A 38 32.829 24.855 14.332 1.00 0.00 H new ATOM 0 HB2 PRO A 38 32.624 22.766 12.446 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.799 24.303 12.277 1.00 0.00 H new ATOM 0 HG2 PRO A 38 34.302 23.349 10.896 1.00 0.00 H new ATOM 0 HG3 PRO A 38 33.091 24.474 10.316 1.00 0.00 H new ATOM 0 HD2 PRO A 38 35.550 25.271 11.361 1.00 0.00 H new ATOM 0 HD3 PRO A 38 34.138 26.307 11.315 1.00 0.00 H new ATOM 610 N ASP A 39 35.373 22.968 14.297 1.00 0.00 N ATOM 611 CA ASP A 39 36.021 21.751 14.732 1.00 0.00 C ATOM 612 C ASP A 39 36.546 21.910 16.159 1.00 0.00 C ATOM 613 O ASP A 39 36.871 20.903 16.783 1.00 0.00 O ATOM 614 CB ASP A 39 37.152 21.340 13.794 1.00 0.00 C ATOM 615 CG ASP A 39 38.430 22.155 13.768 1.00 0.00 C ATOM 616 OD1 ASP A 39 38.433 23.313 13.284 1.00 0.00 O ATOM 617 OD2 ASP A 39 39.465 21.599 14.206 1.00 0.00 O ATOM 0 H ASP A 39 36.010 23.621 13.841 1.00 0.00 H new ATOM 0 HA ASP A 39 35.274 20.957 14.711 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.424 20.313 14.039 1.00 0.00 H new ATOM 0 HB3 ASP A 39 36.750 21.330 12.781 1.00 0.00 H new ATOM 622 N GLN A 40 36.541 23.071 16.803 1.00 0.00 N ATOM 623 CA GLN A 40 37.150 23.360 18.086 1.00 0.00 C ATOM 624 C GLN A 40 36.135 23.603 19.204 1.00 0.00 C ATOM 625 O GLN A 40 36.497 23.636 20.381 1.00 0.00 O ATOM 626 CB GLN A 40 37.990 24.630 17.932 1.00 0.00 C ATOM 627 CG GLN A 40 39.420 24.408 17.457 1.00 0.00 C ATOM 628 CD GLN A 40 40.283 25.655 17.528 1.00 0.00 C ATOM 629 OE1 GLN A 40 40.312 26.377 18.520 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.166 25.972 16.583 1.00 0.00 N ATOM 0 H GLN A 40 36.077 23.890 16.410 1.00 0.00 H new ATOM 0 HA GLN A 40 37.741 22.488 18.367 1.00 0.00 H new ATOM 0 HB2 GLN A 40 37.489 25.294 17.228 1.00 0.00 H new ATOM 0 HB3 GLN A 40 38.019 25.146 18.892 1.00 0.00 H new ATOM 0 HG2 GLN A 40 39.877 23.625 18.061 1.00 0.00 H new ATOM 0 HG3 GLN A 40 39.401 24.047 16.429 1.00 0.00 H new ATOM 0 HE21 GLN A 40 41.212 25.425 15.724 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.797 26.762 16.719 1.00 0.00 H new ATOM 639 N GLN A 41 34.870 23.717 18.793 1.00 0.00 N ATOM 640 CA GLN A 41 33.740 24.105 19.618 1.00 0.00 C ATOM 641 C GLN A 41 33.187 22.824 20.244 1.00 0.00 C ATOM 642 O GLN A 41 32.781 21.872 19.577 1.00 0.00 O ATOM 643 CB GLN A 41 32.609 24.592 18.710 1.00 0.00 C ATOM 644 CG GLN A 41 32.866 25.959 18.084 1.00 0.00 C ATOM 645 CD GLN A 41 31.746 26.315 17.129 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.591 25.984 17.398 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.135 26.841 15.972 1.00 0.00 N ATOM 0 H GLN A 41 34.600 23.531 17.827 1.00 0.00 H new ATOM 0 HA GLN A 41 34.050 24.860 20.340 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.454 23.862 17.915 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.685 24.635 19.287 1.00 0.00 H new ATOM 0 HG2 GLN A 41 32.943 26.716 18.864 1.00 0.00 H new ATOM 0 HG3 GLN A 41 33.818 25.951 17.553 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.114 27.089 15.828 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.455 26.997 15.228 1.00 0.00 H new ATOM 656 N ARG A 42 33.186 22.863 21.570 1.00 0.00 N ATOM 657 CA ARG A 42 32.549 21.895 22.438 1.00 0.00 C ATOM 658 C ARG A 42 31.239 22.495 22.961 1.00 0.00 C ATOM 659 O ARG A 42 31.229 23.235 23.942 1.00 0.00 O ATOM 660 CB ARG A 42 33.542 21.334 23.444 1.00 0.00 C ATOM 661 CG ARG A 42 33.178 20.066 24.215 1.00 0.00 C ATOM 662 CD ARG A 42 34.149 19.707 25.337 1.00 0.00 C ATOM 663 NE ARG A 42 33.677 18.762 26.353 1.00 0.00 N ATOM 664 CZ ARG A 42 33.819 18.668 27.679 1.00 0.00 C ATOM 665 NH1 ARG A 42 34.862 19.279 28.256 1.00 0.00 N ATOM 666 NH2 ARG A 42 33.051 17.756 28.292 1.00 0.00 N ATOM 0 H ARG A 42 33.652 23.607 22.089 1.00 0.00 H new ATOM 0 HA ARG A 42 32.238 20.993 21.912 1.00 0.00 H new ATOM 0 HB2 ARG A 42 34.474 21.140 22.913 1.00 0.00 H new ATOM 0 HB3 ARG A 42 33.748 22.116 24.175 1.00 0.00 H new ATOM 0 HG2 ARG A 42 32.181 20.187 24.639 1.00 0.00 H new ATOM 0 HG3 ARG A 42 33.127 19.232 23.515 1.00 0.00 H new ATOM 0 HD2 ARG A 42 35.051 19.294 24.885 1.00 0.00 H new ATOM 0 HD3 ARG A 42 34.439 20.629 25.841 1.00 0.00 H new ATOM 0 HE ARG A 42 33.114 18.007 25.961 1.00 0.00 H new ATOM 0 HH11 ARG A 42 35.527 19.802 27.685 1.00 0.00 H new ATOM 0 HH12 ARG A 42 34.992 19.222 29.266 1.00 0.00 H new ATOM 0 HH21 ARG A 42 32.406 17.183 27.747 1.00 0.00 H new ATOM 0 HH22 ARG A 42 33.112 17.635 29.303 1.00 0.00 H new ATOM 680 N LEU A 43 30.086 22.140 22.392 1.00 0.00 N ATOM 681 CA LEU A 43 28.769 22.566 22.791 1.00 0.00 C ATOM 682 C LEU A 43 28.149 21.614 23.819 1.00 0.00 C ATOM 683 O LEU A 43 28.217 20.391 23.681 1.00 0.00 O ATOM 684 CB LEU A 43 28.013 22.549 21.454 1.00 0.00 C ATOM 685 CG LEU A 43 28.694 23.229 20.261 1.00 0.00 C ATOM 686 CD1 LEU A 43 27.907 23.241 18.957 1.00 0.00 C ATOM 687 CD2 LEU A 43 29.298 24.582 20.613 1.00 0.00 C ATOM 0 H LEU A 43 30.059 21.508 21.592 1.00 0.00 H new ATOM 0 HA LEU A 43 28.751 23.536 23.289 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.820 21.510 21.187 1.00 0.00 H new ATOM 0 HB3 LEU A 43 27.044 23.024 21.607 1.00 0.00 H new ATOM 0 HG LEU A 43 29.526 22.562 20.035 1.00 0.00 H new ATOM 0 HD11 LEU A 43 28.488 23.748 18.186 1.00 0.00 H new ATOM 0 HD12 LEU A 43 27.705 22.216 18.645 1.00 0.00 H new ATOM 0 HD13 LEU A 43 26.964 23.768 19.106 1.00 0.00 H new ATOM 0 HD21 LEU A 43 29.765 25.013 19.728 1.00 0.00 H new ATOM 0 HD22 LEU A 43 28.513 25.249 20.970 1.00 0.00 H new ATOM 0 HD23 LEU A 43 30.048 24.454 21.393 1.00 0.00 H new ATOM 699 N ILE A 44 27.715 22.176 24.946 1.00 0.00 N ATOM 700 CA ILE A 44 27.309 21.501 26.162 1.00 0.00 C ATOM 701 C ILE A 44 25.975 22.050 26.670 1.00 0.00 C ATOM 702 O ILE A 44 25.878 23.272 26.841 1.00 0.00 O ATOM 703 CB ILE A 44 28.376 21.557 27.262 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.729 21.186 26.643 1.00 0.00 C ATOM 705 CG2 ILE A 44 28.183 20.641 28.468 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.871 21.284 27.649 1.00 0.00 C ATOM 0 H ILE A 44 27.635 23.189 25.032 1.00 0.00 H new ATOM 0 HA ILE A 44 27.182 20.449 25.905 1.00 0.00 H new ATOM 0 HB ILE A 44 28.306 22.575 27.646 1.00 0.00 H new ATOM 0 HG12 ILE A 44 29.680 20.171 26.250 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.933 21.845 25.799 1.00 0.00 H new ATOM 0 HG21 ILE A 44 29.007 20.781 29.167 1.00 0.00 H new ATOM 0 HG22 ILE A 44 27.242 20.884 28.962 1.00 0.00 H new ATOM 0 HG23 ILE A 44 28.161 19.603 28.137 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.808 21.012 27.163 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.940 22.305 28.023 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.683 20.605 28.481 1.00 0.00 H new ATOM 718 N PHE A 45 25.106 21.169 27.151 1.00 0.00 N ATOM 719 CA PHE A 45 23.738 21.373 27.592 1.00 0.00 C ATOM 720 C PHE A 45 23.227 20.221 28.455 1.00 0.00 C ATOM 721 O PHE A 45 23.008 19.076 28.061 1.00 0.00 O ATOM 722 CB PHE A 45 22.874 21.735 26.385 1.00 0.00 C ATOM 723 CG PHE A 45 21.479 22.253 26.627 1.00 0.00 C ATOM 724 CD1 PHE A 45 21.438 23.640 26.864 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.290 21.524 26.728 1.00 0.00 C ATOM 726 CE1 PHE A 45 20.248 24.347 27.076 1.00 0.00 C ATOM 727 CE2 PHE A 45 19.092 22.239 26.855 1.00 0.00 C ATOM 728 CZ PHE A 45 19.042 23.625 27.048 1.00 0.00 C ATOM 0 H PHE A 45 25.375 20.190 27.251 1.00 0.00 H new ATOM 0 HA PHE A 45 23.683 22.221 28.274 1.00 0.00 H new ATOM 0 HB2 PHE A 45 23.411 22.487 25.807 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.794 20.848 25.757 1.00 0.00 H new ATOM 0 HD1 PHE A 45 22.370 24.186 26.883 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.295 20.444 26.709 1.00 0.00 H new ATOM 0 HE1 PHE A 45 20.256 25.412 27.255 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.161 21.694 26.801 1.00 0.00 H new ATOM 0 HZ PHE A 45 18.095 24.130 27.173 1.00 0.00 H new ATOM 738 N ALA A 46 22.998 20.528 29.725 1.00 0.00 N ATOM 739 CA ALA A 46 22.469 19.722 30.806 1.00 0.00 C ATOM 740 C ALA A 46 23.099 18.359 31.073 1.00 0.00 C ATOM 741 O ALA A 46 22.537 17.274 31.237 1.00 0.00 O ATOM 742 CB ALA A 46 20.970 19.540 30.596 1.00 0.00 C ATOM 0 H ALA A 46 23.207 21.469 30.058 1.00 0.00 H new ATOM 0 HA ALA A 46 22.726 20.296 31.696 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.560 18.934 31.404 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.482 20.515 30.590 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.794 19.041 29.643 1.00 0.00 H new ATOM 748 N GLY A 47 24.411 18.448 30.850 1.00 0.00 N ATOM 749 CA GLY A 47 25.415 17.478 31.224 1.00 0.00 C ATOM 750 C GLY A 47 25.893 16.724 29.977 1.00 0.00 C ATOM 751 O GLY A 47 26.890 16.011 29.898 1.00 0.00 O ATOM 0 H GLY A 47 24.816 19.254 30.373 1.00 0.00 H new ATOM 0 HA2 GLY A 47 26.257 17.978 31.704 1.00 0.00 H new ATOM 0 HA3 GLY A 47 25.004 16.776 31.950 1.00 0.00 H new ATOM 755 N LYS A 48 25.187 16.926 28.868 1.00 0.00 N ATOM 756 CA LYS A 48 25.343 16.364 27.540 1.00 0.00 C ATOM 757 C LYS A 48 26.218 17.253 26.656 1.00 0.00 C ATOM 758 O LYS A 48 25.898 18.400 26.364 1.00 0.00 O ATOM 759 CB LYS A 48 23.982 16.195 26.859 1.00 0.00 C ATOM 760 CG LYS A 48 23.035 15.248 27.600 1.00 0.00 C ATOM 761 CD LYS A 48 21.703 15.039 26.896 1.00 0.00 C ATOM 762 CE LYS A 48 20.916 13.833 27.415 1.00 0.00 C ATOM 763 NZ LYS A 48 19.558 13.668 26.869 1.00 0.00 N ATOM 0 H LYS A 48 24.395 17.568 28.888 1.00 0.00 H new ATOM 0 HA LYS A 48 25.823 15.393 27.661 1.00 0.00 H new ATOM 0 HB2 LYS A 48 23.507 17.172 26.769 1.00 0.00 H new ATOM 0 HB3 LYS A 48 24.136 15.821 25.847 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.525 14.282 27.724 1.00 0.00 H new ATOM 0 HG3 LYS A 48 22.850 15.642 28.599 1.00 0.00 H new ATOM 0 HD2 LYS A 48 21.095 15.936 27.013 1.00 0.00 H new ATOM 0 HD3 LYS A 48 21.882 14.913 25.828 1.00 0.00 H new ATOM 0 HE2 LYS A 48 21.487 12.930 27.197 1.00 0.00 H new ATOM 0 HE3 LYS A 48 20.844 13.910 28.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 19.116 12.824 27.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 18.987 14.507 27.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.610 13.557 25.836 1.00 0.00 H new ATOM 777 N GLN A 49 27.324 16.674 26.191 1.00 0.00 N ATOM 778 CA GLN A 49 28.181 17.126 25.122 1.00 0.00 C ATOM 779 C GLN A 49 27.540 16.764 23.781 1.00 0.00 C ATOM 780 O GLN A 49 27.139 15.625 23.554 1.00 0.00 O ATOM 781 CB GLN A 49 29.521 16.441 25.417 1.00 0.00 C ATOM 782 CG GLN A 49 30.540 16.650 24.303 1.00 0.00 C ATOM 783 CD GLN A 49 31.920 16.043 24.473 1.00 0.00 C ATOM 784 OE1 GLN A 49 32.562 16.376 25.473 1.00 0.00 O ATOM 785 NE2 GLN A 49 32.320 15.146 23.581 1.00 0.00 N ATOM 0 H GLN A 49 27.663 15.801 26.595 1.00 0.00 H new ATOM 0 HA GLN A 49 28.332 18.204 25.061 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.925 16.828 26.352 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.356 15.373 25.559 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.113 16.254 23.382 1.00 0.00 H new ATOM 0 HG3 GLN A 49 30.663 17.724 24.161 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.729 14.926 22.779 1.00 0.00 H new ATOM 0 HE22 GLN A 49 33.218 14.677 23.697 1.00 0.00 H new ATOM 794 N LEU A 50 27.252 17.787 22.980 1.00 0.00 N ATOM 795 CA LEU A 50 26.270 17.667 21.925 1.00 0.00 C ATOM 796 C LEU A 50 26.925 16.944 20.747 1.00 0.00 C ATOM 797 O LEU A 50 28.011 17.316 20.303 1.00 0.00 O ATOM 798 CB LEU A 50 25.731 19.018 21.445 1.00 0.00 C ATOM 799 CG LEU A 50 25.121 19.891 22.540 1.00 0.00 C ATOM 800 CD1 LEU A 50 24.323 21.109 22.084 1.00 0.00 C ATOM 801 CD2 LEU A 50 24.145 19.024 23.333 1.00 0.00 C ATOM 0 H LEU A 50 27.689 18.706 23.048 1.00 0.00 H new ATOM 0 HA LEU A 50 25.420 17.113 22.323 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.543 19.569 20.971 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.976 18.841 20.679 1.00 0.00 H new ATOM 0 HG LEU A 50 25.976 20.273 23.097 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.944 21.643 22.956 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.968 21.770 21.505 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.486 20.785 21.465 1.00 0.00 H new ATOM 0 HD21 LEU A 50 23.691 19.619 24.125 1.00 0.00 H new ATOM 0 HD22 LEU A 50 23.367 18.651 22.668 1.00 0.00 H new ATOM 0 HD23 LEU A 50 24.680 18.183 23.773 1.00 0.00 H new ATOM 813 N GLU A 51 26.272 15.904 20.243 1.00 0.00 N ATOM 814 CA GLU A 51 26.898 15.064 19.235 1.00 0.00 C ATOM 815 C GLU A 51 26.693 15.765 17.892 1.00 0.00 C ATOM 816 O GLU A 51 25.699 16.450 17.661 1.00 0.00 O ATOM 817 CB GLU A 51 26.277 13.670 19.222 1.00 0.00 C ATOM 818 CG GLU A 51 27.009 12.692 20.132 1.00 0.00 C ATOM 819 CD GLU A 51 26.362 11.381 20.577 1.00 0.00 C ATOM 820 OE1 GLU A 51 25.126 11.322 20.706 1.00 0.00 O ATOM 821 OE2 GLU A 51 27.081 10.448 20.996 1.00 0.00 O ATOM 0 H GLU A 51 25.327 15.627 20.510 1.00 0.00 H new ATOM 0 HA GLU A 51 27.959 14.930 19.446 1.00 0.00 H new ATOM 0 HB2 GLU A 51 25.234 13.738 19.533 1.00 0.00 H new ATOM 0 HB3 GLU A 51 26.281 13.284 18.203 1.00 0.00 H new ATOM 0 HG2 GLU A 51 27.942 12.432 19.632 1.00 0.00 H new ATOM 0 HG3 GLU A 51 27.274 13.238 21.037 1.00 0.00 H new ATOM 828 N ASP A 52 27.624 15.475 16.980 1.00 0.00 N ATOM 829 CA ASP A 52 27.479 15.897 15.596 1.00 0.00 C ATOM 830 C ASP A 52 26.557 14.976 14.798 1.00 0.00 C ATOM 831 O ASP A 52 26.618 13.761 14.948 1.00 0.00 O ATOM 832 CB ASP A 52 28.817 15.773 14.865 1.00 0.00 C ATOM 833 CG ASP A 52 29.823 16.675 15.552 1.00 0.00 C ATOM 834 OD1 ASP A 52 29.596 17.905 15.512 1.00 0.00 O ATOM 835 OD2 ASP A 52 30.721 16.160 16.252 1.00 0.00 O ATOM 0 H ASP A 52 28.478 14.954 17.178 1.00 0.00 H new ATOM 0 HA ASP A 52 27.091 16.914 15.646 1.00 0.00 H new ATOM 0 HB2 ASP A 52 29.163 14.739 14.879 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.705 16.057 13.819 1.00 0.00 H new ATOM 840 N GLY A 53 25.553 15.587 14.161 1.00 0.00 N ATOM 841 CA GLY A 53 24.520 14.815 13.506 1.00 0.00 C ATOM 842 C GLY A 53 23.166 15.086 14.148 1.00 0.00 C ATOM 843 O GLY A 53 22.208 14.512 13.635 1.00 0.00 O ATOM 0 H GLY A 53 25.443 16.599 14.091 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.484 15.069 12.447 1.00 0.00 H new ATOM 0 HA3 GLY A 53 24.754 13.753 13.572 1.00 0.00 H new ATOM 847 N ARG A 54 23.067 15.874 15.217 1.00 0.00 N ATOM 848 CA ARG A 54 21.832 15.914 15.967 1.00 0.00 C ATOM 849 C ARG A 54 21.087 17.198 15.608 1.00 0.00 C ATOM 850 O ARG A 54 21.674 18.241 15.327 1.00 0.00 O ATOM 851 CB ARG A 54 22.094 15.972 17.469 1.00 0.00 C ATOM 852 CG ARG A 54 22.746 14.731 18.082 1.00 0.00 C ATOM 853 CD ARG A 54 21.740 13.683 18.570 1.00 0.00 C ATOM 854 NE ARG A 54 22.348 12.488 19.149 1.00 0.00 N ATOM 855 CZ ARG A 54 21.567 11.607 19.800 1.00 0.00 C ATOM 856 NH1 ARG A 54 20.240 11.555 19.613 1.00 0.00 N ATOM 857 NH2 ARG A 54 22.160 10.740 20.629 1.00 0.00 N ATOM 0 H ARG A 54 23.811 16.476 15.570 1.00 0.00 H new ATOM 0 HA ARG A 54 21.264 15.016 15.724 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.731 16.832 17.674 1.00 0.00 H new ATOM 0 HB3 ARG A 54 21.146 16.149 17.977 1.00 0.00 H new ATOM 0 HG2 ARG A 54 23.403 14.274 17.342 1.00 0.00 H new ATOM 0 HG3 ARG A 54 23.373 15.037 18.919 1.00 0.00 H new ATOM 0 HD2 ARG A 54 21.088 14.141 19.314 1.00 0.00 H new ATOM 0 HD3 ARG A 54 21.109 13.386 17.733 1.00 0.00 H new ATOM 0 HE ARG A 54 23.351 12.324 19.061 1.00 0.00 H new ATOM 0 HH11 ARG A 54 19.792 12.197 18.959 1.00 0.00 H new ATOM 0 HH12 ARG A 54 19.679 10.873 20.124 1.00 0.00 H new ATOM 0 HH21 ARG A 54 23.173 10.762 20.750 1.00 0.00 H new ATOM 0 HH22 ARG A 54 21.600 10.058 21.139 1.00 0.00 H new ATOM 871 N THR A 55 19.772 17.187 15.787 1.00 0.00 N ATOM 872 CA THR A 55 18.862 18.323 15.759 1.00 0.00 C ATOM 873 C THR A 55 18.620 18.814 17.188 1.00 0.00 C ATOM 874 O THR A 55 18.670 18.013 18.127 1.00 0.00 O ATOM 875 CB THR A 55 17.608 17.818 15.060 1.00 0.00 C ATOM 876 OG1 THR A 55 16.863 16.755 15.620 1.00 0.00 O ATOM 877 CG2 THR A 55 17.702 17.448 13.578 1.00 0.00 C ATOM 0 H THR A 55 19.276 16.314 15.970 1.00 0.00 H new ATOM 0 HA THR A 55 19.252 19.187 15.220 1.00 0.00 H new ATOM 0 HB THR A 55 17.095 18.766 15.222 1.00 0.00 H new ATOM 0 HG1 THR A 55 15.954 16.763 15.253 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.729 17.107 13.226 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.010 18.322 13.004 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.435 16.652 13.448 1.00 0.00 H new ATOM 885 N LEU A 56 18.528 20.119 17.433 1.00 0.00 N ATOM 886 CA LEU A 56 18.333 20.817 18.685 1.00 0.00 C ATOM 887 C LEU A 56 17.135 20.259 19.465 1.00 0.00 C ATOM 888 O LEU A 56 17.211 20.068 20.671 1.00 0.00 O ATOM 889 CB LEU A 56 18.108 22.312 18.465 1.00 0.00 C ATOM 890 CG LEU A 56 19.195 23.075 17.703 1.00 0.00 C ATOM 891 CD1 LEU A 56 18.631 24.372 17.134 1.00 0.00 C ATOM 892 CD2 LEU A 56 20.458 23.244 18.555 1.00 0.00 C ATOM 0 H LEU A 56 18.598 20.783 16.662 1.00 0.00 H new ATOM 0 HA LEU A 56 19.245 20.665 19.262 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.167 22.437 17.929 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.984 22.783 19.440 1.00 0.00 H new ATOM 0 HG LEU A 56 19.519 22.490 16.842 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.415 24.904 16.595 1.00 0.00 H new ATOM 0 HD12 LEU A 56 17.812 24.144 16.452 1.00 0.00 H new ATOM 0 HD13 LEU A 56 18.262 24.996 17.948 1.00 0.00 H new ATOM 0 HD21 LEU A 56 21.211 23.789 17.986 1.00 0.00 H new ATOM 0 HD22 LEU A 56 20.214 23.800 19.460 1.00 0.00 H new ATOM 0 HD23 LEU A 56 20.848 22.263 18.826 1.00 0.00 H new ATOM 904 N SER A 57 16.041 19.893 18.798 1.00 0.00 N ATOM 905 CA SER A 57 14.838 19.422 19.461 1.00 0.00 C ATOM 906 C SER A 57 15.007 17.993 19.986 1.00 0.00 C ATOM 907 O SER A 57 14.211 17.546 20.791 1.00 0.00 O ATOM 908 CB SER A 57 13.611 19.493 18.543 1.00 0.00 C ATOM 909 OG SER A 57 13.703 20.666 17.762 1.00 0.00 O ATOM 0 H SER A 57 15.970 19.917 17.781 1.00 0.00 H new ATOM 0 HA SER A 57 14.673 20.090 20.307 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.567 18.613 17.901 1.00 0.00 H new ATOM 0 HB3 SER A 57 12.695 19.503 19.134 1.00 0.00 H new ATOM 0 HG SER A 57 12.926 20.725 17.168 1.00 0.00 H new ATOM 915 N ASP A 58 15.963 17.225 19.462 1.00 0.00 N ATOM 916 CA ASP A 58 16.265 15.847 19.794 1.00 0.00 C ATOM 917 C ASP A 58 17.088 15.787 21.089 1.00 0.00 C ATOM 918 O ASP A 58 16.977 14.832 21.851 1.00 0.00 O ATOM 919 CB ASP A 58 17.105 15.147 18.729 1.00 0.00 C ATOM 920 CG ASP A 58 17.500 13.701 18.963 1.00 0.00 C ATOM 921 OD1 ASP A 58 16.703 12.875 19.474 1.00 0.00 O ATOM 922 OD2 ASP A 58 18.562 13.259 18.473 1.00 0.00 O ATOM 0 H ASP A 58 16.589 17.584 18.741 1.00 0.00 H new ATOM 0 HA ASP A 58 15.300 15.349 19.886 1.00 0.00 H new ATOM 0 HB2 ASP A 58 16.556 15.194 17.788 1.00 0.00 H new ATOM 0 HB3 ASP A 58 18.020 15.724 18.594 1.00 0.00 H new ATOM 927 N TYR A 59 17.794 16.882 21.348 1.00 0.00 N ATOM 928 CA TYR A 59 18.402 17.141 22.640 1.00 0.00 C ATOM 929 C TYR A 59 17.481 17.816 23.663 1.00 0.00 C ATOM 930 O TYR A 59 17.753 17.905 24.856 1.00 0.00 O ATOM 931 CB TYR A 59 19.645 17.987 22.356 1.00 0.00 C ATOM 932 CG TYR A 59 20.902 17.173 22.184 1.00 0.00 C ATOM 933 CD1 TYR A 59 21.265 16.167 23.087 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.751 17.374 21.086 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.482 15.465 23.038 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.899 16.596 20.926 1.00 0.00 C ATOM 937 CZ TYR A 59 23.278 15.672 21.905 1.00 0.00 C ATOM 938 OH TYR A 59 24.283 14.821 21.561 1.00 0.00 O ATOM 0 H TYR A 59 17.959 17.617 20.661 1.00 0.00 H new ATOM 0 HA TYR A 59 18.644 16.191 23.116 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.476 18.574 21.454 1.00 0.00 H new ATOM 0 HB3 TYR A 59 19.788 18.693 23.174 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.566 15.914 23.871 1.00 0.00 H new ATOM 0 HD2 TYR A 59 21.515 18.137 20.359 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.787 14.801 23.833 1.00 0.00 H new ATOM 0 HE2 TYR A 59 23.501 16.709 20.036 1.00 0.00 H new ATOM 0 HH TYR A 59 24.063 13.915 21.863 1.00 0.00 H new ATOM 948 N ASN A 60 16.406 18.398 23.142 1.00 0.00 N ATOM 949 CA ASN A 60 15.315 18.996 23.891 1.00 0.00 C ATOM 950 C ASN A 60 15.656 20.428 24.314 1.00 0.00 C ATOM 951 O ASN A 60 15.396 20.799 25.451 1.00 0.00 O ATOM 952 CB ASN A 60 14.842 18.094 25.020 1.00 0.00 C ATOM 953 CG ASN A 60 14.611 16.648 24.617 1.00 0.00 C ATOM 954 OD1 ASN A 60 13.756 16.380 23.775 1.00 0.00 O ATOM 955 ND2 ASN A 60 15.451 15.711 25.048 1.00 0.00 N ATOM 0 H ASN A 60 16.269 18.467 22.134 1.00 0.00 H new ATOM 0 HA ASN A 60 14.450 19.087 23.234 1.00 0.00 H new ATOM 0 HB2 ASN A 60 15.579 18.121 25.822 1.00 0.00 H new ATOM 0 HB3 ASN A 60 13.914 18.497 25.426 1.00 0.00 H new ATOM 0 HD21 ASN A 60 15.389 14.762 24.680 1.00 0.00 H new ATOM 0 HD22 ASN A 60 16.157 15.942 25.747 1.00 0.00 H new ATOM 962 N ILE A 61 16.141 21.246 23.387 1.00 0.00 N ATOM 963 CA ILE A 61 16.640 22.608 23.513 1.00 0.00 C ATOM 964 C ILE A 61 15.488 23.371 22.853 1.00 0.00 C ATOM 965 O ILE A 61 15.359 23.259 21.638 1.00 0.00 O ATOM 966 CB ILE A 61 17.970 22.713 22.766 1.00 0.00 C ATOM 967 CG1 ILE A 61 19.160 22.011 23.424 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.503 24.068 22.309 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.182 21.531 22.405 1.00 0.00 C ATOM 0 H ILE A 61 16.200 20.933 22.418 1.00 0.00 H new ATOM 0 HA ILE A 61 16.864 22.975 24.515 1.00 0.00 H new ATOM 0 HB ILE A 61 17.602 22.197 21.879 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.641 22.695 24.123 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.802 21.161 24.005 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.457 23.931 21.799 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.789 24.528 21.626 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.645 24.714 23.175 1.00 0.00 H new ATOM 0 HD11 ILE A 61 21.007 21.040 22.921 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.710 20.826 21.721 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.562 22.383 21.842 1.00 0.00 H new ATOM 981 N GLN A 62 14.701 23.959 23.748 1.00 0.00 N ATOM 982 CA GLN A 62 13.686 24.962 23.485 1.00 0.00 C ATOM 983 C GLN A 62 14.254 26.390 23.380 1.00 0.00 C ATOM 984 O GLN A 62 15.264 26.591 24.048 1.00 0.00 O ATOM 985 CB GLN A 62 12.632 25.012 24.596 1.00 0.00 C ATOM 986 CG GLN A 62 11.861 23.707 24.810 1.00 0.00 C ATOM 987 CD GLN A 62 10.727 23.382 23.861 1.00 0.00 C ATOM 988 OE1 GLN A 62 9.848 22.585 24.172 1.00 0.00 O ATOM 989 NE2 GLN A 62 10.539 24.101 22.761 1.00 0.00 N ATOM 0 H GLN A 62 14.763 23.730 24.740 1.00 0.00 H new ATOM 0 HA GLN A 62 13.254 24.657 22.532 1.00 0.00 H new ATOM 0 HB2 GLN A 62 13.122 25.285 25.530 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.920 25.805 24.366 1.00 0.00 H new ATOM 0 HG2 GLN A 62 12.577 22.886 24.767 1.00 0.00 H new ATOM 0 HG3 GLN A 62 11.455 23.722 25.821 1.00 0.00 H new ATOM 0 HE21 GLN A 62 11.245 24.776 22.466 1.00 0.00 H new ATOM 0 HE22 GLN A 62 9.689 23.979 22.211 1.00 0.00 H new ATOM 998 N LYS A 63 13.569 27.266 22.660 1.00 0.00 N ATOM 999 CA LYS A 63 13.722 28.702 22.513 1.00 0.00 C ATOM 1000 C LYS A 63 14.103 29.519 23.756 1.00 0.00 C ATOM 1001 O LYS A 63 13.407 29.333 24.750 1.00 0.00 O ATOM 1002 CB LYS A 63 12.665 29.364 21.643 1.00 0.00 C ATOM 1003 CG LYS A 63 11.320 29.745 22.264 1.00 0.00 C ATOM 1004 CD LYS A 63 10.431 28.624 22.795 1.00 0.00 C ATOM 1005 CE LYS A 63 8.992 28.886 23.257 1.00 0.00 C ATOM 1006 NZ LYS A 63 8.832 29.290 24.669 1.00 0.00 N ATOM 0 H LYS A 63 12.789 26.939 22.090 1.00 0.00 H new ATOM 0 HA LYS A 63 14.651 28.739 21.944 1.00 0.00 H new ATOM 0 HB2 LYS A 63 13.103 30.271 21.227 1.00 0.00 H new ATOM 0 HB3 LYS A 63 12.463 28.695 20.806 1.00 0.00 H new ATOM 0 HG2 LYS A 63 11.515 30.434 23.086 1.00 0.00 H new ATOM 0 HG3 LYS A 63 10.751 30.296 21.515 1.00 0.00 H new ATOM 0 HD2 LYS A 63 10.379 27.866 22.014 1.00 0.00 H new ATOM 0 HD3 LYS A 63 10.957 28.177 23.639 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.564 29.665 22.626 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.407 27.982 23.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.824 29.441 24.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 9.203 28.542 25.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 9.356 30.172 24.839 1.00 0.00 H new ATOM 1020 N GLU A 64 15.044 30.449 23.802 1.00 0.00 N ATOM 1021 CA GLU A 64 15.443 31.244 24.946 1.00 0.00 C ATOM 1022 C GLU A 64 16.384 30.488 25.879 1.00 0.00 C ATOM 1023 O GLU A 64 16.792 31.079 26.884 1.00 0.00 O ATOM 1024 CB GLU A 64 14.372 32.111 25.603 1.00 0.00 C ATOM 1025 CG GLU A 64 13.406 32.785 24.623 1.00 0.00 C ATOM 1026 CD GLU A 64 12.202 33.522 25.183 1.00 0.00 C ATOM 1027 OE1 GLU A 64 11.518 32.912 26.032 1.00 0.00 O ATOM 1028 OE2 GLU A 64 11.935 34.690 24.812 1.00 0.00 O ATOM 0 H GLU A 64 15.590 30.684 22.973 1.00 0.00 H new ATOM 0 HA GLU A 64 16.049 32.045 24.521 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.797 31.494 26.293 1.00 0.00 H new ATOM 0 HB3 GLU A 64 14.862 32.882 26.198 1.00 0.00 H new ATOM 0 HG2 GLU A 64 13.980 33.494 24.026 1.00 0.00 H new ATOM 0 HG3 GLU A 64 13.038 32.019 23.941 1.00 0.00 H new ATOM 1035 N SER A 65 16.715 29.261 25.502 1.00 0.00 N ATOM 1036 CA SER A 65 17.727 28.502 26.216 1.00 0.00 C ATOM 1037 C SER A 65 19.129 29.099 26.051 1.00 0.00 C ATOM 1038 O SER A 65 19.562 29.520 24.981 1.00 0.00 O ATOM 1039 CB SER A 65 17.855 27.053 25.756 1.00 0.00 C ATOM 1040 OG SER A 65 16.799 26.253 26.257 1.00 0.00 O ATOM 0 H SER A 65 16.298 28.773 24.709 1.00 0.00 H new ATOM 0 HA SER A 65 17.381 28.545 27.249 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.856 27.015 24.667 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.810 26.647 26.090 1.00 0.00 H new ATOM 0 HG SER A 65 16.055 26.257 25.619 1.00 0.00 H new ATOM 1046 N THR A 66 19.889 28.969 27.133 1.00 0.00 N ATOM 1047 CA THR A 66 21.258 29.431 27.231 1.00 0.00 C ATOM 1048 C THR A 66 22.033 28.108 27.226 1.00 0.00 C ATOM 1049 O THR A 66 21.997 27.323 28.172 1.00 0.00 O ATOM 1050 CB THR A 66 21.442 30.309 28.460 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.842 31.579 28.410 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.897 30.652 28.801 1.00 0.00 C ATOM 0 H THR A 66 19.554 28.525 27.988 1.00 0.00 H new ATOM 0 HA THR A 66 21.604 30.087 26.432 1.00 0.00 H new ATOM 0 HB THR A 66 20.968 29.658 29.194 1.00 0.00 H new ATOM 0 HG1 THR A 66 21.019 32.058 29.246 1.00 0.00 H new ATOM 0 HG21 THR A 66 22.924 31.280 29.691 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.453 29.733 28.989 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.350 31.186 27.966 1.00 0.00 H new ATOM 1060 N LEU A 67 22.818 27.906 26.179 1.00 0.00 N ATOM 1061 CA LEU A 67 23.685 26.762 25.988 1.00 0.00 C ATOM 1062 C LEU A 67 25.096 27.166 26.400 1.00 0.00 C ATOM 1063 O LEU A 67 25.491 28.337 26.375 1.00 0.00 O ATOM 1064 CB LEU A 67 23.694 26.279 24.536 1.00 0.00 C ATOM 1065 CG LEU A 67 22.338 25.707 24.112 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.583 26.819 23.369 1.00 0.00 C ATOM 1067 CD2 LEU A 67 22.501 24.525 23.159 1.00 0.00 C ATOM 0 H LEU A 67 22.867 28.569 25.405 1.00 0.00 H new ATOM 0 HA LEU A 67 23.314 25.938 26.597 1.00 0.00 H new ATOM 0 HB2 LEU A 67 23.959 27.108 23.880 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.463 25.517 24.412 1.00 0.00 H new ATOM 0 HG LEU A 67 21.805 25.362 24.998 1.00 0.00 H new ATOM 0 HD11 LEU A 67 20.609 26.447 23.051 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.446 27.672 24.033 1.00 0.00 H new ATOM 0 HD13 LEU A 67 22.157 27.127 22.495 1.00 0.00 H new ATOM 0 HD21 LEU A 67 21.518 24.145 22.879 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.033 24.849 22.264 1.00 0.00 H new ATOM 0 HD23 LEU A 67 23.069 23.736 23.652 1.00 0.00 H new ATOM 1079 N HIS A 68 25.928 26.208 26.788 1.00 0.00 N ATOM 1080 CA HIS A 68 27.291 26.528 27.166 1.00 0.00 C ATOM 1081 C HIS A 68 28.227 26.071 26.041 1.00 0.00 C ATOM 1082 O HIS A 68 27.955 24.981 25.558 1.00 0.00 O ATOM 1083 CB HIS A 68 27.645 25.650 28.377 1.00 0.00 C ATOM 1084 CG HIS A 68 28.968 25.966 29.014 1.00 0.00 C ATOM 1085 ND1 HIS A 68 29.513 27.240 29.143 1.00 0.00 N ATOM 1086 CD2 HIS A 68 29.781 25.116 29.717 1.00 0.00 C ATOM 1087 CE1 HIS A 68 30.673 27.087 29.795 1.00 0.00 C ATOM 1088 NE2 HIS A 68 30.780 25.855 30.311 1.00 0.00 N ATOM 0 H HIS A 68 25.685 25.219 26.848 1.00 0.00 H new ATOM 0 HA HIS A 68 27.388 27.595 27.368 1.00 0.00 H new ATOM 0 HB2 HIS A 68 26.861 25.756 29.127 1.00 0.00 H new ATOM 0 HB3 HIS A 68 27.648 24.606 28.064 1.00 0.00 H new ATOM 0 HD2 HIS A 68 29.659 24.046 29.793 1.00 0.00 H new ATOM 0 HE1 HIS A 68 31.424 27.857 29.892 1.00 0.00 H new ATOM 0 HE2 HIS A 68 31.459 25.532 31.000 1.00 0.00 H new ATOM 1096 N LEU A 69 29.324 26.770 25.791 1.00 0.00 N ATOM 1097 CA LEU A 69 30.338 26.442 24.809 1.00 0.00 C ATOM 1098 C LEU A 69 31.698 26.400 25.503 1.00 0.00 C ATOM 1099 O LEU A 69 32.028 27.252 26.316 1.00 0.00 O ATOM 1100 CB LEU A 69 30.240 27.413 23.626 1.00 0.00 C ATOM 1101 CG LEU A 69 31.247 27.200 22.495 1.00 0.00 C ATOM 1102 CD1 LEU A 69 30.760 27.696 21.130 1.00 0.00 C ATOM 1103 CD2 LEU A 69 32.446 28.110 22.778 1.00 0.00 C ATOM 0 H LEU A 69 29.539 27.628 26.298 1.00 0.00 H new ATOM 0 HA LEU A 69 30.187 25.452 24.380 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.236 27.344 23.208 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.359 28.428 24.005 1.00 0.00 H new ATOM 0 HG LEU A 69 31.443 26.128 22.461 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.529 27.510 20.380 1.00 0.00 H new ATOM 0 HD12 LEU A 69 29.848 27.166 20.854 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.556 28.765 21.183 1.00 0.00 H new ATOM 0 HD21 LEU A 69 33.190 27.987 21.991 1.00 0.00 H new ATOM 0 HD22 LEU A 69 32.116 29.148 22.806 1.00 0.00 H new ATOM 0 HD23 LEU A 69 32.887 27.843 23.739 1.00 0.00 H new ATOM 1115 N VAL A 70 32.525 25.382 25.238 1.00 0.00 N ATOM 1116 CA VAL A 70 33.858 25.053 25.712 1.00 0.00 C ATOM 1117 C VAL A 70 34.683 24.777 24.460 1.00 0.00 C ATOM 1118 O VAL A 70 34.231 24.690 23.321 1.00 0.00 O ATOM 1119 CB VAL A 70 33.790 23.949 26.768 1.00 0.00 C ATOM 1120 CG1 VAL A 70 35.172 23.409 27.145 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.850 24.167 27.959 1.00 0.00 C ATOM 0 H VAL A 70 32.215 24.665 24.582 1.00 0.00 H new ATOM 0 HA VAL A 70 34.358 25.856 26.254 1.00 0.00 H new ATOM 0 HB VAL A 70 33.267 23.148 26.247 1.00 0.00 H new ATOM 0 HG11 VAL A 70 35.065 22.628 27.898 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.655 22.996 26.260 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.782 24.218 27.546 1.00 0.00 H new ATOM 0 HG21 VAL A 70 32.903 23.307 28.626 1.00 0.00 H new ATOM 0 HG22 VAL A 70 33.150 25.065 28.500 1.00 0.00 H new ATOM 0 HG23 VAL A 70 31.828 24.285 27.599 1.00 0.00 H new ATOM 1131 N LEU A 71 36.009 24.769 24.626 1.00 0.00 N ATOM 1132 CA LEU A 71 37.006 24.707 23.573 1.00 0.00 C ATOM 1133 C LEU A 71 37.809 23.433 23.833 1.00 0.00 C ATOM 1134 O LEU A 71 38.080 23.241 25.010 1.00 0.00 O ATOM 1135 CB LEU A 71 37.901 25.937 23.643 1.00 0.00 C ATOM 1136 CG LEU A 71 38.480 26.387 22.301 1.00 0.00 C ATOM 1137 CD1 LEU A 71 39.337 25.299 21.640 1.00 0.00 C ATOM 1138 CD2 LEU A 71 37.431 27.080 21.432 1.00 0.00 C ATOM 0 H LEU A 71 36.431 24.808 25.554 1.00 0.00 H new ATOM 0 HA LEU A 71 36.557 24.689 22.580 1.00 0.00 H new ATOM 0 HB2 LEU A 71 37.329 26.761 24.071 1.00 0.00 H new ATOM 0 HB3 LEU A 71 38.724 25.731 24.327 1.00 0.00 H new ATOM 0 HG LEU A 71 39.209 27.178 22.476 1.00 0.00 H new ATOM 0 HD11 LEU A 71 39.725 25.668 20.690 1.00 0.00 H new ATOM 0 HD12 LEU A 71 40.169 25.042 22.296 1.00 0.00 H new ATOM 0 HD13 LEU A 71 38.727 24.413 21.463 1.00 0.00 H new ATOM 0 HD21 LEU A 71 37.884 27.384 20.488 1.00 0.00 H new ATOM 0 HD22 LEU A 71 36.609 26.392 21.235 1.00 0.00 H new ATOM 0 HD23 LEU A 71 37.051 27.960 21.952 1.00 0.00 H new ATOM 1150 N ARG A 72 37.901 22.586 22.804 1.00 0.00 N ATOM 1151 CA ARG A 72 38.838 21.489 22.725 1.00 0.00 C ATOM 1152 C ARG A 72 39.324 21.370 21.274 1.00 0.00 C ATOM 1153 O ARG A 72 38.580 21.115 20.327 1.00 0.00 O ATOM 1154 CB ARG A 72 38.136 20.205 23.175 1.00 0.00 C ATOM 1155 CG ARG A 72 39.147 19.082 23.439 1.00 0.00 C ATOM 1156 CD ARG A 72 38.540 17.933 24.235 1.00 0.00 C ATOM 1157 NE ARG A 72 39.550 16.874 24.300 1.00 0.00 N ATOM 1158 CZ ARG A 72 39.510 15.597 23.884 1.00 0.00 C ATOM 1159 NH1 ARG A 72 38.435 15.026 23.339 1.00 0.00 N ATOM 1160 NH2 ARG A 72 40.642 14.898 24.070 1.00 0.00 N ATOM 0 H ARG A 72 37.301 22.657 21.982 1.00 0.00 H new ATOM 0 HA ARG A 72 39.697 21.660 23.374 1.00 0.00 H new ATOM 0 HB2 ARG A 72 37.561 20.400 24.080 1.00 0.00 H new ATOM 0 HB3 ARG A 72 37.428 19.888 22.410 1.00 0.00 H new ATOM 0 HG2 ARG A 72 39.523 18.704 22.488 1.00 0.00 H new ATOM 0 HG3 ARG A 72 40.002 19.486 23.982 1.00 0.00 H new ATOM 0 HD2 ARG A 72 38.262 18.262 25.236 1.00 0.00 H new ATOM 0 HD3 ARG A 72 37.631 17.570 23.755 1.00 0.00 H new ATOM 0 HE ARG A 72 40.430 17.152 24.733 1.00 0.00 H new ATOM 0 HH11 ARG A 72 37.578 15.565 23.218 1.00 0.00 H new ATOM 0 HH12 ARG A 72 38.470 14.050 23.044 1.00 0.00 H new ATOM 0 HH21 ARG A 72 41.452 15.344 24.501 1.00 0.00 H new ATOM 0 HH22 ARG A 72 40.692 13.921 23.781 1.00 0.00 H new ATOM 1174 N LEU A 73 40.633 21.470 21.060 1.00 0.00 N ATOM 1175 CA LEU A 73 41.480 21.198 19.917 1.00 0.00 C ATOM 1176 C LEU A 73 41.694 19.685 19.876 1.00 0.00 C ATOM 1177 O LEU A 73 42.065 19.042 20.859 1.00 0.00 O ATOM 1178 CB LEU A 73 42.824 21.912 20.088 1.00 0.00 C ATOM 1179 CG LEU A 73 42.927 23.301 19.451 1.00 0.00 C ATOM 1180 CD1 LEU A 73 43.868 24.261 20.171 1.00 0.00 C ATOM 1181 CD2 LEU A 73 43.280 23.155 17.963 1.00 0.00 C ATOM 0 H LEU A 73 41.216 21.804 21.827 1.00 0.00 H new ATOM 0 HA LEU A 73 41.023 21.553 18.993 1.00 0.00 H new ATOM 0 HB2 LEU A 73 43.031 22.006 21.154 1.00 0.00 H new ATOM 0 HB3 LEU A 73 43.606 21.281 19.666 1.00 0.00 H new ATOM 0 HG LEU A 73 41.948 23.769 19.552 1.00 0.00 H new ATOM 0 HD11 LEU A 73 43.878 25.219 19.651 1.00 0.00 H new ATOM 0 HD12 LEU A 73 43.524 24.408 21.195 1.00 0.00 H new ATOM 0 HD13 LEU A 73 44.875 23.843 20.183 1.00 0.00 H new ATOM 0 HD21 LEU A 73 43.354 24.143 17.508 1.00 0.00 H new ATOM 0 HD22 LEU A 73 44.234 22.638 17.865 1.00 0.00 H new ATOM 0 HD23 LEU A 73 42.503 22.581 17.459 1.00 0.00 H new ATOM 1193 N ARG A 74 41.344 19.113 18.731 1.00 0.00 N ATOM 1194 CA ARG A 74 41.651 17.718 18.474 1.00 0.00 C ATOM 1195 C ARG A 74 41.686 17.675 16.950 1.00 0.00 C ATOM 1196 O ARG A 74 40.620 17.434 16.382 1.00 0.00 O ATOM 1197 CB ARG A 74 40.630 16.826 19.173 1.00 0.00 C ATOM 1198 CG ARG A 74 40.737 15.321 18.915 1.00 0.00 C ATOM 1199 CD ARG A 74 42.136 14.832 19.296 1.00 0.00 C ATOM 1200 NE ARG A 74 42.925 14.626 18.084 1.00 0.00 N ATOM 1201 CZ ARG A 74 44.263 14.702 18.035 1.00 0.00 C ATOM 1202 NH1 ARG A 74 45.065 14.973 19.069 1.00 0.00 N ATOM 1203 NH2 ARG A 74 44.877 14.378 16.881 1.00 0.00 N ATOM 0 H ARG A 74 40.853 19.590 17.975 1.00 0.00 H new ATOM 0 HA ARG A 74 42.591 17.336 18.873 1.00 0.00 H new ATOM 0 HB2 ARG A 74 40.712 16.993 20.247 1.00 0.00 H new ATOM 0 HB3 ARG A 74 39.634 17.152 18.875 1.00 0.00 H new ATOM 0 HG2 ARG A 74 39.984 14.788 19.496 1.00 0.00 H new ATOM 0 HG3 ARG A 74 40.540 15.107 17.865 1.00 0.00 H new ATOM 0 HD2 ARG A 74 42.625 15.561 19.942 1.00 0.00 H new ATOM 0 HD3 ARG A 74 42.067 13.902 19.861 1.00 0.00 H new ATOM 0 HE ARG A 74 42.427 14.411 17.220 1.00 0.00 H new ATOM 0 HH11 ARG A 74 44.667 15.143 19.992 1.00 0.00 H new ATOM 0 HH12 ARG A 74 46.075 15.010 18.935 1.00 0.00 H new ATOM 0 HH21 ARG A 74 44.325 14.085 16.075 1.00 0.00 H new ATOM 0 HH22 ARG A 74 45.894 14.426 16.813 1.00 0.00 H new ATOM 1217 N GLY A 75 42.858 17.685 16.306 1.00 0.00 N ATOM 1218 CA GLY A 75 43.105 17.625 14.882 1.00 0.00 C ATOM 1219 C GLY A 75 44.194 16.599 14.574 1.00 0.00 C ATOM 1220 O GLY A 75 45.345 16.779 14.959 1.00 0.00 O ATOM 0 H GLY A 75 43.732 17.741 16.828 1.00 0.00 H new ATOM 0 HA2 GLY A 75 42.187 17.359 14.358 1.00 0.00 H new ATOM 0 HA3 GLY A 75 43.407 18.607 14.517 1.00 0.00 H new ATOM 1224 N GLY A 76 43.882 15.530 13.852 1.00 0.00 N ATOM 1225 CA GLY A 76 44.867 14.689 13.202 1.00 0.00 C ATOM 1226 C GLY A 76 45.014 13.259 13.690 1.00 0.00 C ATOM 1227 O GLY A 76 44.236 12.906 14.603 1.00 0.00 O ATOM 1228 OXT GLY A 76 46.055 12.622 13.436 1.00 0.00 O ATOM 0 H GLY A 76 42.921 15.222 13.702 1.00 0.00 H new ATOM 0 HA2 GLY A 76 44.629 14.657 12.139 1.00 0.00 H new ATOM 0 HA3 GLY A 76 45.837 15.176 13.297 1.00 0.00 H new TER 1232 GLY A 76