USER MOD reduce.3.24.130724 H: found=0, std=0, add=607, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 610 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 38 TYR OH : rot 177:sc= 1.52 USER MOD Set 1.2: B 201 ASN : amide:sc= 0.331 K(o=1.9,f=1.3) USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=-0.0022) USER MOD Single : A 9 ASN : amide:sc= -0.247 X(o=-0.25,f=-0.61) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 45:sc= 1.2 USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 16 LYS NZ :NH3+ -176:sc= 0.361! (180deg=0.242!) USER MOD Single : A 18 LYS NZ :NH3+ 131:sc= 0.0668 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 84:sc= 0.931 USER MOD Single : A 24 HIS : no HD1:sc=-0.00169 X(o=-0.0017,f=-0.0017) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= -0.168 USER MOD Single : A 36 HIS : no HD1:sc= -0.564 X(o=-0.56,f=-0.97) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.477 X(o=-0.48,f=-0.039) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.0004) USER MOD Single : A 74 SER OG : rot -72:sc= 1.26 USER MOD Single : A 78 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : B 203 GLN : amide:sc= -0.117 K(o=-0.12,f=-1.7!) USER MOD Single : B 204 MET CE :methyl -173:sc=-0.00194 (180deg=-0.089) USER MOD Single : B 211 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 52 N VAL A 5 35.438 44.666 40.080 1.00 0.00 N ATOM 53 CA VAL A 5 36.004 43.538 40.753 1.00 0.00 C ATOM 54 C VAL A 5 35.676 42.280 40.025 1.00 0.00 C ATOM 55 O VAL A 5 36.539 41.479 39.668 1.00 0.00 O ATOM 56 CB VAL A 5 35.504 43.483 42.167 1.00 0.00 C ATOM 57 CG1 VAL A 5 35.875 42.159 42.854 1.00 0.00 C ATOM 58 CG2 VAL A 5 36.096 44.685 42.923 1.00 0.00 C ATOM 0 HA VAL A 5 37.089 43.643 40.772 1.00 0.00 H new ATOM 0 HB VAL A 5 34.415 43.532 42.171 1.00 0.00 H new ATOM 0 HG11 VAL A 5 35.495 42.160 43.875 1.00 0.00 H new ATOM 0 HG12 VAL A 5 35.435 41.328 42.304 1.00 0.00 H new ATOM 0 HG13 VAL A 5 36.959 42.049 42.871 1.00 0.00 H new ATOM 0 HG21 VAL A 5 35.749 44.672 43.956 1.00 0.00 H new ATOM 0 HG22 VAL A 5 37.184 44.626 42.905 1.00 0.00 H new ATOM 0 HG23 VAL A 5 35.774 45.610 42.444 1.00 0.00 H new ATOM 68 N GLU A 6 34.387 42.097 39.691 1.00 0.00 N ATOM 69 CA GLU A 6 33.919 40.965 38.953 1.00 0.00 C ATOM 70 C GLU A 6 34.334 40.936 37.522 1.00 0.00 C ATOM 71 O GLU A 6 34.398 39.871 36.909 1.00 0.00 O ATOM 72 CB GLU A 6 32.393 40.816 39.083 1.00 0.00 C ATOM 73 CG GLU A 6 32.018 39.992 40.317 1.00 0.00 C ATOM 74 CD GLU A 6 30.523 40.004 40.602 1.00 0.00 C ATOM 75 OE1 GLU A 6 29.693 40.092 39.658 1.00 0.00 O ATOM 76 OE2 GLU A 6 30.128 39.941 41.797 1.00 0.00 O ATOM 0 H GLU A 6 33.649 42.755 39.941 1.00 0.00 H new ATOM 0 HA GLU A 6 34.410 40.106 39.411 1.00 0.00 H new ATOM 0 HB2 GLU A 6 31.933 41.802 39.148 1.00 0.00 H new ATOM 0 HB3 GLU A 6 31.995 40.337 38.188 1.00 0.00 H new ATOM 0 HG2 GLU A 6 32.348 38.963 40.175 1.00 0.00 H new ATOM 0 HG3 GLU A 6 32.552 40.381 41.184 1.00 0.00 H new ATOM 83 N PHE A 7 34.750 42.085 36.960 1.00 0.00 N ATOM 84 CA PHE A 7 35.382 42.104 35.678 1.00 0.00 C ATOM 85 C PHE A 7 36.707 41.426 35.749 1.00 0.00 C ATOM 86 O PHE A 7 37.029 40.578 34.918 1.00 0.00 O ATOM 87 CB PHE A 7 35.501 43.542 35.144 1.00 0.00 C ATOM 88 CG PHE A 7 35.142 43.594 33.699 1.00 0.00 C ATOM 89 CD1 PHE A 7 35.960 43.031 32.748 1.00 0.00 C ATOM 90 CD2 PHE A 7 33.964 44.183 33.303 1.00 0.00 C ATOM 91 CE1 PHE A 7 35.607 43.051 31.420 1.00 0.00 C ATOM 92 CE2 PHE A 7 33.604 44.212 31.976 1.00 0.00 C ATOM 93 CZ PHE A 7 34.427 43.644 31.033 1.00 0.00 C ATOM 0 H PHE A 7 34.648 43.002 37.395 1.00 0.00 H new ATOM 0 HA PHE A 7 34.762 41.552 34.971 1.00 0.00 H new ATOM 0 HB2 PHE A 7 34.845 44.202 35.712 1.00 0.00 H new ATOM 0 HB3 PHE A 7 36.519 43.905 35.285 1.00 0.00 H new ATOM 0 HD1 PHE A 7 36.889 42.569 33.048 1.00 0.00 H new ATOM 0 HD2 PHE A 7 33.314 44.628 34.042 1.00 0.00 H new ATOM 0 HE1 PHE A 7 36.255 42.602 30.681 1.00 0.00 H new ATOM 0 HE2 PHE A 7 32.678 44.679 31.676 1.00 0.00 H new ATOM 0 HZ PHE A 7 34.148 43.663 29.990 1.00 0.00 H new ATOM 103 N ASN A 8 37.478 41.695 36.818 1.00 0.00 N ATOM 104 CA ASN A 8 38.804 41.224 37.073 1.00 0.00 C ATOM 105 C ASN A 8 38.825 39.805 37.524 1.00 0.00 C ATOM 106 O ASN A 8 39.802 39.093 37.295 1.00 0.00 O ATOM 107 CB ASN A 8 39.510 42.116 38.107 1.00 0.00 C ATOM 108 CG ASN A 8 39.967 43.406 37.442 1.00 0.00 C ATOM 109 OD1 ASN A 8 40.890 43.404 36.629 1.00 0.00 O ATOM 110 ND2 ASN A 8 39.320 44.556 37.772 1.00 0.00 N ATOM 0 H ASN A 8 37.141 42.296 37.570 1.00 0.00 H new ATOM 0 HA ASN A 8 39.343 41.275 36.127 1.00 0.00 H new ATOM 0 HB2 ASN A 8 38.833 42.340 38.931 1.00 0.00 H new ATOM 0 HB3 ASN A 8 40.366 41.591 38.531 1.00 0.00 H new ATOM 0 HD21 ASN A 8 39.598 45.439 37.343 1.00 0.00 H new ATOM 0 HD22 ASN A 8 38.557 44.536 38.449 1.00 0.00 H new ATOM 117 N ASN A 9 37.732 39.313 38.135 1.00 0.00 N ATOM 118 CA ASN A 9 37.560 37.935 38.478 1.00 0.00 C ATOM 119 C ASN A 9 37.228 37.101 37.288 1.00 0.00 C ATOM 120 O ASN A 9 37.474 35.896 37.260 1.00 0.00 O ATOM 121 CB ASN A 9 36.463 37.739 39.539 1.00 0.00 C ATOM 122 CG ASN A 9 36.857 38.402 40.852 1.00 0.00 C ATOM 123 OD1 ASN A 9 38.017 38.467 41.256 1.00 0.00 O ATOM 124 ND2 ASN A 9 35.829 38.891 41.597 1.00 0.00 N ATOM 0 H ASN A 9 36.939 39.897 38.400 1.00 0.00 H new ATOM 0 HA ASN A 9 38.517 37.611 38.887 1.00 0.00 H new ATOM 0 HB2 ASN A 9 35.524 38.161 39.180 1.00 0.00 H new ATOM 0 HB3 ASN A 9 36.293 36.675 39.700 1.00 0.00 H new ATOM 0 HD21 ASN A 9 36.015 39.319 42.504 1.00 0.00 H new ATOM 0 HD22 ASN A 9 34.872 38.830 41.248 1.00 0.00 H new ATOM 131 N ALA A 10 36.678 37.713 36.225 1.00 0.00 N ATOM 132 CA ALA A 10 36.612 37.100 34.934 1.00 0.00 C ATOM 133 C ALA A 10 37.940 37.045 34.261 1.00 0.00 C ATOM 134 O ALA A 10 38.295 36.021 33.680 1.00 0.00 O ATOM 135 CB ALA A 10 35.540 37.767 34.054 1.00 0.00 C ATOM 0 H ALA A 10 36.272 38.648 36.261 1.00 0.00 H new ATOM 0 HA ALA A 10 36.309 36.064 35.086 1.00 0.00 H new ATOM 0 HB1 ALA A 10 35.514 37.279 33.080 1.00 0.00 H new ATOM 0 HB2 ALA A 10 34.566 37.673 34.533 1.00 0.00 H new ATOM 0 HB3 ALA A 10 35.780 38.822 33.925 1.00 0.00 H new ATOM 141 N ILE A 11 38.763 38.106 34.339 1.00 0.00 N ATOM 142 CA ILE A 11 40.085 38.171 33.798 1.00 0.00 C ATOM 143 C ILE A 11 41.001 37.117 34.317 1.00 0.00 C ATOM 144 O ILE A 11 41.687 36.438 33.554 1.00 0.00 O ATOM 145 CB ILE A 11 40.783 39.467 34.088 1.00 0.00 C ATOM 146 CG1 ILE A 11 39.975 40.698 33.646 1.00 0.00 C ATOM 147 CG2 ILE A 11 42.155 39.569 33.399 1.00 0.00 C ATOM 148 CD1 ILE A 11 39.392 40.611 32.236 1.00 0.00 C ATOM 0 H ILE A 11 38.488 38.969 34.808 1.00 0.00 H new ATOM 0 HA ILE A 11 39.905 38.042 32.731 1.00 0.00 H new ATOM 0 HB ILE A 11 40.899 39.463 35.172 1.00 0.00 H new ATOM 0 HG12 ILE A 11 39.159 40.852 34.352 1.00 0.00 H new ATOM 0 HG13 ILE A 11 40.617 41.577 33.705 1.00 0.00 H new ATOM 0 HG21 ILE A 11 42.615 40.527 33.644 1.00 0.00 H new ATOM 0 HG22 ILE A 11 42.797 38.759 33.745 1.00 0.00 H new ATOM 0 HG23 ILE A 11 42.026 39.494 32.319 1.00 0.00 H new ATOM 0 HD11 ILE A 11 38.840 41.524 32.014 1.00 0.00 H new ATOM 0 HD12 ILE A 11 40.200 40.491 31.515 1.00 0.00 H new ATOM 0 HD13 ILE A 11 38.720 39.756 32.172 1.00 0.00 H new ATOM 160 N SER A 12 41.039 36.961 35.653 1.00 0.00 N ATOM 161 CA SER A 12 41.899 36.057 36.351 1.00 0.00 C ATOM 162 C SER A 12 41.789 34.643 35.895 1.00 0.00 C ATOM 163 O SER A 12 42.791 33.938 35.793 1.00 0.00 O ATOM 164 CB SER A 12 41.732 36.098 37.880 1.00 0.00 C ATOM 165 OG SER A 12 40.408 35.781 38.283 1.00 0.00 O ATOM 0 H SER A 12 40.437 37.495 36.279 1.00 0.00 H new ATOM 0 HA SER A 12 42.893 36.425 36.098 1.00 0.00 H new ATOM 0 HB2 SER A 12 42.428 35.396 38.339 1.00 0.00 H new ATOM 0 HB3 SER A 12 41.994 37.091 38.246 1.00 0.00 H new ATOM 0 HG SER A 12 40.346 35.817 39.260 1.00 0.00 H new ATOM 171 N TYR A 13 40.572 34.207 35.520 1.00 0.00 N ATOM 172 CA TYR A 13 40.290 32.929 34.945 1.00 0.00 C ATOM 173 C TYR A 13 41.005 32.730 33.652 1.00 0.00 C ATOM 174 O TYR A 13 41.775 31.788 33.478 1.00 0.00 O ATOM 175 CB TYR A 13 38.767 32.808 34.765 1.00 0.00 C ATOM 176 CG TYR A 13 38.245 31.481 34.333 1.00 0.00 C ATOM 177 CD1 TYR A 13 39.004 30.336 34.289 1.00 0.00 C ATOM 178 CD2 TYR A 13 36.935 31.429 33.917 1.00 0.00 C ATOM 179 CE1 TYR A 13 38.476 29.163 33.803 1.00 0.00 C ATOM 180 CE2 TYR A 13 36.405 30.273 33.394 1.00 0.00 C ATOM 181 CZ TYR A 13 37.186 29.143 33.326 1.00 0.00 C ATOM 182 OH TYR A 13 36.678 27.931 32.814 1.00 0.00 O ATOM 0 H TYR A 13 39.736 34.782 35.625 1.00 0.00 H new ATOM 0 HA TYR A 13 40.649 32.146 35.613 1.00 0.00 H new ATOM 0 HB2 TYR A 13 38.291 33.069 35.710 1.00 0.00 H new ATOM 0 HB3 TYR A 13 38.451 33.552 34.034 1.00 0.00 H new ATOM 0 HD1 TYR A 13 40.025 30.358 34.640 1.00 0.00 H new ATOM 0 HD2 TYR A 13 36.314 32.308 34.002 1.00 0.00 H new ATOM 0 HE1 TYR A 13 39.071 28.262 33.796 1.00 0.00 H new ATOM 0 HE2 TYR A 13 35.385 30.253 33.040 1.00 0.00 H new ATOM 0 HH TYR A 13 36.913 27.196 33.419 1.00 0.00 H new ATOM 192 N VAL A 14 40.809 33.642 32.682 1.00 0.00 N ATOM 193 CA VAL A 14 41.422 33.619 31.391 1.00 0.00 C ATOM 194 C VAL A 14 42.905 33.747 31.461 1.00 0.00 C ATOM 195 O VAL A 14 43.652 33.074 30.753 1.00 0.00 O ATOM 196 CB VAL A 14 40.837 34.701 30.531 1.00 0.00 C ATOM 197 CG1 VAL A 14 41.138 34.405 29.053 1.00 0.00 C ATOM 198 CG2 VAL A 14 39.307 34.753 30.675 1.00 0.00 C ATOM 0 H VAL A 14 40.187 34.440 32.807 1.00 0.00 H new ATOM 0 HA VAL A 14 41.213 32.646 30.945 1.00 0.00 H new ATOM 0 HB VAL A 14 41.277 35.647 30.848 1.00 0.00 H new ATOM 0 HG11 VAL A 14 40.712 35.192 28.430 1.00 0.00 H new ATOM 0 HG12 VAL A 14 42.217 34.366 28.902 1.00 0.00 H new ATOM 0 HG13 VAL A 14 40.699 33.446 28.777 1.00 0.00 H new ATOM 0 HG21 VAL A 14 38.909 35.545 30.041 1.00 0.00 H new ATOM 0 HG22 VAL A 14 38.880 33.797 30.372 1.00 0.00 H new ATOM 0 HG23 VAL A 14 39.046 34.954 31.714 1.00 0.00 H new ATOM 208 N ASN A 15 43.413 34.589 32.377 1.00 0.00 N ATOM 209 CA ASN A 15 44.801 34.682 32.709 1.00 0.00 C ATOM 210 C ASN A 15 45.435 33.428 33.202 1.00 0.00 C ATOM 211 O ASN A 15 46.540 33.089 32.783 1.00 0.00 O ATOM 212 CB ASN A 15 45.007 35.806 33.740 1.00 0.00 C ATOM 213 CG ASN A 15 46.394 36.430 33.662 1.00 0.00 C ATOM 214 OD1 ASN A 15 46.856 36.857 32.607 1.00 0.00 O ATOM 215 ND2 ASN A 15 47.079 36.523 34.834 1.00 0.00 N ATOM 0 H ASN A 15 42.831 35.234 32.911 1.00 0.00 H new ATOM 0 HA ASN A 15 45.305 34.899 31.767 1.00 0.00 H new ATOM 0 HB2 ASN A 15 44.256 36.580 33.582 1.00 0.00 H new ATOM 0 HB3 ASN A 15 44.848 35.407 34.742 1.00 0.00 H new ATOM 0 HD21 ASN A 15 48.002 36.957 34.852 1.00 0.00 H new ATOM 0 HD22 ASN A 15 46.669 36.159 35.694 1.00 0.00 H new ATOM 222 N LYS A 16 44.777 32.657 34.086 1.00 0.00 N ATOM 223 CA LYS A 16 45.203 31.361 34.513 1.00 0.00 C ATOM 224 C LYS A 16 45.271 30.381 33.392 1.00 0.00 C ATOM 225 O LYS A 16 46.243 29.638 33.254 1.00 0.00 O ATOM 226 CB LYS A 16 44.272 30.727 35.560 1.00 0.00 C ATOM 227 CG LYS A 16 44.356 31.309 36.973 1.00 0.00 C ATOM 228 CD LYS A 16 43.279 30.706 37.878 1.00 0.00 C ATOM 229 CE LYS A 16 43.582 29.285 38.356 1.00 0.00 C ATOM 230 NZ LYS A 16 42.330 28.579 38.708 1.00 0.00 N ATOM 0 H LYS A 16 43.905 32.953 34.524 1.00 0.00 H new ATOM 0 HA LYS A 16 46.189 31.549 34.938 1.00 0.00 H new ATOM 0 HB2 LYS A 16 43.244 30.824 35.209 1.00 0.00 H new ATOM 0 HB3 LYS A 16 44.492 29.661 35.614 1.00 0.00 H new ATOM 0 HG2 LYS A 16 45.342 31.112 37.394 1.00 0.00 H new ATOM 0 HG3 LYS A 16 44.238 32.392 36.932 1.00 0.00 H new ATOM 0 HD2 LYS A 16 43.150 31.350 38.748 1.00 0.00 H new ATOM 0 HD3 LYS A 16 42.330 30.702 37.341 1.00 0.00 H new ATOM 0 HE2 LYS A 16 44.108 28.737 37.575 1.00 0.00 H new ATOM 0 HE3 LYS A 16 44.243 29.319 39.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 42.557 27.641 39.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 41.809 29.130 39.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 41.742 28.470 37.857 1.00 0.00 H new ATOM 244 N ILE A 17 44.248 30.372 32.519 1.00 0.00 N ATOM 245 CA ILE A 17 44.171 29.573 31.336 1.00 0.00 C ATOM 246 C ILE A 17 45.345 29.790 30.444 1.00 0.00 C ATOM 247 O ILE A 17 46.012 28.828 30.067 1.00 0.00 O ATOM 248 CB ILE A 17 42.861 29.808 30.643 1.00 0.00 C ATOM 249 CG1 ILE A 17 41.722 29.145 31.437 1.00 0.00 C ATOM 250 CG2 ILE A 17 42.871 29.301 29.192 1.00 0.00 C ATOM 251 CD1 ILE A 17 40.328 29.439 30.886 1.00 0.00 C ATOM 0 H ILE A 17 43.424 30.959 32.648 1.00 0.00 H new ATOM 0 HA ILE A 17 44.209 28.521 31.620 1.00 0.00 H new ATOM 0 HB ILE A 17 42.698 30.885 30.603 1.00 0.00 H new ATOM 0 HG12 ILE A 17 41.878 28.066 31.445 1.00 0.00 H new ATOM 0 HG13 ILE A 17 41.771 29.482 32.473 1.00 0.00 H new ATOM 0 HG21 ILE A 17 41.901 29.493 28.733 1.00 0.00 H new ATOM 0 HG22 ILE A 17 43.648 29.820 28.631 1.00 0.00 H new ATOM 0 HG23 ILE A 17 43.071 28.229 29.182 1.00 0.00 H new ATOM 0 HD11 ILE A 17 39.581 28.936 31.500 1.00 0.00 H new ATOM 0 HD12 ILE A 17 40.149 30.514 30.904 1.00 0.00 H new ATOM 0 HD13 ILE A 17 40.258 29.077 29.860 1.00 0.00 H new ATOM 263 N LYS A 18 45.693 31.052 30.133 1.00 0.00 N ATOM 264 CA LYS A 18 46.866 31.375 29.382 1.00 0.00 C ATOM 265 C LYS A 18 48.134 30.949 30.038 1.00 0.00 C ATOM 266 O LYS A 18 49.008 30.376 29.391 1.00 0.00 O ATOM 267 CB LYS A 18 46.966 32.878 29.068 1.00 0.00 C ATOM 268 CG LYS A 18 45.848 33.365 28.144 1.00 0.00 C ATOM 269 CD LYS A 18 46.213 34.630 27.363 1.00 0.00 C ATOM 270 CE LYS A 18 46.509 35.869 28.210 1.00 0.00 C ATOM 271 NZ LYS A 18 46.896 36.989 27.323 1.00 0.00 N ATOM 0 H LYS A 18 45.146 31.867 30.410 1.00 0.00 H new ATOM 0 HA LYS A 18 46.750 30.810 28.457 1.00 0.00 H new ATOM 0 HB2 LYS A 18 46.933 33.442 30.000 1.00 0.00 H new ATOM 0 HB3 LYS A 18 47.931 33.085 28.604 1.00 0.00 H new ATOM 0 HG2 LYS A 18 45.597 32.572 27.440 1.00 0.00 H new ATOM 0 HG3 LYS A 18 44.954 33.558 28.738 1.00 0.00 H new ATOM 0 HD2 LYS A 18 47.087 34.416 26.748 1.00 0.00 H new ATOM 0 HD3 LYS A 18 45.394 34.864 26.683 1.00 0.00 H new ATOM 0 HE2 LYS A 18 45.631 36.141 28.796 1.00 0.00 H new ATOM 0 HE3 LYS A 18 47.311 35.657 28.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 46.350 37.837 27.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 47.911 37.185 27.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 46.698 36.733 26.334 1.00 0.00 H new ATOM 285 N THR A 19 48.270 31.175 31.357 1.00 0.00 N ATOM 286 CA THR A 19 49.413 30.837 32.148 1.00 0.00 C ATOM 287 C THR A 19 49.762 29.389 32.197 1.00 0.00 C ATOM 288 O THR A 19 50.935 29.045 32.329 1.00 0.00 O ATOM 289 CB THR A 19 49.230 31.410 33.522 1.00 0.00 C ATOM 290 OG1 THR A 19 49.249 32.829 33.455 1.00 0.00 O ATOM 291 CG2 THR A 19 50.325 31.006 34.524 1.00 0.00 C ATOM 0 H THR A 19 47.535 31.622 31.905 1.00 0.00 H new ATOM 0 HA THR A 19 50.276 31.281 31.651 1.00 0.00 H new ATOM 0 HB THR A 19 48.278 31.012 33.872 1.00 0.00 H new ATOM 0 HG1 THR A 19 48.356 33.157 33.220 1.00 0.00 H new ATOM 0 HG21 THR A 19 50.118 31.462 35.492 1.00 0.00 H new ATOM 0 HG22 THR A 19 50.340 29.921 34.629 1.00 0.00 H new ATOM 0 HG23 THR A 19 51.294 31.348 34.161 1.00 0.00 H new ATOM 299 N ARG A 20 48.805 28.454 32.070 1.00 0.00 N ATOM 300 CA ARG A 20 49.125 27.070 31.895 1.00 0.00 C ATOM 301 C ARG A 20 49.188 26.636 30.471 1.00 0.00 C ATOM 302 O ARG A 20 49.919 25.700 30.148 1.00 0.00 O ATOM 303 CB ARG A 20 48.131 26.195 32.676 1.00 0.00 C ATOM 304 CG ARG A 20 48.504 25.914 34.133 1.00 0.00 C ATOM 305 CD ARG A 20 49.687 24.955 34.279 1.00 0.00 C ATOM 306 NE ARG A 20 49.799 24.639 35.731 1.00 0.00 N ATOM 307 CZ ARG A 20 50.642 23.715 36.277 1.00 0.00 C ATOM 308 NH1 ARG A 20 51.414 22.874 35.530 1.00 0.00 N ATOM 309 NH2 ARG A 20 50.705 23.608 37.638 1.00 0.00 N ATOM 0 H ARG A 20 47.805 28.656 32.088 1.00 0.00 H new ATOM 0 HA ARG A 20 50.132 26.940 32.291 1.00 0.00 H new ATOM 0 HB2 ARG A 20 47.154 26.679 32.656 1.00 0.00 H new ATOM 0 HB3 ARG A 20 48.026 25.243 32.156 1.00 0.00 H new ATOM 0 HG2 ARG A 20 48.745 26.855 34.627 1.00 0.00 H new ATOM 0 HG3 ARG A 20 47.640 25.495 34.648 1.00 0.00 H new ATOM 0 HD2 ARG A 20 49.526 24.048 33.696 1.00 0.00 H new ATOM 0 HD3 ARG A 20 50.605 25.412 33.910 1.00 0.00 H new ATOM 0 HE ARG A 20 49.195 25.156 36.370 1.00 0.00 H new ATOM 0 HH11 ARG A 20 51.378 22.918 34.512 1.00 0.00 H new ATOM 0 HH12 ARG A 20 52.027 22.201 35.990 1.00 0.00 H new ATOM 0 HH21 ARG A 20 50.129 24.212 38.224 1.00 0.00 H new ATOM 0 HH22 ARG A 20 51.328 22.924 38.068 1.00 0.00 H new ATOM 323 N PHE A 21 48.471 27.281 29.534 1.00 0.00 N ATOM 324 CA PHE A 21 48.521 26.941 28.146 1.00 0.00 C ATOM 325 C PHE A 21 49.538 27.717 27.383 1.00 0.00 C ATOM 326 O PHE A 21 49.301 28.183 26.270 1.00 0.00 O ATOM 327 CB PHE A 21 47.143 27.034 27.469 1.00 0.00 C ATOM 328 CG PHE A 21 46.161 26.059 28.018 1.00 0.00 C ATOM 329 CD1 PHE A 21 46.484 24.766 28.356 1.00 0.00 C ATOM 330 CD2 PHE A 21 44.854 26.465 28.152 1.00 0.00 C ATOM 331 CE1 PHE A 21 45.535 23.908 28.859 1.00 0.00 C ATOM 332 CE2 PHE A 21 43.896 25.620 28.660 1.00 0.00 C ATOM 333 CZ PHE A 21 44.237 24.337 29.020 1.00 0.00 C ATOM 0 H PHE A 21 47.842 28.056 29.745 1.00 0.00 H new ATOM 0 HA PHE A 21 48.837 25.898 28.123 1.00 0.00 H new ATOM 0 HB2 PHE A 21 46.751 28.044 27.591 1.00 0.00 H new ATOM 0 HB3 PHE A 21 47.257 26.863 26.399 1.00 0.00 H new ATOM 0 HD1 PHE A 21 47.498 24.419 28.224 1.00 0.00 H new ATOM 0 HD2 PHE A 21 44.575 27.465 27.853 1.00 0.00 H new ATOM 0 HE1 PHE A 21 45.808 22.898 29.128 1.00 0.00 H new ATOM 0 HE2 PHE A 21 42.878 25.963 28.776 1.00 0.00 H new ATOM 0 HZ PHE A 21 43.491 23.670 29.426 1.00 0.00 H new ATOM 343 N LEU A 22 50.769 27.821 27.916 1.00 0.00 N ATOM 344 CA LEU A 22 51.870 28.459 27.265 1.00 0.00 C ATOM 345 C LEU A 22 52.540 27.548 26.293 1.00 0.00 C ATOM 346 O LEU A 22 53.075 27.971 25.270 1.00 0.00 O ATOM 347 CB LEU A 22 52.902 29.010 28.263 1.00 0.00 C ATOM 348 CG LEU A 22 52.292 30.092 29.172 1.00 0.00 C ATOM 349 CD1 LEU A 22 53.305 30.408 30.285 1.00 0.00 C ATOM 350 CD2 LEU A 22 51.894 31.379 28.431 1.00 0.00 C ATOM 0 H LEU A 22 51.006 27.447 28.835 1.00 0.00 H new ATOM 0 HA LEU A 22 51.448 29.302 26.719 1.00 0.00 H new ATOM 0 HB2 LEU A 22 53.287 28.195 28.875 1.00 0.00 H new ATOM 0 HB3 LEU A 22 53.749 29.427 27.718 1.00 0.00 H new ATOM 0 HG LEU A 22 51.362 29.695 29.579 1.00 0.00 H new ATOM 0 HD11 LEU A 22 52.895 31.174 30.944 1.00 0.00 H new ATOM 0 HD12 LEU A 22 53.507 29.505 30.860 1.00 0.00 H new ATOM 0 HD13 LEU A 22 54.232 30.770 29.841 1.00 0.00 H new ATOM 0 HD21 LEU A 22 51.472 32.092 29.140 1.00 0.00 H new ATOM 0 HD22 LEU A 22 52.775 31.814 27.959 1.00 0.00 H new ATOM 0 HD23 LEU A 22 51.152 31.145 27.668 1.00 0.00 H new ATOM 362 N ASP A 23 52.491 26.233 26.568 1.00 0.00 N ATOM 363 CA ASP A 23 52.950 25.255 25.632 1.00 0.00 C ATOM 364 C ASP A 23 51.945 24.988 24.565 1.00 0.00 C ATOM 365 O ASP A 23 52.262 24.387 23.539 1.00 0.00 O ATOM 366 CB ASP A 23 53.319 23.914 26.289 1.00 0.00 C ATOM 367 CG ASP A 23 54.189 24.092 27.526 1.00 0.00 C ATOM 368 OD1 ASP A 23 55.264 24.746 27.466 1.00 0.00 O ATOM 369 OD2 ASP A 23 53.775 23.580 28.600 1.00 0.00 O ATOM 0 H ASP A 23 52.132 25.846 27.441 1.00 0.00 H new ATOM 0 HA ASP A 23 53.849 25.691 25.197 1.00 0.00 H new ATOM 0 HB2 ASP A 23 52.407 23.384 26.563 1.00 0.00 H new ATOM 0 HB3 ASP A 23 53.845 23.291 25.565 1.00 0.00 H new ATOM 374 N HIS A 24 50.684 25.411 24.764 1.00 0.00 N ATOM 375 CA HIS A 24 49.592 25.079 23.901 1.00 0.00 C ATOM 376 C HIS A 24 48.746 26.239 23.508 1.00 0.00 C ATOM 377 O HIS A 24 47.648 26.359 24.049 1.00 0.00 O ATOM 378 CB HIS A 24 48.723 23.995 24.562 1.00 0.00 C ATOM 379 CG HIS A 24 49.468 22.727 24.853 1.00 0.00 C ATOM 380 ND1 HIS A 24 50.118 22.006 23.887 1.00 0.00 N ATOM 381 CD2 HIS A 24 49.695 22.091 26.035 1.00 0.00 C ATOM 382 CE1 HIS A 24 50.728 20.980 24.449 1.00 0.00 C ATOM 383 NE2 HIS A 24 50.491 21.013 25.747 1.00 0.00 N ATOM 0 H HIS A 24 50.415 26.003 25.550 1.00 0.00 H new ATOM 0 HA HIS A 24 50.037 24.710 22.977 1.00 0.00 H new ATOM 0 HB2 HIS A 24 48.312 24.387 25.492 1.00 0.00 H new ATOM 0 HB3 HIS A 24 47.879 23.770 23.910 1.00 0.00 H new ATOM 0 HD2 HIS A 24 49.322 22.379 27.007 1.00 0.00 H new ATOM 0 HE1 HIS A 24 51.321 20.239 23.934 1.00 0.00 H new ATOM 0 HE2 HIS A 24 50.845 20.342 26.429 1.00 0.00 H new ATOM 392 N PRO A 25 49.066 27.081 22.571 1.00 0.00 N ATOM 393 CA PRO A 25 48.206 28.151 22.158 1.00 0.00 C ATOM 394 C PRO A 25 46.967 27.738 21.442 1.00 0.00 C ATOM 395 O PRO A 25 46.127 28.580 21.132 1.00 0.00 O ATOM 396 CB PRO A 25 49.063 29.013 21.234 1.00 0.00 C ATOM 397 CG PRO A 25 50.501 28.742 21.705 1.00 0.00 C ATOM 398 CD PRO A 25 50.423 27.252 22.073 1.00 0.00 C ATOM 0 HA PRO A 25 47.839 28.663 23.048 1.00 0.00 H new ATOM 0 HB2 PRO A 25 48.926 28.736 20.189 1.00 0.00 H new ATOM 0 HB3 PRO A 25 48.806 30.069 21.321 1.00 0.00 H new ATOM 0 HG2 PRO A 25 51.233 28.934 20.921 1.00 0.00 H new ATOM 0 HG3 PRO A 25 50.778 29.362 22.558 1.00 0.00 H new ATOM 0 HD2 PRO A 25 50.613 26.617 21.208 1.00 0.00 H new ATOM 0 HD3 PRO A 25 51.162 26.989 22.830 1.00 0.00 H new ATOM 406 N GLU A 26 46.787 26.432 21.171 1.00 0.00 N ATOM 407 CA GLU A 26 45.679 25.862 20.471 1.00 0.00 C ATOM 408 C GLU A 26 44.443 25.961 21.299 1.00 0.00 C ATOM 409 O GLU A 26 43.322 26.097 20.812 1.00 0.00 O ATOM 410 CB GLU A 26 45.900 24.370 20.171 1.00 0.00 C ATOM 411 CG GLU A 26 47.352 23.967 19.907 1.00 0.00 C ATOM 412 CD GLU A 26 47.463 22.486 19.579 1.00 0.00 C ATOM 413 OE1 GLU A 26 46.904 21.650 20.338 1.00 0.00 O ATOM 414 OE2 GLU A 26 48.127 22.138 18.565 1.00 0.00 O ATOM 0 H GLU A 26 47.464 25.727 21.462 1.00 0.00 H new ATOM 0 HA GLU A 26 45.580 26.416 19.538 1.00 0.00 H new ATOM 0 HB2 GLU A 26 45.525 23.787 21.012 1.00 0.00 H new ATOM 0 HB3 GLU A 26 45.300 24.098 19.302 1.00 0.00 H new ATOM 0 HG2 GLU A 26 47.751 24.556 19.081 1.00 0.00 H new ATOM 0 HG3 GLU A 26 47.960 24.194 20.783 1.00 0.00 H new ATOM 421 N ILE A 27 44.620 25.890 22.630 1.00 0.00 N ATOM 422 CA ILE A 27 43.550 25.793 23.574 1.00 0.00 C ATOM 423 C ILE A 27 42.879 27.116 23.719 1.00 0.00 C ATOM 424 O ILE A 27 41.657 27.202 23.818 1.00 0.00 O ATOM 425 CB ILE A 27 43.989 25.306 24.923 1.00 0.00 C ATOM 426 CG1 ILE A 27 45.172 24.323 24.966 1.00 0.00 C ATOM 427 CG2 ILE A 27 42.774 24.597 25.543 1.00 0.00 C ATOM 428 CD1 ILE A 27 45.188 23.259 23.870 1.00 0.00 C ATOM 0 H ILE A 27 45.542 25.901 23.065 1.00 0.00 H new ATOM 0 HA ILE A 27 42.856 25.052 23.178 1.00 0.00 H new ATOM 0 HB ILE A 27 44.346 26.188 25.455 1.00 0.00 H new ATOM 0 HG12 ILE A 27 46.098 24.895 24.906 1.00 0.00 H new ATOM 0 HG13 ILE A 27 45.169 23.822 25.934 1.00 0.00 H new ATOM 0 HG21 ILE A 27 43.038 24.220 26.531 1.00 0.00 H new ATOM 0 HG22 ILE A 27 41.948 25.302 25.632 1.00 0.00 H new ATOM 0 HG23 ILE A 27 42.474 23.765 24.906 1.00 0.00 H new ATOM 0 HD11 ILE A 27 46.063 22.621 23.995 1.00 0.00 H new ATOM 0 HD12 ILE A 27 44.285 22.653 23.938 1.00 0.00 H new ATOM 0 HD13 ILE A 27 45.228 23.743 22.894 1.00 0.00 H new ATOM 440 N TYR A 28 43.676 28.198 23.660 1.00 0.00 N ATOM 441 CA TYR A 28 43.215 29.552 23.645 1.00 0.00 C ATOM 442 C TYR A 28 42.381 29.834 22.443 1.00 0.00 C ATOM 443 O TYR A 28 41.315 30.442 22.530 1.00 0.00 O ATOM 444 CB TYR A 28 44.410 30.516 23.749 1.00 0.00 C ATOM 445 CG TYR A 28 43.970 31.849 24.244 1.00 0.00 C ATOM 446 CD1 TYR A 28 43.477 31.957 25.524 1.00 0.00 C ATOM 447 CD2 TYR A 28 44.035 32.973 23.454 1.00 0.00 C ATOM 448 CE1 TYR A 28 43.034 33.168 26.001 1.00 0.00 C ATOM 449 CE2 TYR A 28 43.603 34.189 23.929 1.00 0.00 C ATOM 450 CZ TYR A 28 43.104 34.288 25.206 1.00 0.00 C ATOM 451 OH TYR A 28 42.709 35.531 25.744 1.00 0.00 O ATOM 0 H TYR A 28 44.693 28.125 23.621 1.00 0.00 H new ATOM 0 HA TYR A 28 42.573 29.708 24.512 1.00 0.00 H new ATOM 0 HB2 TYR A 28 45.160 30.102 24.423 1.00 0.00 H new ATOM 0 HB3 TYR A 28 44.883 30.623 22.773 1.00 0.00 H new ATOM 0 HD1 TYR A 28 43.438 31.084 26.159 1.00 0.00 H new ATOM 0 HD2 TYR A 28 44.429 32.900 22.451 1.00 0.00 H new ATOM 0 HE1 TYR A 28 42.631 33.240 27.000 1.00 0.00 H new ATOM 0 HE2 TYR A 28 43.656 35.065 23.300 1.00 0.00 H new ATOM 0 HH TYR A 28 42.815 36.230 25.065 1.00 0.00 H new ATOM 461 N ARG A 29 42.789 29.330 21.264 1.00 0.00 N ATOM 462 CA ARG A 29 41.997 29.390 20.075 1.00 0.00 C ATOM 463 C ARG A 29 40.724 28.621 20.156 1.00 0.00 C ATOM 464 O ARG A 29 39.684 29.085 19.691 1.00 0.00 O ATOM 465 CB ARG A 29 42.793 28.870 18.866 1.00 0.00 C ATOM 466 CG ARG A 29 44.060 29.653 18.516 1.00 0.00 C ATOM 467 CD ARG A 29 43.843 30.996 17.815 1.00 0.00 C ATOM 468 NE ARG A 29 43.336 30.724 16.440 1.00 0.00 N ATOM 469 CZ ARG A 29 43.035 31.699 15.534 1.00 0.00 C ATOM 470 NH1 ARG A 29 43.135 33.027 15.829 1.00 0.00 N ATOM 471 NH2 ARG A 29 42.642 31.358 14.271 1.00 0.00 N ATOM 0 H ARG A 29 43.690 28.870 21.134 1.00 0.00 H new ATOM 0 HA ARG A 29 41.742 30.443 19.958 1.00 0.00 H new ATOM 0 HB2 ARG A 29 43.070 27.833 19.056 1.00 0.00 H new ATOM 0 HB3 ARG A 29 42.137 28.870 17.996 1.00 0.00 H new ATOM 0 HG2 ARG A 29 44.619 29.831 19.434 1.00 0.00 H new ATOM 0 HG3 ARG A 29 44.685 29.029 17.878 1.00 0.00 H new ATOM 0 HD2 ARG A 29 43.129 31.604 18.370 1.00 0.00 H new ATOM 0 HD3 ARG A 29 44.776 31.558 17.772 1.00 0.00 H new ATOM 0 HE ARG A 29 43.206 29.752 16.160 1.00 0.00 H new ATOM 0 HH11 ARG A 29 43.444 33.322 16.755 1.00 0.00 H new ATOM 0 HH12 ARG A 29 42.901 33.725 15.123 1.00 0.00 H new ATOM 0 HH21 ARG A 29 42.574 30.375 14.006 1.00 0.00 H new ATOM 0 HH22 ARG A 29 42.417 32.086 13.593 1.00 0.00 H new ATOM 485 N SER A 30 40.745 27.407 20.735 1.00 0.00 N ATOM 486 CA SER A 30 39.653 26.485 20.728 1.00 0.00 C ATOM 487 C SER A 30 38.601 26.804 21.735 1.00 0.00 C ATOM 488 O SER A 30 37.415 26.787 21.409 1.00 0.00 O ATOM 489 CB SER A 30 40.185 25.050 20.880 1.00 0.00 C ATOM 490 OG SER A 30 39.185 24.044 20.834 1.00 0.00 O ATOM 0 H SER A 30 41.562 27.052 21.231 1.00 0.00 H new ATOM 0 HA SER A 30 39.153 26.576 19.764 1.00 0.00 H new ATOM 0 HB2 SER A 30 40.911 24.859 20.090 1.00 0.00 H new ATOM 0 HB3 SER A 30 40.718 24.972 21.828 1.00 0.00 H new ATOM 0 HG SER A 30 39.602 23.163 20.936 1.00 0.00 H new ATOM 496 N PHE A 31 38.957 27.124 22.993 1.00 0.00 N ATOM 497 CA PHE A 31 37.982 27.293 24.025 1.00 0.00 C ATOM 498 C PHE A 31 37.014 28.409 23.833 1.00 0.00 C ATOM 499 O PHE A 31 35.808 28.247 24.013 1.00 0.00 O ATOM 500 CB PHE A 31 38.581 27.200 25.439 1.00 0.00 C ATOM 501 CG PHE A 31 38.753 28.455 26.223 1.00 0.00 C ATOM 502 CD1 PHE A 31 39.925 29.170 26.148 1.00 0.00 C ATOM 503 CD2 PHE A 31 37.766 28.873 27.084 1.00 0.00 C ATOM 504 CE1 PHE A 31 40.116 30.282 26.934 1.00 0.00 C ATOM 505 CE2 PHE A 31 37.954 29.980 27.879 1.00 0.00 C ATOM 506 CZ PHE A 31 39.134 30.683 27.808 1.00 0.00 C ATOM 0 H PHE A 31 39.921 27.266 23.295 1.00 0.00 H new ATOM 0 HA PHE A 31 37.337 26.420 23.920 1.00 0.00 H new ATOM 0 HB2 PHE A 31 37.951 26.529 26.022 1.00 0.00 H new ATOM 0 HB3 PHE A 31 39.559 26.726 25.354 1.00 0.00 H new ATOM 0 HD1 PHE A 31 40.702 28.856 25.466 1.00 0.00 H new ATOM 0 HD2 PHE A 31 36.835 28.328 27.137 1.00 0.00 H new ATOM 0 HE1 PHE A 31 41.038 30.840 26.865 1.00 0.00 H new ATOM 0 HE2 PHE A 31 37.176 30.297 28.558 1.00 0.00 H new ATOM 0 HZ PHE A 31 39.288 31.547 28.437 1.00 0.00 H new ATOM 516 N LEU A 32 37.486 29.596 23.413 1.00 0.00 N ATOM 517 CA LEU A 32 36.660 30.747 23.220 1.00 0.00 C ATOM 518 C LEU A 32 35.733 30.600 22.063 1.00 0.00 C ATOM 519 O LEU A 32 34.620 31.122 22.060 1.00 0.00 O ATOM 520 CB LEU A 32 37.435 32.037 22.900 1.00 0.00 C ATOM 521 CG LEU A 32 38.815 32.167 23.565 1.00 0.00 C ATOM 522 CD1 LEU A 32 39.694 33.057 22.668 1.00 0.00 C ATOM 523 CD2 LEU A 32 38.705 32.674 25.013 1.00 0.00 C ATOM 0 H LEU A 32 38.470 29.760 23.202 1.00 0.00 H new ATOM 0 HA LEU A 32 36.143 30.820 24.177 1.00 0.00 H new ATOM 0 HB2 LEU A 32 37.565 32.103 21.820 1.00 0.00 H new ATOM 0 HB3 LEU A 32 36.825 32.889 23.200 1.00 0.00 H new ATOM 0 HG LEU A 32 39.288 31.189 23.653 1.00 0.00 H new ATOM 0 HD11 LEU A 32 40.681 33.165 23.118 1.00 0.00 H new ATOM 0 HD12 LEU A 32 39.792 32.598 21.684 1.00 0.00 H new ATOM 0 HD13 LEU A 32 39.232 34.039 22.565 1.00 0.00 H new ATOM 0 HD21 LEU A 32 39.701 32.752 25.448 1.00 0.00 H new ATOM 0 HD22 LEU A 32 38.228 33.654 25.020 1.00 0.00 H new ATOM 0 HD23 LEU A 32 38.107 31.975 25.599 1.00 0.00 H new ATOM 535 N GLU A 33 36.181 29.897 21.008 1.00 0.00 N ATOM 536 CA GLU A 33 35.381 29.486 19.896 1.00 0.00 C ATOM 537 C GLU A 33 34.085 28.837 20.237 1.00 0.00 C ATOM 538 O GLU A 33 33.050 29.130 19.640 1.00 0.00 O ATOM 539 CB GLU A 33 36.218 28.607 18.950 1.00 0.00 C ATOM 540 CG GLU A 33 35.703 28.701 17.513 1.00 0.00 C ATOM 541 CD GLU A 33 36.691 28.196 16.471 1.00 0.00 C ATOM 542 OE1 GLU A 33 37.578 28.997 16.075 1.00 0.00 O ATOM 543 OE2 GLU A 33 36.571 27.032 15.999 1.00 0.00 O ATOM 0 H GLU A 33 37.153 29.600 20.927 1.00 0.00 H new ATOM 0 HA GLU A 33 35.083 30.407 19.395 1.00 0.00 H new ATOM 0 HB2 GLU A 33 37.262 28.919 18.987 1.00 0.00 H new ATOM 0 HB3 GLU A 33 36.183 27.570 19.285 1.00 0.00 H new ATOM 0 HG2 GLU A 33 34.779 28.129 17.430 1.00 0.00 H new ATOM 0 HG3 GLU A 33 35.456 29.740 17.293 1.00 0.00 H new ATOM 550 N ILE A 34 34.057 27.986 21.279 1.00 0.00 N ATOM 551 CA ILE A 34 32.885 27.401 21.853 1.00 0.00 C ATOM 552 C ILE A 34 32.060 28.421 22.560 1.00 0.00 C ATOM 553 O ILE A 34 30.848 28.483 22.362 1.00 0.00 O ATOM 554 CB ILE A 34 33.286 26.264 22.748 1.00 0.00 C ATOM 555 CG1 ILE A 34 34.126 25.214 22.001 1.00 0.00 C ATOM 556 CG2 ILE A 34 32.043 25.601 23.363 1.00 0.00 C ATOM 557 CD1 ILE A 34 34.960 24.336 22.931 1.00 0.00 C ATOM 0 H ILE A 34 34.911 27.688 21.751 1.00 0.00 H new ATOM 0 HA ILE A 34 32.253 27.002 21.060 1.00 0.00 H new ATOM 0 HB ILE A 34 33.904 26.680 23.543 1.00 0.00 H new ATOM 0 HG12 ILE A 34 33.463 24.580 21.412 1.00 0.00 H new ATOM 0 HG13 ILE A 34 34.789 25.721 21.300 1.00 0.00 H new ATOM 0 HG21 ILE A 34 32.351 24.779 24.009 1.00 0.00 H new ATOM 0 HG22 ILE A 34 31.491 26.336 23.949 1.00 0.00 H new ATOM 0 HG23 ILE A 34 31.404 25.217 22.568 1.00 0.00 H new ATOM 0 HD11 ILE A 34 35.528 23.617 22.340 1.00 0.00 H new ATOM 0 HD12 ILE A 34 35.647 24.961 23.502 1.00 0.00 H new ATOM 0 HD13 ILE A 34 34.301 23.802 23.616 1.00 0.00 H new ATOM 569 N LEU A 35 32.647 29.330 23.359 1.00 0.00 N ATOM 570 CA LEU A 35 31.919 30.382 23.999 1.00 0.00 C ATOM 571 C LEU A 35 31.397 31.410 23.055 1.00 0.00 C ATOM 572 O LEU A 35 30.455 32.148 23.338 1.00 0.00 O ATOM 573 CB LEU A 35 32.792 31.090 25.048 1.00 0.00 C ATOM 574 CG LEU A 35 33.662 30.184 25.935 1.00 0.00 C ATOM 575 CD1 LEU A 35 33.980 30.980 27.212 1.00 0.00 C ATOM 576 CD2 LEU A 35 33.055 28.884 26.487 1.00 0.00 C ATOM 0 H LEU A 35 33.646 29.335 23.565 1.00 0.00 H new ATOM 0 HA LEU A 35 31.065 29.894 24.468 1.00 0.00 H new ATOM 0 HB2 LEU A 35 33.446 31.792 24.531 1.00 0.00 H new ATOM 0 HB3 LEU A 35 32.141 31.678 25.695 1.00 0.00 H new ATOM 0 HG LEU A 35 34.479 29.901 25.271 1.00 0.00 H new ATOM 0 HD11 LEU A 35 34.598 30.374 27.874 1.00 0.00 H new ATOM 0 HD12 LEU A 35 34.516 31.892 26.948 1.00 0.00 H new ATOM 0 HD13 LEU A 35 33.051 31.240 27.720 1.00 0.00 H new ATOM 0 HD21 LEU A 35 33.798 28.363 27.091 1.00 0.00 H new ATOM 0 HD22 LEU A 35 32.187 29.120 27.103 1.00 0.00 H new ATOM 0 HD23 LEU A 35 32.749 28.245 25.659 1.00 0.00 H new ATOM 588 N HIS A 36 31.935 31.503 21.826 1.00 0.00 N ATOM 589 CA HIS A 36 31.399 32.298 20.765 1.00 0.00 C ATOM 590 C HIS A 36 30.120 31.747 20.233 1.00 0.00 C ATOM 591 O HIS A 36 29.245 32.514 19.836 1.00 0.00 O ATOM 592 CB HIS A 36 32.411 32.540 19.632 1.00 0.00 C ATOM 593 CG HIS A 36 33.480 33.523 20.005 1.00 0.00 C ATOM 594 ND1 HIS A 36 33.183 34.850 20.165 1.00 0.00 N ATOM 595 CD2 HIS A 36 34.825 33.404 20.171 1.00 0.00 C ATOM 596 CE1 HIS A 36 34.294 35.517 20.414 1.00 0.00 C ATOM 597 NE2 HIS A 36 35.301 34.663 20.425 1.00 0.00 N ATOM 0 H HIS A 36 32.782 31.001 21.560 1.00 0.00 H new ATOM 0 HA HIS A 36 31.178 33.269 21.209 1.00 0.00 H new ATOM 0 HB2 HIS A 36 32.875 31.593 19.358 1.00 0.00 H new ATOM 0 HB3 HIS A 36 31.882 32.903 18.751 1.00 0.00 H new ATOM 0 HD2 HIS A 36 35.404 32.494 20.114 1.00 0.00 H new ATOM 0 HE1 HIS A 36 34.367 36.582 20.581 1.00 0.00 H new ATOM 0 HE2 HIS A 36 36.278 34.903 20.595 1.00 0.00 H new ATOM 606 N THR A 37 29.886 30.424 20.282 1.00 0.00 N ATOM 607 CA THR A 37 28.643 29.799 19.952 1.00 0.00 C ATOM 608 C THR A 37 27.533 30.183 20.869 1.00 0.00 C ATOM 609 O THR A 37 26.356 30.141 20.515 1.00 0.00 O ATOM 610 CB THR A 37 28.818 28.324 19.748 1.00 0.00 C ATOM 611 OG1 THR A 37 28.753 27.993 18.369 1.00 0.00 O ATOM 612 CG2 THR A 37 27.796 27.411 20.447 1.00 0.00 C ATOM 0 H THR A 37 30.602 29.755 20.567 1.00 0.00 H new ATOM 0 HA THR A 37 28.316 30.191 18.989 1.00 0.00 H new ATOM 0 HB THR A 37 29.794 28.139 20.197 1.00 0.00 H new ATOM 0 HG1 THR A 37 28.871 27.026 18.259 1.00 0.00 H new ATOM 0 HG21 THR A 37 28.027 26.369 20.225 1.00 0.00 H new ATOM 0 HG22 THR A 37 27.842 27.571 21.524 1.00 0.00 H new ATOM 0 HG23 THR A 37 26.794 27.645 20.088 1.00 0.00 H new ATOM 620 N TYR A 38 27.880 30.665 22.076 1.00 0.00 N ATOM 621 CA TYR A 38 27.030 31.384 22.972 1.00 0.00 C ATOM 622 C TYR A 38 26.866 32.807 22.562 1.00 0.00 C ATOM 623 O TYR A 38 25.770 33.304 22.309 1.00 0.00 O ATOM 624 CB TYR A 38 27.650 31.267 24.375 1.00 0.00 C ATOM 625 CG TYR A 38 26.820 31.706 25.531 1.00 0.00 C ATOM 626 CD1 TYR A 38 26.813 33.028 25.910 1.00 0.00 C ATOM 627 CD2 TYR A 38 26.222 30.765 26.336 1.00 0.00 C ATOM 628 CE1 TYR A 38 26.218 33.413 27.088 1.00 0.00 C ATOM 629 CE2 TYR A 38 25.613 31.150 27.507 1.00 0.00 C ATOM 630 CZ TYR A 38 25.611 32.472 27.886 1.00 0.00 C ATOM 631 OH TYR A 38 25.026 32.868 29.108 1.00 0.00 O ATOM 0 H TYR A 38 28.821 30.543 22.450 1.00 0.00 H new ATOM 0 HA TYR A 38 26.026 30.959 22.961 1.00 0.00 H new ATOM 0 HB2 TYR A 38 27.926 30.225 24.535 1.00 0.00 H new ATOM 0 HB3 TYR A 38 28.573 31.846 24.384 1.00 0.00 H new ATOM 0 HD1 TYR A 38 27.278 33.769 25.277 1.00 0.00 H new ATOM 0 HD2 TYR A 38 26.231 29.724 26.048 1.00 0.00 H new ATOM 0 HE1 TYR A 38 26.227 34.451 27.386 1.00 0.00 H new ATOM 0 HE2 TYR A 38 25.134 30.411 28.132 1.00 0.00 H new ATOM 0 HH TYR A 38 24.596 32.095 29.531 1.00 0.00 H new ATOM 641 N GLN A 39 27.980 33.561 22.526 1.00 0.00 N ATOM 642 CA GLN A 39 27.984 34.990 22.477 1.00 0.00 C ATOM 643 C GLN A 39 27.623 35.628 21.181 1.00 0.00 C ATOM 644 O GLN A 39 27.225 36.791 21.152 1.00 0.00 O ATOM 645 CB GLN A 39 29.315 35.490 23.065 1.00 0.00 C ATOM 646 CG GLN A 39 29.160 36.453 24.243 1.00 0.00 C ATOM 647 CD GLN A 39 28.559 37.815 23.927 1.00 0.00 C ATOM 648 OE1 GLN A 39 27.374 38.073 24.134 1.00 0.00 O ATOM 649 NE2 GLN A 39 29.429 38.760 23.481 1.00 0.00 N ATOM 0 H GLN A 39 28.917 33.157 22.531 1.00 0.00 H new ATOM 0 HA GLN A 39 27.147 35.322 23.090 1.00 0.00 H new ATOM 0 HB2 GLN A 39 29.902 34.630 23.388 1.00 0.00 H new ATOM 0 HB3 GLN A 39 29.883 35.986 22.278 1.00 0.00 H new ATOM 0 HG2 GLN A 39 28.539 35.972 24.998 1.00 0.00 H new ATOM 0 HG3 GLN A 39 30.142 36.608 24.690 1.00 0.00 H new ATOM 0 HE21 GLN A 39 30.406 38.517 23.318 1.00 0.00 H new ATOM 0 HE22 GLN A 39 29.104 39.712 23.309 1.00 0.00 H new ATOM 898 N SER A 54 22.114 25.279 25.972 1.00 0.00 N ATOM 899 CA SER A 54 22.291 24.791 27.304 1.00 0.00 C ATOM 900 C SER A 54 23.678 25.100 27.751 1.00 0.00 C ATOM 901 O SER A 54 24.660 24.801 27.072 1.00 0.00 O ATOM 902 CB SER A 54 22.022 23.287 27.482 1.00 0.00 C ATOM 903 OG SER A 54 20.646 23.002 27.275 1.00 0.00 O ATOM 0 HA SER A 54 21.543 25.298 27.914 1.00 0.00 H new ATOM 0 HB2 SER A 54 22.628 22.717 26.778 1.00 0.00 H new ATOM 0 HB3 SER A 54 22.318 22.974 28.483 1.00 0.00 H new ATOM 0 HG SER A 54 20.490 22.041 27.390 1.00 0.00 H new ATOM 909 N GLU A 55 23.830 25.727 28.931 1.00 0.00 N ATOM 910 CA GLU A 55 25.072 26.243 29.417 1.00 0.00 C ATOM 911 C GLU A 55 26.012 25.157 29.815 1.00 0.00 C ATOM 912 O GLU A 55 27.231 25.310 29.792 1.00 0.00 O ATOM 913 CB GLU A 55 24.810 27.327 30.476 1.00 0.00 C ATOM 914 CG GLU A 55 23.895 28.424 29.927 1.00 0.00 C ATOM 915 CD GLU A 55 23.710 29.635 30.831 1.00 0.00 C ATOM 916 OE1 GLU A 55 22.836 29.560 31.734 1.00 0.00 O ATOM 917 OE2 GLU A 55 24.370 30.684 30.602 1.00 0.00 O ATOM 0 H GLU A 55 23.054 25.881 29.574 1.00 0.00 H new ATOM 0 HA GLU A 55 25.606 26.746 28.611 1.00 0.00 H new ATOM 0 HB2 GLU A 55 24.354 26.876 31.357 1.00 0.00 H new ATOM 0 HB3 GLU A 55 25.756 27.764 30.795 1.00 0.00 H new ATOM 0 HG2 GLU A 55 24.296 28.763 28.972 1.00 0.00 H new ATOM 0 HG3 GLU A 55 22.916 27.989 29.726 1.00 0.00 H new ATOM 924 N GLU A 56 25.460 23.952 30.045 1.00 0.00 N ATOM 925 CA GLU A 56 26.111 22.679 30.011 1.00 0.00 C ATOM 926 C GLU A 56 26.983 22.400 28.835 1.00 0.00 C ATOM 927 O GLU A 56 28.025 21.763 28.987 1.00 0.00 O ATOM 928 CB GLU A 56 25.054 21.562 30.012 1.00 0.00 C ATOM 929 CG GLU A 56 24.276 21.375 31.316 1.00 0.00 C ATOM 930 CD GLU A 56 25.056 20.573 32.348 1.00 0.00 C ATOM 931 OE1 GLU A 56 25.387 19.385 32.088 1.00 0.00 O ATOM 932 OE2 GLU A 56 25.300 21.117 33.457 1.00 0.00 O ATOM 0 H GLU A 56 24.470 23.863 30.275 1.00 0.00 H new ATOM 0 HA GLU A 56 26.753 22.706 30.892 1.00 0.00 H new ATOM 0 HB2 GLU A 56 24.341 21.763 29.213 1.00 0.00 H new ATOM 0 HB3 GLU A 56 25.548 20.621 29.769 1.00 0.00 H new ATOM 0 HG2 GLU A 56 24.028 22.352 31.731 1.00 0.00 H new ATOM 0 HG3 GLU A 56 23.334 20.870 31.104 1.00 0.00 H new ATOM 939 N GLU A 57 26.629 22.790 27.598 1.00 0.00 N ATOM 940 CA GLU A 57 27.284 22.289 26.430 1.00 0.00 C ATOM 941 C GLU A 57 28.527 23.054 26.130 1.00 0.00 C ATOM 942 O GLU A 57 29.544 22.552 25.656 1.00 0.00 O ATOM 943 CB GLU A 57 26.405 22.163 25.173 1.00 0.00 C ATOM 944 CG GLU A 57 26.489 23.301 24.154 1.00 0.00 C ATOM 945 CD GLU A 57 25.725 22.921 22.894 1.00 0.00 C ATOM 946 OE1 GLU A 57 26.282 22.138 22.079 1.00 0.00 O ATOM 947 OE2 GLU A 57 24.570 23.387 22.703 1.00 0.00 O ATOM 0 H GLU A 57 25.883 23.458 27.406 1.00 0.00 H new ATOM 0 HA GLU A 57 27.540 21.263 26.694 1.00 0.00 H new ATOM 0 HB2 GLU A 57 26.668 21.234 24.667 1.00 0.00 H new ATOM 0 HB3 GLU A 57 25.367 22.069 25.493 1.00 0.00 H new ATOM 0 HG2 GLU A 57 26.074 24.215 24.580 1.00 0.00 H new ATOM 0 HG3 GLU A 57 27.531 23.507 23.910 1.00 0.00 H new ATOM 954 N VAL A 58 28.468 24.366 26.423 1.00 0.00 N ATOM 955 CA VAL A 58 29.532 25.296 26.210 1.00 0.00 C ATOM 956 C VAL A 58 30.668 24.992 27.125 1.00 0.00 C ATOM 957 O VAL A 58 31.845 25.052 26.775 1.00 0.00 O ATOM 958 CB VAL A 58 28.922 26.664 26.285 1.00 0.00 C ATOM 959 CG1 VAL A 58 29.079 27.328 27.663 1.00 0.00 C ATOM 960 CG2 VAL A 58 29.580 27.596 25.253 1.00 0.00 C ATOM 0 H VAL A 58 27.638 24.798 26.828 1.00 0.00 H new ATOM 0 HA VAL A 58 30.001 25.227 25.229 1.00 0.00 H new ATOM 0 HB VAL A 58 27.860 26.522 26.086 1.00 0.00 H new ATOM 0 HG11 VAL A 58 28.615 28.314 27.647 1.00 0.00 H new ATOM 0 HG12 VAL A 58 28.595 26.712 28.421 1.00 0.00 H new ATOM 0 HG13 VAL A 58 30.138 27.429 27.900 1.00 0.00 H new ATOM 0 HG21 VAL A 58 29.129 28.586 25.317 1.00 0.00 H new ATOM 0 HG22 VAL A 58 30.648 27.670 25.458 1.00 0.00 H new ATOM 0 HG23 VAL A 58 29.430 27.193 24.251 1.00 0.00 H new ATOM 970 N PHE A 59 30.283 24.518 28.324 1.00 0.00 N ATOM 971 CA PHE A 59 31.073 23.815 29.286 1.00 0.00 C ATOM 972 C PHE A 59 31.580 22.504 28.792 1.00 0.00 C ATOM 973 O PHE A 59 32.789 22.277 28.800 1.00 0.00 O ATOM 974 CB PHE A 59 30.248 23.707 30.579 1.00 0.00 C ATOM 975 CG PHE A 59 30.900 23.038 31.740 1.00 0.00 C ATOM 976 CD1 PHE A 59 30.886 21.668 31.860 1.00 0.00 C ATOM 977 CD2 PHE A 59 31.432 23.785 32.764 1.00 0.00 C ATOM 978 CE1 PHE A 59 31.421 21.051 32.966 1.00 0.00 C ATOM 979 CE2 PHE A 59 31.955 23.181 33.883 1.00 0.00 C ATOM 980 CZ PHE A 59 31.958 21.809 33.978 1.00 0.00 C ATOM 0 H PHE A 59 29.324 24.641 28.649 1.00 0.00 H new ATOM 0 HA PHE A 59 31.987 24.374 29.486 1.00 0.00 H new ATOM 0 HB2 PHE A 59 29.962 24.714 30.884 1.00 0.00 H new ATOM 0 HB3 PHE A 59 29.328 23.169 30.350 1.00 0.00 H new ATOM 0 HD1 PHE A 59 30.449 21.069 31.075 1.00 0.00 H new ATOM 0 HD2 PHE A 59 31.439 24.862 32.688 1.00 0.00 H new ATOM 0 HE1 PHE A 59 31.419 19.973 33.039 1.00 0.00 H new ATOM 0 HE2 PHE A 59 32.362 23.781 34.684 1.00 0.00 H new ATOM 0 HZ PHE A 59 32.382 21.328 34.847 1.00 0.00 H new ATOM 990 N THR A 60 30.716 21.584 28.326 1.00 0.00 N ATOM 991 CA THR A 60 31.024 20.275 27.838 1.00 0.00 C ATOM 992 C THR A 60 32.121 20.209 26.832 1.00 0.00 C ATOM 993 O THR A 60 33.011 19.363 26.902 1.00 0.00 O ATOM 994 CB THR A 60 29.834 19.482 27.383 1.00 0.00 C ATOM 995 OG1 THR A 60 29.843 18.172 27.932 1.00 0.00 O ATOM 996 CG2 THR A 60 29.686 19.301 25.863 1.00 0.00 C ATOM 0 H THR A 60 29.715 21.775 28.288 1.00 0.00 H new ATOM 0 HA THR A 60 31.408 19.792 28.737 1.00 0.00 H new ATOM 0 HB THR A 60 29.000 20.088 27.737 1.00 0.00 H new ATOM 0 HG1 THR A 60 29.055 17.681 27.619 1.00 0.00 H new ATOM 0 HG21 THR A 60 28.793 18.713 25.652 1.00 0.00 H new ATOM 0 HG22 THR A 60 29.598 20.278 25.387 1.00 0.00 H new ATOM 0 HG23 THR A 60 30.562 18.784 25.471 1.00 0.00 H new ATOM 1004 N GLU A 61 32.118 21.128 25.851 1.00 0.00 N ATOM 1005 CA GLU A 61 33.115 21.148 24.827 1.00 0.00 C ATOM 1006 C GLU A 61 34.433 21.630 25.328 1.00 0.00 C ATOM 1007 O GLU A 61 35.444 20.970 25.094 1.00 0.00 O ATOM 1008 CB GLU A 61 32.593 21.796 23.533 1.00 0.00 C ATOM 1009 CG GLU A 61 31.631 20.881 22.773 1.00 0.00 C ATOM 1010 CD GLU A 61 32.357 19.718 22.111 1.00 0.00 C ATOM 1011 OE1 GLU A 61 33.033 19.970 21.078 1.00 0.00 O ATOM 1012 OE2 GLU A 61 32.256 18.553 22.575 1.00 0.00 O ATOM 0 H GLU A 61 31.417 21.864 25.767 1.00 0.00 H new ATOM 0 HA GLU A 61 33.329 20.121 24.530 1.00 0.00 H new ATOM 0 HB2 GLU A 61 32.087 22.730 23.776 1.00 0.00 H new ATOM 0 HB3 GLU A 61 33.436 22.048 22.890 1.00 0.00 H new ATOM 0 HG2 GLU A 61 30.878 20.495 23.460 1.00 0.00 H new ATOM 0 HG3 GLU A 61 31.104 21.459 22.014 1.00 0.00 H new ATOM 1019 N VAL A 62 34.491 22.708 26.130 1.00 0.00 N ATOM 1020 CA VAL A 62 35.658 23.215 26.781 1.00 0.00 C ATOM 1021 C VAL A 62 36.301 22.236 27.703 1.00 0.00 C ATOM 1022 O VAL A 62 37.514 22.204 27.909 1.00 0.00 O ATOM 1023 CB VAL A 62 35.273 24.447 27.546 1.00 0.00 C ATOM 1024 CG1 VAL A 62 36.410 24.994 28.427 1.00 0.00 C ATOM 1025 CG2 VAL A 62 34.888 25.528 26.522 1.00 0.00 C ATOM 0 H VAL A 62 33.662 23.264 26.337 1.00 0.00 H new ATOM 0 HA VAL A 62 36.395 23.434 26.008 1.00 0.00 H new ATOM 0 HB VAL A 62 34.451 24.185 28.212 1.00 0.00 H new ATOM 0 HG11 VAL A 62 36.066 25.885 28.953 1.00 0.00 H new ATOM 0 HG12 VAL A 62 36.705 24.236 29.152 1.00 0.00 H new ATOM 0 HG13 VAL A 62 37.265 25.250 27.801 1.00 0.00 H new ATOM 0 HG21 VAL A 62 34.602 26.440 27.046 1.00 0.00 H new ATOM 0 HG22 VAL A 62 35.739 25.734 25.873 1.00 0.00 H new ATOM 0 HG23 VAL A 62 34.050 25.177 25.920 1.00 0.00 H new ATOM 1035 N ALA A 63 35.488 21.323 28.265 1.00 0.00 N ATOM 1036 CA ALA A 63 35.887 20.312 29.194 1.00 0.00 C ATOM 1037 C ALA A 63 36.846 19.345 28.590 1.00 0.00 C ATOM 1038 O ALA A 63 37.755 18.863 29.263 1.00 0.00 O ATOM 1039 CB ALA A 63 34.681 19.501 29.699 1.00 0.00 C ATOM 0 H ALA A 63 34.490 21.290 28.057 1.00 0.00 H new ATOM 0 HA ALA A 63 36.362 20.844 30.018 1.00 0.00 H new ATOM 0 HB1 ALA A 63 35.022 18.742 30.403 1.00 0.00 H new ATOM 0 HB2 ALA A 63 33.977 20.168 30.197 1.00 0.00 H new ATOM 0 HB3 ALA A 63 34.188 19.018 28.855 1.00 0.00 H new ATOM 1045 N ASN A 64 36.701 19.060 27.283 1.00 0.00 N ATOM 1046 CA ASN A 64 37.562 18.136 26.614 1.00 0.00 C ATOM 1047 C ASN A 64 38.949 18.674 26.509 1.00 0.00 C ATOM 1048 O ASN A 64 39.939 17.954 26.625 1.00 0.00 O ATOM 1049 CB ASN A 64 37.168 17.773 25.173 1.00 0.00 C ATOM 1050 CG ASN A 64 35.689 17.467 24.984 1.00 0.00 C ATOM 1051 OD1 ASN A 64 35.116 16.501 25.485 1.00 0.00 O ATOM 1052 ND2 ASN A 64 35.054 18.332 24.149 1.00 0.00 N ATOM 0 H ASN A 64 35.983 19.473 26.687 1.00 0.00 H new ATOM 0 HA ASN A 64 37.480 17.246 27.237 1.00 0.00 H new ATOM 0 HB2 ASN A 64 37.443 18.598 24.515 1.00 0.00 H new ATOM 0 HB3 ASN A 64 37.749 16.906 24.858 1.00 0.00 H new ATOM 0 HD21 ASN A 64 34.070 18.190 23.920 1.00 0.00 H new ATOM 0 HD22 ASN A 64 35.561 19.123 23.752 1.00 0.00 H new ATOM 1059 N LEU A 65 39.062 19.995 26.287 1.00 0.00 N ATOM 1060 CA LEU A 65 40.289 20.692 26.053 1.00 0.00 C ATOM 1061 C LEU A 65 41.168 20.706 27.256 1.00 0.00 C ATOM 1062 O LEU A 65 42.394 20.624 27.189 1.00 0.00 O ATOM 1063 CB LEU A 65 40.037 22.177 25.738 1.00 0.00 C ATOM 1064 CG LEU A 65 39.432 22.506 24.364 1.00 0.00 C ATOM 1065 CD1 LEU A 65 38.031 21.897 24.183 1.00 0.00 C ATOM 1066 CD2 LEU A 65 39.338 24.035 24.216 1.00 0.00 C ATOM 0 H LEU A 65 38.250 20.612 26.270 1.00 0.00 H new ATOM 0 HA LEU A 65 40.757 20.164 25.222 1.00 0.00 H new ATOM 0 HB2 LEU A 65 39.374 22.578 26.505 1.00 0.00 H new ATOM 0 HB3 LEU A 65 40.985 22.708 25.827 1.00 0.00 H new ATOM 0 HG LEU A 65 40.081 22.076 23.601 1.00 0.00 H new ATOM 0 HD11 LEU A 65 37.646 22.157 23.197 1.00 0.00 H new ATOM 0 HD12 LEU A 65 38.091 20.813 24.274 1.00 0.00 H new ATOM 0 HD13 LEU A 65 37.362 22.289 24.949 1.00 0.00 H new ATOM 0 HD21 LEU A 65 38.910 24.281 23.244 1.00 0.00 H new ATOM 0 HD22 LEU A 65 38.703 24.439 25.005 1.00 0.00 H new ATOM 0 HD23 LEU A 65 40.334 24.470 24.294 1.00 0.00 H new ATOM 1078 N PHE A 66 40.527 20.863 28.427 1.00 0.00 N ATOM 1079 CA PHE A 66 41.150 21.202 29.670 1.00 0.00 C ATOM 1080 C PHE A 66 41.322 19.983 30.510 1.00 0.00 C ATOM 1081 O PHE A 66 41.610 20.065 31.703 1.00 0.00 O ATOM 1082 CB PHE A 66 40.287 22.192 30.468 1.00 0.00 C ATOM 1083 CG PHE A 66 40.110 23.561 29.907 1.00 0.00 C ATOM 1084 CD1 PHE A 66 40.680 24.020 28.743 1.00 0.00 C ATOM 1085 CD2 PHE A 66 39.324 24.426 30.631 1.00 0.00 C ATOM 1086 CE1 PHE A 66 40.445 25.299 28.295 1.00 0.00 C ATOM 1087 CE2 PHE A 66 39.117 25.722 30.221 1.00 0.00 C ATOM 1088 CZ PHE A 66 39.678 26.159 29.044 1.00 0.00 C ATOM 0 H PHE A 66 39.517 20.747 28.512 1.00 0.00 H new ATOM 0 HA PHE A 66 42.115 21.651 29.435 1.00 0.00 H new ATOM 0 HB2 PHE A 66 39.299 21.750 30.594 1.00 0.00 H new ATOM 0 HB3 PHE A 66 40.721 22.290 31.463 1.00 0.00 H new ATOM 0 HD1 PHE A 66 41.322 23.366 28.172 1.00 0.00 H new ATOM 0 HD2 PHE A 66 38.859 24.080 31.542 1.00 0.00 H new ATOM 0 HE1 PHE A 66 40.863 25.627 27.355 1.00 0.00 H new ATOM 0 HE2 PHE A 66 38.518 26.392 30.819 1.00 0.00 H new ATOM 0 HZ PHE A 66 39.517 27.173 28.710 1.00 0.00 H new ATOM 1098 N ARG A 67 41.120 18.791 29.923 1.00 0.00 N ATOM 1099 CA ARG A 67 40.887 17.584 30.655 1.00 0.00 C ATOM 1100 C ARG A 67 42.029 17.120 31.493 1.00 0.00 C ATOM 1101 O ARG A 67 43.144 16.888 31.029 1.00 0.00 O ATOM 1102 CB ARG A 67 40.235 16.527 29.748 1.00 0.00 C ATOM 1103 CG ARG A 67 41.131 15.665 28.857 1.00 0.00 C ATOM 1104 CD ARG A 67 41.699 14.422 29.545 1.00 0.00 C ATOM 1105 NE ARG A 67 42.215 13.469 28.522 1.00 0.00 N ATOM 1106 CZ ARG A 67 43.440 13.547 27.926 1.00 0.00 C ATOM 1107 NH1 ARG A 67 44.280 14.613 28.081 1.00 0.00 N ATOM 1108 NH2 ARG A 67 43.890 12.536 27.127 1.00 0.00 N ATOM 0 H ARG A 67 41.118 18.662 28.911 1.00 0.00 H new ATOM 0 HA ARG A 67 40.158 17.808 31.434 1.00 0.00 H new ATOM 0 HB2 ARG A 67 39.660 15.855 30.385 1.00 0.00 H new ATOM 0 HB3 ARG A 67 39.523 17.041 29.102 1.00 0.00 H new ATOM 0 HG2 ARG A 67 40.560 15.352 27.983 1.00 0.00 H new ATOM 0 HG3 ARG A 67 41.959 16.275 28.496 1.00 0.00 H new ATOM 0 HD2 ARG A 67 42.500 14.707 30.227 1.00 0.00 H new ATOM 0 HD3 ARG A 67 40.926 13.942 30.145 1.00 0.00 H new ATOM 0 HE ARG A 67 41.605 12.699 28.246 1.00 0.00 H new ATOM 0 HH11 ARG A 67 44.001 15.401 28.665 1.00 0.00 H new ATOM 0 HH12 ARG A 67 45.186 14.621 27.612 1.00 0.00 H new ATOM 0 HH21 ARG A 67 43.309 11.712 26.971 1.00 0.00 H new ATOM 0 HH22 ARG A 67 44.807 12.604 26.686 1.00 0.00 H new ATOM 1122 N GLY A 68 41.798 17.041 32.816 1.00 0.00 N ATOM 1123 CA GLY A 68 42.799 16.757 33.798 1.00 0.00 C ATOM 1124 C GLY A 68 42.951 17.890 34.754 1.00 0.00 C ATOM 1125 O GLY A 68 43.458 17.715 35.860 1.00 0.00 O ATOM 0 H GLY A 68 40.872 17.181 33.219 1.00 0.00 H new ATOM 0 HA2 GLY A 68 42.532 15.851 34.342 1.00 0.00 H new ATOM 0 HA3 GLY A 68 43.752 16.563 33.305 1.00 0.00 H new ATOM 1129 N GLN A 69 42.505 19.100 34.371 1.00 0.00 N ATOM 1130 CA GLN A 69 42.412 20.225 35.248 1.00 0.00 C ATOM 1131 C GLN A 69 40.991 20.446 35.638 1.00 0.00 C ATOM 1132 O GLN A 69 40.170 20.899 34.843 1.00 0.00 O ATOM 1133 CB GLN A 69 42.943 21.520 34.608 1.00 0.00 C ATOM 1134 CG GLN A 69 44.419 21.468 34.210 1.00 0.00 C ATOM 1135 CD GLN A 69 44.891 22.860 33.813 1.00 0.00 C ATOM 1136 OE1 GLN A 69 44.983 23.751 34.655 1.00 0.00 O ATOM 1137 NE2 GLN A 69 45.185 23.071 32.501 1.00 0.00 N ATOM 0 H GLN A 69 42.199 19.302 33.419 1.00 0.00 H new ATOM 0 HA GLN A 69 43.028 19.995 36.118 1.00 0.00 H new ATOM 0 HB2 GLN A 69 42.348 21.744 33.723 1.00 0.00 H new ATOM 0 HB3 GLN A 69 42.796 22.343 35.307 1.00 0.00 H new ATOM 0 HG2 GLN A 69 45.017 21.094 35.041 1.00 0.00 H new ATOM 0 HG3 GLN A 69 44.558 20.775 33.380 1.00 0.00 H new ATOM 0 HE21 GLN A 69 45.097 22.308 31.830 1.00 0.00 H new ATOM 0 HE22 GLN A 69 45.493 23.992 32.189 1.00 0.00 H new ATOM 1146 N GLU A 70 40.623 20.163 36.901 1.00 0.00 N ATOM 1147 CA GLU A 70 39.325 20.444 37.430 1.00 0.00 C ATOM 1148 C GLU A 70 39.183 21.866 37.849 1.00 0.00 C ATOM 1149 O GLU A 70 38.085 22.420 37.866 1.00 0.00 O ATOM 1150 CB GLU A 70 38.966 19.539 38.621 1.00 0.00 C ATOM 1151 CG GLU A 70 39.933 19.540 39.806 1.00 0.00 C ATOM 1152 CD GLU A 70 39.494 18.552 40.877 1.00 0.00 C ATOM 1153 OE1 GLU A 70 39.126 17.396 40.534 1.00 0.00 O ATOM 1154 OE2 GLU A 70 39.520 18.916 42.082 1.00 0.00 O ATOM 0 H GLU A 70 41.250 19.724 37.576 1.00 0.00 H new ATOM 0 HA GLU A 70 38.634 20.241 36.612 1.00 0.00 H new ATOM 0 HB2 GLU A 70 37.982 19.833 38.986 1.00 0.00 H new ATOM 0 HB3 GLU A 70 38.878 18.516 38.255 1.00 0.00 H new ATOM 0 HG2 GLU A 70 40.935 19.285 39.461 1.00 0.00 H new ATOM 0 HG3 GLU A 70 39.988 20.542 40.232 1.00 0.00 H new ATOM 1161 N ASP A 71 40.324 22.508 38.159 1.00 0.00 N ATOM 1162 CA ASP A 71 40.506 23.870 38.554 1.00 0.00 C ATOM 1163 C ASP A 71 39.846 24.837 37.632 1.00 0.00 C ATOM 1164 O ASP A 71 39.054 25.686 38.041 1.00 0.00 O ATOM 1165 CB ASP A 71 42.026 24.076 38.667 1.00 0.00 C ATOM 1166 CG ASP A 71 42.423 25.473 39.121 1.00 0.00 C ATOM 1167 OD1 ASP A 71 41.822 26.028 40.080 1.00 0.00 O ATOM 1168 OD2 ASP A 71 43.360 26.049 38.506 1.00 0.00 O ATOM 0 H ASP A 71 41.216 22.014 38.128 1.00 0.00 H new ATOM 0 HA ASP A 71 40.020 24.067 39.509 1.00 0.00 H new ATOM 0 HB2 ASP A 71 42.431 23.347 39.369 1.00 0.00 H new ATOM 0 HB3 ASP A 71 42.484 23.875 37.698 1.00 0.00 H new ATOM 1173 N LEU A 72 40.089 24.710 36.316 1.00 0.00 N ATOM 1174 CA LEU A 72 39.549 25.599 35.334 1.00 0.00 C ATOM 1175 C LEU A 72 38.068 25.533 35.181 1.00 0.00 C ATOM 1176 O LEU A 72 37.402 26.549 34.987 1.00 0.00 O ATOM 1177 CB LEU A 72 40.267 25.358 33.996 1.00 0.00 C ATOM 1178 CG LEU A 72 41.800 25.464 34.072 1.00 0.00 C ATOM 1179 CD1 LEU A 72 42.416 25.252 32.679 1.00 0.00 C ATOM 1180 CD2 LEU A 72 42.305 26.783 34.680 1.00 0.00 C ATOM 0 H LEU A 72 40.675 23.972 35.924 1.00 0.00 H new ATOM 0 HA LEU A 72 39.733 26.614 35.687 1.00 0.00 H new ATOM 0 HB2 LEU A 72 40.001 24.367 33.628 1.00 0.00 H new ATOM 0 HB3 LEU A 72 39.900 26.079 33.265 1.00 0.00 H new ATOM 0 HG LEU A 72 42.124 24.675 34.751 1.00 0.00 H new ATOM 0 HD11 LEU A 72 43.501 25.329 32.745 1.00 0.00 H new ATOM 0 HD12 LEU A 72 42.145 24.264 32.308 1.00 0.00 H new ATOM 0 HD13 LEU A 72 42.039 26.013 31.995 1.00 0.00 H new ATOM 0 HD21 LEU A 72 43.395 26.781 34.699 1.00 0.00 H new ATOM 0 HD22 LEU A 72 41.954 27.620 34.076 1.00 0.00 H new ATOM 0 HD23 LEU A 72 41.925 26.884 35.696 1.00 0.00 H new ATOM 1192 N LEU A 73 37.434 24.355 35.324 1.00 0.00 N ATOM 1193 CA LEU A 73 36.014 24.219 35.221 1.00 0.00 C ATOM 1194 C LEU A 73 35.320 24.623 36.476 1.00 0.00 C ATOM 1195 O LEU A 73 34.137 24.957 36.492 1.00 0.00 O ATOM 1196 CB LEU A 73 35.598 22.776 34.888 1.00 0.00 C ATOM 1197 CG LEU A 73 35.910 22.283 33.465 1.00 0.00 C ATOM 1198 CD1 LEU A 73 35.353 23.188 32.353 1.00 0.00 C ATOM 1199 CD2 LEU A 73 37.414 22.015 33.277 1.00 0.00 C ATOM 0 H LEU A 73 37.919 23.478 35.515 1.00 0.00 H new ATOM 0 HA LEU A 73 35.716 24.883 34.410 1.00 0.00 H new ATOM 0 HB2 LEU A 73 36.088 22.108 35.596 1.00 0.00 H new ATOM 0 HB3 LEU A 73 34.525 22.684 35.053 1.00 0.00 H new ATOM 0 HG LEU A 73 35.379 21.337 33.362 1.00 0.00 H new ATOM 0 HD11 LEU A 73 35.615 22.772 31.380 1.00 0.00 H new ATOM 0 HD12 LEU A 73 34.268 23.248 32.442 1.00 0.00 H new ATOM 0 HD13 LEU A 73 35.780 24.186 32.448 1.00 0.00 H new ATOM 0 HD21 LEU A 73 37.597 21.668 32.260 1.00 0.00 H new ATOM 0 HD22 LEU A 73 37.972 22.935 33.453 1.00 0.00 H new ATOM 0 HD23 LEU A 73 37.739 21.252 33.985 1.00 0.00 H new ATOM 1211 N SER A 74 36.052 24.632 37.605 1.00 0.00 N ATOM 1212 CA SER A 74 35.570 25.011 38.897 1.00 0.00 C ATOM 1213 C SER A 74 35.199 26.452 38.968 1.00 0.00 C ATOM 1214 O SER A 74 34.109 26.818 39.403 1.00 0.00 O ATOM 1215 CB SER A 74 36.488 24.637 40.073 1.00 0.00 C ATOM 1216 OG SER A 74 37.626 25.471 40.235 1.00 0.00 O ATOM 0 H SER A 74 37.035 24.359 37.616 1.00 0.00 H new ATOM 0 HA SER A 74 34.670 24.408 39.017 1.00 0.00 H new ATOM 0 HB2 SER A 74 35.904 24.663 40.993 1.00 0.00 H new ATOM 0 HB3 SER A 74 36.826 23.609 39.938 1.00 0.00 H new ATOM 0 HG SER A 74 38.272 25.285 39.522 1.00 0.00 H new ATOM 1222 N GLU A 75 36.092 27.322 38.462 1.00 0.00 N ATOM 1223 CA GLU A 75 35.914 28.738 38.370 1.00 0.00 C ATOM 1224 C GLU A 75 34.960 29.125 37.293 1.00 0.00 C ATOM 1225 O GLU A 75 34.358 30.197 37.327 1.00 0.00 O ATOM 1226 CB GLU A 75 37.269 29.445 38.194 1.00 0.00 C ATOM 1227 CG GLU A 75 38.165 29.243 39.416 1.00 0.00 C ATOM 1228 CD GLU A 75 39.511 29.946 39.320 1.00 0.00 C ATOM 1229 OE1 GLU A 75 39.736 30.734 38.362 1.00 0.00 O ATOM 1230 OE2 GLU A 75 40.380 29.698 40.198 1.00 0.00 O ATOM 0 H GLU A 75 36.993 27.017 38.095 1.00 0.00 H new ATOM 0 HA GLU A 75 35.470 29.067 39.310 1.00 0.00 H new ATOM 0 HB2 GLU A 75 37.770 29.060 37.306 1.00 0.00 H new ATOM 0 HB3 GLU A 75 37.107 30.511 38.032 1.00 0.00 H new ATOM 0 HG2 GLU A 75 37.641 29.603 40.301 1.00 0.00 H new ATOM 0 HG3 GLU A 75 38.334 28.175 39.558 1.00 0.00 H new ATOM 1237 N PHE A 76 34.701 28.228 36.325 1.00 0.00 N ATOM 1238 CA PHE A 76 33.651 28.377 35.366 1.00 0.00 C ATOM 1239 C PHE A 76 32.309 28.337 36.011 1.00 0.00 C ATOM 1240 O PHE A 76 31.340 28.973 35.597 1.00 0.00 O ATOM 1241 CB PHE A 76 33.781 27.221 34.361 1.00 0.00 C ATOM 1242 CG PHE A 76 33.468 27.454 32.924 1.00 0.00 C ATOM 1243 CD1 PHE A 76 33.102 28.649 32.350 1.00 0.00 C ATOM 1244 CD2 PHE A 76 33.632 26.358 32.110 1.00 0.00 C ATOM 1245 CE1 PHE A 76 32.912 28.734 30.991 1.00 0.00 C ATOM 1246 CE2 PHE A 76 33.432 26.429 30.751 1.00 0.00 C ATOM 1247 CZ PHE A 76 33.055 27.627 30.190 1.00 0.00 C ATOM 0 H PHE A 76 35.240 27.371 36.206 1.00 0.00 H new ATOM 0 HA PHE A 76 33.741 29.345 34.873 1.00 0.00 H new ATOM 0 HB2 PHE A 76 34.806 26.856 34.416 1.00 0.00 H new ATOM 0 HB3 PHE A 76 33.136 26.414 34.708 1.00 0.00 H new ATOM 0 HD1 PHE A 76 32.963 29.523 32.969 1.00 0.00 H new ATOM 0 HD2 PHE A 76 33.926 25.416 32.549 1.00 0.00 H new ATOM 0 HE1 PHE A 76 32.647 29.683 30.548 1.00 0.00 H new ATOM 0 HE2 PHE A 76 33.569 25.555 30.132 1.00 0.00 H new ATOM 0 HZ PHE A 76 32.873 27.697 29.128 1.00 0.00 H new ATOM 1257 N GLY A 77 32.229 27.599 37.132 1.00 0.00 N ATOM 1258 CA GLY A 77 31.082 27.334 37.944 1.00 0.00 C ATOM 1259 C GLY A 77 30.503 28.498 38.674 1.00 0.00 C ATOM 1260 O GLY A 77 29.371 28.428 39.150 1.00 0.00 O ATOM 0 H GLY A 77 33.059 27.140 37.507 1.00 0.00 H new ATOM 0 HA2 GLY A 77 30.305 26.908 37.309 1.00 0.00 H new ATOM 0 HA3 GLY A 77 31.350 26.571 38.675 1.00 0.00 H new ATOM 1264 N GLN A 78 31.251 29.606 38.825 1.00 0.00 N ATOM 1265 CA GLN A 78 30.882 30.721 39.641 1.00 0.00 C ATOM 1266 C GLN A 78 29.665 31.447 39.185 1.00 0.00 C ATOM 1267 O GLN A 78 28.937 32.048 39.975 1.00 0.00 O ATOM 1268 CB GLN A 78 32.095 31.660 39.752 1.00 0.00 C ATOM 1269 CG GLN A 78 32.505 32.428 38.493 1.00 0.00 C ATOM 1270 CD GLN A 78 33.899 33.020 38.640 1.00 0.00 C ATOM 1271 OE1 GLN A 78 34.520 33.026 39.702 1.00 0.00 O ATOM 1272 NE2 GLN A 78 34.433 33.554 37.509 1.00 0.00 N ATOM 0 H GLN A 78 32.150 29.730 38.359 1.00 0.00 H new ATOM 0 HA GLN A 78 30.603 30.333 40.621 1.00 0.00 H new ATOM 0 HB2 GLN A 78 31.889 32.386 40.538 1.00 0.00 H new ATOM 0 HB3 GLN A 78 32.950 31.069 40.080 1.00 0.00 H new ATOM 0 HG2 GLN A 78 32.479 31.760 37.632 1.00 0.00 H new ATOM 0 HG3 GLN A 78 31.787 33.225 38.300 1.00 0.00 H new ATOM 0 HE21 GLN A 78 33.902 33.539 36.638 1.00 0.00 H new ATOM 0 HE22 GLN A 78 35.364 33.969 37.532 1.00 0.00 H new ATOM 1466 N ASN B 201 27.959 35.961 33.667 1.00 0.00 N ATOM 1467 CA ASN B 201 27.741 34.883 32.751 1.00 0.00 C ATOM 1468 C ASN B 201 28.752 34.824 31.658 1.00 0.00 C ATOM 1469 O ASN B 201 29.607 35.698 31.528 1.00 0.00 O ATOM 1470 CB ASN B 201 26.297 34.878 32.224 1.00 0.00 C ATOM 1471 CG ASN B 201 25.953 36.065 31.335 1.00 0.00 C ATOM 1472 OD1 ASN B 201 26.143 37.224 31.701 1.00 0.00 O ATOM 1473 ND2 ASN B 201 25.416 35.773 30.120 1.00 0.00 N ATOM 0 HA ASN B 201 27.882 33.962 33.317 1.00 0.00 H new ATOM 0 HB2 ASN B 201 26.130 33.958 31.664 1.00 0.00 H new ATOM 0 HB3 ASN B 201 25.613 34.863 33.072 1.00 0.00 H new ATOM 0 HD21 ASN B 201 25.158 36.526 29.482 1.00 0.00 H new ATOM 0 HD22 ASN B 201 25.271 34.801 29.847 1.00 0.00 H new ATOM 1480 N ILE B 202 28.707 33.780 30.810 1.00 0.00 N ATOM 1481 CA ILE B 202 29.712 33.457 29.846 1.00 0.00 C ATOM 1482 C ILE B 202 30.079 34.528 28.877 1.00 0.00 C ATOM 1483 O ILE B 202 31.209 34.583 28.394 1.00 0.00 O ATOM 1484 CB ILE B 202 29.454 32.109 29.241 1.00 0.00 C ATOM 1485 CG1 ILE B 202 30.128 31.086 30.170 1.00 0.00 C ATOM 1486 CG2 ILE B 202 29.891 31.981 27.771 1.00 0.00 C ATOM 1487 CD1 ILE B 202 30.009 29.623 29.744 1.00 0.00 C ATOM 0 H ILE B 202 27.925 33.125 30.797 1.00 0.00 H new ATOM 0 HA ILE B 202 30.644 33.389 30.408 1.00 0.00 H new ATOM 0 HB ILE B 202 28.381 31.929 29.178 1.00 0.00 H new ATOM 0 HG12 ILE B 202 31.186 31.337 30.250 1.00 0.00 H new ATOM 0 HG13 ILE B 202 29.700 31.191 31.167 1.00 0.00 H new ATOM 0 HG21 ILE B 202 29.669 30.976 27.412 1.00 0.00 H new ATOM 0 HG22 ILE B 202 29.352 32.710 27.166 1.00 0.00 H new ATOM 0 HG23 ILE B 202 30.962 32.166 27.693 1.00 0.00 H new ATOM 0 HD11 ILE B 202 30.519 28.990 30.470 1.00 0.00 H new ATOM 0 HD12 ILE B 202 28.957 29.343 29.695 1.00 0.00 H new ATOM 0 HD13 ILE B 202 30.466 29.491 28.763 1.00 0.00 H new ATOM 1499 N GLN B 203 29.183 35.496 28.612 1.00 0.00 N ATOM 1500 CA GLN B 203 29.455 36.672 27.845 1.00 0.00 C ATOM 1501 C GLN B 203 30.636 37.480 28.257 1.00 0.00 C ATOM 1502 O GLN B 203 31.335 38.057 27.425 1.00 0.00 O ATOM 1503 CB GLN B 203 28.190 37.537 27.714 1.00 0.00 C ATOM 1504 CG GLN B 203 27.707 38.264 28.971 1.00 0.00 C ATOM 1505 CD GLN B 203 28.235 39.686 29.095 1.00 0.00 C ATOM 1506 OE1 GLN B 203 28.771 40.289 28.167 1.00 0.00 O ATOM 1507 NE2 GLN B 203 28.036 40.287 30.299 1.00 0.00 N ATOM 0 H GLN B 203 28.221 35.456 28.950 1.00 0.00 H new ATOM 0 HA GLN B 203 29.750 36.292 26.867 1.00 0.00 H new ATOM 0 HB2 GLN B 203 28.370 38.283 26.940 1.00 0.00 H new ATOM 0 HB3 GLN B 203 27.380 36.899 27.360 1.00 0.00 H new ATOM 0 HG2 GLN B 203 26.617 38.289 28.970 1.00 0.00 H new ATOM 0 HG3 GLN B 203 28.012 37.695 29.849 1.00 0.00 H new ATOM 0 HE21 GLN B 203 27.590 39.772 31.058 1.00 0.00 H new ATOM 0 HE22 GLN B 203 28.333 41.252 30.442 1.00 0.00 H new ATOM 1516 N MET B 204 30.955 37.480 29.563 1.00 0.00 N ATOM 1517 CA MET B 204 32.117 38.079 30.144 1.00 0.00 C ATOM 1518 C MET B 204 33.412 37.510 29.677 1.00 0.00 C ATOM 1519 O MET B 204 34.434 38.196 29.665 1.00 0.00 O ATOM 1520 CB MET B 204 32.092 37.933 31.675 1.00 0.00 C ATOM 1521 CG MET B 204 30.971 38.716 32.360 1.00 0.00 C ATOM 1522 SD MET B 204 31.263 40.506 32.500 1.00 0.00 S ATOM 1523 CE MET B 204 32.318 40.420 33.977 1.00 0.00 C ATOM 0 H MET B 204 30.361 37.031 30.260 1.00 0.00 H new ATOM 0 HA MET B 204 32.070 39.120 29.824 1.00 0.00 H new ATOM 0 HB2 MET B 204 31.989 36.877 31.927 1.00 0.00 H new ATOM 0 HB3 MET B 204 33.050 38.265 32.076 1.00 0.00 H new ATOM 0 HG2 MET B 204 30.045 38.556 31.807 1.00 0.00 H new ATOM 0 HG3 MET B 204 30.820 38.308 33.359 1.00 0.00 H new ATOM 0 HE1 MET B 204 32.528 41.428 34.334 1.00 0.00 H new ATOM 0 HE2 MET B 204 31.806 39.858 34.758 1.00 0.00 H new ATOM 0 HE3 MET B 204 33.255 39.922 33.727 1.00 0.00 H new ATOM 1533 N LEU B 205 33.462 36.231 29.264 1.00 0.00 N ATOM 1534 CA LEU B 205 34.692 35.573 28.949 1.00 0.00 C ATOM 1535 C LEU B 205 35.345 36.026 27.690 1.00 0.00 C ATOM 1536 O LEU B 205 36.567 36.131 27.599 1.00 0.00 O ATOM 1537 CB LEU B 205 34.568 34.041 28.983 1.00 0.00 C ATOM 1538 CG LEU B 205 34.462 33.469 30.408 1.00 0.00 C ATOM 1539 CD1 LEU B 205 34.118 31.970 30.379 1.00 0.00 C ATOM 1540 CD2 LEU B 205 35.763 33.695 31.196 1.00 0.00 C ATOM 0 H LEU B 205 32.636 35.644 29.147 1.00 0.00 H new ATOM 0 HA LEU B 205 35.361 35.882 29.752 1.00 0.00 H new ATOM 0 HB2 LEU B 205 33.688 33.742 28.413 1.00 0.00 H new ATOM 0 HB3 LEU B 205 35.434 33.602 28.487 1.00 0.00 H new ATOM 0 HG LEU B 205 33.655 34.001 30.912 1.00 0.00 H new ATOM 0 HD11 LEU B 205 34.050 31.593 31.399 1.00 0.00 H new ATOM 0 HD12 LEU B 205 33.163 31.826 29.874 1.00 0.00 H new ATOM 0 HD13 LEU B 205 34.897 31.428 29.843 1.00 0.00 H new ATOM 0 HD21 LEU B 205 35.658 33.280 32.199 1.00 0.00 H new ATOM 0 HD22 LEU B 205 36.589 33.201 30.684 1.00 0.00 H new ATOM 0 HD23 LEU B 205 35.966 34.764 31.265 1.00 0.00 H new ATOM 1552 N LEU B 206 34.530 36.391 26.683 1.00 0.00 N ATOM 1553 CA LEU B 206 34.974 36.906 25.425 1.00 0.00 C ATOM 1554 C LEU B 206 35.446 38.309 25.589 1.00 0.00 C ATOM 1555 O LEU B 206 36.334 38.782 24.881 1.00 0.00 O ATOM 1556 CB LEU B 206 33.804 36.764 24.437 1.00 0.00 C ATOM 1557 CG LEU B 206 33.275 35.333 24.241 1.00 0.00 C ATOM 1558 CD1 LEU B 206 34.398 34.344 23.885 1.00 0.00 C ATOM 1559 CD2 LEU B 206 32.428 34.751 25.386 1.00 0.00 C ATOM 0 H LEU B 206 33.514 36.324 26.750 1.00 0.00 H new ATOM 0 HA LEU B 206 35.827 36.352 25.032 1.00 0.00 H new ATOM 0 HB2 LEU B 206 32.983 37.393 24.780 1.00 0.00 H new ATOM 0 HB3 LEU B 206 34.119 37.152 23.469 1.00 0.00 H new ATOM 0 HG LEU B 206 32.589 35.452 23.402 1.00 0.00 H new ATOM 0 HD11 LEU B 206 33.977 33.347 23.756 1.00 0.00 H new ATOM 0 HD12 LEU B 206 34.879 34.658 22.958 1.00 0.00 H new ATOM 0 HD13 LEU B 206 35.135 34.326 24.688 1.00 0.00 H new ATOM 0 HD21 LEU B 206 32.115 33.739 25.129 1.00 0.00 H new ATOM 0 HD22 LEU B 206 33.020 34.726 26.301 1.00 0.00 H new ATOM 0 HD23 LEU B 206 31.548 35.375 25.541 1.00 0.00 H new ATOM 1571 N GLU B 207 34.939 39.008 26.620 1.00 0.00 N ATOM 1572 CA GLU B 207 35.343 40.342 26.941 1.00 0.00 C ATOM 1573 C GLU B 207 36.673 40.335 27.611 1.00 0.00 C ATOM 1574 O GLU B 207 37.573 41.085 27.236 1.00 0.00 O ATOM 1575 CB GLU B 207 34.351 41.047 27.881 1.00 0.00 C ATOM 1576 CG GLU B 207 32.995 41.387 27.258 1.00 0.00 C ATOM 1577 CD GLU B 207 33.029 42.611 26.355 1.00 0.00 C ATOM 1578 OE1 GLU B 207 34.120 43.171 26.064 1.00 0.00 O ATOM 1579 OE2 GLU B 207 31.922 43.045 25.934 1.00 0.00 O ATOM 0 H GLU B 207 34.228 38.635 27.249 1.00 0.00 H new ATOM 0 HA GLU B 207 35.382 40.883 25.996 1.00 0.00 H new ATOM 0 HB2 GLU B 207 34.185 40.412 28.751 1.00 0.00 H new ATOM 0 HB3 GLU B 207 34.809 41.968 28.242 1.00 0.00 H new ATOM 0 HG2 GLU B 207 32.644 40.531 26.682 1.00 0.00 H new ATOM 0 HG3 GLU B 207 32.270 41.554 28.055 1.00 0.00 H new ATOM 1586 N ALA B 208 36.840 39.450 28.609 1.00 0.00 N ATOM 1587 CA ALA B 208 38.068 39.199 29.299 1.00 0.00 C ATOM 1588 C ALA B 208 39.166 38.750 28.397 1.00 0.00 C ATOM 1589 O ALA B 208 40.286 39.253 28.483 1.00 0.00 O ATOM 1590 CB ALA B 208 37.820 38.168 30.413 1.00 0.00 C ATOM 0 H ALA B 208 36.072 38.875 28.955 1.00 0.00 H new ATOM 0 HA ALA B 208 38.403 40.143 29.729 1.00 0.00 H new ATOM 0 HB1 ALA B 208 38.753 37.973 30.942 1.00 0.00 H new ATOM 0 HB2 ALA B 208 37.081 38.559 31.112 1.00 0.00 H new ATOM 0 HB3 ALA B 208 37.451 37.241 29.975 1.00 0.00 H new ATOM 1596 N ALA B 209 38.875 37.833 27.458 1.00 0.00 N ATOM 1597 CA ALA B 209 39.785 37.369 26.455 1.00 0.00 C ATOM 1598 C ALA B 209 40.315 38.428 25.552 1.00 0.00 C ATOM 1599 O ALA B 209 41.528 38.574 25.408 1.00 0.00 O ATOM 1600 CB ALA B 209 39.113 36.270 25.616 1.00 0.00 C ATOM 0 H ALA B 209 37.958 37.392 27.394 1.00 0.00 H new ATOM 0 HA ALA B 209 40.648 36.984 26.998 1.00 0.00 H new ATOM 0 HB1 ALA B 209 39.808 35.919 24.853 1.00 0.00 H new ATOM 0 HB2 ALA B 209 38.833 35.438 26.263 1.00 0.00 H new ATOM 0 HB3 ALA B 209 38.221 36.673 25.136 1.00 0.00 H new ATOM 1606 N ASP B 210 39.454 39.247 24.924 1.00 0.00 N ATOM 1607 CA ASP B 210 39.887 40.271 24.024 1.00 0.00 C ATOM 1608 C ASP B 210 40.526 41.440 24.691 1.00 0.00 C ATOM 1609 O ASP B 210 41.325 42.148 24.079 1.00 0.00 O ATOM 1610 CB ASP B 210 38.741 40.703 23.094 1.00 0.00 C ATOM 1611 CG ASP B 210 38.635 39.746 21.914 1.00 0.00 C ATOM 1612 OD1 ASP B 210 39.655 39.570 21.197 1.00 0.00 O ATOM 1613 OD2 ASP B 210 37.531 39.192 21.664 1.00 0.00 O ATOM 0 H ASP B 210 38.442 39.198 25.042 1.00 0.00 H new ATOM 0 HA ASP B 210 40.678 39.824 23.421 1.00 0.00 H new ATOM 0 HB2 ASP B 210 37.801 40.718 23.645 1.00 0.00 H new ATOM 0 HB3 ASP B 210 38.916 41.717 22.735 1.00 0.00 H new ATOM 1618 N TYR B 211 40.269 41.655 25.993 1.00 0.00 N ATOM 1619 CA TYR B 211 40.992 42.528 26.865 1.00 0.00 C ATOM 1620 C TYR B 211 42.386 42.054 27.091 1.00 0.00 C ATOM 1621 O TYR B 211 43.350 42.801 26.931 1.00 0.00 O ATOM 1622 CB TYR B 211 40.185 42.686 28.165 1.00 0.00 C ATOM 1623 CG TYR B 211 40.918 43.221 29.348 1.00 0.00 C ATOM 1624 CD1 TYR B 211 41.039 44.570 29.583 1.00 0.00 C ATOM 1625 CD2 TYR B 211 41.483 42.335 30.234 1.00 0.00 C ATOM 1626 CE1 TYR B 211 41.740 45.028 30.673 1.00 0.00 C ATOM 1627 CE2 TYR B 211 42.174 42.785 31.334 1.00 0.00 C ATOM 1628 CZ TYR B 211 42.316 44.136 31.547 1.00 0.00 C ATOM 1629 OH TYR B 211 43.030 44.598 32.674 1.00 0.00 O ATOM 0 H TYR B 211 39.500 41.184 26.470 1.00 0.00 H new ATOM 0 HA TYR B 211 41.104 43.510 26.405 1.00 0.00 H new ATOM 0 HB2 TYR B 211 39.340 43.344 27.963 1.00 0.00 H new ATOM 0 HB3 TYR B 211 39.775 41.712 28.431 1.00 0.00 H new ATOM 0 HD1 TYR B 211 40.580 45.275 28.906 1.00 0.00 H new ATOM 0 HD2 TYR B 211 41.383 41.273 30.064 1.00 0.00 H new ATOM 0 HE1 TYR B 211 41.839 46.090 30.843 1.00 0.00 H new ATOM 0 HE2 TYR B 211 42.604 42.079 32.029 1.00 0.00 H new ATOM 0 HH TYR B 211 43.369 43.832 33.183 1.00 0.00 H new ATOM 1639 N LEU B 212 42.560 40.772 27.459 1.00 0.00 N ATOM 1640 CA LEU B 212 43.811 40.160 27.780 1.00 0.00 C ATOM 1641 C LEU B 212 44.735 39.983 26.624 1.00 0.00 C ATOM 1642 O LEU B 212 45.951 39.919 26.798 1.00 0.00 O ATOM 1643 CB LEU B 212 43.583 38.807 28.476 1.00 0.00 C ATOM 1644 CG LEU B 212 43.794 38.863 29.998 1.00 0.00 C ATOM 1645 CD1 LEU B 212 43.226 37.576 30.620 1.00 0.00 C ATOM 1646 CD2 LEU B 212 45.268 39.035 30.398 1.00 0.00 C ATOM 0 H LEU B 212 41.777 40.123 27.537 1.00 0.00 H new ATOM 0 HA LEU B 212 44.307 40.860 28.453 1.00 0.00 H new ATOM 0 HB2 LEU B 212 42.569 38.466 28.269 1.00 0.00 H new ATOM 0 HB3 LEU B 212 44.261 38.068 28.049 1.00 0.00 H new ATOM 0 HG LEU B 212 43.271 39.743 30.374 1.00 0.00 H new ATOM 0 HD11 LEU B 212 43.368 37.601 31.700 1.00 0.00 H new ATOM 0 HD12 LEU B 212 42.162 37.502 30.396 1.00 0.00 H new ATOM 0 HD13 LEU B 212 43.745 36.712 30.205 1.00 0.00 H new ATOM 0 HD21 LEU B 212 45.349 39.067 31.485 1.00 0.00 H new ATOM 0 HD22 LEU B 212 45.849 38.196 30.016 1.00 0.00 H new ATOM 0 HD23 LEU B 212 45.653 39.964 29.978 1.00 0.00 H new ATOM 1658 N GLU B 213 44.190 39.935 25.396 1.00 0.00 N ATOM 1659 CA GLU B 213 44.910 39.995 24.161 1.00 0.00 C ATOM 1660 C GLU B 213 45.713 41.242 24.014 1.00 0.00 C ATOM 1661 O GLU B 213 46.898 41.208 23.687 1.00 0.00 O ATOM 1662 CB GLU B 213 43.956 39.871 22.962 1.00 0.00 C ATOM 1663 CG GLU B 213 43.497 38.443 22.663 1.00 0.00 C ATOM 1664 CD GLU B 213 44.543 37.636 21.907 1.00 0.00 C ATOM 1665 OE1 GLU B 213 45.692 37.492 22.403 1.00 0.00 O ATOM 1666 OE2 GLU B 213 44.225 37.135 20.795 1.00 0.00 O ATOM 0 H GLU B 213 43.183 39.849 25.257 1.00 0.00 H new ATOM 0 HA GLU B 213 45.601 39.152 24.179 1.00 0.00 H new ATOM 0 HB2 GLU B 213 43.078 40.490 23.146 1.00 0.00 H new ATOM 0 HB3 GLU B 213 44.450 40.273 22.078 1.00 0.00 H new ATOM 0 HG2 GLU B 213 43.261 37.938 23.600 1.00 0.00 H new ATOM 0 HG3 GLU B 213 42.577 38.476 22.079 1.00 0.00 H new ATOM 1673 N ARG B 214 45.096 42.403 24.299 1.00 0.00 N ATOM 1674 CA ARG B 214 45.736 43.681 24.255 1.00 0.00 C ATOM 1675 C ARG B 214 46.682 43.869 25.390 1.00 0.00 C ATOM 1676 O ARG B 214 47.784 44.386 25.218 1.00 0.00 O ATOM 1677 CB ARG B 214 44.670 44.789 24.250 1.00 0.00 C ATOM 1678 CG ARG B 214 45.229 46.153 24.659 1.00 0.00 C ATOM 1679 CD ARG B 214 44.275 47.330 24.447 1.00 0.00 C ATOM 1680 NE ARG B 214 44.956 48.517 25.036 1.00 0.00 N ATOM 1681 CZ ARG B 214 44.354 49.738 25.138 1.00 0.00 C ATOM 1682 NH1 ARG B 214 43.098 49.965 24.654 1.00 0.00 N ATOM 1683 NH2 ARG B 214 45.052 50.745 25.741 1.00 0.00 N ATOM 0 H ARG B 214 44.114 42.453 24.570 1.00 0.00 H new ATOM 0 HA ARG B 214 46.323 43.735 23.338 1.00 0.00 H new ATOM 0 HB2 ARG B 214 44.235 44.864 23.253 1.00 0.00 H new ATOM 0 HB3 ARG B 214 43.863 44.514 24.930 1.00 0.00 H new ATOM 0 HG2 ARG B 214 45.507 46.115 25.712 1.00 0.00 H new ATOM 0 HG3 ARG B 214 46.143 46.339 24.095 1.00 0.00 H new ATOM 0 HD2 ARG B 214 44.072 47.482 23.387 1.00 0.00 H new ATOM 0 HD3 ARG B 214 43.316 47.148 24.933 1.00 0.00 H new ATOM 0 HE ARG B 214 45.912 48.413 25.377 1.00 0.00 H new ATOM 0 HH11 ARG B 214 42.582 49.211 24.201 1.00 0.00 H new ATOM 0 HH12 ARG B 214 42.675 50.889 24.746 1.00 0.00 H new ATOM 0 HH21 ARG B 214 45.992 50.572 26.098 1.00 0.00 H new ATOM 0 HH22 ARG B 214 44.634 51.670 25.835 1.00 0.00 H new ATOM 1697 N ARG B 215 46.311 43.445 26.612 1.00 0.00 N ATOM 1698 CA ARG B 215 47.088 43.625 27.799 1.00 0.00 C ATOM 1699 C ARG B 215 48.488 43.120 27.721 1.00 0.00 C ATOM 1700 O ARG B 215 49.435 43.741 28.201 1.00 0.00 O ATOM 1701 CB ARG B 215 46.359 42.960 28.978 1.00 0.00 C ATOM 1702 CG ARG B 215 46.438 43.782 30.267 1.00 0.00 C ATOM 1703 CD ARG B 215 45.907 43.048 31.500 1.00 0.00 C ATOM 1704 NE ARG B 215 47.008 42.205 32.046 1.00 0.00 N ATOM 1705 CZ ARG B 215 47.898 42.636 32.986 1.00 0.00 C ATOM 1706 NH1 ARG B 215 47.921 43.913 33.467 1.00 0.00 N ATOM 1707 NH2 ARG B 215 48.784 41.724 33.481 1.00 0.00 N ATOM 0 H ARG B 215 45.432 42.956 26.779 1.00 0.00 H new ATOM 0 HA ARG B 215 47.182 44.702 27.938 1.00 0.00 H new ATOM 0 HB2 ARG B 215 45.313 42.809 28.713 1.00 0.00 H new ATOM 0 HB3 ARG B 215 46.789 41.974 29.155 1.00 0.00 H new ATOM 0 HG2 ARG B 215 47.476 44.066 30.443 1.00 0.00 H new ATOM 0 HG3 ARG B 215 45.874 44.705 30.134 1.00 0.00 H new ATOM 0 HD2 ARG B 215 45.566 43.761 32.250 1.00 0.00 H new ATOM 0 HD3 ARG B 215 45.049 42.430 31.235 1.00 0.00 H new ATOM 0 HE ARG B 215 47.102 41.251 31.697 1.00 0.00 H new ATOM 0 HH11 ARG B 215 47.250 44.600 33.123 1.00 0.00 H new ATOM 0 HH12 ARG B 215 48.609 44.181 34.170 1.00 0.00 H new ATOM 0 HH21 ARG B 215 48.764 40.761 33.147 1.00 0.00 H new ATOM 0 HH22 ARG B 215 49.466 42.006 34.185 1.00 0.00 H new