USER MOD reduce.3.24.130724 H: found=0, std=0, add=630, rem=0, adj=17 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 170:sc= 0.996 USER MOD Set 1.2: A 25 ASN : amide:sc= 1.15 K(o=2.1,f=0.35) USER MOD Set 2.1: A 7 THR OG1 : rot -88:sc= 0.662 USER MOD Set 2.2: A 9 THR OG1 : rot 180:sc= 0.00472 USER MOD Set 3.1: A 6 LYS NZ :NH3+ 147:sc= 0.705 (180deg=0) USER MOD Set 3.2: A 12 THR OG1 : rot 141:sc= 0.523 USER MOD Single : A 1 MET CE :methyl 174:sc=-0.000821 (180deg=-0.0598) USER MOD Single : A 1 MET N :NH3+ 155:sc= 1.26 (180deg=1.25) USER MOD Single : A 2 GLN : amide:sc= -0.03 X(o=-0.03,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -58:sc= 0.343 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0847 USER MOD Single : A 27 LYS NZ :NH3+ 176:sc= 0.567 (180deg=0.521) USER MOD Single : A 29 LYS NZ :NH3+ 171:sc= 0.644 (180deg=0.603) USER MOD Single : A 31 GLN : amide:sc= -0.371 X(o=-0.37,f=-0.056) USER MOD Single : A 33 LYS NZ :NH3+ -173:sc= 0.227! (180deg=0.111!) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 41 GLN : amide:sc= 0.986 K(o=0.99,f=-7.5!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -4.26! K(o=-4.3!,f=0.18) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= -0.859 K(o=-0.86,f=-5.1!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 118:sc= 0.841 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.109 X(o=-0.11,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.222 31.256 15.775 1.00 0.00 N ATOM 2 CA MET A 1 14.122 31.266 17.240 1.00 0.00 C ATOM 3 C MET A 1 15.495 31.698 17.785 1.00 0.00 C ATOM 4 O MET A 1 16.508 31.341 17.206 1.00 0.00 O ATOM 5 CB MET A 1 13.567 29.954 17.795 1.00 0.00 C ATOM 6 CG MET A 1 14.541 28.786 17.664 1.00 0.00 C ATOM 7 SD MET A 1 13.706 27.272 18.190 1.00 0.00 S ATOM 8 CE MET A 1 15.028 26.128 18.632 1.00 0.00 C ATOM 0 H1 MET A 1 13.518 30.598 15.383 1.00 0.00 H new ATOM 0 H2 MET A 1 14.044 32.213 15.408 1.00 0.00 H new ATOM 0 H3 MET A 1 15.175 30.950 15.494 1.00 0.00 H new ATOM 0 HA MET A 1 13.383 31.989 17.587 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.313 30.090 18.846 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.643 29.708 17.273 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.881 28.691 16.633 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.426 28.962 18.276 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.598 25.223 19.062 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.599 25.870 17.740 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.687 26.598 19.361 1.00 0.00 H new ATOM 20 N GLN A 2 15.613 32.197 19.014 1.00 0.00 N ATOM 21 CA GLN A 2 16.877 32.559 19.624 1.00 0.00 C ATOM 22 C GLN A 2 17.219 31.419 20.584 1.00 0.00 C ATOM 23 O GLN A 2 16.370 30.955 21.339 1.00 0.00 O ATOM 24 CB GLN A 2 16.727 33.916 20.327 1.00 0.00 C ATOM 25 CG GLN A 2 16.811 35.079 19.349 1.00 0.00 C ATOM 26 CD GLN A 2 16.545 36.482 19.893 1.00 0.00 C ATOM 27 OE1 GLN A 2 16.967 37.387 19.176 1.00 0.00 O ATOM 28 NE2 GLN A 2 15.921 36.714 21.043 1.00 0.00 N ATOM 0 H GLN A 2 14.810 32.362 19.621 1.00 0.00 H new ATOM 0 HA GLN A 2 17.686 32.680 18.903 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.771 33.950 20.849 1.00 0.00 H new ATOM 0 HB3 GLN A 2 17.506 34.021 21.082 1.00 0.00 H new ATOM 0 HG2 GLN A 2 17.807 35.074 18.906 1.00 0.00 H new ATOM 0 HG3 GLN A 2 16.102 34.891 18.542 1.00 0.00 H new ATOM 0 HE21 GLN A 2 15.586 35.934 21.608 1.00 0.00 H new ATOM 0 HE22 GLN A 2 15.777 37.672 21.361 1.00 0.00 H new ATOM 37 N ILE A 3 18.507 31.170 20.818 1.00 0.00 N ATOM 38 CA ILE A 3 19.159 30.392 21.861 1.00 0.00 C ATOM 39 C ILE A 3 20.413 31.164 22.265 1.00 0.00 C ATOM 40 O ILE A 3 20.965 31.900 21.460 1.00 0.00 O ATOM 41 CB ILE A 3 19.212 28.890 21.572 1.00 0.00 C ATOM 42 CG1 ILE A 3 19.984 28.516 20.312 1.00 0.00 C ATOM 43 CG2 ILE A 3 17.889 28.151 21.353 1.00 0.00 C ATOM 44 CD1 ILE A 3 20.521 27.084 20.224 1.00 0.00 C ATOM 0 H ILE A 3 19.208 31.566 20.192 1.00 0.00 H new ATOM 0 HA ILE A 3 18.576 30.308 22.778 1.00 0.00 H new ATOM 0 HB ILE A 3 19.682 28.586 22.507 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.335 28.687 19.454 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.827 29.200 20.216 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.089 27.097 21.159 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.268 28.245 22.244 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.367 28.584 20.500 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.049 26.951 19.280 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.206 26.901 21.052 1.00 0.00 H new ATOM 0 HD13 ILE A 3 19.691 26.380 20.278 1.00 0.00 H new ATOM 56 N PHE A 4 20.897 30.899 23.478 1.00 0.00 N ATOM 57 CA PHE A 4 22.021 31.622 24.024 1.00 0.00 C ATOM 58 C PHE A 4 23.166 30.613 24.103 1.00 0.00 C ATOM 59 O PHE A 4 22.949 29.440 24.383 1.00 0.00 O ATOM 60 CB PHE A 4 21.699 32.239 25.385 1.00 0.00 C ATOM 61 CG PHE A 4 20.633 33.299 25.474 1.00 0.00 C ATOM 62 CD1 PHE A 4 20.729 34.516 24.782 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.457 33.058 26.193 1.00 0.00 C ATOM 64 CE1 PHE A 4 19.760 35.501 24.964 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.461 34.026 26.345 1.00 0.00 C ATOM 66 CZ PHE A 4 18.672 35.312 25.821 1.00 0.00 C ATOM 0 H PHE A 4 20.518 30.182 24.097 1.00 0.00 H new ATOM 0 HA PHE A 4 22.289 32.469 23.393 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.413 31.428 26.054 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.621 32.666 25.779 1.00 0.00 H new ATOM 0 HD1 PHE A 4 21.555 34.690 24.108 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.314 32.089 26.647 1.00 0.00 H new ATOM 0 HE1 PHE A 4 19.852 36.435 24.429 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.541 33.789 26.859 1.00 0.00 H new ATOM 0 HZ PHE A 4 18.013 36.130 26.073 1.00 0.00 H new ATOM 76 N VAL A 5 24.372 31.075 23.764 1.00 0.00 N ATOM 77 CA VAL A 5 25.663 30.465 23.996 1.00 0.00 C ATOM 78 C VAL A 5 26.444 31.370 24.953 1.00 0.00 C ATOM 79 O VAL A 5 26.640 32.539 24.642 1.00 0.00 O ATOM 80 CB VAL A 5 26.470 30.287 22.716 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.631 29.316 22.942 1.00 0.00 C ATOM 82 CG2 VAL A 5 25.582 29.675 21.643 1.00 0.00 C ATOM 0 H VAL A 5 24.467 31.966 23.277 1.00 0.00 H new ATOM 0 HA VAL A 5 25.500 29.471 24.413 1.00 0.00 H new ATOM 0 HB VAL A 5 26.847 31.265 22.416 1.00 0.00 H new ATOM 0 HG11 VAL A 5 28.195 29.202 22.016 1.00 0.00 H new ATOM 0 HG12 VAL A 5 28.286 29.707 23.721 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.240 28.346 23.250 1.00 0.00 H new ATOM 0 HG21 VAL A 5 26.156 29.546 20.725 1.00 0.00 H new ATOM 0 HG22 VAL A 5 25.217 28.705 21.982 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.735 30.334 21.452 1.00 0.00 H new ATOM 92 N LYS A 6 26.898 30.720 26.025 1.00 0.00 N ATOM 93 CA LYS A 6 27.835 31.296 26.963 1.00 0.00 C ATOM 94 C LYS A 6 29.270 30.932 26.590 1.00 0.00 C ATOM 95 O LYS A 6 29.621 29.756 26.508 1.00 0.00 O ATOM 96 CB LYS A 6 27.555 30.777 28.378 1.00 0.00 C ATOM 97 CG LYS A 6 28.314 31.467 29.508 1.00 0.00 C ATOM 98 CD LYS A 6 27.671 32.708 30.126 1.00 0.00 C ATOM 99 CE LYS A 6 26.509 32.403 31.083 1.00 0.00 C ATOM 100 NZ LYS A 6 25.583 33.523 31.262 1.00 0.00 N ATOM 0 H LYS A 6 26.616 29.768 26.260 1.00 0.00 H new ATOM 0 HA LYS A 6 27.714 32.379 26.930 1.00 0.00 H new ATOM 0 HB2 LYS A 6 26.487 30.873 28.574 1.00 0.00 H new ATOM 0 HB3 LYS A 6 27.790 29.713 28.406 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.473 30.738 30.302 1.00 0.00 H new ATOM 0 HG3 LYS A 6 29.298 31.748 29.132 1.00 0.00 H new ATOM 0 HD2 LYS A 6 28.434 33.269 30.666 1.00 0.00 H new ATOM 0 HD3 LYS A 6 27.308 33.353 29.325 1.00 0.00 H new ATOM 0 HE2 LYS A 6 25.956 31.543 30.706 1.00 0.00 H new ATOM 0 HE3 LYS A 6 26.915 32.120 32.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 24.620 33.158 31.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 25.871 34.083 32.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 25.599 34.125 30.414 1.00 0.00 H new ATOM 114 N THR A 7 30.124 31.939 26.441 1.00 0.00 N ATOM 115 CA THR A 7 31.508 31.720 26.081 1.00 0.00 C ATOM 116 C THR A 7 32.486 31.275 27.180 1.00 0.00 C ATOM 117 O THR A 7 32.070 31.034 28.309 1.00 0.00 O ATOM 118 CB THR A 7 31.865 33.115 25.561 1.00 0.00 C ATOM 119 OG1 THR A 7 31.751 34.018 26.637 1.00 0.00 O ATOM 120 CG2 THR A 7 31.095 33.654 24.358 1.00 0.00 C ATOM 0 H THR A 7 29.873 32.920 26.567 1.00 0.00 H new ATOM 0 HA THR A 7 31.603 30.875 25.399 1.00 0.00 H new ATOM 0 HB THR A 7 32.878 33.013 25.171 1.00 0.00 H new ATOM 0 HG1 THR A 7 30.829 34.345 26.693 1.00 0.00 H new ATOM 0 HG21 THR A 7 31.460 34.650 24.109 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.241 32.990 23.506 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.033 33.707 24.599 1.00 0.00 H new ATOM 128 N LEU A 8 33.798 31.336 26.999 1.00 0.00 N ATOM 129 CA LEU A 8 34.773 31.270 28.077 1.00 0.00 C ATOM 130 C LEU A 8 34.877 32.595 28.834 1.00 0.00 C ATOM 131 O LEU A 8 34.929 32.562 30.067 1.00 0.00 O ATOM 132 CB LEU A 8 36.121 30.765 27.566 1.00 0.00 C ATOM 133 CG LEU A 8 36.102 29.431 26.834 1.00 0.00 C ATOM 134 CD1 LEU A 8 36.966 29.230 25.588 1.00 0.00 C ATOM 135 CD2 LEU A 8 36.519 28.320 27.804 1.00 0.00 C ATOM 0 H LEU A 8 34.223 31.435 26.077 1.00 0.00 H new ATOM 0 HA LEU A 8 34.421 30.540 28.806 1.00 0.00 H new ATOM 0 HB2 LEU A 8 36.538 31.518 26.897 1.00 0.00 H new ATOM 0 HB3 LEU A 8 36.800 30.681 28.414 1.00 0.00 H new ATOM 0 HG LEU A 8 35.074 29.406 26.472 1.00 0.00 H new ATOM 0 HD11 LEU A 8 36.822 28.220 25.204 1.00 0.00 H new ATOM 0 HD12 LEU A 8 36.678 29.953 24.825 1.00 0.00 H new ATOM 0 HD13 LEU A 8 38.015 29.374 25.846 1.00 0.00 H new ATOM 0 HD21 LEU A 8 36.507 27.361 27.286 1.00 0.00 H new ATOM 0 HD22 LEU A 8 37.524 28.520 28.175 1.00 0.00 H new ATOM 0 HD23 LEU A 8 35.822 28.288 28.642 1.00 0.00 H new ATOM 147 N THR A 9 34.902 33.731 28.148 1.00 0.00 N ATOM 148 CA THR A 9 35.220 35.002 28.777 1.00 0.00 C ATOM 149 C THR A 9 34.111 35.583 29.641 1.00 0.00 C ATOM 150 O THR A 9 34.300 36.582 30.345 1.00 0.00 O ATOM 151 CB THR A 9 35.552 36.004 27.664 1.00 0.00 C ATOM 152 OG1 THR A 9 34.384 36.107 26.867 1.00 0.00 O ATOM 153 CG2 THR A 9 36.720 35.726 26.729 1.00 0.00 C ATOM 0 H THR A 9 34.704 33.795 27.149 1.00 0.00 H new ATOM 0 HA THR A 9 36.056 34.818 29.452 1.00 0.00 H new ATOM 0 HB THR A 9 35.873 36.901 28.194 1.00 0.00 H new ATOM 0 HG1 THR A 9 34.542 36.741 26.136 1.00 0.00 H new ATOM 0 HG21 THR A 9 36.808 36.537 26.006 1.00 0.00 H new ATOM 0 HG22 THR A 9 37.641 35.654 27.308 1.00 0.00 H new ATOM 0 HG23 THR A 9 36.549 34.787 26.202 1.00 0.00 H new ATOM 161 N GLY A 10 32.941 34.948 29.628 1.00 0.00 N ATOM 162 CA GLY A 10 31.834 35.389 30.447 1.00 0.00 C ATOM 163 C GLY A 10 30.691 36.128 29.743 1.00 0.00 C ATOM 164 O GLY A 10 29.695 36.457 30.386 1.00 0.00 O ATOM 0 H GLY A 10 32.743 34.127 29.056 1.00 0.00 H new ATOM 0 HA2 GLY A 10 31.414 34.516 30.946 1.00 0.00 H new ATOM 0 HA3 GLY A 10 32.229 36.042 31.225 1.00 0.00 H new ATOM 168 N LYS A 11 30.779 36.301 28.429 1.00 0.00 N ATOM 169 CA LYS A 11 29.737 36.861 27.596 1.00 0.00 C ATOM 170 C LYS A 11 28.720 35.800 27.172 1.00 0.00 C ATOM 171 O LYS A 11 29.067 34.630 27.059 1.00 0.00 O ATOM 172 CB LYS A 11 30.362 37.390 26.293 1.00 0.00 C ATOM 173 CG LYS A 11 31.471 38.435 26.401 1.00 0.00 C ATOM 174 CD LYS A 11 32.059 38.616 25.003 1.00 0.00 C ATOM 175 CE LYS A 11 33.281 39.525 25.099 1.00 0.00 C ATOM 176 NZ LYS A 11 34.075 39.549 23.857 1.00 0.00 N ATOM 0 H LYS A 11 31.613 36.043 27.901 1.00 0.00 H new ATOM 0 HA LYS A 11 29.248 37.642 28.177 1.00 0.00 H new ATOM 0 HB2 LYS A 11 30.760 36.537 25.743 1.00 0.00 H new ATOM 0 HB3 LYS A 11 29.561 37.814 25.687 1.00 0.00 H new ATOM 0 HG2 LYS A 11 31.075 39.378 26.777 1.00 0.00 H new ATOM 0 HG3 LYS A 11 32.239 38.110 27.102 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.339 37.650 24.583 1.00 0.00 H new ATOM 0 HD3 LYS A 11 31.316 39.051 24.334 1.00 0.00 H new ATOM 0 HE2 LYS A 11 32.957 40.538 25.337 1.00 0.00 H new ATOM 0 HE3 LYS A 11 33.913 39.191 25.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 34.891 40.182 23.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 34.410 38.589 23.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 33.484 39.894 23.074 1.00 0.00 H new ATOM 190 N THR A 12 27.456 36.160 26.997 1.00 0.00 N ATOM 191 CA THR A 12 26.295 35.446 26.500 1.00 0.00 C ATOM 192 C THR A 12 26.082 36.164 25.167 1.00 0.00 C ATOM 193 O THR A 12 25.631 37.313 25.178 1.00 0.00 O ATOM 194 CB THR A 12 25.150 35.462 27.514 1.00 0.00 C ATOM 195 OG1 THR A 12 25.696 35.144 28.776 1.00 0.00 O ATOM 196 CG2 THR A 12 24.026 34.483 27.178 1.00 0.00 C ATOM 0 H THR A 12 27.185 37.113 27.241 1.00 0.00 H new ATOM 0 HA THR A 12 26.392 34.370 26.352 1.00 0.00 H new ATOM 0 HB THR A 12 24.698 36.454 27.501 1.00 0.00 H new ATOM 0 HG1 THR A 12 25.269 35.695 29.465 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.248 34.547 27.939 1.00 0.00 H new ATOM 0 HG22 THR A 12 23.604 34.734 26.205 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.423 33.468 27.150 1.00 0.00 H new ATOM 204 N ILE A 13 26.352 35.504 24.040 1.00 0.00 N ATOM 205 CA ILE A 13 25.978 35.878 22.698 1.00 0.00 C ATOM 206 C ILE A 13 24.680 35.129 22.391 1.00 0.00 C ATOM 207 O ILE A 13 24.561 33.994 22.841 1.00 0.00 O ATOM 208 CB ILE A 13 27.089 35.574 21.693 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.467 36.102 22.078 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.664 35.981 20.286 1.00 0.00 C ATOM 211 CD1 ILE A 13 29.484 35.330 21.241 1.00 0.00 C ATOM 0 H ILE A 13 26.878 34.630 24.056 1.00 0.00 H new ATOM 0 HA ILE A 13 25.822 36.954 22.616 1.00 0.00 H new ATOM 0 HB ILE A 13 27.225 34.493 21.710 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.539 37.172 21.884 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.653 35.958 23.142 1.00 0.00 H new ATOM 0 HG21 ILE A 13 27.467 35.757 19.584 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.769 35.427 20.002 1.00 0.00 H new ATOM 0 HG23 ILE A 13 26.451 37.050 20.265 1.00 0.00 H new ATOM 0 HD11 ILE A 13 30.490 35.674 21.482 1.00 0.00 H new ATOM 0 HD12 ILE A 13 29.402 34.265 21.460 1.00 0.00 H new ATOM 0 HD13 ILE A 13 29.287 35.499 20.182 1.00 0.00 H new ATOM 223 N THR A 14 23.763 35.779 21.674 1.00 0.00 N ATOM 224 CA THR A 14 22.479 35.243 21.294 1.00 0.00 C ATOM 225 C THR A 14 22.664 34.695 19.880 1.00 0.00 C ATOM 226 O THR A 14 23.156 35.391 19.007 1.00 0.00 O ATOM 227 CB THR A 14 21.453 36.380 21.386 1.00 0.00 C ATOM 228 OG1 THR A 14 21.542 37.088 22.601 1.00 0.00 O ATOM 229 CG2 THR A 14 20.002 35.898 21.306 1.00 0.00 C ATOM 0 H THR A 14 23.911 36.729 21.335 1.00 0.00 H new ATOM 0 HA THR A 14 22.114 34.440 21.935 1.00 0.00 H new ATOM 0 HB THR A 14 21.699 37.010 20.532 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.412 36.470 23.350 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.330 36.753 21.377 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.840 35.387 20.357 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.802 35.210 22.127 1.00 0.00 H new ATOM 237 N LEU A 15 22.179 33.479 19.642 1.00 0.00 N ATOM 238 CA LEU A 15 22.337 32.810 18.361 1.00 0.00 C ATOM 239 C LEU A 15 20.950 32.580 17.773 1.00 0.00 C ATOM 240 O LEU A 15 20.022 32.337 18.541 1.00 0.00 O ATOM 241 CB LEU A 15 23.166 31.545 18.588 1.00 0.00 C ATOM 242 CG LEU A 15 24.700 31.575 18.599 1.00 0.00 C ATOM 243 CD1 LEU A 15 25.384 31.459 17.236 1.00 0.00 C ATOM 244 CD2 LEU A 15 25.282 32.585 19.587 1.00 0.00 C ATOM 0 H LEU A 15 21.666 32.933 20.334 1.00 0.00 H new ATOM 0 HA LEU A 15 22.882 33.402 17.625 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.852 31.130 19.546 1.00 0.00 H new ATOM 0 HB3 LEU A 15 22.870 30.832 17.819 1.00 0.00 H new ATOM 0 HG LEU A 15 24.991 30.615 19.026 1.00 0.00 H new ATOM 0 HD11 LEU A 15 26.466 31.492 17.368 1.00 0.00 H new ATOM 0 HD12 LEU A 15 25.104 30.515 16.768 1.00 0.00 H new ATOM 0 HD13 LEU A 15 25.071 32.287 16.600 1.00 0.00 H new ATOM 0 HD21 LEU A 15 26.371 32.552 19.542 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.938 33.586 19.329 1.00 0.00 H new ATOM 0 HD23 LEU A 15 24.953 32.338 20.596 1.00 0.00 H new ATOM 256 N GLU A 16 20.779 32.756 16.460 1.00 0.00 N ATOM 257 CA GLU A 16 19.501 32.617 15.795 1.00 0.00 C ATOM 258 C GLU A 16 19.658 31.227 15.166 1.00 0.00 C ATOM 259 O GLU A 16 20.607 30.857 14.475 1.00 0.00 O ATOM 260 CB GLU A 16 19.228 33.638 14.689 1.00 0.00 C ATOM 261 CG GLU A 16 19.114 35.112 15.099 1.00 0.00 C ATOM 262 CD GLU A 16 20.485 35.770 15.107 1.00 0.00 C ATOM 263 OE1 GLU A 16 21.509 35.240 14.637 1.00 0.00 O ATOM 264 OE2 GLU A 16 20.510 36.928 15.587 1.00 0.00 O ATOM 0 H GLU A 16 21.542 33.002 15.829 1.00 0.00 H new ATOM 0 HA GLU A 16 18.672 32.764 16.487 1.00 0.00 H new ATOM 0 HB2 GLU A 16 20.025 33.555 13.950 1.00 0.00 H new ATOM 0 HB3 GLU A 16 18.301 33.355 14.191 1.00 0.00 H new ATOM 0 HG2 GLU A 16 18.456 35.638 14.408 1.00 0.00 H new ATOM 0 HG3 GLU A 16 18.662 35.187 16.088 1.00 0.00 H new ATOM 271 N VAL A 17 18.625 30.422 15.398 1.00 0.00 N ATOM 272 CA VAL A 17 18.478 29.082 14.873 1.00 0.00 C ATOM 273 C VAL A 17 17.033 28.882 14.400 1.00 0.00 C ATOM 274 O VAL A 17 16.157 29.647 14.790 1.00 0.00 O ATOM 275 CB VAL A 17 18.955 28.054 15.897 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.425 28.137 16.322 1.00 0.00 C ATOM 277 CG2 VAL A 17 18.057 27.746 17.096 1.00 0.00 C ATOM 0 H VAL A 17 17.838 30.704 15.982 1.00 0.00 H new ATOM 0 HA VAL A 17 19.114 28.934 14.000 1.00 0.00 H new ATOM 0 HB VAL A 17 18.856 27.183 15.249 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.638 27.355 17.051 1.00 0.00 H new ATOM 0 HG12 VAL A 17 21.064 28.004 15.449 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.620 29.112 16.769 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.537 26.998 17.727 1.00 0.00 H new ATOM 0 HG22 VAL A 17 17.894 28.657 17.672 1.00 0.00 H new ATOM 0 HG23 VAL A 17 17.099 27.363 16.744 1.00 0.00 H new ATOM 287 N GLU A 18 16.799 27.856 13.587 1.00 0.00 N ATOM 288 CA GLU A 18 15.494 27.300 13.309 1.00 0.00 C ATOM 289 C GLU A 18 15.633 25.882 13.870 1.00 0.00 C ATOM 290 O GLU A 18 16.640 25.259 13.540 1.00 0.00 O ATOM 291 CB GLU A 18 15.485 27.172 11.793 1.00 0.00 C ATOM 292 CG GLU A 18 15.329 28.459 10.974 1.00 0.00 C ATOM 293 CD GLU A 18 13.975 29.101 11.259 1.00 0.00 C ATOM 294 OE1 GLU A 18 12.906 28.463 11.169 1.00 0.00 O ATOM 295 OE2 GLU A 18 13.856 30.334 11.474 1.00 0.00 O ATOM 0 H GLU A 18 17.548 27.376 13.088 1.00 0.00 H new ATOM 0 HA GLU A 18 14.632 27.846 13.691 1.00 0.00 H new ATOM 0 HB2 GLU A 18 16.416 26.692 11.491 1.00 0.00 H new ATOM 0 HB3 GLU A 18 14.674 26.498 11.517 1.00 0.00 H new ATOM 0 HG2 GLU A 18 16.130 29.156 11.221 1.00 0.00 H new ATOM 0 HG3 GLU A 18 15.418 28.236 9.911 1.00 0.00 H new ATOM 302 N PRO A 19 14.577 25.287 14.430 1.00 0.00 N ATOM 303 CA PRO A 19 14.581 24.006 15.102 1.00 0.00 C ATOM 304 C PRO A 19 14.711 22.812 14.158 1.00 0.00 C ATOM 305 O PRO A 19 14.985 21.697 14.601 1.00 0.00 O ATOM 306 CB PRO A 19 13.308 23.982 15.955 1.00 0.00 C ATOM 307 CG PRO A 19 12.360 24.956 15.242 1.00 0.00 C ATOM 308 CD PRO A 19 13.287 25.927 14.516 1.00 0.00 C ATOM 0 HA PRO A 19 15.469 23.901 15.726 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.883 22.980 16.008 1.00 0.00 H new ATOM 0 HB3 PRO A 19 13.508 24.298 16.979 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.706 24.434 14.544 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.717 25.476 15.952 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.903 26.158 13.522 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.359 26.870 15.057 1.00 0.00 H new ATOM 316 N SER A 20 14.731 23.053 12.855 1.00 0.00 N ATOM 317 CA SER A 20 15.135 22.175 11.777 1.00 0.00 C ATOM 318 C SER A 20 16.643 22.069 11.540 1.00 0.00 C ATOM 319 O SER A 20 17.110 21.151 10.880 1.00 0.00 O ATOM 320 CB SER A 20 14.455 22.779 10.550 1.00 0.00 C ATOM 321 OG SER A 20 14.700 24.166 10.419 1.00 0.00 O ATOM 0 H SER A 20 14.434 23.960 12.496 1.00 0.00 H new ATOM 0 HA SER A 20 14.848 21.150 12.012 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.807 22.266 9.655 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.380 22.608 10.614 1.00 0.00 H new ATOM 0 HG SER A 20 14.246 24.504 9.619 1.00 0.00 H new ATOM 327 N ASP A 21 17.391 23.066 12.012 1.00 0.00 N ATOM 328 CA ASP A 21 18.835 23.049 11.934 1.00 0.00 C ATOM 329 C ASP A 21 19.474 21.890 12.696 1.00 0.00 C ATOM 330 O ASP A 21 19.005 21.419 13.737 1.00 0.00 O ATOM 331 CB ASP A 21 19.432 24.261 12.660 1.00 0.00 C ATOM 332 CG ASP A 21 19.423 25.572 11.894 1.00 0.00 C ATOM 333 OD1 ASP A 21 19.657 25.549 10.667 1.00 0.00 O ATOM 334 OD2 ASP A 21 19.122 26.626 12.504 1.00 0.00 O ATOM 0 H ASP A 21 17.007 23.900 12.455 1.00 0.00 H new ATOM 0 HA ASP A 21 19.034 23.004 10.863 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.886 24.405 13.592 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.463 24.027 12.927 1.00 0.00 H new ATOM 339 N THR A 22 20.521 21.354 12.087 1.00 0.00 N ATOM 340 CA THR A 22 21.468 20.421 12.674 1.00 0.00 C ATOM 341 C THR A 22 22.329 21.150 13.703 1.00 0.00 C ATOM 342 O THR A 22 22.507 22.363 13.638 1.00 0.00 O ATOM 343 CB THR A 22 22.169 19.771 11.491 1.00 0.00 C ATOM 344 OG1 THR A 22 22.867 20.706 10.690 1.00 0.00 O ATOM 345 CG2 THR A 22 21.359 19.008 10.437 1.00 0.00 C ATOM 0 H THR A 22 20.744 21.571 11.116 1.00 0.00 H new ATOM 0 HA THR A 22 21.034 19.615 13.265 1.00 0.00 H new ATOM 0 HB THR A 22 22.766 19.061 12.063 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.428 20.229 10.043 1.00 0.00 H new ATOM 0 HG21 THR A 22 22.032 18.617 9.674 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.830 18.182 10.912 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.638 19.682 9.974 1.00 0.00 H new ATOM 353 N ILE A 23 22.915 20.365 14.603 1.00 0.00 N ATOM 354 CA ILE A 23 24.032 20.631 15.490 1.00 0.00 C ATOM 355 C ILE A 23 25.211 21.330 14.812 1.00 0.00 C ATOM 356 O ILE A 23 25.837 22.133 15.502 1.00 0.00 O ATOM 357 CB ILE A 23 24.416 19.378 16.273 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.283 18.446 16.716 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.501 19.647 17.319 1.00 0.00 C ATOM 360 CD1 ILE A 23 22.059 19.089 17.368 1.00 0.00 C ATOM 0 H ILE A 23 22.572 19.414 14.740 1.00 0.00 H new ATOM 0 HA ILE A 23 23.692 21.367 16.219 1.00 0.00 H new ATOM 0 HB ILE A 23 24.879 18.741 15.519 1.00 0.00 H new ATOM 0 HG12 ILE A 23 22.945 17.887 15.843 1.00 0.00 H new ATOM 0 HG13 ILE A 23 23.697 17.722 17.417 1.00 0.00 H new ATOM 0 HG21 ILE A 23 25.736 18.722 17.846 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.398 20.021 16.825 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.143 20.390 18.032 1.00 0.00 H new ATOM 0 HD11 ILE A 23 21.338 18.315 17.631 1.00 0.00 H new ATOM 0 HD12 ILE A 23 22.364 19.622 18.269 1.00 0.00 H new ATOM 0 HD13 ILE A 23 21.601 19.790 16.670 1.00 0.00 H new ATOM 372 N GLU A 24 25.562 20.970 13.585 1.00 0.00 N ATOM 373 CA GLU A 24 26.658 21.589 12.873 1.00 0.00 C ATOM 374 C GLU A 24 26.250 22.963 12.338 1.00 0.00 C ATOM 375 O GLU A 24 27.103 23.840 12.243 1.00 0.00 O ATOM 376 CB GLU A 24 26.942 20.720 11.648 1.00 0.00 C ATOM 377 CG GLU A 24 28.319 20.880 10.996 1.00 0.00 C ATOM 378 CD GLU A 24 28.639 19.857 9.920 1.00 0.00 C ATOM 379 OE1 GLU A 24 27.775 19.049 9.534 1.00 0.00 O ATOM 380 OE2 GLU A 24 29.756 19.802 9.341 1.00 0.00 O ATOM 0 H GLU A 24 25.089 20.236 13.058 1.00 0.00 H new ATOM 0 HA GLU A 24 27.512 21.689 13.543 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.821 19.676 11.936 1.00 0.00 H new ATOM 0 HB3 GLU A 24 26.182 20.933 10.896 1.00 0.00 H new ATOM 0 HG2 GLU A 24 28.385 21.877 10.560 1.00 0.00 H new ATOM 0 HG3 GLU A 24 29.082 20.820 11.772 1.00 0.00 H new ATOM 387 N ASN A 25 24.996 23.161 11.919 1.00 0.00 N ATOM 388 CA ASN A 25 24.451 24.435 11.501 1.00 0.00 C ATOM 389 C ASN A 25 24.658 25.522 12.558 1.00 0.00 C ATOM 390 O ASN A 25 25.104 26.594 12.166 1.00 0.00 O ATOM 391 CB ASN A 25 23.054 24.312 10.911 1.00 0.00 C ATOM 392 CG ASN A 25 23.019 24.059 9.407 1.00 0.00 C ATOM 393 OD1 ASN A 25 23.261 24.940 8.596 1.00 0.00 O ATOM 394 ND2 ASN A 25 22.821 22.843 8.908 1.00 0.00 N ATOM 0 H ASN A 25 24.316 22.403 11.864 1.00 0.00 H new ATOM 0 HA ASN A 25 25.034 24.794 10.653 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.531 23.499 11.415 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.502 25.227 11.125 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.875 22.690 7.901 1.00 0.00 H new ATOM 0 HD22 ASN A 25 22.615 22.063 9.532 1.00 0.00 H new ATOM 401 N VAL A 26 24.416 25.231 13.829 1.00 0.00 N ATOM 402 CA VAL A 26 24.784 26.007 14.996 1.00 0.00 C ATOM 403 C VAL A 26 26.239 26.440 15.122 1.00 0.00 C ATOM 404 O VAL A 26 26.518 27.581 15.502 1.00 0.00 O ATOM 405 CB VAL A 26 24.201 25.396 16.279 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.050 26.482 17.344 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.891 24.634 16.094 1.00 0.00 C ATOM 0 H VAL A 26 23.918 24.379 14.086 1.00 0.00 H new ATOM 0 HA VAL A 26 24.306 26.972 14.829 1.00 0.00 H new ATOM 0 HB VAL A 26 24.917 24.640 16.601 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.636 26.045 18.253 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.026 26.916 17.562 1.00 0.00 H new ATOM 0 HG13 VAL A 26 23.380 27.260 16.978 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.560 24.241 17.055 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.132 25.307 15.696 1.00 0.00 H new ATOM 0 HG23 VAL A 26 23.045 23.809 15.398 1.00 0.00 H new ATOM 417 N LYS A 27 27.110 25.450 14.938 1.00 0.00 N ATOM 418 CA LYS A 27 28.549 25.666 14.925 1.00 0.00 C ATOM 419 C LYS A 27 29.038 26.718 13.933 1.00 0.00 C ATOM 420 O LYS A 27 29.809 27.618 14.266 1.00 0.00 O ATOM 421 CB LYS A 27 29.308 24.386 14.607 1.00 0.00 C ATOM 422 CG LYS A 27 29.116 23.236 15.590 1.00 0.00 C ATOM 423 CD LYS A 27 29.790 21.901 15.265 1.00 0.00 C ATOM 424 CE LYS A 27 29.081 20.810 16.042 1.00 0.00 C ATOM 425 NZ LYS A 27 29.873 19.580 15.891 1.00 0.00 N ATOM 0 H LYS A 27 26.835 24.478 14.794 1.00 0.00 H new ATOM 0 HA LYS A 27 28.751 26.023 15.935 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.008 24.045 13.616 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.371 24.620 14.555 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.476 23.565 16.565 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.046 23.056 15.690 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.739 21.700 14.195 1.00 0.00 H new ATOM 0 HD3 LYS A 27 30.846 21.933 15.533 1.00 0.00 H new ATOM 0 HE2 LYS A 27 28.992 21.083 17.093 1.00 0.00 H new ATOM 0 HE3 LYS A 27 28.069 20.664 15.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 29.453 18.823 16.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 29.879 19.291 14.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 30.849 19.754 16.207 1.00 0.00 H new ATOM 439 N ALA A 28 28.622 26.561 12.677 1.00 0.00 N ATOM 440 CA ALA A 28 28.647 27.459 11.544 1.00 0.00 C ATOM 441 C ALA A 28 28.222 28.915 11.724 1.00 0.00 C ATOM 442 O ALA A 28 28.770 29.843 11.120 1.00 0.00 O ATOM 443 CB ALA A 28 27.987 26.726 10.382 1.00 0.00 C ATOM 0 H ALA A 28 28.202 25.672 12.404 1.00 0.00 H new ATOM 0 HA ALA A 28 29.697 27.673 11.344 1.00 0.00 H new ATOM 0 HB1 ALA A 28 27.983 27.368 9.501 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.543 25.814 10.164 1.00 0.00 H new ATOM 0 HB3 ALA A 28 26.962 26.470 10.649 1.00 0.00 H new ATOM 449 N LYS A 29 27.182 29.006 12.543 1.00 0.00 N ATOM 450 CA LYS A 29 26.525 30.242 12.910 1.00 0.00 C ATOM 451 C LYS A 29 27.311 30.795 14.106 1.00 0.00 C ATOM 452 O LYS A 29 27.680 31.963 14.063 1.00 0.00 O ATOM 453 CB LYS A 29 25.076 29.907 13.267 1.00 0.00 C ATOM 454 CG LYS A 29 24.124 29.790 12.078 1.00 0.00 C ATOM 455 CD LYS A 29 22.749 29.218 12.413 1.00 0.00 C ATOM 456 CE LYS A 29 22.014 28.740 11.161 1.00 0.00 C ATOM 457 NZ LYS A 29 20.592 28.547 11.463 1.00 0.00 N ATOM 0 H LYS A 29 26.762 28.187 12.983 1.00 0.00 H new ATOM 0 HA LYS A 29 26.505 30.988 12.115 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.062 28.966 13.817 1.00 0.00 H new ATOM 0 HB3 LYS A 29 24.698 30.676 13.941 1.00 0.00 H new ATOM 0 HG2 LYS A 29 23.993 30.778 11.637 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.589 29.161 11.319 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.861 28.387 13.109 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.152 29.978 12.917 1.00 0.00 H new ATOM 0 HE2 LYS A 29 22.129 29.470 10.360 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.450 27.806 10.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.070 28.371 10.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.480 27.733 12.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.216 29.401 11.923 1.00 0.00 H new ATOM 471 N ILE A 30 27.800 30.026 15.072 1.00 0.00 N ATOM 472 CA ILE A 30 28.769 30.477 16.054 1.00 0.00 C ATOM 473 C ILE A 30 30.032 31.081 15.449 1.00 0.00 C ATOM 474 O ILE A 30 30.513 32.072 15.973 1.00 0.00 O ATOM 475 CB ILE A 30 28.940 29.412 17.141 1.00 0.00 C ATOM 476 CG1 ILE A 30 27.699 29.237 18.012 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.192 29.652 17.985 1.00 0.00 C ATOM 478 CD1 ILE A 30 27.856 27.922 18.773 1.00 0.00 C ATOM 0 H ILE A 30 27.526 29.051 15.194 1.00 0.00 H new ATOM 0 HA ILE A 30 28.379 31.351 16.575 1.00 0.00 H new ATOM 0 HB ILE A 30 29.075 28.468 16.613 1.00 0.00 H new ATOM 0 HG12 ILE A 30 27.596 30.072 18.705 1.00 0.00 H new ATOM 0 HG13 ILE A 30 26.799 29.220 17.398 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.274 28.874 18.743 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.073 29.628 17.344 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.123 30.626 18.470 1.00 0.00 H new ATOM 0 HD11 ILE A 30 26.985 27.763 19.408 1.00 0.00 H new ATOM 0 HD12 ILE A 30 27.943 27.099 18.063 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.753 27.964 19.391 1.00 0.00 H new ATOM 490 N GLN A 31 30.559 30.577 14.335 1.00 0.00 N ATOM 491 CA GLN A 31 31.694 31.074 13.577 1.00 0.00 C ATOM 492 C GLN A 31 31.629 32.550 13.174 1.00 0.00 C ATOM 493 O GLN A 31 32.613 33.267 13.252 1.00 0.00 O ATOM 494 CB GLN A 31 31.933 30.183 12.353 1.00 0.00 C ATOM 495 CG GLN A 31 33.383 29.985 11.893 1.00 0.00 C ATOM 496 CD GLN A 31 33.791 31.063 10.895 1.00 0.00 C ATOM 497 OE1 GLN A 31 34.772 31.788 11.043 1.00 0.00 O ATOM 498 NE2 GLN A 31 33.029 31.217 9.825 1.00 0.00 N ATOM 0 H GLN A 31 30.165 29.739 13.907 1.00 0.00 H new ATOM 0 HA GLN A 31 32.541 31.023 14.261 1.00 0.00 H new ATOM 0 HB2 GLN A 31 31.510 29.201 12.564 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.369 30.600 11.518 1.00 0.00 H new ATOM 0 HG2 GLN A 31 34.049 30.012 12.756 1.00 0.00 H new ATOM 0 HG3 GLN A 31 33.492 29.001 11.436 1.00 0.00 H new ATOM 0 HE21 GLN A 31 32.212 30.621 9.691 1.00 0.00 H new ATOM 0 HE22 GLN A 31 33.258 31.931 9.134 1.00 0.00 H new ATOM 507 N ASP A 32 30.478 33.006 12.681 1.00 0.00 N ATOM 508 CA ASP A 32 30.126 34.393 12.468 1.00 0.00 C ATOM 509 C ASP A 32 30.221 35.205 13.763 1.00 0.00 C ATOM 510 O ASP A 32 30.840 36.260 13.791 1.00 0.00 O ATOM 511 CB ASP A 32 28.812 34.608 11.704 1.00 0.00 C ATOM 512 CG ASP A 32 28.502 36.038 11.307 1.00 0.00 C ATOM 513 OD1 ASP A 32 29.275 36.628 10.516 1.00 0.00 O ATOM 514 OD2 ASP A 32 27.451 36.511 11.792 1.00 0.00 O ATOM 0 H ASP A 32 29.728 32.372 12.406 1.00 0.00 H new ATOM 0 HA ASP A 32 30.881 34.789 11.789 1.00 0.00 H new ATOM 0 HB2 ASP A 32 28.835 33.998 10.801 1.00 0.00 H new ATOM 0 HB3 ASP A 32 27.992 34.236 12.319 1.00 0.00 H new ATOM 519 N LYS A 33 29.560 34.692 14.801 1.00 0.00 N ATOM 520 CA LYS A 33 29.308 35.388 16.056 1.00 0.00 C ATOM 521 C LYS A 33 30.412 35.398 17.120 1.00 0.00 C ATOM 522 O LYS A 33 30.480 36.226 18.030 1.00 0.00 O ATOM 523 CB LYS A 33 27.998 34.921 16.683 1.00 0.00 C ATOM 524 CG LYS A 33 26.855 35.753 16.090 1.00 0.00 C ATOM 525 CD LYS A 33 25.516 35.612 16.823 1.00 0.00 C ATOM 526 CE LYS A 33 24.358 35.976 15.897 1.00 0.00 C ATOM 527 NZ LYS A 33 23.169 36.400 16.644 1.00 0.00 N ATOM 0 H LYS A 33 29.174 33.748 14.787 1.00 0.00 H new ATOM 0 HA LYS A 33 29.262 36.427 15.730 1.00 0.00 H new ATOM 0 HB2 LYS A 33 27.839 33.861 16.484 1.00 0.00 H new ATOM 0 HB3 LYS A 33 28.032 35.040 17.766 1.00 0.00 H new ATOM 0 HG2 LYS A 33 27.148 36.803 16.094 1.00 0.00 H new ATOM 0 HG3 LYS A 33 26.716 35.465 15.048 1.00 0.00 H new ATOM 0 HD2 LYS A 33 25.396 34.589 17.180 1.00 0.00 H new ATOM 0 HD3 LYS A 33 25.505 36.259 17.700 1.00 0.00 H new ATOM 0 HE2 LYS A 33 24.669 36.776 15.226 1.00 0.00 H new ATOM 0 HE3 LYS A 33 24.108 35.117 15.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 22.372 36.524 15.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 22.926 35.676 17.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 23.364 37.301 17.125 1.00 0.00 H new ATOM 541 N GLU A 34 31.417 34.525 17.049 1.00 0.00 N ATOM 542 CA GLU A 34 32.412 34.397 18.094 1.00 0.00 C ATOM 543 C GLU A 34 33.709 33.833 17.497 1.00 0.00 C ATOM 544 O GLU A 34 34.628 33.469 18.233 1.00 0.00 O ATOM 545 CB GLU A 34 31.853 33.466 19.162 1.00 0.00 C ATOM 546 CG GLU A 34 32.700 32.949 20.324 1.00 0.00 C ATOM 547 CD GLU A 34 33.393 34.000 21.171 1.00 0.00 C ATOM 548 OE1 GLU A 34 33.358 35.199 20.789 1.00 0.00 O ATOM 549 OE2 GLU A 34 34.011 33.641 22.188 1.00 0.00 O ATOM 0 H GLU A 34 31.557 33.891 16.263 1.00 0.00 H new ATOM 0 HA GLU A 34 32.639 35.366 18.539 1.00 0.00 H new ATOM 0 HB2 GLU A 34 30.996 33.976 19.603 1.00 0.00 H new ATOM 0 HB3 GLU A 34 31.469 32.589 18.641 1.00 0.00 H new ATOM 0 HG2 GLU A 34 32.060 32.353 20.975 1.00 0.00 H new ATOM 0 HG3 GLU A 34 33.459 32.278 19.922 1.00 0.00 H new ATOM 556 N GLY A 35 33.824 33.581 16.200 1.00 0.00 N ATOM 557 CA GLY A 35 35.080 33.425 15.506 1.00 0.00 C ATOM 558 C GLY A 35 35.578 31.980 15.388 1.00 0.00 C ATOM 559 O GLY A 35 36.459 31.696 14.575 1.00 0.00 O ATOM 0 H GLY A 35 33.014 33.477 15.588 1.00 0.00 H new ATOM 0 HA2 GLY A 35 34.979 33.842 14.504 1.00 0.00 H new ATOM 0 HA3 GLY A 35 35.839 34.014 16.021 1.00 0.00 H new ATOM 563 N ILE A 36 35.121 31.036 16.209 1.00 0.00 N ATOM 564 CA ILE A 36 35.776 29.754 16.290 1.00 0.00 C ATOM 565 C ILE A 36 35.243 28.883 15.137 1.00 0.00 C ATOM 566 O ILE A 36 34.022 28.786 15.024 1.00 0.00 O ATOM 567 CB ILE A 36 35.414 29.127 17.633 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.650 30.033 18.842 1.00 0.00 C ATOM 569 CG2 ILE A 36 36.334 27.923 17.796 1.00 0.00 C ATOM 570 CD1 ILE A 36 35.207 29.433 20.179 1.00 0.00 C ATOM 0 H ILE A 36 34.309 31.143 16.817 1.00 0.00 H new ATOM 0 HA ILE A 36 36.859 29.845 16.211 1.00 0.00 H new ATOM 0 HB ILE A 36 34.348 28.898 17.614 1.00 0.00 H new ATOM 0 HG12 ILE A 36 36.712 30.272 18.899 1.00 0.00 H new ATOM 0 HG13 ILE A 36 35.119 30.972 18.686 1.00 0.00 H new ATOM 0 HG21 ILE A 36 36.122 27.429 18.744 1.00 0.00 H new ATOM 0 HG22 ILE A 36 36.166 27.223 16.977 1.00 0.00 H new ATOM 0 HG23 ILE A 36 37.372 28.254 17.783 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.411 30.142 20.981 1.00 0.00 H new ATOM 0 HD12 ILE A 36 34.139 29.220 20.146 1.00 0.00 H new ATOM 0 HD13 ILE A 36 35.756 28.509 20.363 1.00 0.00 H new ATOM 582 N PRO A 37 36.074 28.213 14.343 1.00 0.00 N ATOM 583 CA PRO A 37 35.601 27.170 13.463 1.00 0.00 C ATOM 584 C PRO A 37 34.899 25.949 14.073 1.00 0.00 C ATOM 585 O PRO A 37 35.433 25.492 15.088 1.00 0.00 O ATOM 586 CB PRO A 37 36.835 26.615 12.742 1.00 0.00 C ATOM 587 CG PRO A 37 37.982 27.571 13.071 1.00 0.00 C ATOM 588 CD PRO A 37 37.507 28.394 14.264 1.00 0.00 C ATOM 0 HA PRO A 37 34.839 27.661 12.858 1.00 0.00 H new ATOM 0 HB2 PRO A 37 37.062 25.603 13.079 1.00 0.00 H new ATOM 0 HB3 PRO A 37 36.667 26.563 11.666 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.892 27.022 13.312 1.00 0.00 H new ATOM 0 HG3 PRO A 37 38.213 28.212 12.220 1.00 0.00 H new ATOM 0 HD2 PRO A 37 37.991 28.062 15.182 1.00 0.00 H new ATOM 0 HD3 PRO A 37 37.759 29.447 14.134 1.00 0.00 H new ATOM 596 N PRO A 38 33.976 25.267 13.400 1.00 0.00 N ATOM 597 CA PRO A 38 33.369 24.030 13.854 1.00 0.00 C ATOM 598 C PRO A 38 34.298 22.934 14.388 1.00 0.00 C ATOM 599 O PRO A 38 33.953 22.281 15.362 1.00 0.00 O ATOM 600 CB PRO A 38 32.362 23.479 12.851 1.00 0.00 C ATOM 601 CG PRO A 38 32.104 24.747 12.031 1.00 0.00 C ATOM 602 CD PRO A 38 33.292 25.704 12.201 1.00 0.00 C ATOM 0 HA PRO A 38 32.844 24.353 14.753 1.00 0.00 H new ATOM 0 HB2 PRO A 38 32.771 22.667 12.250 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.460 23.098 13.329 1.00 0.00 H new ATOM 0 HG2 PRO A 38 31.972 24.494 10.979 1.00 0.00 H new ATOM 0 HG3 PRO A 38 31.183 25.228 12.361 1.00 0.00 H new ATOM 0 HD2 PRO A 38 33.954 25.665 11.336 1.00 0.00 H new ATOM 0 HD3 PRO A 38 32.954 26.736 12.297 1.00 0.00 H new ATOM 610 N ASP A 39 35.433 22.752 13.713 1.00 0.00 N ATOM 611 CA ASP A 39 36.401 21.747 14.097 1.00 0.00 C ATOM 612 C ASP A 39 37.325 22.290 15.189 1.00 0.00 C ATOM 613 O ASP A 39 38.250 21.567 15.561 1.00 0.00 O ATOM 614 CB ASP A 39 37.067 21.120 12.870 1.00 0.00 C ATOM 615 CG ASP A 39 38.302 21.872 12.390 1.00 0.00 C ATOM 616 OD1 ASP A 39 38.171 23.063 12.055 1.00 0.00 O ATOM 617 OD2 ASP A 39 39.381 21.268 12.182 1.00 0.00 O ATOM 0 H ASP A 39 35.698 23.297 12.892 1.00 0.00 H new ATOM 0 HA ASP A 39 35.908 20.896 14.567 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.347 20.093 13.105 1.00 0.00 H new ATOM 0 HB3 ASP A 39 36.342 21.075 12.058 1.00 0.00 H new ATOM 622 N GLN A 40 37.190 23.499 15.728 1.00 0.00 N ATOM 623 CA GLN A 40 37.883 24.034 16.882 1.00 0.00 C ATOM 624 C GLN A 40 36.928 24.411 18.015 1.00 0.00 C ATOM 625 O GLN A 40 37.411 24.931 19.013 1.00 0.00 O ATOM 626 CB GLN A 40 38.858 25.171 16.562 1.00 0.00 C ATOM 627 CG GLN A 40 39.883 24.814 15.490 1.00 0.00 C ATOM 628 CD GLN A 40 40.839 25.968 15.198 1.00 0.00 C ATOM 629 OE1 GLN A 40 40.742 27.079 15.708 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.832 25.574 14.410 1.00 0.00 N ATOM 0 H GLN A 40 36.540 24.179 15.333 1.00 0.00 H new ATOM 0 HA GLN A 40 38.503 23.210 17.234 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.291 26.043 16.235 1.00 0.00 H new ATOM 0 HB3 GLN A 40 39.383 25.456 17.474 1.00 0.00 H new ATOM 0 HG2 GLN A 40 40.455 23.944 15.812 1.00 0.00 H new ATOM 0 HG3 GLN A 40 39.364 24.533 14.573 1.00 0.00 H new ATOM 0 HE21 GLN A 40 41.835 24.629 14.027 1.00 0.00 H new ATOM 0 HE22 GLN A 40 42.592 26.217 14.188 1.00 0.00 H new ATOM 639 N GLN A 41 35.642 24.110 17.891 1.00 0.00 N ATOM 640 CA GLN A 41 34.673 24.333 18.940 1.00 0.00 C ATOM 641 C GLN A 41 34.414 23.019 19.697 1.00 0.00 C ATOM 642 O GLN A 41 34.570 21.943 19.134 1.00 0.00 O ATOM 643 CB GLN A 41 33.313 24.620 18.307 1.00 0.00 C ATOM 644 CG GLN A 41 33.115 26.044 17.764 1.00 0.00 C ATOM 645 CD GLN A 41 31.834 26.237 16.963 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.866 25.472 16.981 1.00 0.00 O ATOM 647 NE2 GLN A 41 31.835 27.330 16.211 1.00 0.00 N ATOM 0 H GLN A 41 35.244 23.699 17.046 1.00 0.00 H new ATOM 0 HA GLN A 41 35.053 25.135 19.573 1.00 0.00 H new ATOM 0 HB2 GLN A 41 33.158 23.915 17.490 1.00 0.00 H new ATOM 0 HB3 GLN A 41 32.539 24.424 19.049 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.115 26.743 18.601 1.00 0.00 H new ATOM 0 HG3 GLN A 41 33.966 26.301 17.134 1.00 0.00 H new ATOM 0 HE21 GLN A 41 32.646 27.949 16.211 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.025 27.552 15.633 1.00 0.00 H new ATOM 656 N ARG A 42 33.959 23.079 20.942 1.00 0.00 N ATOM 657 CA ARG A 42 33.302 21.923 21.527 1.00 0.00 C ATOM 658 C ARG A 42 32.019 22.546 22.078 1.00 0.00 C ATOM 659 O ARG A 42 32.163 23.356 22.992 1.00 0.00 O ATOM 660 CB ARG A 42 34.207 21.177 22.515 1.00 0.00 C ATOM 661 CG ARG A 42 33.458 20.168 23.383 1.00 0.00 C ATOM 662 CD ARG A 42 34.302 19.344 24.357 1.00 0.00 C ATOM 663 NE ARG A 42 34.758 18.056 23.858 1.00 0.00 N ATOM 664 CZ ARG A 42 35.492 17.076 24.403 1.00 0.00 C ATOM 665 NH1 ARG A 42 35.985 17.236 25.641 1.00 0.00 N ATOM 666 NH2 ARG A 42 35.745 16.021 23.610 1.00 0.00 N ATOM 0 H ARG A 42 34.031 23.894 21.551 1.00 0.00 H new ATOM 0 HA ARG A 42 33.071 21.107 20.842 1.00 0.00 H new ATOM 0 HB2 ARG A 42 34.988 20.658 21.960 1.00 0.00 H new ATOM 0 HB3 ARG A 42 34.703 21.902 23.160 1.00 0.00 H new ATOM 0 HG2 ARG A 42 32.703 20.706 23.957 1.00 0.00 H new ATOM 0 HG3 ARG A 42 32.928 19.480 22.725 1.00 0.00 H new ATOM 0 HD2 ARG A 42 35.174 19.933 24.642 1.00 0.00 H new ATOM 0 HD3 ARG A 42 33.720 19.177 25.263 1.00 0.00 H new ATOM 0 HE ARG A 42 34.460 17.859 22.903 1.00 0.00 H new ATOM 0 HH11 ARG A 42 35.800 18.096 26.157 1.00 0.00 H new ATOM 0 HH12 ARG A 42 36.545 16.497 26.066 1.00 0.00 H new ATOM 0 HH21 ARG A 42 35.384 16.002 22.656 1.00 0.00 H new ATOM 0 HH22 ARG A 42 36.298 15.240 23.962 1.00 0.00 H new ATOM 680 N LEU A 43 30.788 22.281 21.661 1.00 0.00 N ATOM 681 CA LEU A 43 29.555 22.804 22.214 1.00 0.00 C ATOM 682 C LEU A 43 29.109 21.918 23.361 1.00 0.00 C ATOM 683 O LEU A 43 29.395 20.719 23.360 1.00 0.00 O ATOM 684 CB LEU A 43 28.409 22.701 21.209 1.00 0.00 C ATOM 685 CG LEU A 43 28.659 22.969 19.719 1.00 0.00 C ATOM 686 CD1 LEU A 43 27.481 22.517 18.861 1.00 0.00 C ATOM 687 CD2 LEU A 43 28.829 24.479 19.532 1.00 0.00 C ATOM 0 H LEU A 43 30.618 21.653 20.875 1.00 0.00 H new ATOM 0 HA LEU A 43 29.752 23.836 22.503 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.997 21.695 21.291 1.00 0.00 H new ATOM 0 HB3 LEU A 43 27.631 23.391 21.535 1.00 0.00 H new ATOM 0 HG LEU A 43 29.545 22.415 19.411 1.00 0.00 H new ATOM 0 HD11 LEU A 43 27.695 22.723 17.812 1.00 0.00 H new ATOM 0 HD12 LEU A 43 27.322 21.447 18.996 1.00 0.00 H new ATOM 0 HD13 LEU A 43 26.583 23.058 19.161 1.00 0.00 H new ATOM 0 HD21 LEU A 43 29.008 24.697 18.479 1.00 0.00 H new ATOM 0 HD22 LEU A 43 27.924 24.990 19.860 1.00 0.00 H new ATOM 0 HD23 LEU A 43 29.676 24.826 20.124 1.00 0.00 H new ATOM 699 N ILE A 44 28.481 22.484 24.395 1.00 0.00 N ATOM 700 CA ILE A 44 27.958 21.882 25.599 1.00 0.00 C ATOM 701 C ILE A 44 26.566 22.486 25.816 1.00 0.00 C ATOM 702 O ILE A 44 26.395 23.619 25.366 1.00 0.00 O ATOM 703 CB ILE A 44 28.845 22.389 26.733 1.00 0.00 C ATOM 704 CG1 ILE A 44 30.280 21.861 26.670 1.00 0.00 C ATOM 705 CG2 ILE A 44 28.384 22.337 28.192 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.467 20.385 27.027 1.00 0.00 C ATOM 0 H ILE A 44 28.314 23.490 24.397 1.00 0.00 H new ATOM 0 HA ILE A 44 27.925 20.794 25.551 1.00 0.00 H new ATOM 0 HB ILE A 44 28.763 23.446 26.482 1.00 0.00 H new ATOM 0 HG12 ILE A 44 30.661 22.022 25.662 1.00 0.00 H new ATOM 0 HG13 ILE A 44 30.896 22.458 27.343 1.00 0.00 H new ATOM 0 HG21 ILE A 44 29.164 22.746 28.835 1.00 0.00 H new ATOM 0 HG22 ILE A 44 27.473 22.925 28.307 1.00 0.00 H new ATOM 0 HG23 ILE A 44 28.186 21.303 28.474 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.522 20.122 26.948 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.125 20.211 28.047 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.887 19.768 26.340 1.00 0.00 H new ATOM 718 N PHE A 45 25.708 21.775 26.537 1.00 0.00 N ATOM 719 CA PHE A 45 24.529 22.307 27.202 1.00 0.00 C ATOM 720 C PHE A 45 24.085 21.350 28.317 1.00 0.00 C ATOM 721 O PHE A 45 24.253 20.151 28.080 1.00 0.00 O ATOM 722 CB PHE A 45 23.438 22.602 26.176 1.00 0.00 C ATOM 723 CG PHE A 45 22.027 22.638 26.716 1.00 0.00 C ATOM 724 CD1 PHE A 45 21.476 23.682 27.459 1.00 0.00 C ATOM 725 CD2 PHE A 45 21.268 21.461 26.655 1.00 0.00 C ATOM 726 CE1 PHE A 45 20.150 23.635 27.900 1.00 0.00 C ATOM 727 CE2 PHE A 45 19.913 21.401 27.016 1.00 0.00 C ATOM 728 CZ PHE A 45 19.344 22.521 27.629 1.00 0.00 C ATOM 0 H PHE A 45 25.821 20.771 26.679 1.00 0.00 H new ATOM 0 HA PHE A 45 24.760 23.257 27.683 1.00 0.00 H new ATOM 0 HB2 PHE A 45 23.654 23.563 25.709 1.00 0.00 H new ATOM 0 HB3 PHE A 45 23.489 21.847 25.391 1.00 0.00 H new ATOM 0 HD1 PHE A 45 22.084 24.542 27.698 1.00 0.00 H new ATOM 0 HD2 PHE A 45 21.749 20.556 26.314 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.742 24.466 28.456 1.00 0.00 H new ATOM 0 HE2 PHE A 45 19.326 20.514 26.826 1.00 0.00 H new ATOM 0 HZ PHE A 45 18.296 22.528 27.891 1.00 0.00 H new ATOM 738 N ALA A 46 23.518 21.799 29.426 1.00 0.00 N ATOM 739 CA ALA A 46 22.945 21.094 30.558 1.00 0.00 C ATOM 740 C ALA A 46 23.911 20.059 31.157 1.00 0.00 C ATOM 741 O ALA A 46 23.364 19.129 31.742 1.00 0.00 O ATOM 742 CB ALA A 46 21.506 20.587 30.411 1.00 0.00 C ATOM 0 H ALA A 46 23.440 22.806 29.569 1.00 0.00 H new ATOM 0 HA ALA A 46 22.817 21.883 31.298 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.203 20.080 31.327 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.840 21.430 30.226 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.449 19.890 29.575 1.00 0.00 H new ATOM 748 N GLY A 47 25.216 20.155 30.922 1.00 0.00 N ATOM 749 CA GLY A 47 26.289 19.347 31.450 1.00 0.00 C ATOM 750 C GLY A 47 26.671 18.251 30.444 1.00 0.00 C ATOM 751 O GLY A 47 27.602 17.489 30.660 1.00 0.00 O ATOM 0 H GLY A 47 25.574 20.874 30.294 1.00 0.00 H new ATOM 0 HA2 GLY A 47 27.155 19.974 31.663 1.00 0.00 H new ATOM 0 HA3 GLY A 47 25.983 18.895 32.393 1.00 0.00 H new ATOM 755 N LYS A 48 25.999 18.203 29.298 1.00 0.00 N ATOM 756 CA LYS A 48 26.224 17.216 28.266 1.00 0.00 C ATOM 757 C LYS A 48 27.073 17.753 27.110 1.00 0.00 C ATOM 758 O LYS A 48 26.983 18.956 26.887 1.00 0.00 O ATOM 759 CB LYS A 48 24.824 16.968 27.689 1.00 0.00 C ATOM 760 CG LYS A 48 23.635 16.737 28.618 1.00 0.00 C ATOM 761 CD LYS A 48 22.296 16.387 27.964 1.00 0.00 C ATOM 762 CE LYS A 48 21.078 16.457 28.890 1.00 0.00 C ATOM 763 NZ LYS A 48 20.796 15.162 29.543 1.00 0.00 N ATOM 0 H LYS A 48 25.265 18.871 29.062 1.00 0.00 H new ATOM 0 HA LYS A 48 26.736 16.348 28.681 1.00 0.00 H new ATOM 0 HB2 LYS A 48 24.579 17.823 27.059 1.00 0.00 H new ATOM 0 HB3 LYS A 48 24.895 16.099 27.034 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.895 15.933 29.307 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.494 17.637 29.217 1.00 0.00 H new ATOM 0 HD2 LYS A 48 22.133 17.063 27.124 1.00 0.00 H new ATOM 0 HD3 LYS A 48 22.363 15.379 27.554 1.00 0.00 H new ATOM 0 HE2 LYS A 48 21.247 17.217 29.653 1.00 0.00 H new ATOM 0 HE3 LYS A 48 20.206 16.770 28.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 19.964 15.258 30.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 20.608 14.441 28.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 21.617 14.874 30.112 1.00 0.00 H new ATOM 777 N GLN A 49 27.887 16.944 26.442 1.00 0.00 N ATOM 778 CA GLN A 49 28.371 17.332 25.129 1.00 0.00 C ATOM 779 C GLN A 49 27.160 17.162 24.218 1.00 0.00 C ATOM 780 O GLN A 49 26.436 16.161 24.241 1.00 0.00 O ATOM 781 CB GLN A 49 29.488 16.379 24.698 1.00 0.00 C ATOM 782 CG GLN A 49 30.879 16.581 25.309 1.00 0.00 C ATOM 783 CD GLN A 49 31.197 16.144 26.736 1.00 0.00 C ATOM 784 OE1 GLN A 49 32.312 16.244 27.218 1.00 0.00 O ATOM 785 NE2 GLN A 49 30.217 15.468 27.328 1.00 0.00 N ATOM 0 H GLN A 49 28.217 16.040 26.779 1.00 0.00 H new ATOM 0 HA GLN A 49 28.773 18.345 25.104 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.167 15.363 24.926 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.586 16.447 23.614 1.00 0.00 H new ATOM 0 HG2 GLN A 49 31.588 16.071 24.657 1.00 0.00 H new ATOM 0 HG3 GLN A 49 31.099 17.647 25.248 1.00 0.00 H new ATOM 0 HE21 GLN A 49 29.299 15.411 26.888 1.00 0.00 H new ATOM 0 HE22 GLN A 49 30.384 15.007 28.222 1.00 0.00 H new ATOM 794 N LEU A 50 26.931 18.198 23.414 1.00 0.00 N ATOM 795 CA LEU A 50 25.929 18.186 22.373 1.00 0.00 C ATOM 796 C LEU A 50 26.220 17.048 21.399 1.00 0.00 C ATOM 797 O LEU A 50 27.306 16.945 20.835 1.00 0.00 O ATOM 798 CB LEU A 50 25.911 19.489 21.568 1.00 0.00 C ATOM 799 CG LEU A 50 24.560 20.198 21.473 1.00 0.00 C ATOM 800 CD1 LEU A 50 23.495 19.460 20.660 1.00 0.00 C ATOM 801 CD2 LEU A 50 24.154 20.739 22.840 1.00 0.00 C ATOM 0 H LEU A 50 27.447 19.076 23.475 1.00 0.00 H new ATOM 0 HA LEU A 50 24.964 18.061 22.864 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.630 20.177 22.012 1.00 0.00 H new ATOM 0 HB3 LEU A 50 26.258 19.274 20.557 1.00 0.00 H new ATOM 0 HG LEU A 50 24.677 21.077 20.839 1.00 0.00 H new ATOM 0 HD11 LEU A 50 22.574 20.043 20.652 1.00 0.00 H new ATOM 0 HD12 LEU A 50 23.847 19.324 19.637 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.304 18.486 21.110 1.00 0.00 H new ATOM 0 HD21 LEU A 50 23.190 21.242 22.761 1.00 0.00 H new ATOM 0 HD22 LEU A 50 24.076 19.915 23.549 1.00 0.00 H new ATOM 0 HD23 LEU A 50 24.905 21.447 23.189 1.00 0.00 H new ATOM 813 N GLU A 51 25.267 16.118 21.305 1.00 0.00 N ATOM 814 CA GLU A 51 25.225 14.997 20.388 1.00 0.00 C ATOM 815 C GLU A 51 24.866 15.450 18.978 1.00 0.00 C ATOM 816 O GLU A 51 23.720 15.702 18.638 1.00 0.00 O ATOM 817 CB GLU A 51 24.144 14.102 20.990 1.00 0.00 C ATOM 818 CG GLU A 51 24.124 12.728 20.312 1.00 0.00 C ATOM 819 CD GLU A 51 23.273 11.693 21.028 1.00 0.00 C ATOM 820 OE1 GLU A 51 22.124 12.002 21.417 1.00 0.00 O ATOM 821 OE2 GLU A 51 23.790 10.547 21.049 1.00 0.00 O ATOM 0 H GLU A 51 24.450 16.138 21.915 1.00 0.00 H new ATOM 0 HA GLU A 51 26.183 14.489 20.281 1.00 0.00 H new ATOM 0 HB2 GLU A 51 24.321 13.981 22.059 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.170 14.579 20.881 1.00 0.00 H new ATOM 0 HG2 GLU A 51 23.755 12.843 19.293 1.00 0.00 H new ATOM 0 HG3 GLU A 51 25.146 12.355 20.241 1.00 0.00 H new ATOM 828 N ASP A 52 25.930 15.577 18.177 1.00 0.00 N ATOM 829 CA ASP A 52 25.937 15.421 16.734 1.00 0.00 C ATOM 830 C ASP A 52 25.073 14.296 16.161 1.00 0.00 C ATOM 831 O ASP A 52 25.067 13.182 16.674 1.00 0.00 O ATOM 832 CB ASP A 52 27.426 15.305 16.397 1.00 0.00 C ATOM 833 CG ASP A 52 28.005 16.696 16.207 1.00 0.00 C ATOM 834 OD1 ASP A 52 27.767 17.409 15.206 1.00 0.00 O ATOM 835 OD2 ASP A 52 28.876 17.022 17.048 1.00 0.00 O ATOM 0 H ASP A 52 26.854 15.803 18.546 1.00 0.00 H new ATOM 0 HA ASP A 52 25.451 16.269 16.252 1.00 0.00 H new ATOM 0 HB2 ASP A 52 27.953 14.785 17.197 1.00 0.00 H new ATOM 0 HB3 ASP A 52 27.561 14.715 15.491 1.00 0.00 H new ATOM 840 N GLY A 53 24.319 14.567 15.098 1.00 0.00 N ATOM 841 CA GLY A 53 23.608 13.535 14.379 1.00 0.00 C ATOM 842 C GLY A 53 22.099 13.736 14.214 1.00 0.00 C ATOM 843 O GLY A 53 21.418 12.768 13.871 1.00 0.00 O ATOM 0 H GLY A 53 24.190 15.505 14.720 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.051 13.443 13.387 1.00 0.00 H new ATOM 0 HA3 GLY A 53 23.772 12.587 14.891 1.00 0.00 H new ATOM 847 N ARG A 54 21.666 14.891 14.728 1.00 0.00 N ATOM 848 CA ARG A 54 20.288 15.207 15.027 1.00 0.00 C ATOM 849 C ARG A 54 19.883 16.550 14.415 1.00 0.00 C ATOM 850 O ARG A 54 20.658 17.160 13.682 1.00 0.00 O ATOM 851 CB ARG A 54 20.016 15.202 16.538 1.00 0.00 C ATOM 852 CG ARG A 54 20.544 13.999 17.320 1.00 0.00 C ATOM 853 CD ARG A 54 20.085 14.117 18.771 1.00 0.00 C ATOM 854 NE ARG A 54 20.217 12.922 19.609 1.00 0.00 N ATOM 855 CZ ARG A 54 19.364 11.886 19.610 1.00 0.00 C ATOM 856 NH1 ARG A 54 18.259 11.802 18.856 1.00 0.00 N ATOM 857 NH2 ARG A 54 19.849 10.827 20.265 1.00 0.00 N ATOM 0 H ARG A 54 22.302 15.656 14.952 1.00 0.00 H new ATOM 0 HA ARG A 54 19.677 14.425 14.577 1.00 0.00 H new ATOM 0 HB2 ARG A 54 20.451 16.105 16.966 1.00 0.00 H new ATOM 0 HB3 ARG A 54 18.939 15.263 16.691 1.00 0.00 H new ATOM 0 HG2 ARG A 54 20.175 13.072 16.881 1.00 0.00 H new ATOM 0 HG3 ARG A 54 21.632 13.964 17.270 1.00 0.00 H new ATOM 0 HD2 ARG A 54 20.648 14.924 19.240 1.00 0.00 H new ATOM 0 HD3 ARG A 54 19.037 14.417 18.772 1.00 0.00 H new ATOM 0 HE ARG A 54 21.018 12.874 20.239 1.00 0.00 H new ATOM 0 HH11 ARG A 54 18.015 12.563 18.222 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.662 10.977 18.916 1.00 0.00 H new ATOM 0 HH21 ARG A 54 20.774 10.872 20.693 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.294 9.974 20.337 1.00 0.00 H new ATOM 871 N THR A 55 18.731 17.064 14.832 1.00 0.00 N ATOM 872 CA THR A 55 18.327 18.447 14.708 1.00 0.00 C ATOM 873 C THR A 55 17.942 19.012 16.083 1.00 0.00 C ATOM 874 O THR A 55 17.845 18.271 17.055 1.00 0.00 O ATOM 875 CB THR A 55 17.280 18.609 13.607 1.00 0.00 C ATOM 876 OG1 THR A 55 16.104 17.862 13.807 1.00 0.00 O ATOM 877 CG2 THR A 55 17.881 18.259 12.247 1.00 0.00 C ATOM 0 H THR A 55 18.021 16.491 15.289 1.00 0.00 H new ATOM 0 HA THR A 55 19.164 19.062 14.376 1.00 0.00 H new ATOM 0 HB THR A 55 16.985 19.658 13.641 1.00 0.00 H new ATOM 0 HG1 THR A 55 15.486 18.020 13.063 1.00 0.00 H new ATOM 0 HG21 THR A 55 17.123 18.379 11.473 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.721 18.922 12.039 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.228 17.226 12.258 1.00 0.00 H new ATOM 885 N LEU A 56 17.819 20.319 16.279 1.00 0.00 N ATOM 886 CA LEU A 56 17.532 21.018 17.522 1.00 0.00 C ATOM 887 C LEU A 56 16.210 20.552 18.119 1.00 0.00 C ATOM 888 O LEU A 56 15.994 20.492 19.326 1.00 0.00 O ATOM 889 CB LEU A 56 17.585 22.535 17.320 1.00 0.00 C ATOM 890 CG LEU A 56 18.912 23.280 17.307 1.00 0.00 C ATOM 891 CD1 LEU A 56 20.115 22.423 16.918 1.00 0.00 C ATOM 892 CD2 LEU A 56 18.936 24.638 16.587 1.00 0.00 C ATOM 0 H LEU A 56 17.927 20.972 15.503 1.00 0.00 H new ATOM 0 HA LEU A 56 18.307 20.769 18.247 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.091 22.748 16.372 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.976 22.983 18.105 1.00 0.00 H new ATOM 0 HG LEU A 56 19.014 23.527 18.364 1.00 0.00 H new ATOM 0 HD11 LEU A 56 21.018 23.034 16.935 1.00 0.00 H new ATOM 0 HD12 LEU A 56 20.220 21.601 17.626 1.00 0.00 H new ATOM 0 HD13 LEU A 56 19.967 22.022 15.915 1.00 0.00 H new ATOM 0 HD21 LEU A 56 19.937 25.065 16.649 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.665 24.500 15.540 1.00 0.00 H new ATOM 0 HD23 LEU A 56 18.223 25.313 17.060 1.00 0.00 H new ATOM 904 N SER A 57 15.230 20.347 17.241 1.00 0.00 N ATOM 905 CA SER A 57 13.911 19.819 17.523 1.00 0.00 C ATOM 906 C SER A 57 14.025 18.380 18.015 1.00 0.00 C ATOM 907 O SER A 57 13.240 17.972 18.866 1.00 0.00 O ATOM 908 CB SER A 57 13.050 19.875 16.259 1.00 0.00 C ATOM 909 OG SER A 57 11.726 19.441 16.490 1.00 0.00 O ATOM 0 H SER A 57 15.352 20.562 16.251 1.00 0.00 H new ATOM 0 HA SER A 57 13.441 20.422 18.299 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.034 20.896 15.879 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.503 19.254 15.486 1.00 0.00 H new ATOM 0 HG SER A 57 11.214 19.496 15.656 1.00 0.00 H new ATOM 915 N ASP A 58 14.962 17.539 17.585 1.00 0.00 N ATOM 916 CA ASP A 58 15.098 16.140 17.953 1.00 0.00 C ATOM 917 C ASP A 58 15.816 15.885 19.284 1.00 0.00 C ATOM 918 O ASP A 58 15.531 14.952 20.039 1.00 0.00 O ATOM 919 CB ASP A 58 16.031 15.525 16.905 1.00 0.00 C ATOM 920 CG ASP A 58 16.250 14.014 16.854 1.00 0.00 C ATOM 921 OD1 ASP A 58 15.244 13.281 16.918 1.00 0.00 O ATOM 922 OD2 ASP A 58 17.390 13.554 16.643 1.00 0.00 O ATOM 0 H ASP A 58 15.687 17.837 16.932 1.00 0.00 H new ATOM 0 HA ASP A 58 14.089 15.735 18.024 1.00 0.00 H new ATOM 0 HB2 ASP A 58 15.661 15.830 15.926 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.009 15.988 17.034 1.00 0.00 H new ATOM 927 N TYR A 59 16.766 16.742 19.627 1.00 0.00 N ATOM 928 CA TYR A 59 17.438 16.706 20.913 1.00 0.00 C ATOM 929 C TYR A 59 16.692 17.613 21.896 1.00 0.00 C ATOM 930 O TYR A 59 17.015 17.509 23.076 1.00 0.00 O ATOM 931 CB TYR A 59 18.875 17.208 20.759 1.00 0.00 C ATOM 932 CG TYR A 59 19.906 16.743 21.762 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.257 15.397 21.859 1.00 0.00 C ATOM 934 CD2 TYR A 59 20.748 17.670 22.376 1.00 0.00 C ATOM 935 CE1 TYR A 59 21.312 14.966 22.668 1.00 0.00 C ATOM 936 CE2 TYR A 59 21.737 17.238 23.273 1.00 0.00 C ATOM 937 CZ TYR A 59 22.092 15.886 23.391 1.00 0.00 C ATOM 938 OH TYR A 59 23.183 15.603 24.155 1.00 0.00 O ATOM 0 H TYR A 59 17.094 17.488 19.013 1.00 0.00 H new ATOM 0 HA TYR A 59 17.450 15.682 21.287 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.223 16.921 19.767 1.00 0.00 H new ATOM 0 HB3 TYR A 59 18.852 18.297 20.786 1.00 0.00 H new ATOM 0 HD1 TYR A 59 19.698 14.667 21.293 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.639 18.723 22.161 1.00 0.00 H new ATOM 0 HE1 TYR A 59 21.531 13.911 22.739 1.00 0.00 H new ATOM 0 HE2 TYR A 59 22.240 17.968 23.891 1.00 0.00 H new ATOM 0 HH TYR A 59 23.534 16.431 24.544 1.00 0.00 H new ATOM 948 N ASN A 60 15.649 18.300 21.453 1.00 0.00 N ATOM 949 CA ASN A 60 14.654 19.047 22.182 1.00 0.00 C ATOM 950 C ASN A 60 15.165 20.358 22.793 1.00 0.00 C ATOM 951 O ASN A 60 15.080 20.658 23.986 1.00 0.00 O ATOM 952 CB ASN A 60 13.912 18.185 23.205 1.00 0.00 C ATOM 953 CG ASN A 60 13.067 17.005 22.739 1.00 0.00 C ATOM 954 OD1 ASN A 60 11.932 17.123 22.283 1.00 0.00 O ATOM 955 ND2 ASN A 60 13.571 15.775 22.779 1.00 0.00 N ATOM 0 H ASN A 60 15.466 18.347 20.451 1.00 0.00 H new ATOM 0 HA ASN A 60 13.930 19.352 21.426 1.00 0.00 H new ATOM 0 HB2 ASN A 60 14.655 17.796 23.901 1.00 0.00 H new ATOM 0 HB3 ASN A 60 13.259 18.847 23.773 1.00 0.00 H new ATOM 0 HD21 ASN A 60 13.019 14.987 22.441 1.00 0.00 H new ATOM 0 HD22 ASN A 60 14.509 15.620 23.148 1.00 0.00 H new ATOM 962 N ILE A 61 15.994 21.035 22.015 1.00 0.00 N ATOM 963 CA ILE A 61 16.590 22.305 22.402 1.00 0.00 C ATOM 964 C ILE A 61 15.457 23.284 22.125 1.00 0.00 C ATOM 965 O ILE A 61 15.269 23.652 20.972 1.00 0.00 O ATOM 966 CB ILE A 61 17.897 22.709 21.730 1.00 0.00 C ATOM 967 CG1 ILE A 61 18.976 21.710 22.158 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.342 24.140 22.044 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.143 21.607 21.174 1.00 0.00 C ATOM 0 H ILE A 61 16.275 20.716 21.088 1.00 0.00 H new ATOM 0 HA ILE A 61 16.934 22.264 23.435 1.00 0.00 H new ATOM 0 HB ILE A 61 17.737 22.689 20.652 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.361 22.001 23.135 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.522 20.726 22.274 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.279 24.351 21.529 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.578 24.841 21.708 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.486 24.249 23.119 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.867 20.881 21.543 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.771 21.286 20.201 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.623 22.581 21.076 1.00 0.00 H new ATOM 981 N GLN A 62 14.877 23.824 23.204 1.00 0.00 N ATOM 982 CA GLN A 62 13.890 24.879 23.206 1.00 0.00 C ATOM 983 C GLN A 62 14.528 26.268 23.118 1.00 0.00 C ATOM 984 O GLN A 62 15.744 26.399 23.248 1.00 0.00 O ATOM 985 CB GLN A 62 13.024 24.842 24.457 1.00 0.00 C ATOM 986 CG GLN A 62 12.140 23.611 24.649 1.00 0.00 C ATOM 987 CD GLN A 62 11.268 23.120 23.494 1.00 0.00 C ATOM 988 OE1 GLN A 62 11.412 23.430 22.318 1.00 0.00 O ATOM 989 NE2 GLN A 62 10.266 22.324 23.846 1.00 0.00 N ATOM 0 H GLN A 62 15.106 23.509 24.147 1.00 0.00 H new ATOM 0 HA GLN A 62 13.276 24.702 22.323 1.00 0.00 H new ATOM 0 HB2 GLN A 62 13.678 24.929 25.325 1.00 0.00 H new ATOM 0 HB3 GLN A 62 12.382 25.723 24.452 1.00 0.00 H new ATOM 0 HG2 GLN A 62 12.789 22.786 24.941 1.00 0.00 H new ATOM 0 HG3 GLN A 62 11.480 23.812 25.493 1.00 0.00 H new ATOM 0 HE21 GLN A 62 10.142 22.063 24.824 1.00 0.00 H new ATOM 0 HE22 GLN A 62 9.620 21.973 23.138 1.00 0.00 H new ATOM 998 N LYS A 63 13.758 27.305 22.808 1.00 0.00 N ATOM 999 CA LYS A 63 14.148 28.690 22.612 1.00 0.00 C ATOM 1000 C LYS A 63 14.530 29.292 23.959 1.00 0.00 C ATOM 1001 O LYS A 63 13.993 28.888 24.990 1.00 0.00 O ATOM 1002 CB LYS A 63 13.010 29.512 22.010 1.00 0.00 C ATOM 1003 CG LYS A 63 11.791 29.648 22.928 1.00 0.00 C ATOM 1004 CD LYS A 63 10.462 29.871 22.202 1.00 0.00 C ATOM 1005 CE LYS A 63 9.356 29.637 23.225 1.00 0.00 C ATOM 1006 NZ LYS A 63 7.986 29.749 22.691 1.00 0.00 N ATOM 0 H LYS A 63 12.754 27.182 22.676 1.00 0.00 H new ATOM 0 HA LYS A 63 14.991 28.713 21.922 1.00 0.00 H new ATOM 0 HB2 LYS A 63 13.383 30.507 21.767 1.00 0.00 H new ATOM 0 HB3 LYS A 63 12.698 29.051 21.073 1.00 0.00 H new ATOM 0 HG2 LYS A 63 11.710 28.747 23.536 1.00 0.00 H new ATOM 0 HG3 LYS A 63 11.960 30.480 23.611 1.00 0.00 H new ATOM 0 HD2 LYS A 63 10.407 30.882 21.798 1.00 0.00 H new ATOM 0 HD3 LYS A 63 10.361 29.186 21.361 1.00 0.00 H new ATOM 0 HE2 LYS A 63 9.483 28.644 23.656 1.00 0.00 H new ATOM 0 HE3 LYS A 63 9.474 30.354 24.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.301 29.575 23.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.841 30.704 22.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.849 29.047 21.936 1.00 0.00 H new ATOM 1020 N GLU A 64 15.340 30.344 23.895 1.00 0.00 N ATOM 1021 CA GLU A 64 15.795 31.167 24.989 1.00 0.00 C ATOM 1022 C GLU A 64 16.632 30.378 26.000 1.00 0.00 C ATOM 1023 O GLU A 64 17.084 30.917 27.004 1.00 0.00 O ATOM 1024 CB GLU A 64 14.684 31.964 25.689 1.00 0.00 C ATOM 1025 CG GLU A 64 14.808 33.480 25.640 1.00 0.00 C ATOM 1026 CD GLU A 64 13.423 34.109 25.765 1.00 0.00 C ATOM 1027 OE1 GLU A 64 12.903 33.985 26.897 1.00 0.00 O ATOM 1028 OE2 GLU A 64 12.936 34.721 24.796 1.00 0.00 O ATOM 0 H GLU A 64 15.720 30.660 23.003 1.00 0.00 H new ATOM 0 HA GLU A 64 16.440 31.910 24.520 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.730 31.684 25.243 1.00 0.00 H new ATOM 0 HB3 GLU A 64 14.650 31.657 26.734 1.00 0.00 H new ATOM 0 HG2 GLU A 64 15.452 33.829 26.447 1.00 0.00 H new ATOM 0 HG3 GLU A 64 15.275 33.787 24.704 1.00 0.00 H new ATOM 1035 N SER A 65 16.977 29.118 25.726 1.00 0.00 N ATOM 1036 CA SER A 65 17.768 28.237 26.553 1.00 0.00 C ATOM 1037 C SER A 65 19.246 28.616 26.515 1.00 0.00 C ATOM 1038 O SER A 65 19.652 29.146 25.485 1.00 0.00 O ATOM 1039 CB SER A 65 17.623 26.825 25.986 1.00 0.00 C ATOM 1040 OG SER A 65 16.304 26.328 25.963 1.00 0.00 O ATOM 0 H SER A 65 16.686 28.666 24.859 1.00 0.00 H new ATOM 0 HA SER A 65 17.421 28.307 27.584 1.00 0.00 H new ATOM 0 HB2 SER A 65 18.018 26.815 24.970 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.241 26.147 26.575 1.00 0.00 H new ATOM 0 HG SER A 65 16.037 26.153 25.037 1.00 0.00 H new ATOM 1046 N THR A 66 20.004 28.405 27.591 1.00 0.00 N ATOM 1047 CA THR A 66 21.397 28.795 27.538 1.00 0.00 C ATOM 1048 C THR A 66 22.343 27.598 27.469 1.00 0.00 C ATOM 1049 O THR A 66 22.456 26.863 28.448 1.00 0.00 O ATOM 1050 CB THR A 66 21.803 29.611 28.772 1.00 0.00 C ATOM 1051 OG1 THR A 66 21.120 30.836 28.616 1.00 0.00 O ATOM 1052 CG2 THR A 66 23.303 29.888 28.906 1.00 0.00 C ATOM 0 H THR A 66 19.690 27.986 28.467 1.00 0.00 H new ATOM 0 HA THR A 66 21.486 29.390 26.629 1.00 0.00 H new ATOM 0 HB THR A 66 21.552 29.049 29.672 1.00 0.00 H new ATOM 0 HG1 THR A 66 21.325 31.424 29.373 1.00 0.00 H new ATOM 0 HG21 THR A 66 23.486 30.470 29.809 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.843 28.943 28.968 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.649 30.448 28.037 1.00 0.00 H new ATOM 1060 N LEU A 67 23.020 27.417 26.335 1.00 0.00 N ATOM 1061 CA LEU A 67 24.091 26.491 26.030 1.00 0.00 C ATOM 1062 C LEU A 67 25.438 27.122 26.372 1.00 0.00 C ATOM 1063 O LEU A 67 25.605 28.284 26.746 1.00 0.00 O ATOM 1064 CB LEU A 67 24.083 26.251 24.516 1.00 0.00 C ATOM 1065 CG LEU A 67 22.763 25.630 24.063 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.670 26.661 23.762 1.00 0.00 C ATOM 1067 CD2 LEU A 67 23.064 24.709 22.885 1.00 0.00 C ATOM 0 H LEU A 67 22.798 27.987 25.518 1.00 0.00 H new ATOM 0 HA LEU A 67 23.950 25.571 26.598 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.242 27.195 23.995 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.909 25.594 24.245 1.00 0.00 H new ATOM 0 HG LEU A 67 22.338 25.050 24.883 1.00 0.00 H new ATOM 0 HD11 LEU A 67 20.762 26.147 23.446 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.463 27.245 24.659 1.00 0.00 H new ATOM 0 HD13 LEU A 67 22.006 27.326 22.966 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.139 24.249 22.537 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.508 25.288 22.075 1.00 0.00 H new ATOM 0 HD23 LEU A 67 23.760 23.932 23.200 1.00 0.00 H new ATOM 1079 N HIS A 68 26.534 26.377 26.230 1.00 0.00 N ATOM 1080 CA HIS A 68 27.877 26.795 26.605 1.00 0.00 C ATOM 1081 C HIS A 68 28.880 26.457 25.500 1.00 0.00 C ATOM 1082 O HIS A 68 28.568 25.586 24.697 1.00 0.00 O ATOM 1083 CB HIS A 68 28.412 26.347 27.961 1.00 0.00 C ATOM 1084 CG HIS A 68 27.759 26.796 29.238 1.00 0.00 C ATOM 1085 ND1 HIS A 68 26.538 26.279 29.653 1.00 0.00 N ATOM 1086 CD2 HIS A 68 28.205 27.655 30.207 1.00 0.00 C ATOM 1087 CE1 HIS A 68 26.295 26.867 30.818 1.00 0.00 C ATOM 1088 NE2 HIS A 68 27.279 27.683 31.228 1.00 0.00 N ATOM 0 H HIS A 68 26.506 25.436 25.838 1.00 0.00 H new ATOM 0 HA HIS A 68 27.765 27.872 26.727 1.00 0.00 H new ATOM 0 HB2 HIS A 68 28.402 25.257 27.964 1.00 0.00 H new ATOM 0 HB3 HIS A 68 29.456 26.657 28.010 1.00 0.00 H new ATOM 0 HD2 HIS A 68 29.127 28.216 30.176 1.00 0.00 H new ATOM 0 HE1 HIS A 68 25.390 26.704 31.384 1.00 0.00 H new ATOM 0 HE2 HIS A 68 27.330 28.207 32.101 1.00 0.00 H new ATOM 1096 N LEU A 69 30.000 27.162 25.373 1.00 0.00 N ATOM 1097 CA LEU A 69 31.095 26.787 24.496 1.00 0.00 C ATOM 1098 C LEU A 69 32.320 26.553 25.380 1.00 0.00 C ATOM 1099 O LEU A 69 32.370 26.984 26.533 1.00 0.00 O ATOM 1100 CB LEU A 69 31.346 28.069 23.692 1.00 0.00 C ATOM 1101 CG LEU A 69 31.230 27.930 22.173 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.548 29.310 21.602 1.00 0.00 C ATOM 1103 CD2 LEU A 69 32.030 26.819 21.496 1.00 0.00 C ATOM 0 H LEU A 69 30.171 28.026 25.888 1.00 0.00 H new ATOM 0 HA LEU A 69 30.898 25.908 23.882 1.00 0.00 H new ATOM 0 HB2 LEU A 69 30.639 28.829 24.024 1.00 0.00 H new ATOM 0 HB3 LEU A 69 32.344 28.436 23.930 1.00 0.00 H new ATOM 0 HG LEU A 69 30.217 27.595 21.953 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.482 29.278 20.514 1.00 0.00 H new ATOM 0 HD12 LEU A 69 30.833 30.037 21.988 1.00 0.00 H new ATOM 0 HD13 LEU A 69 32.556 29.602 21.896 1.00 0.00 H new ATOM 0 HD21 LEU A 69 31.849 26.843 20.421 1.00 0.00 H new ATOM 0 HD22 LEU A 69 33.093 26.967 21.688 1.00 0.00 H new ATOM 0 HD23 LEU A 69 31.720 25.853 21.895 1.00 0.00 H new ATOM 1115 N VAL A 70 33.243 25.675 24.984 1.00 0.00 N ATOM 1116 CA VAL A 70 34.617 25.484 25.416 1.00 0.00 C ATOM 1117 C VAL A 70 35.437 25.346 24.131 1.00 0.00 C ATOM 1118 O VAL A 70 34.858 24.838 23.169 1.00 0.00 O ATOM 1119 CB VAL A 70 34.678 24.276 26.344 1.00 0.00 C ATOM 1120 CG1 VAL A 70 33.884 24.519 27.638 1.00 0.00 C ATOM 1121 CG2 VAL A 70 34.421 22.867 25.812 1.00 0.00 C ATOM 0 H VAL A 70 33.007 24.997 24.259 1.00 0.00 H new ATOM 0 HA VAL A 70 35.024 26.311 25.998 1.00 0.00 H new ATOM 0 HB VAL A 70 35.754 24.234 26.515 1.00 0.00 H new ATOM 0 HG11 VAL A 70 33.949 23.638 28.276 1.00 0.00 H new ATOM 0 HG12 VAL A 70 34.299 25.379 28.164 1.00 0.00 H new ATOM 0 HG13 VAL A 70 32.840 24.713 27.393 1.00 0.00 H new ATOM 0 HG21 VAL A 70 34.511 22.148 26.627 1.00 0.00 H new ATOM 0 HG22 VAL A 70 33.417 22.815 25.391 1.00 0.00 H new ATOM 0 HG23 VAL A 70 35.152 22.631 25.038 1.00 0.00 H new ATOM 1131 N LEU A 71 36.690 25.794 24.117 1.00 0.00 N ATOM 1132 CA LEU A 71 37.546 25.700 22.950 1.00 0.00 C ATOM 1133 C LEU A 71 38.329 24.388 23.079 1.00 0.00 C ATOM 1134 O LEU A 71 38.680 23.985 24.192 1.00 0.00 O ATOM 1135 CB LEU A 71 38.543 26.850 22.992 1.00 0.00 C ATOM 1136 CG LEU A 71 39.576 26.851 21.861 1.00 0.00 C ATOM 1137 CD1 LEU A 71 38.905 27.281 20.553 1.00 0.00 C ATOM 1138 CD2 LEU A 71 40.779 27.721 22.253 1.00 0.00 C ATOM 0 H LEU A 71 37.137 26.234 24.922 1.00 0.00 H new ATOM 0 HA LEU A 71 36.967 25.736 22.027 1.00 0.00 H new ATOM 0 HB2 LEU A 71 37.992 27.790 22.962 1.00 0.00 H new ATOM 0 HB3 LEU A 71 39.070 26.820 23.946 1.00 0.00 H new ATOM 0 HG LEU A 71 39.966 25.847 21.695 1.00 0.00 H new ATOM 0 HD11 LEU A 71 39.641 27.281 19.749 1.00 0.00 H new ATOM 0 HD12 LEU A 71 38.102 26.585 20.310 1.00 0.00 H new ATOM 0 HD13 LEU A 71 38.493 28.284 20.668 1.00 0.00 H new ATOM 0 HD21 LEU A 71 41.510 27.717 21.444 1.00 0.00 H new ATOM 0 HD22 LEU A 71 40.445 28.742 22.436 1.00 0.00 H new ATOM 0 HD23 LEU A 71 41.237 27.322 23.158 1.00 0.00 H new ATOM 1150 N ARG A 72 38.513 23.697 21.963 1.00 0.00 N ATOM 1151 CA ARG A 72 39.317 22.492 21.870 1.00 0.00 C ATOM 1152 C ARG A 72 39.808 22.595 20.427 1.00 0.00 C ATOM 1153 O ARG A 72 39.051 22.437 19.471 1.00 0.00 O ATOM 1154 CB ARG A 72 38.362 21.337 22.152 1.00 0.00 C ATOM 1155 CG ARG A 72 39.001 19.957 22.324 1.00 0.00 C ATOM 1156 CD ARG A 72 37.935 18.885 22.553 1.00 0.00 C ATOM 1157 NE ARG A 72 38.554 17.561 22.537 1.00 0.00 N ATOM 1158 CZ ARG A 72 38.490 16.699 21.520 1.00 0.00 C ATOM 1159 NH1 ARG A 72 37.785 16.873 20.390 1.00 0.00 N ATOM 1160 NH2 ARG A 72 39.322 15.643 21.604 1.00 0.00 N ATOM 0 H ARG A 72 38.094 23.969 21.074 1.00 0.00 H new ATOM 0 HA ARG A 72 40.157 22.355 22.551 1.00 0.00 H new ATOM 0 HB2 ARG A 72 37.801 21.570 23.057 1.00 0.00 H new ATOM 0 HB3 ARG A 72 37.642 21.281 21.336 1.00 0.00 H new ATOM 0 HG2 ARG A 72 39.586 19.710 21.438 1.00 0.00 H new ATOM 0 HG3 ARG A 72 39.692 19.974 23.167 1.00 0.00 H new ATOM 0 HD2 ARG A 72 37.437 19.052 23.508 1.00 0.00 H new ATOM 0 HD3 ARG A 72 37.170 18.948 21.779 1.00 0.00 H new ATOM 0 HE ARG A 72 39.074 17.274 23.366 1.00 0.00 H new ATOM 0 HH11 ARG A 72 37.237 17.723 20.256 1.00 0.00 H new ATOM 0 HH12 ARG A 72 37.798 16.155 19.665 1.00 0.00 H new ATOM 0 HH21 ARG A 72 39.943 15.546 22.407 1.00 0.00 H new ATOM 0 HH22 ARG A 72 39.331 14.941 20.864 1.00 0.00 H new ATOM 1174 N LEU A 73 41.118 22.796 20.291 1.00 0.00 N ATOM 1175 CA LEU A 73 41.887 22.935 19.075 1.00 0.00 C ATOM 1176 C LEU A 73 42.224 21.490 18.710 1.00 0.00 C ATOM 1177 O LEU A 73 43.353 21.114 18.408 1.00 0.00 O ATOM 1178 CB LEU A 73 43.131 23.826 19.204 1.00 0.00 C ATOM 1179 CG LEU A 73 42.780 25.257 19.611 1.00 0.00 C ATOM 1180 CD1 LEU A 73 44.027 26.021 20.066 1.00 0.00 C ATOM 1181 CD2 LEU A 73 41.909 26.071 18.667 1.00 0.00 C ATOM 0 H LEU A 73 41.716 22.871 21.114 1.00 0.00 H new ATOM 0 HA LEU A 73 41.324 23.456 18.300 1.00 0.00 H new ATOM 0 HB2 LEU A 73 43.808 23.396 19.942 1.00 0.00 H new ATOM 0 HB3 LEU A 73 43.664 23.841 18.254 1.00 0.00 H new ATOM 0 HG LEU A 73 42.106 25.117 20.456 1.00 0.00 H new ATOM 0 HD11 LEU A 73 43.749 27.036 20.350 1.00 0.00 H new ATOM 0 HD12 LEU A 73 44.472 25.514 20.922 1.00 0.00 H new ATOM 0 HD13 LEU A 73 44.749 26.058 19.250 1.00 0.00 H new ATOM 0 HD21 LEU A 73 41.745 27.063 19.088 1.00 0.00 H new ATOM 0 HD22 LEU A 73 42.407 26.164 17.702 1.00 0.00 H new ATOM 0 HD23 LEU A 73 40.950 25.570 18.534 1.00 0.00 H new ATOM 1193 N ARG A 74 41.189 20.655 18.622 1.00 0.00 N ATOM 1194 CA ARG A 74 41.031 19.254 18.285 1.00 0.00 C ATOM 1195 C ARG A 74 39.565 19.055 17.912 1.00 0.00 C ATOM 1196 O ARG A 74 38.658 19.366 18.682 1.00 0.00 O ATOM 1197 CB ARG A 74 41.446 18.421 19.497 1.00 0.00 C ATOM 1198 CG ARG A 74 41.721 16.964 19.111 1.00 0.00 C ATOM 1199 CD ARG A 74 42.275 16.052 20.205 1.00 0.00 C ATOM 1200 NE ARG A 74 41.913 14.677 19.827 1.00 0.00 N ATOM 1201 CZ ARG A 74 42.757 13.653 19.666 1.00 0.00 C ATOM 1202 NH1 ARG A 74 44.036 13.714 20.067 1.00 0.00 N ATOM 1203 NH2 ARG A 74 42.146 12.525 19.303 1.00 0.00 N ATOM 0 H ARG A 74 40.266 21.036 18.830 1.00 0.00 H new ATOM 0 HA ARG A 74 41.654 18.942 17.447 1.00 0.00 H new ATOM 0 HB2 ARG A 74 42.339 18.853 19.948 1.00 0.00 H new ATOM 0 HB3 ARG A 74 40.659 18.456 20.250 1.00 0.00 H new ATOM 0 HG2 ARG A 74 40.791 16.529 18.745 1.00 0.00 H new ATOM 0 HG3 ARG A 74 42.424 16.961 18.278 1.00 0.00 H new ATOM 0 HD2 ARG A 74 43.357 16.159 20.288 1.00 0.00 H new ATOM 0 HD3 ARG A 74 41.853 16.311 21.176 1.00 0.00 H new ATOM 0 HE ARG A 74 40.923 14.487 19.673 1.00 0.00 H new ATOM 0 HH11 ARG A 74 44.392 14.561 20.510 1.00 0.00 H new ATOM 0 HH12 ARG A 74 44.653 12.913 19.928 1.00 0.00 H new ATOM 0 HH21 ARG A 74 41.134 12.511 19.177 1.00 0.00 H new ATOM 0 HH22 ARG A 74 42.691 11.676 19.151 1.00 0.00 H new ATOM 1217 N GLY A 75 39.261 18.397 16.795 1.00 0.00 N ATOM 1218 CA GLY A 75 37.949 18.132 16.254 1.00 0.00 C ATOM 1219 C GLY A 75 37.681 16.630 16.195 1.00 0.00 C ATOM 1220 O GLY A 75 36.768 16.085 15.578 1.00 0.00 O ATOM 0 H GLY A 75 39.995 18.007 16.203 1.00 0.00 H new ATOM 0 HA2 GLY A 75 37.192 18.617 16.870 1.00 0.00 H new ATOM 0 HA3 GLY A 75 37.869 18.560 15.255 1.00 0.00 H new ATOM 1224 N GLY A 76 38.614 15.856 16.755 1.00 0.00 N ATOM 1225 CA GLY A 76 38.663 14.417 16.801 1.00 0.00 C ATOM 1226 C GLY A 76 39.010 13.923 18.196 1.00 0.00 C ATOM 1227 O GLY A 76 39.388 14.755 19.045 1.00 0.00 O ATOM 1228 OXT GLY A 76 39.054 12.699 18.440 1.00 0.00 O ATOM 0 H GLY A 76 39.419 16.270 17.225 1.00 0.00 H new ATOM 0 HA2 GLY A 76 37.700 14.008 16.497 1.00 0.00 H new ATOM 0 HA3 GLY A 76 39.403 14.053 16.089 1.00 0.00 H new TER 1232 GLY A 76