USER MOD reduce.3.24.130724 H: found=0, std=0, add=821, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 822 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 162 TYR OH : rot -60:sc= 0.00792 USER MOD Set 1.2: A 216 GLN : amide:sc= -2.9! K(o=-2.9!,f=-0.37) USER MOD Set 2.1: A 215 THR OG1 : rot -3:sc= 1.01 USER MOD Set 2.2: A 218 GLN : amide:sc= 0.469 K(o=1.5,f=-1.4!) USER MOD Set 3.1: A 212 MET CE :methyl -126:sc= -9.02! (180deg=-12.7!) USER MOD Set 3.2: A 219 GLN : amide:sc= -4.27! C(o=-13!,f=-18!) USER MOD Set 4.1: A 168 TYR OH : rot 178:sc= 0.927 USER MOD Set 4.2: A 173 ASN : amide:sc= -0.0533 K(o=0.87,f=-0.32!) USER MOD Set 5.1: A 159 GLN : amide:sc= -1.29 K(o=-1.3,f=-0.0023) USER MOD Set 5.2: A 161 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 152 ASN : amide:sc= -15.3! C(o=-26!,f=-36!) USER MOD Set 6.2: A 153 MET CE :methyl -171:sc= -11.1! (180deg=-10.5!) USER MOD Single : A 127 TYR OH : rot -150:sc= 1.29 USER MOD Single : A 128 MET CE :methyl -154:sc= -2.33 (180deg=-4.01!) USER MOD Single : A 131 SER OG : rot 56:sc= 0.0155 USER MOD Single : A 133 MET CE :methyl -120:sc= -8.89! (180deg=-11.3!) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 139 HIS : no HE2:sc= -1.36 K(o=-1.4,f=-4.3!) USER MOD Single : A 142 ASN : amide:sc= 0.825 K(o=0.83,f=-0.71) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot 179:sc= 1.25 USER MOD Single : A 149 TYR OH : rot 50:sc= -2.22! USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 TYR OH : rot -60:sc= 0.0296 USER MOD Single : A 158 ASN : amide:sc= -1.16 K(o=-1.2,f=-4.3!) USER MOD Single : A 167 GLN : amide:sc= -0.702 K(o=-0.7,f=-2.6!) USER MOD Single : A 169 SER OG : rot -36:sc= 0.549 USER MOD Single : A 170 ASN : amide:sc= -0.183 K(o=-0.18,f=-4.5!) USER MOD Single : A 171 GLN : amide:sc= -18.7! C(o=-19!,f=-12!) USER MOD Single : A 172 ASN : amide:sc= -2.1! K(o=-2.1!,f=-0.21) USER MOD Single : A 176 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 180 ASN : amide:sc= -0.293 X(o=-0.29,f=-0.6) USER MOD Single : A 182 THR OG1 : rot -88:sc= -4.36! USER MOD Single : A 184 LYS NZ :NH3+ 153:sc= -0.0651 (180deg=-0.41) USER MOD Single : A 185 GLN : amide:sc= -4.32! C(o=-4.3!,f=-4.2!) USER MOD Single : A 186 HIS : no HE2:sc= -4.3! C(o=-4.3!,f=-4.5!) USER MOD Single : A 187 THR OG1 : rot -179:sc= 1.4 USER MOD Single : A 189 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 THR OG1 : rot 61:sc= 1.21 USER MOD Single : A 191 THR OG1 : rot -150:sc= -0.329 USER MOD Single : A 192 THR OG1 : rot -24:sc= 0.283 USER MOD Single : A 193 LYS NZ :NH3+ -169:sc= 1.14 (180deg=0.799) USER MOD Single : A 196 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 198 THR OG1 : rot 180:sc= -0.0478 USER MOD Single : A 200 THR OG1 : rot 180:sc= 0 USER MOD Single : A 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -159:sc= -6.15! (180deg=-7!) USER MOD Single : A 211 GLN : amide:sc= -1.17! X(o=-1.2!,f=-0.84) USER MOD Single : A 217 TYR OH : rot 180:sc= 0 USER MOD Single : A 221 SER OG : rot -55:sc= 0.135 USER MOD Single : A 222 GLN : amide:sc= -2.97! C(o=-3!,f=-1.9!) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 GLN : amide:sc= -0.0349 K(o=-0.035,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 124 5.878 -10.497 2.861 1.00 1.95 N ATOM 2 CA LEU A 124 4.949 -11.513 3.392 1.00 1.27 C ATOM 3 C LEU A 124 5.724 -12.398 4.361 1.00 1.45 C ATOM 4 O LEU A 124 5.329 -12.579 5.514 1.00 2.10 O ATOM 5 CB LEU A 124 4.360 -12.331 2.236 1.00 1.02 C ATOM 6 CG LEU A 124 4.101 -11.541 0.942 1.00 1.01 C ATOM 7 CD1 LEU A 124 3.429 -12.413 -0.099 1.00 1.54 C ATOM 8 CD2 LEU A 124 3.256 -10.308 1.206 1.00 1.39 C ATOM 0 HA LEU A 124 4.118 -11.044 3.919 1.00 1.27 H new ATOM 0 HB2 LEU A 124 5.039 -13.154 2.011 1.00 1.02 H new ATOM 0 HB3 LEU A 124 3.421 -12.774 2.567 1.00 1.02 H new ATOM 0 HG LEU A 124 5.070 -11.219 0.560 1.00 1.01 H new ATOM 0 HD11 LEU A 124 3.257 -11.831 -1.005 1.00 1.54 H new ATOM 0 HD12 LEU A 124 4.071 -13.263 -0.331 1.00 1.54 H new ATOM 0 HD13 LEU A 124 2.476 -12.773 0.288 1.00 1.54 H new ATOM 0 HD21 LEU A 124 3.092 -9.773 0.271 1.00 1.39 H new ATOM 0 HD22 LEU A 124 2.296 -10.608 1.626 1.00 1.39 H new ATOM 0 HD23 LEU A 124 3.773 -9.657 1.911 1.00 1.39 H new ATOM 20 N GLY A 125 6.849 -12.912 3.883 1.00 1.53 N ATOM 21 CA GLY A 125 7.813 -13.555 4.747 1.00 1.74 C ATOM 22 C GLY A 125 9.157 -12.859 4.653 1.00 1.74 C ATOM 23 O GLY A 125 9.628 -12.260 5.621 1.00 2.56 O ATOM 0 H GLY A 125 7.111 -12.893 2.898 1.00 1.53 H new ATOM 0 HA2 GLY A 125 7.457 -13.535 5.777 1.00 1.74 H new ATOM 0 HA3 GLY A 125 7.919 -14.603 4.467 1.00 1.74 H new ATOM 27 N GLY A 126 9.757 -12.905 3.466 1.00 1.12 N ATOM 28 CA GLY A 126 11.001 -12.196 3.219 1.00 1.08 C ATOM 29 C GLY A 126 10.776 -10.885 2.488 1.00 0.96 C ATOM 30 O GLY A 126 11.528 -10.522 1.585 1.00 1.39 O ATOM 0 H GLY A 126 9.400 -13.425 2.665 1.00 1.12 H new ATOM 0 HA2 GLY A 126 11.501 -12.000 4.168 1.00 1.08 H new ATOM 0 HA3 GLY A 126 11.668 -12.828 2.632 1.00 1.08 H new ATOM 34 N TYR A 127 9.744 -10.166 2.903 1.00 0.57 N ATOM 35 CA TYR A 127 9.363 -8.903 2.287 1.00 0.44 C ATOM 36 C TYR A 127 9.067 -7.932 3.380 1.00 0.40 C ATOM 37 O TYR A 127 7.980 -7.944 3.958 1.00 0.60 O ATOM 38 CB TYR A 127 8.122 -9.023 1.399 1.00 0.46 C ATOM 39 CG TYR A 127 8.367 -9.371 -0.054 1.00 0.65 C ATOM 40 CD1 TYR A 127 9.367 -10.252 -0.444 1.00 1.09 C ATOM 41 CD2 TYR A 127 7.566 -8.816 -1.042 1.00 1.10 C ATOM 42 CE1 TYR A 127 9.563 -10.563 -1.777 1.00 1.30 C ATOM 43 CE2 TYR A 127 7.754 -9.123 -2.370 1.00 1.26 C ATOM 44 CZ TYR A 127 8.752 -9.996 -2.735 1.00 1.17 C ATOM 45 OH TYR A 127 8.937 -10.294 -4.063 1.00 1.41 O ATOM 0 H TYR A 127 9.144 -10.443 3.680 1.00 0.57 H new ATOM 0 HA TYR A 127 10.187 -8.578 1.652 1.00 0.44 H new ATOM 0 HB2 TYR A 127 7.468 -9.782 1.827 1.00 0.46 H new ATOM 0 HB3 TYR A 127 7.581 -8.077 1.438 1.00 0.46 H new ATOM 0 HD1 TYR A 127 10.002 -10.701 0.306 1.00 1.09 H new ATOM 0 HD2 TYR A 127 6.780 -8.130 -0.763 1.00 1.10 H new ATOM 0 HE1 TYR A 127 10.348 -11.247 -2.065 1.00 1.30 H new ATOM 0 HE2 TYR A 127 7.120 -8.680 -3.123 1.00 1.26 H new ATOM 0 HH TYR A 127 8.669 -9.527 -4.611 1.00 1.41 H new ATOM 55 N MET A 128 10.059 -7.138 3.670 1.00 0.42 N ATOM 56 CA MET A 128 9.994 -6.137 4.701 1.00 0.37 C ATOM 57 C MET A 128 8.671 -5.408 4.696 1.00 0.31 C ATOM 58 O MET A 128 8.315 -4.704 3.747 1.00 0.30 O ATOM 59 CB MET A 128 11.144 -5.184 4.504 1.00 0.45 C ATOM 60 CG MET A 128 11.675 -4.656 5.799 1.00 0.90 C ATOM 61 SD MET A 128 10.754 -3.240 6.424 1.00 1.18 S ATOM 62 CE MET A 128 10.512 -2.317 4.909 1.00 0.45 C ATOM 0 H MET A 128 10.956 -7.168 3.186 1.00 0.42 H new ATOM 0 HA MET A 128 10.071 -6.618 5.676 1.00 0.37 H new ATOM 0 HB2 MET A 128 11.945 -5.691 3.966 1.00 0.45 H new ATOM 0 HB3 MET A 128 10.819 -4.351 3.881 1.00 0.45 H new ATOM 0 HG2 MET A 128 11.653 -5.452 6.544 1.00 0.90 H new ATOM 0 HG3 MET A 128 12.719 -4.372 5.666 1.00 0.90 H new ATOM 0 HE1 MET A 128 10.392 -1.259 5.143 1.00 0.45 H new ATOM 0 HE2 MET A 128 11.378 -2.450 4.260 1.00 0.45 H new ATOM 0 HE3 MET A 128 9.619 -2.680 4.401 1.00 0.45 H new ATOM 72 N LEU A 129 7.930 -5.636 5.756 1.00 0.32 N ATOM 73 CA LEU A 129 6.665 -4.993 5.943 1.00 0.28 C ATOM 74 C LEU A 129 6.878 -3.494 5.959 1.00 0.26 C ATOM 75 O LEU A 129 7.638 -2.981 6.784 1.00 0.30 O ATOM 76 CB LEU A 129 6.027 -5.489 7.248 1.00 0.33 C ATOM 77 CG LEU A 129 4.611 -4.991 7.542 1.00 0.35 C ATOM 78 CD1 LEU A 129 3.925 -5.928 8.516 1.00 0.87 C ATOM 79 CD2 LEU A 129 4.648 -3.591 8.122 1.00 0.80 C ATOM 0 H LEU A 129 8.193 -6.273 6.508 1.00 0.32 H new ATOM 0 HA LEU A 129 5.985 -5.236 5.127 1.00 0.28 H new ATOM 0 HB2 LEU A 129 6.009 -6.579 7.227 1.00 0.33 H new ATOM 0 HB3 LEU A 129 6.672 -5.196 8.077 1.00 0.33 H new ATOM 0 HG LEU A 129 4.052 -4.968 6.606 1.00 0.35 H new ATOM 0 HD11 LEU A 129 2.917 -5.566 8.720 1.00 0.87 H new ATOM 0 HD12 LEU A 129 3.871 -6.927 8.083 1.00 0.87 H new ATOM 0 HD13 LEU A 129 4.492 -5.965 9.446 1.00 0.87 H new ATOM 0 HD21 LEU A 129 3.631 -3.254 8.324 1.00 0.80 H new ATOM 0 HD22 LEU A 129 5.220 -3.597 9.050 1.00 0.80 H new ATOM 0 HD23 LEU A 129 5.119 -2.914 7.409 1.00 0.80 H new ATOM 91 N GLY A 130 6.248 -2.810 5.014 1.00 0.23 N ATOM 92 CA GLY A 130 6.252 -1.369 5.003 1.00 0.25 C ATOM 93 C GLY A 130 5.499 -0.839 6.191 1.00 0.21 C ATOM 94 O GLY A 130 4.320 -0.502 6.075 1.00 0.20 O ATOM 0 H GLY A 130 5.729 -3.238 4.247 1.00 0.23 H new ATOM 0 HA2 GLY A 130 7.278 -1.001 5.020 1.00 0.25 H new ATOM 0 HA3 GLY A 130 5.797 -1.004 4.082 1.00 0.25 H new ATOM 98 N SER A 131 6.194 -0.915 7.322 1.00 0.26 N ATOM 99 CA SER A 131 5.770 -0.447 8.659 1.00 0.31 C ATOM 100 C SER A 131 4.479 0.379 8.682 1.00 0.23 C ATOM 101 O SER A 131 4.519 1.601 8.833 1.00 0.29 O ATOM 102 CB SER A 131 6.912 0.345 9.302 1.00 0.53 C ATOM 103 OG SER A 131 7.437 1.313 8.402 1.00 1.41 O ATOM 0 H SER A 131 7.126 -1.328 7.342 1.00 0.26 H new ATOM 0 HA SER A 131 5.539 -1.346 9.230 1.00 0.31 H new ATOM 0 HB2 SER A 131 6.552 0.840 10.204 1.00 0.53 H new ATOM 0 HB3 SER A 131 7.704 -0.338 9.608 1.00 0.53 H new ATOM 0 HG SER A 131 6.714 1.898 8.092 1.00 1.41 H new ATOM 109 N ALA A 132 3.345 -0.317 8.539 1.00 0.23 N ATOM 110 CA ALA A 132 2.009 0.291 8.560 1.00 0.24 C ATOM 111 C ALA A 132 1.906 1.533 7.677 1.00 0.21 C ATOM 112 O ALA A 132 1.021 2.374 7.870 1.00 0.31 O ATOM 113 CB ALA A 132 1.584 0.601 9.987 1.00 0.33 C ATOM 0 H ALA A 132 3.329 -1.328 8.404 1.00 0.23 H new ATOM 0 HA ALA A 132 1.323 -0.444 8.139 1.00 0.24 H new ATOM 0 HB1 ALA A 132 0.591 1.051 9.981 1.00 0.33 H new ATOM 0 HB2 ALA A 132 1.561 -0.321 10.568 1.00 0.33 H new ATOM 0 HB3 ALA A 132 2.295 1.295 10.436 1.00 0.33 H new ATOM 119 N MET A 133 2.782 1.608 6.683 1.00 0.16 N ATOM 120 CA MET A 133 2.788 2.696 5.720 1.00 0.21 C ATOM 121 C MET A 133 2.775 4.055 6.422 1.00 0.29 C ATOM 122 O MET A 133 3.091 4.168 7.610 1.00 0.55 O ATOM 123 CB MET A 133 1.576 2.555 4.789 1.00 0.20 C ATOM 124 CG MET A 133 1.639 1.314 3.914 1.00 0.26 C ATOM 125 SD MET A 133 0.051 0.848 3.193 1.00 0.41 S ATOM 126 CE MET A 133 -0.454 2.362 2.394 1.00 0.22 C ATOM 0 H MET A 133 3.510 0.912 6.524 1.00 0.16 H new ATOM 0 HA MET A 133 3.704 2.641 5.132 1.00 0.21 H new ATOM 0 HB2 MET A 133 0.666 2.524 5.389 1.00 0.20 H new ATOM 0 HB3 MET A 133 1.509 3.438 4.153 1.00 0.20 H new ATOM 0 HG2 MET A 133 2.356 1.483 3.111 1.00 0.26 H new ATOM 0 HG3 MET A 133 2.016 0.481 4.508 1.00 0.26 H new ATOM 0 HE1 MET A 133 -1.401 2.698 2.816 1.00 0.22 H new ATOM 0 HE2 MET A 133 0.305 3.128 2.552 1.00 0.22 H new ATOM 0 HE3 MET A 133 -0.575 2.187 1.325 1.00 0.22 H new ATOM 136 N SER A 134 2.445 5.091 5.681 1.00 0.47 N ATOM 137 CA SER A 134 2.158 6.385 6.273 1.00 0.56 C ATOM 138 C SER A 134 0.646 6.573 6.327 1.00 0.61 C ATOM 139 O SER A 134 0.153 7.697 6.372 1.00 0.74 O ATOM 140 CB SER A 134 2.813 7.495 5.451 1.00 0.65 C ATOM 141 OG SER A 134 4.210 7.269 5.320 1.00 1.52 O ATOM 0 H SER A 134 2.368 5.065 4.664 1.00 0.47 H new ATOM 0 HA SER A 134 2.564 6.432 7.284 1.00 0.56 H new ATOM 0 HB2 SER A 134 2.354 7.542 4.464 1.00 0.65 H new ATOM 0 HB3 SER A 134 2.639 8.459 5.930 1.00 0.65 H new ATOM 0 HG SER A 134 4.610 7.989 4.789 1.00 1.52 H new ATOM 147 N ARG A 135 -0.066 5.428 6.341 1.00 0.61 N ATOM 148 CA ARG A 135 -1.536 5.360 6.230 1.00 0.76 C ATOM 149 C ARG A 135 -2.105 6.419 5.290 1.00 0.75 C ATOM 150 O ARG A 135 -3.188 6.919 5.524 1.00 1.14 O ATOM 151 CB ARG A 135 -2.211 5.411 7.620 1.00 1.01 C ATOM 152 CG ARG A 135 -1.883 6.626 8.498 1.00 0.98 C ATOM 153 CD ARG A 135 -2.397 7.902 7.863 1.00 1.57 C ATOM 154 NE ARG A 135 -2.522 9.029 8.782 1.00 2.57 N ATOM 155 CZ ARG A 135 -2.638 10.294 8.370 1.00 3.27 C ATOM 156 NH1 ARG A 135 -2.588 10.570 7.071 1.00 3.37 N ATOM 157 NH2 ARG A 135 -2.803 11.274 9.249 1.00 4.17 N ATOM 0 H ARG A 135 0.371 4.511 6.431 1.00 0.61 H new ATOM 0 HA ARG A 135 -1.769 4.394 5.782 1.00 0.76 H new ATOM 0 HB2 ARG A 135 -3.291 5.376 7.476 1.00 1.01 H new ATOM 0 HB3 ARG A 135 -1.933 4.510 8.167 1.00 1.01 H new ATOM 0 HG2 ARG A 135 -2.330 6.499 9.484 1.00 0.98 H new ATOM 0 HG3 ARG A 135 -0.805 6.695 8.643 1.00 0.98 H new ATOM 0 HD2 ARG A 135 -1.726 8.184 7.051 1.00 1.57 H new ATOM 0 HD3 ARG A 135 -3.372 7.704 7.417 1.00 1.57 H new ATOM 0 HE ARG A 135 -2.521 8.842 9.785 1.00 2.57 H new ATOM 0 HH11 ARG A 135 -2.462 9.817 6.394 1.00 3.37 H new ATOM 0 HH12 ARG A 135 -2.676 11.534 6.751 1.00 3.37 H new ATOM 0 HH21 ARG A 135 -2.842 11.063 10.246 1.00 4.17 H new ATOM 0 HH22 ARG A 135 -2.891 12.238 8.927 1.00 4.17 H new ATOM 171 N PRO A 136 -1.454 6.626 4.132 1.00 0.54 N ATOM 172 CA PRO A 136 -1.579 7.821 3.279 1.00 0.50 C ATOM 173 C PRO A 136 -2.920 8.519 3.367 1.00 0.51 C ATOM 174 O PRO A 136 -2.975 9.723 3.625 1.00 0.57 O ATOM 175 CB PRO A 136 -1.369 7.246 1.870 1.00 0.55 C ATOM 176 CG PRO A 136 -1.234 5.777 2.088 1.00 0.62 C ATOM 177 CD PRO A 136 -0.649 5.648 3.446 1.00 0.59 C ATOM 0 HA PRO A 136 -0.871 8.594 3.578 1.00 0.50 H new ATOM 0 HB2 PRO A 136 -2.211 7.476 1.217 1.00 0.55 H new ATOM 0 HB3 PRO A 136 -0.478 7.662 1.399 1.00 0.55 H new ATOM 0 HG2 PRO A 136 -2.201 5.277 2.024 1.00 0.62 H new ATOM 0 HG3 PRO A 136 -0.590 5.323 1.335 1.00 0.62 H new ATOM 0 HD2 PRO A 136 -0.761 4.646 3.859 1.00 0.59 H new ATOM 0 HD3 PRO A 136 0.414 5.886 3.471 1.00 0.59 H new ATOM 185 N LEU A 137 -3.995 7.754 3.174 1.00 0.50 N ATOM 186 CA LEU A 137 -5.333 8.304 3.162 1.00 0.54 C ATOM 187 C LEU A 137 -5.405 9.385 2.106 1.00 0.58 C ATOM 188 O LEU A 137 -5.470 10.576 2.405 1.00 0.99 O ATOM 189 CB LEU A 137 -5.711 8.845 4.543 1.00 0.59 C ATOM 190 CG LEU A 137 -5.894 7.782 5.623 1.00 0.64 C ATOM 191 CD1 LEU A 137 -6.118 8.430 6.974 1.00 0.97 C ATOM 192 CD2 LEU A 137 -7.048 6.865 5.273 1.00 0.90 C ATOM 0 H LEU A 137 -3.955 6.746 3.024 1.00 0.50 H new ATOM 0 HA LEU A 137 -6.051 7.520 2.920 1.00 0.54 H new ATOM 0 HB2 LEU A 137 -4.939 9.542 4.868 1.00 0.59 H new ATOM 0 HB3 LEU A 137 -6.637 9.414 4.453 1.00 0.59 H new ATOM 0 HG LEU A 137 -4.984 7.184 5.677 1.00 0.64 H new ATOM 0 HD11 LEU A 137 -6.246 7.657 7.732 1.00 0.97 H new ATOM 0 HD12 LEU A 137 -5.257 9.048 7.228 1.00 0.97 H new ATOM 0 HD13 LEU A 137 -7.012 9.052 6.935 1.00 0.97 H new ATOM 0 HD21 LEU A 137 -7.165 6.113 6.053 1.00 0.90 H new ATOM 0 HD22 LEU A 137 -7.965 7.449 5.192 1.00 0.90 H new ATOM 0 HD23 LEU A 137 -6.846 6.372 4.322 1.00 0.90 H new ATOM 204 N ILE A 138 -5.350 8.936 0.861 1.00 0.55 N ATOM 205 CA ILE A 138 -5.222 9.809 -0.301 1.00 0.64 C ATOM 206 C ILE A 138 -6.350 10.839 -0.388 1.00 0.61 C ATOM 207 O ILE A 138 -6.251 11.793 -1.156 1.00 1.10 O ATOM 208 CB ILE A 138 -5.212 8.975 -1.604 1.00 0.91 C ATOM 209 CG1 ILE A 138 -4.396 7.692 -1.418 1.00 1.07 C ATOM 210 CG2 ILE A 138 -4.645 9.792 -2.759 1.00 1.17 C ATOM 211 CD1 ILE A 138 -2.924 7.934 -1.164 1.00 0.63 C ATOM 0 H ILE A 138 -5.393 7.945 0.624 1.00 0.55 H new ATOM 0 HA ILE A 138 -4.279 10.344 -0.183 1.00 0.64 H new ATOM 0 HB ILE A 138 -6.241 8.703 -1.840 1.00 0.91 H new ATOM 0 HG12 ILE A 138 -4.811 7.127 -0.583 1.00 1.07 H new ATOM 0 HG13 ILE A 138 -4.504 7.072 -2.308 1.00 1.07 H new ATOM 0 HG21 ILE A 138 -4.646 9.188 -3.667 1.00 1.17 H new ATOM 0 HG22 ILE A 138 -5.259 10.680 -2.913 1.00 1.17 H new ATOM 0 HG23 ILE A 138 -3.624 10.093 -2.525 1.00 1.17 H new ATOM 0 HD11 ILE A 138 -2.414 6.978 -1.043 1.00 0.63 H new ATOM 0 HD12 ILE A 138 -2.493 8.471 -2.009 1.00 0.63 H new ATOM 0 HD13 ILE A 138 -2.804 8.527 -0.257 1.00 0.63 H new ATOM 223 N HIS A 139 -7.419 10.623 0.396 1.00 0.40 N ATOM 224 CA HIS A 139 -8.643 11.453 0.419 1.00 0.41 C ATOM 225 C HIS A 139 -9.343 11.518 -0.936 1.00 0.46 C ATOM 226 O HIS A 139 -10.543 11.754 -0.991 1.00 0.82 O ATOM 227 CB HIS A 139 -8.463 12.865 1.056 1.00 0.53 C ATOM 228 CG HIS A 139 -7.109 13.502 0.922 1.00 0.65 C ATOM 229 ND1 HIS A 139 -6.042 13.156 1.720 1.00 0.86 N ATOM 230 CD2 HIS A 139 -6.645 14.448 0.071 1.00 1.13 C ATOM 231 CE1 HIS A 139 -4.982 13.851 1.364 1.00 1.07 C ATOM 232 NE2 HIS A 139 -5.316 14.645 0.363 1.00 1.28 N ATOM 0 H HIS A 139 -7.460 9.843 1.052 1.00 0.40 H new ATOM 0 HA HIS A 139 -9.309 10.921 1.099 1.00 0.41 H new ATOM 0 HB2 HIS A 139 -9.199 13.535 0.611 1.00 0.53 H new ATOM 0 HB3 HIS A 139 -8.700 12.791 2.117 1.00 0.53 H new ATOM 0 HD1 HIS A 139 -6.069 12.467 2.472 1.00 0.86 H new ATOM 0 HD2 HIS A 139 -7.214 14.954 -0.695 1.00 1.13 H new ATOM 0 HE1 HIS A 139 -4.003 13.783 1.815 1.00 1.07 H new ATOM 241 N PHE A 140 -8.590 11.320 -2.015 1.00 0.45 N ATOM 242 CA PHE A 140 -9.138 11.084 -3.349 1.00 0.41 C ATOM 243 C PHE A 140 -9.734 12.348 -3.965 1.00 0.46 C ATOM 244 O PHE A 140 -9.840 12.468 -5.185 1.00 0.64 O ATOM 245 CB PHE A 140 -10.194 9.967 -3.294 1.00 0.38 C ATOM 246 CG PHE A 140 -10.702 9.557 -4.644 1.00 0.70 C ATOM 247 CD1 PHE A 140 -9.947 8.710 -5.437 1.00 0.74 C ATOM 248 CD2 PHE A 140 -11.918 10.008 -5.120 1.00 1.23 C ATOM 249 CE1 PHE A 140 -10.397 8.321 -6.683 1.00 1.19 C ATOM 250 CE2 PHE A 140 -12.374 9.623 -6.367 1.00 1.74 C ATOM 251 CZ PHE A 140 -11.613 8.778 -7.148 1.00 1.70 C ATOM 0 H PHE A 140 -7.570 11.319 -1.988 1.00 0.45 H new ATOM 0 HA PHE A 140 -8.313 10.775 -3.990 1.00 0.41 H new ATOM 0 HB2 PHE A 140 -9.766 9.097 -2.796 1.00 0.38 H new ATOM 0 HB3 PHE A 140 -11.034 10.301 -2.685 1.00 0.38 H new ATOM 0 HD1 PHE A 140 -8.995 8.349 -5.077 1.00 0.74 H new ATOM 0 HD2 PHE A 140 -12.519 10.668 -4.512 1.00 1.23 H new ATOM 0 HE1 PHE A 140 -9.798 7.660 -7.292 1.00 1.19 H new ATOM 0 HE2 PHE A 140 -13.325 9.984 -6.730 1.00 1.74 H new ATOM 0 HZ PHE A 140 -11.968 8.475 -8.122 1.00 1.70 H new ATOM 261 N GLY A 141 -10.083 13.293 -3.120 1.00 0.47 N ATOM 262 CA GLY A 141 -10.899 14.397 -3.541 1.00 0.53 C ATOM 263 C GLY A 141 -12.320 14.163 -3.096 1.00 0.48 C ATOM 264 O GLY A 141 -13.172 15.046 -3.198 1.00 0.54 O ATOM 0 H GLY A 141 -9.811 13.314 -2.137 1.00 0.47 H new ATOM 0 HA2 GLY A 141 -10.521 15.327 -3.116 1.00 0.53 H new ATOM 0 HA3 GLY A 141 -10.858 14.502 -4.625 1.00 0.53 H new ATOM 268 N ASN A 142 -12.567 12.959 -2.571 1.00 0.41 N ATOM 269 CA ASN A 142 -13.871 12.588 -2.075 1.00 0.45 C ATOM 270 C ASN A 142 -13.712 12.030 -0.687 1.00 0.47 C ATOM 271 O ASN A 142 -13.187 10.942 -0.528 1.00 0.46 O ATOM 272 CB ASN A 142 -14.521 11.515 -2.949 1.00 0.48 C ATOM 273 CG ASN A 142 -14.860 11.992 -4.345 1.00 1.22 C ATOM 274 OD1 ASN A 142 -15.045 13.184 -4.587 1.00 1.71 O ATOM 275 ND2 ASN A 142 -14.977 11.055 -5.270 1.00 1.88 N ATOM 0 H ASN A 142 -11.864 12.226 -2.484 1.00 0.41 H new ATOM 0 HA ASN A 142 -14.505 13.474 -2.083 1.00 0.45 H new ATOM 0 HB2 ASN A 142 -13.849 10.660 -3.020 1.00 0.48 H new ATOM 0 HB3 ASN A 142 -15.432 11.165 -2.463 1.00 0.48 H new ATOM 0 HD21 ASN A 142 -15.229 11.310 -6.225 1.00 1.88 H new ATOM 0 HD22 ASN A 142 -14.815 10.077 -5.029 1.00 1.88 H new ATOM 282 N ASP A 143 -14.128 12.782 0.311 1.00 0.54 N ATOM 283 CA ASP A 143 -14.096 12.321 1.689 1.00 0.57 C ATOM 284 C ASP A 143 -14.878 11.029 1.868 1.00 0.52 C ATOM 285 O ASP A 143 -14.714 10.339 2.862 1.00 0.52 O ATOM 286 CB ASP A 143 -14.633 13.389 2.632 1.00 0.72 C ATOM 287 CG ASP A 143 -16.123 13.621 2.494 1.00 1.04 C ATOM 288 OD1 ASP A 143 -16.522 14.427 1.625 1.00 1.14 O ATOM 289 OD2 ASP A 143 -16.903 13.010 3.254 1.00 1.39 O ATOM 0 H ASP A 143 -14.497 13.726 0.194 1.00 0.54 H new ATOM 0 HA ASP A 143 -13.053 12.123 1.937 1.00 0.57 H new ATOM 0 HB2 ASP A 143 -14.412 13.100 3.659 1.00 0.72 H new ATOM 0 HB3 ASP A 143 -14.108 14.326 2.444 1.00 0.72 H new ATOM 294 N TYR A 144 -15.731 10.717 0.907 1.00 0.53 N ATOM 295 CA TYR A 144 -16.405 9.434 0.872 1.00 0.55 C ATOM 296 C TYR A 144 -15.377 8.329 0.634 1.00 0.45 C ATOM 297 O TYR A 144 -15.405 7.286 1.279 1.00 0.47 O ATOM 298 CB TYR A 144 -17.465 9.443 -0.225 1.00 0.63 C ATOM 299 CG TYR A 144 -18.342 8.207 -0.245 1.00 0.82 C ATOM 300 CD1 TYR A 144 -19.362 8.043 0.682 1.00 1.15 C ATOM 301 CD2 TYR A 144 -18.154 7.211 -1.194 1.00 0.90 C ATOM 302 CE1 TYR A 144 -20.170 6.923 0.665 1.00 1.41 C ATOM 303 CE2 TYR A 144 -18.957 6.088 -1.217 1.00 1.19 C ATOM 304 CZ TYR A 144 -19.935 5.929 -0.277 1.00 1.40 C ATOM 305 OH TYR A 144 -20.769 4.833 -0.305 1.00 1.70 O ATOM 0 H TYR A 144 -15.973 11.340 0.137 1.00 0.53 H new ATOM 0 HA TYR A 144 -16.901 9.246 1.824 1.00 0.55 H new ATOM 0 HB2 TYR A 144 -18.097 10.322 -0.098 1.00 0.63 H new ATOM 0 HB3 TYR A 144 -16.972 9.542 -1.192 1.00 0.63 H new ATOM 0 HD1 TYR A 144 -19.527 8.805 1.430 1.00 1.15 H new ATOM 0 HD2 TYR A 144 -17.367 7.316 -1.926 1.00 0.90 H new ATOM 0 HE1 TYR A 144 -20.976 6.821 1.376 1.00 1.41 H new ATOM 0 HE2 TYR A 144 -18.812 5.336 -1.978 1.00 1.19 H new ATOM 0 HH TYR A 144 -20.483 4.222 -1.016 1.00 1.70 H new ATOM 315 N GLU A 145 -14.451 8.580 -0.280 1.00 0.39 N ATOM 316 CA GLU A 145 -13.327 7.683 -0.492 1.00 0.34 C ATOM 317 C GLU A 145 -12.267 7.898 0.550 1.00 0.33 C ATOM 318 O GLU A 145 -11.553 6.966 0.919 1.00 0.34 O ATOM 319 CB GLU A 145 -12.676 7.897 -1.820 1.00 0.34 C ATOM 320 CG GLU A 145 -13.281 7.104 -2.956 1.00 0.43 C ATOM 321 CD GLU A 145 -14.673 7.556 -3.336 1.00 1.12 C ATOM 322 OE1 GLU A 145 -14.792 8.515 -4.124 1.00 1.23 O ATOM 323 OE2 GLU A 145 -15.651 6.970 -2.825 1.00 2.20 O ATOM 0 H GLU A 145 -14.457 9.399 -0.887 1.00 0.39 H new ATOM 0 HA GLU A 145 -13.738 6.675 -0.437 1.00 0.34 H new ATOM 0 HB2 GLU A 145 -12.727 8.957 -2.068 1.00 0.34 H new ATOM 0 HB3 GLU A 145 -11.620 7.640 -1.737 1.00 0.34 H new ATOM 0 HG2 GLU A 145 -12.632 7.182 -3.828 1.00 0.43 H new ATOM 0 HG3 GLU A 145 -13.314 6.051 -2.676 1.00 0.43 H new ATOM 330 N ASP A 146 -12.126 9.139 0.987 1.00 0.37 N ATOM 331 CA ASP A 146 -11.179 9.450 2.031 1.00 0.45 C ATOM 332 C ASP A 146 -11.489 8.593 3.216 1.00 0.45 C ATOM 333 O ASP A 146 -10.632 7.925 3.799 1.00 0.49 O ATOM 334 CB ASP A 146 -11.245 10.907 2.461 1.00 0.56 C ATOM 335 CG ASP A 146 -10.395 11.176 3.691 1.00 1.11 C ATOM 336 OD1 ASP A 146 -9.153 11.236 3.558 1.00 1.44 O ATOM 337 OD2 ASP A 146 -10.963 11.332 4.791 1.00 1.40 O ATOM 0 H ASP A 146 -12.653 9.938 0.635 1.00 0.37 H new ATOM 0 HA ASP A 146 -10.178 9.263 1.642 1.00 0.45 H new ATOM 0 HB2 ASP A 146 -10.909 11.542 1.642 1.00 0.56 H new ATOM 0 HB3 ASP A 146 -12.280 11.177 2.669 1.00 0.56 H new ATOM 342 N ARG A 147 -12.760 8.610 3.522 1.00 0.47 N ATOM 343 CA ARG A 147 -13.318 7.770 4.539 1.00 0.52 C ATOM 344 C ARG A 147 -13.132 6.323 4.164 1.00 0.50 C ATOM 345 O ARG A 147 -12.923 5.481 5.016 1.00 0.54 O ATOM 346 CB ARG A 147 -14.805 8.058 4.711 1.00 0.57 C ATOM 347 CG ARG A 147 -15.608 6.818 5.106 1.00 0.66 C ATOM 348 CD ARG A 147 -16.187 6.144 3.875 1.00 0.69 C ATOM 349 NE ARG A 147 -16.678 4.793 4.153 1.00 1.11 N ATOM 350 CZ ARG A 147 -17.904 4.368 3.855 1.00 1.15 C ATOM 351 NH1 ARG A 147 -18.796 5.203 3.336 1.00 1.34 N ATOM 352 NH2 ARG A 147 -18.241 3.107 4.093 1.00 1.94 N ATOM 0 H ARG A 147 -13.441 9.216 3.064 1.00 0.47 H new ATOM 0 HA ARG A 147 -12.805 7.976 5.478 1.00 0.52 H new ATOM 0 HB2 ARG A 147 -14.936 8.827 5.472 1.00 0.57 H new ATOM 0 HB3 ARG A 147 -15.202 8.461 3.779 1.00 0.57 H new ATOM 0 HG2 ARG A 147 -14.967 6.119 5.643 1.00 0.66 H new ATOM 0 HG3 ARG A 147 -16.412 7.100 5.786 1.00 0.66 H new ATOM 0 HD2 ARG A 147 -17.004 6.750 3.483 1.00 0.69 H new ATOM 0 HD3 ARG A 147 -15.424 6.097 3.098 1.00 0.69 H new ATOM 0 HE ARG A 147 -16.041 4.136 4.603 1.00 1.11 H new ATOM 0 HH11 ARG A 147 -18.544 6.176 3.163 1.00 1.34 H new ATOM 0 HH12 ARG A 147 -19.734 4.871 3.110 1.00 1.34 H new ATOM 0 HH21 ARG A 147 -17.562 2.466 4.503 1.00 1.94 H new ATOM 0 HH22 ARG A 147 -19.179 2.778 3.866 1.00 1.94 H new ATOM 366 N TYR A 148 -13.235 6.034 2.881 1.00 0.45 N ATOM 367 CA TYR A 148 -13.213 4.663 2.442 1.00 0.46 C ATOM 368 C TYR A 148 -11.880 4.037 2.747 1.00 0.44 C ATOM 369 O TYR A 148 -11.825 2.891 3.133 1.00 0.57 O ATOM 370 CB TYR A 148 -13.577 4.537 0.959 1.00 0.47 C ATOM 371 CG TYR A 148 -13.904 3.124 0.532 1.00 0.49 C ATOM 372 CD1 TYR A 148 -14.368 2.193 1.449 1.00 0.71 C ATOM 373 CD2 TYR A 148 -13.745 2.720 -0.788 1.00 0.38 C ATOM 374 CE1 TYR A 148 -14.666 0.903 1.064 1.00 0.77 C ATOM 375 CE2 TYR A 148 -14.043 1.432 -1.181 1.00 0.43 C ATOM 376 CZ TYR A 148 -14.505 0.527 -0.256 1.00 0.60 C ATOM 377 OH TYR A 148 -14.804 -0.757 -0.638 1.00 0.68 O ATOM 0 H TYR A 148 -13.333 6.725 2.137 1.00 0.45 H new ATOM 0 HA TYR A 148 -13.976 4.116 2.996 1.00 0.46 H new ATOM 0 HB2 TYR A 148 -14.433 5.178 0.748 1.00 0.47 H new ATOM 0 HB3 TYR A 148 -12.746 4.906 0.357 1.00 0.47 H new ATOM 0 HD1 TYR A 148 -14.498 2.483 2.481 1.00 0.71 H new ATOM 0 HD2 TYR A 148 -13.382 3.427 -1.519 1.00 0.38 H new ATOM 0 HE1 TYR A 148 -15.024 0.189 1.791 1.00 0.77 H new ATOM 0 HE2 TYR A 148 -13.914 1.136 -2.212 1.00 0.43 H new ATOM 0 HH TYR A 148 -14.653 -0.855 -1.601 1.00 0.68 H new ATOM 387 N TYR A 149 -10.824 4.797 2.593 1.00 0.41 N ATOM 388 CA TYR A 149 -9.503 4.365 3.023 1.00 0.43 C ATOM 389 C TYR A 149 -9.421 4.366 4.534 1.00 0.41 C ATOM 390 O TYR A 149 -8.858 3.459 5.127 1.00 0.40 O ATOM 391 CB TYR A 149 -8.418 5.280 2.479 1.00 0.54 C ATOM 392 CG TYR A 149 -8.657 5.752 1.072 1.00 0.67 C ATOM 393 CD1 TYR A 149 -9.172 4.890 0.115 1.00 1.40 C ATOM 394 CD2 TYR A 149 -8.357 7.049 0.699 1.00 0.97 C ATOM 395 CE1 TYR A 149 -9.384 5.313 -1.181 1.00 2.09 C ATOM 396 CE2 TYR A 149 -8.563 7.478 -0.595 1.00 1.54 C ATOM 397 CZ TYR A 149 -9.120 6.639 -1.512 1.00 2.08 C ATOM 398 OH TYR A 149 -9.278 7.033 -2.816 1.00 2.82 O ATOM 0 H TYR A 149 -10.847 5.725 2.171 1.00 0.41 H new ATOM 0 HA TYR A 149 -9.346 3.358 2.637 1.00 0.43 H new ATOM 0 HB2 TYR A 149 -8.330 6.149 3.132 1.00 0.54 H new ATOM 0 HB3 TYR A 149 -7.463 4.755 2.517 1.00 0.54 H new ATOM 0 HD1 TYR A 149 -9.411 3.873 0.388 1.00 1.40 H new ATOM 0 HD2 TYR A 149 -7.956 7.735 1.431 1.00 0.97 H new ATOM 0 HE1 TYR A 149 -9.750 4.625 -1.929 1.00 2.09 H new ATOM 0 HE2 TYR A 149 -8.282 8.481 -0.882 1.00 1.54 H new ATOM 0 HH TYR A 149 -10.155 6.742 -3.142 1.00 2.82 H new ATOM 408 N ARG A 150 -10.006 5.373 5.170 1.00 0.45 N ATOM 409 CA ARG A 150 -9.981 5.432 6.624 1.00 0.48 C ATOM 410 C ARG A 150 -10.849 4.319 7.179 1.00 0.50 C ATOM 411 O ARG A 150 -10.880 4.045 8.380 1.00 0.60 O ATOM 412 CB ARG A 150 -10.415 6.811 7.142 1.00 0.56 C ATOM 413 CG ARG A 150 -11.896 6.926 7.439 1.00 0.59 C ATOM 414 CD ARG A 150 -12.317 8.376 7.630 1.00 1.15 C ATOM 415 NE ARG A 150 -11.641 9.011 8.759 1.00 1.83 N ATOM 416 CZ ARG A 150 -11.138 10.243 8.728 1.00 2.65 C ATOM 417 NH1 ARG A 150 -11.179 10.961 7.611 1.00 2.97 N ATOM 418 NH2 ARG A 150 -10.569 10.754 9.812 1.00 3.59 N ATOM 0 H ARG A 150 -10.493 6.144 4.713 1.00 0.45 H new ATOM 0 HA ARG A 150 -8.958 5.287 6.971 1.00 0.48 H new ATOM 0 HB2 ARG A 150 -9.855 7.038 8.049 1.00 0.56 H new ATOM 0 HB3 ARG A 150 -10.145 7.566 6.403 1.00 0.56 H new ATOM 0 HG2 ARG A 150 -12.467 6.485 6.622 1.00 0.59 H new ATOM 0 HG3 ARG A 150 -12.133 6.356 8.337 1.00 0.59 H new ATOM 0 HD2 ARG A 150 -12.102 8.936 6.720 1.00 1.15 H new ATOM 0 HD3 ARG A 150 -13.395 8.421 7.784 1.00 1.15 H new ATOM 0 HE ARG A 150 -11.549 8.478 9.624 1.00 1.83 H new ATOM 0 HH11 ARG A 150 -11.598 10.569 6.768 1.00 2.97 H new ATOM 0 HH12 ARG A 150 -10.791 11.904 7.597 1.00 2.97 H new ATOM 0 HH21 ARG A 150 -10.517 10.203 10.669 1.00 3.59 H new ATOM 0 HH22 ARG A 150 -10.183 11.698 9.789 1.00 3.59 H new ATOM 432 N GLU A 151 -11.540 3.680 6.263 1.00 0.44 N ATOM 433 CA GLU A 151 -12.294 2.504 6.530 1.00 0.48 C ATOM 434 C GLU A 151 -11.449 1.317 6.154 1.00 0.44 C ATOM 435 O GLU A 151 -11.364 0.319 6.872 1.00 0.50 O ATOM 436 CB GLU A 151 -13.569 2.482 5.694 1.00 0.54 C ATOM 437 CG GLU A 151 -13.937 1.078 5.230 1.00 0.49 C ATOM 438 CD GLU A 151 -15.425 0.810 5.263 1.00 0.60 C ATOM 439 OE1 GLU A 151 -16.214 1.766 5.075 1.00 0.73 O ATOM 440 OE2 GLU A 151 -15.818 -0.351 5.475 1.00 0.83 O ATOM 0 H GLU A 151 -11.586 3.982 5.290 1.00 0.44 H new ATOM 0 HA GLU A 151 -12.567 2.479 7.585 1.00 0.48 H new ATOM 0 HB2 GLU A 151 -14.391 2.895 6.279 1.00 0.54 H new ATOM 0 HB3 GLU A 151 -13.441 3.127 4.825 1.00 0.54 H new ATOM 0 HG2 GLU A 151 -13.570 0.930 4.214 1.00 0.49 H new ATOM 0 HG3 GLU A 151 -13.429 0.349 5.861 1.00 0.49 H new ATOM 447 N ASN A 152 -10.786 1.461 5.014 1.00 0.40 N ATOM 448 CA ASN A 152 -10.266 0.324 4.333 1.00 0.43 C ATOM 449 C ASN A 152 -8.833 0.051 4.698 1.00 0.37 C ATOM 450 O ASN A 152 -8.252 -0.906 4.230 1.00 0.36 O ATOM 451 CB ASN A 152 -10.465 0.348 2.811 1.00 0.62 C ATOM 452 CG ASN A 152 -9.640 1.355 2.043 1.00 0.67 C ATOM 453 OD1 ASN A 152 -8.533 1.672 2.402 1.00 1.69 O ATOM 454 ND2 ASN A 152 -10.186 1.850 0.950 1.00 0.48 N ATOM 0 H ASN A 152 -10.606 2.356 4.558 1.00 0.40 H new ATOM 0 HA ASN A 152 -10.870 -0.510 4.690 1.00 0.43 H new ATOM 0 HB2 ASN A 152 -10.242 -0.645 2.421 1.00 0.62 H new ATOM 0 HB3 ASN A 152 -11.518 0.542 2.607 1.00 0.62 H new ATOM 0 HD21 ASN A 152 -9.670 2.521 0.381 1.00 0.48 H new ATOM 0 HD22 ASN A 152 -11.124 1.562 0.673 1.00 0.48 H new ATOM 461 N MET A 153 -8.272 0.887 5.541 1.00 0.35 N ATOM 462 CA MET A 153 -6.874 0.764 5.946 1.00 0.34 C ATOM 463 C MET A 153 -6.553 -0.552 6.626 1.00 0.33 C ATOM 464 O MET A 153 -5.421 -0.790 7.026 1.00 0.36 O ATOM 465 CB MET A 153 -6.475 1.906 6.854 1.00 0.36 C ATOM 466 CG MET A 153 -5.398 2.830 6.305 1.00 0.69 C ATOM 467 SD MET A 153 -5.884 3.798 4.866 1.00 0.61 S ATOM 468 CE MET A 153 -6.247 2.512 3.687 1.00 0.34 C ATOM 0 H MET A 153 -8.763 1.672 5.969 1.00 0.35 H new ATOM 0 HA MET A 153 -6.297 0.799 5.022 1.00 0.34 H new ATOM 0 HB2 MET A 153 -7.362 2.500 7.074 1.00 0.36 H new ATOM 0 HB3 MET A 153 -6.127 1.491 7.800 1.00 0.36 H new ATOM 0 HG2 MET A 153 -5.089 3.513 7.096 1.00 0.69 H new ATOM 0 HG3 MET A 153 -4.526 2.231 6.043 1.00 0.69 H new ATOM 0 HE1 MET A 153 -6.406 2.954 2.704 1.00 0.34 H new ATOM 0 HE2 MET A 153 -5.411 1.815 3.640 1.00 0.34 H new ATOM 0 HE3 MET A 153 -7.147 1.979 3.995 1.00 0.34 H new ATOM 478 N TYR A 154 -7.538 -1.389 6.790 1.00 0.33 N ATOM 479 CA TYR A 154 -7.310 -2.693 7.356 1.00 0.36 C ATOM 480 C TYR A 154 -7.583 -3.769 6.317 1.00 0.34 C ATOM 481 O TYR A 154 -7.612 -4.960 6.617 1.00 0.39 O ATOM 482 CB TYR A 154 -8.165 -2.853 8.606 1.00 0.47 C ATOM 483 CG TYR A 154 -7.803 -1.834 9.663 1.00 0.60 C ATOM 484 CD1 TYR A 154 -6.777 -2.079 10.569 1.00 0.76 C ATOM 485 CD2 TYR A 154 -8.513 -0.647 9.780 1.00 0.68 C ATOM 486 CE1 TYR A 154 -6.467 -1.165 11.556 1.00 0.92 C ATOM 487 CE2 TYR A 154 -8.212 0.269 10.768 1.00 0.83 C ATOM 488 CZ TYR A 154 -7.083 0.067 11.558 1.00 0.95 C ATOM 489 OH TYR A 154 -6.894 0.915 12.643 1.00 1.10 O ATOM 0 H TYR A 154 -8.508 -1.194 6.541 1.00 0.33 H new ATOM 0 HA TYR A 154 -6.267 -2.801 7.653 1.00 0.36 H new ATOM 0 HB2 TYR A 154 -9.218 -2.747 8.343 1.00 0.47 H new ATOM 0 HB3 TYR A 154 -8.036 -3.858 9.009 1.00 0.47 H new ATOM 0 HD1 TYR A 154 -6.214 -2.998 10.499 1.00 0.76 H new ATOM 0 HD2 TYR A 154 -9.314 -0.437 9.087 1.00 0.68 H new ATOM 0 HE1 TYR A 154 -5.747 -1.414 12.321 1.00 0.92 H new ATOM 0 HE2 TYR A 154 -8.844 1.131 10.926 1.00 0.83 H new ATOM 0 HH TYR A 154 -7.391 1.747 12.499 1.00 1.10 H new ATOM 499 N ARG A 155 -7.758 -3.322 5.076 1.00 0.30 N ATOM 500 CA ARG A 155 -8.008 -4.213 3.950 1.00 0.31 C ATOM 501 C ARG A 155 -7.300 -3.691 2.724 1.00 0.25 C ATOM 502 O ARG A 155 -6.492 -4.370 2.120 1.00 0.26 O ATOM 503 CB ARG A 155 -9.505 -4.340 3.658 1.00 0.41 C ATOM 504 CG ARG A 155 -10.358 -4.050 4.866 1.00 0.60 C ATOM 505 CD ARG A 155 -10.924 -2.660 4.816 1.00 0.43 C ATOM 506 NE ARG A 155 -11.891 -2.514 3.727 1.00 0.95 N ATOM 507 CZ ARG A 155 -13.171 -2.187 3.907 1.00 1.23 C ATOM 508 NH1 ARG A 155 -13.642 -1.985 5.133 1.00 1.36 N ATOM 509 NH2 ARG A 155 -13.986 -2.084 2.862 1.00 1.92 N ATOM 0 H ARG A 155 -7.730 -2.334 4.825 1.00 0.30 H new ATOM 0 HA ARG A 155 -7.627 -5.200 4.211 1.00 0.31 H new ATOM 0 HB2 ARG A 155 -9.774 -3.654 2.855 1.00 0.41 H new ATOM 0 HB3 ARG A 155 -9.718 -5.348 3.301 1.00 0.41 H new ATOM 0 HG2 ARG A 155 -11.171 -4.774 4.921 1.00 0.60 H new ATOM 0 HG3 ARG A 155 -9.762 -4.170 5.771 1.00 0.60 H new ATOM 0 HD2 ARG A 155 -11.406 -2.428 5.766 1.00 0.43 H new ATOM 0 HD3 ARG A 155 -10.115 -1.941 4.685 1.00 0.43 H new ATOM 0 HE ARG A 155 -11.566 -2.672 2.773 1.00 0.95 H new ATOM 0 HH11 ARG A 155 -13.024 -2.080 5.939 1.00 1.36 H new ATOM 0 HH12 ARG A 155 -14.622 -1.735 5.268 1.00 1.36 H new ATOM 0 HH21 ARG A 155 -13.632 -2.255 1.921 1.00 1.92 H new ATOM 0 HH22 ARG A 155 -14.965 -1.834 3.001 1.00 1.92 H new ATOM 523 N TYR A 156 -7.602 -2.474 2.364 1.00 0.26 N ATOM 524 CA TYR A 156 -6.919 -1.825 1.282 1.00 0.24 C ATOM 525 C TYR A 156 -5.996 -0.835 1.941 1.00 0.24 C ATOM 526 O TYR A 156 -6.083 0.368 1.726 1.00 0.29 O ATOM 527 CB TYR A 156 -7.941 -1.145 0.384 1.00 0.28 C ATOM 528 CG TYR A 156 -9.206 -1.955 0.175 1.00 0.33 C ATOM 529 CD1 TYR A 156 -9.175 -3.342 0.131 1.00 0.53 C ATOM 530 CD2 TYR A 156 -10.427 -1.325 0.019 1.00 0.43 C ATOM 531 CE1 TYR A 156 -10.327 -4.078 -0.064 1.00 0.62 C ATOM 532 CE2 TYR A 156 -11.586 -2.048 -0.172 1.00 0.49 C ATOM 533 CZ TYR A 156 -11.531 -3.425 -0.216 1.00 0.56 C ATOM 534 OH TYR A 156 -12.683 -4.149 -0.407 1.00 0.65 O ATOM 0 H TYR A 156 -8.324 -1.908 2.810 1.00 0.26 H new ATOM 0 HA TYR A 156 -6.356 -2.511 0.649 1.00 0.24 H new ATOM 0 HB2 TYR A 156 -8.206 -0.180 0.816 1.00 0.28 H new ATOM 0 HB3 TYR A 156 -7.484 -0.946 -0.585 1.00 0.28 H new ATOM 0 HD1 TYR A 156 -8.232 -3.855 0.252 1.00 0.53 H new ATOM 0 HD2 TYR A 156 -10.474 -0.246 0.047 1.00 0.43 H new ATOM 0 HE1 TYR A 156 -10.285 -5.157 -0.097 1.00 0.62 H new ATOM 0 HE2 TYR A 156 -12.531 -1.538 -0.286 1.00 0.49 H new ATOM 0 HH TYR A 156 -12.603 -4.680 -1.227 1.00 0.65 H new ATOM 544 N PRO A 157 -5.056 -1.379 2.712 1.00 0.21 N ATOM 545 CA PRO A 157 -4.777 -0.908 4.043 1.00 0.22 C ATOM 546 C PRO A 157 -3.588 0.010 4.201 1.00 0.23 C ATOM 547 O PRO A 157 -3.004 0.493 3.234 1.00 0.25 O ATOM 548 CB PRO A 157 -4.483 -2.250 4.681 1.00 0.21 C ATOM 549 CG PRO A 157 -3.563 -2.872 3.697 1.00 0.21 C ATOM 550 CD PRO A 157 -4.103 -2.456 2.350 1.00 0.22 C ATOM 0 HA PRO A 157 -5.579 -0.291 4.449 1.00 0.22 H new ATOM 0 HB2 PRO A 157 -4.018 -2.141 5.661 1.00 0.21 H new ATOM 0 HB3 PRO A 157 -5.388 -2.841 4.822 1.00 0.21 H new ATOM 0 HG2 PRO A 157 -2.539 -2.525 3.838 1.00 0.21 H new ATOM 0 HG3 PRO A 157 -3.548 -3.957 3.800 1.00 0.21 H new ATOM 0 HD2 PRO A 157 -3.314 -2.096 1.689 1.00 0.22 H new ATOM 0 HD3 PRO A 157 -4.597 -3.281 1.837 1.00 0.22 H new ATOM 558 N ASN A 158 -3.247 0.232 5.464 1.00 0.24 N ATOM 559 CA ASN A 158 -2.054 0.953 5.819 1.00 0.27 C ATOM 560 C ASN A 158 -0.980 -0.026 6.252 1.00 0.32 C ATOM 561 O ASN A 158 -0.488 0.017 7.368 1.00 0.57 O ATOM 562 CB ASN A 158 -2.308 1.994 6.917 1.00 0.29 C ATOM 563 CG ASN A 158 -2.759 1.407 8.250 1.00 1.07 C ATOM 564 OD1 ASN A 158 -3.371 0.344 8.310 1.00 1.56 O ATOM 565 ND2 ASN A 158 -2.453 2.106 9.333 1.00 1.86 N ATOM 0 H ASN A 158 -3.796 -0.086 6.263 1.00 0.24 H new ATOM 0 HA ASN A 158 -1.719 1.500 4.938 1.00 0.27 H new ATOM 0 HB2 ASN A 158 -1.394 2.566 7.077 1.00 0.29 H new ATOM 0 HB3 ASN A 158 -3.066 2.695 6.568 1.00 0.29 H new ATOM 0 HD21 ASN A 158 -2.727 1.765 10.254 1.00 1.86 H new ATOM 0 HD22 ASN A 158 -1.943 2.985 9.245 1.00 1.86 H new ATOM 572 N GLN A 159 -0.694 -0.968 5.379 1.00 0.22 N ATOM 573 CA GLN A 159 0.526 -1.763 5.485 1.00 0.23 C ATOM 574 C GLN A 159 0.826 -2.520 4.207 1.00 0.21 C ATOM 575 O GLN A 159 -0.079 -2.946 3.487 1.00 0.24 O ATOM 576 CB GLN A 159 0.493 -2.728 6.661 1.00 0.25 C ATOM 577 CG GLN A 159 -0.731 -3.629 6.698 1.00 0.25 C ATOM 578 CD GLN A 159 -0.729 -4.581 7.881 1.00 0.42 C ATOM 579 OE1 GLN A 159 -1.783 -4.938 8.403 1.00 0.87 O ATOM 580 NE2 GLN A 159 0.452 -5.009 8.303 1.00 0.63 N ATOM 0 H GLN A 159 -1.286 -1.208 4.584 1.00 0.22 H new ATOM 0 HA GLN A 159 1.328 -1.046 5.659 1.00 0.23 H new ATOM 0 HB2 GLN A 159 1.387 -3.351 6.630 1.00 0.25 H new ATOM 0 HB3 GLN A 159 0.536 -2.155 7.587 1.00 0.25 H new ATOM 0 HG2 GLN A 159 -1.629 -3.012 6.736 1.00 0.25 H new ATOM 0 HG3 GLN A 159 -0.779 -4.206 5.774 1.00 0.25 H new ATOM 0 HE21 GLN A 159 1.304 -4.689 7.843 1.00 0.63 H new ATOM 0 HE22 GLN A 159 0.509 -5.658 9.088 1.00 0.63 H new ATOM 589 N VAL A 160 2.115 -2.702 3.950 1.00 0.20 N ATOM 590 CA VAL A 160 2.570 -3.350 2.745 1.00 0.18 C ATOM 591 C VAL A 160 3.749 -4.239 3.029 1.00 0.20 C ATOM 592 O VAL A 160 4.299 -4.216 4.121 1.00 0.26 O ATOM 593 CB VAL A 160 2.946 -2.361 1.635 1.00 0.20 C ATOM 594 CG1 VAL A 160 1.727 -2.052 0.802 1.00 0.22 C ATOM 595 CG2 VAL A 160 3.546 -1.085 2.202 1.00 0.23 C ATOM 0 H VAL A 160 2.865 -2.403 4.573 1.00 0.20 H new ATOM 0 HA VAL A 160 1.728 -3.944 2.390 1.00 0.18 H new ATOM 0 HB VAL A 160 3.707 -2.823 1.006 1.00 0.20 H new ATOM 0 HG11 VAL A 160 1.994 -1.349 0.013 1.00 0.22 H new ATOM 0 HG12 VAL A 160 1.349 -2.972 0.356 1.00 0.22 H new ATOM 0 HG13 VAL A 160 0.956 -1.612 1.434 1.00 0.22 H new ATOM 0 HG21 VAL A 160 3.800 -0.408 1.386 1.00 0.23 H new ATOM 0 HG22 VAL A 160 2.823 -0.604 2.860 1.00 0.23 H new ATOM 0 HG23 VAL A 160 4.446 -1.326 2.767 1.00 0.23 H new ATOM 605 N TYR A 161 4.099 -5.056 2.067 1.00 0.20 N ATOM 606 CA TYR A 161 5.217 -5.961 2.211 1.00 0.24 C ATOM 607 C TYR A 161 6.097 -5.894 0.973 1.00 0.31 C ATOM 608 O TYR A 161 5.758 -6.428 -0.071 1.00 0.62 O ATOM 609 CB TYR A 161 4.702 -7.377 2.395 1.00 0.26 C ATOM 610 CG TYR A 161 3.723 -7.552 3.533 1.00 0.60 C ATOM 611 CD1 TYR A 161 2.366 -7.354 3.326 1.00 1.05 C ATOM 612 CD2 TYR A 161 4.147 -7.922 4.801 1.00 0.71 C ATOM 613 CE1 TYR A 161 1.454 -7.513 4.345 1.00 1.60 C ATOM 614 CE2 TYR A 161 3.241 -8.089 5.830 1.00 1.25 C ATOM 615 CZ TYR A 161 1.895 -7.884 5.600 1.00 1.70 C ATOM 616 OH TYR A 161 0.992 -8.050 6.626 1.00 2.25 O ATOM 0 H TYR A 161 3.622 -5.114 1.167 1.00 0.20 H new ATOM 0 HA TYR A 161 5.804 -5.672 3.083 1.00 0.24 H new ATOM 0 HB2 TYR A 161 4.223 -7.698 1.470 1.00 0.26 H new ATOM 0 HB3 TYR A 161 5.552 -8.039 2.560 1.00 0.26 H new ATOM 0 HD1 TYR A 161 2.017 -7.069 2.344 1.00 1.05 H new ATOM 0 HD2 TYR A 161 5.199 -8.082 4.986 1.00 0.71 H new ATOM 0 HE1 TYR A 161 0.402 -7.349 4.164 1.00 1.60 H new ATOM 0 HE2 TYR A 161 3.584 -8.379 6.812 1.00 1.25 H new ATOM 0 HH TYR A 161 1.468 -8.313 7.441 1.00 2.25 H new ATOM 626 N TYR A 162 7.215 -5.239 1.085 1.00 0.27 N ATOM 627 CA TYR A 162 8.109 -5.083 -0.042 1.00 0.35 C ATOM 628 C TYR A 162 9.512 -5.362 0.399 1.00 0.41 C ATOM 629 O TYR A 162 9.798 -5.465 1.580 1.00 0.46 O ATOM 630 CB TYR A 162 7.977 -3.679 -0.671 1.00 0.41 C ATOM 631 CG TYR A 162 8.840 -2.600 -0.042 1.00 0.47 C ATOM 632 CD1 TYR A 162 8.885 -2.444 1.342 1.00 0.62 C ATOM 633 CD2 TYR A 162 9.593 -1.729 -0.819 1.00 0.79 C ATOM 634 CE1 TYR A 162 9.647 -1.455 1.925 1.00 0.78 C ATOM 635 CE2 TYR A 162 10.362 -0.739 -0.238 1.00 0.92 C ATOM 636 CZ TYR A 162 10.459 -0.641 1.091 1.00 0.83 C ATOM 637 OH TYR A 162 11.141 0.387 1.715 1.00 1.03 O ATOM 0 H TYR A 162 7.537 -4.799 1.947 1.00 0.27 H new ATOM 0 HA TYR A 162 7.837 -5.799 -0.817 1.00 0.35 H new ATOM 0 HB2 TYR A 162 8.227 -3.749 -1.730 1.00 0.41 H new ATOM 0 HB3 TYR A 162 6.934 -3.368 -0.609 1.00 0.41 H new ATOM 0 HD1 TYR A 162 8.312 -3.111 1.969 1.00 0.62 H new ATOM 0 HD2 TYR A 162 9.577 -1.827 -1.894 1.00 0.79 H new ATOM 0 HE1 TYR A 162 9.627 -1.302 2.994 1.00 0.78 H new ATOM 0 HE2 TYR A 162 10.891 -0.036 -0.865 1.00 0.92 H new ATOM 0 HH TYR A 162 10.500 0.998 2.134 1.00 1.03 H new ATOM 647 N ARG A 163 10.380 -5.479 -0.546 1.00 0.49 N ATOM 648 CA ARG A 163 11.750 -5.727 -0.244 1.00 0.56 C ATOM 649 C ARG A 163 12.422 -4.362 -0.245 1.00 0.60 C ATOM 650 O ARG A 163 12.016 -3.496 -1.010 1.00 0.68 O ATOM 651 CB ARG A 163 12.327 -6.657 -1.309 1.00 0.71 C ATOM 652 CG ARG A 163 13.718 -7.103 -0.990 1.00 0.89 C ATOM 653 CD ARG A 163 13.740 -8.315 -0.065 1.00 1.18 C ATOM 654 NE ARG A 163 13.036 -9.464 -0.633 1.00 1.82 N ATOM 655 CZ ARG A 163 13.556 -10.285 -1.548 1.00 2.23 C ATOM 656 NH1 ARG A 163 14.811 -10.124 -1.956 1.00 2.21 N ATOM 657 NH2 ARG A 163 12.828 -11.285 -2.032 1.00 3.01 N ATOM 0 H ARG A 163 10.165 -5.407 -1.540 1.00 0.49 H new ATOM 0 HA ARG A 163 11.900 -6.216 0.719 1.00 0.56 H new ATOM 0 HB2 ARG A 163 11.683 -7.531 -1.410 1.00 0.71 H new ATOM 0 HB3 ARG A 163 12.325 -6.146 -2.272 1.00 0.71 H new ATOM 0 HG2 ARG A 163 14.240 -7.346 -1.915 1.00 0.89 H new ATOM 0 HG3 ARG A 163 14.262 -6.282 -0.523 1.00 0.89 H new ATOM 0 HD2 ARG A 163 14.774 -8.592 0.142 1.00 1.18 H new ATOM 0 HD3 ARG A 163 13.285 -8.049 0.889 1.00 1.18 H new ATOM 0 HE ARG A 163 12.087 -9.650 -0.309 1.00 1.82 H new ATOM 0 HH11 ARG A 163 15.380 -9.371 -1.570 1.00 2.21 H new ATOM 0 HH12 ARG A 163 15.205 -10.754 -2.655 1.00 2.21 H new ATOM 0 HH21 ARG A 163 11.872 -11.425 -1.704 1.00 3.01 H new ATOM 0 HH22 ARG A 163 13.225 -11.913 -2.731 1.00 3.01 H new ATOM 671 N PRO A 164 13.451 -4.120 0.580 1.00 0.61 N ATOM 672 CA PRO A 164 13.821 -2.779 0.943 1.00 0.66 C ATOM 673 C PRO A 164 14.882 -2.222 0.027 1.00 0.65 C ATOM 674 O PRO A 164 15.885 -2.858 -0.298 1.00 0.73 O ATOM 675 CB PRO A 164 14.378 -2.943 2.367 1.00 0.72 C ATOM 676 CG PRO A 164 14.467 -4.425 2.600 1.00 0.71 C ATOM 677 CD PRO A 164 14.323 -5.064 1.250 1.00 0.62 C ATOM 0 HA PRO A 164 12.984 -2.085 0.874 1.00 0.66 H new ATOM 0 HB2 PRO A 164 15.357 -2.472 2.461 1.00 0.72 H new ATOM 0 HB3 PRO A 164 13.725 -2.470 3.100 1.00 0.72 H new ATOM 0 HG2 PRO A 164 15.419 -4.692 3.059 1.00 0.71 H new ATOM 0 HG3 PRO A 164 13.682 -4.762 3.277 1.00 0.71 H new ATOM 0 HD2 PRO A 164 15.281 -5.171 0.742 1.00 0.62 H new ATOM 0 HD3 PRO A 164 13.882 -6.059 1.311 1.00 0.62 H new ATOM 685 N VAL A 165 14.615 -1.013 -0.369 1.00 0.60 N ATOM 686 CA VAL A 165 15.325 -0.341 -1.419 1.00 0.63 C ATOM 687 C VAL A 165 16.276 0.657 -0.821 1.00 0.59 C ATOM 688 O VAL A 165 15.890 1.511 -0.047 1.00 0.62 O ATOM 689 CB VAL A 165 14.300 0.362 -2.328 1.00 0.72 C ATOM 690 CG1 VAL A 165 13.132 0.857 -1.503 1.00 0.63 C ATOM 691 CG2 VAL A 165 14.911 1.529 -3.077 1.00 0.82 C ATOM 0 H VAL A 165 13.873 -0.448 0.043 1.00 0.60 H new ATOM 0 HA VAL A 165 15.902 -1.054 -2.009 1.00 0.63 H new ATOM 0 HB VAL A 165 13.961 -0.370 -3.061 1.00 0.72 H new ATOM 0 HG11 VAL A 165 12.412 1.353 -2.153 1.00 0.63 H new ATOM 0 HG12 VAL A 165 12.653 0.013 -1.008 1.00 0.63 H new ATOM 0 HG13 VAL A 165 13.489 1.562 -0.753 1.00 0.63 H new ATOM 0 HG21 VAL A 165 14.152 1.995 -3.706 1.00 0.82 H new ATOM 0 HG22 VAL A 165 15.291 2.261 -2.364 1.00 0.82 H new ATOM 0 HG23 VAL A 165 15.730 1.172 -3.701 1.00 0.82 H new ATOM 701 N ASP A 166 17.524 0.537 -1.154 1.00 0.68 N ATOM 702 CA ASP A 166 18.510 1.466 -0.660 1.00 0.72 C ATOM 703 C ASP A 166 18.547 2.685 -1.567 1.00 0.94 C ATOM 704 O ASP A 166 19.575 3.029 -2.153 1.00 1.54 O ATOM 705 CB ASP A 166 19.838 0.752 -0.578 1.00 1.14 C ATOM 706 CG ASP A 166 20.933 1.585 0.065 1.00 1.67 C ATOM 707 OD1 ASP A 166 20.761 1.999 1.236 1.00 2.37 O ATOM 708 OD2 ASP A 166 21.960 1.839 -0.588 1.00 2.09 O ATOM 0 H ASP A 166 17.890 -0.193 -1.765 1.00 0.68 H new ATOM 0 HA ASP A 166 18.261 1.822 0.340 1.00 0.72 H new ATOM 0 HB2 ASP A 166 19.712 -0.170 -0.010 1.00 1.14 H new ATOM 0 HB3 ASP A 166 20.151 0.467 -1.582 1.00 1.14 H new ATOM 713 N GLN A 167 17.370 3.307 -1.674 1.00 1.12 N ATOM 714 CA GLN A 167 17.110 4.434 -2.564 1.00 1.74 C ATOM 715 C GLN A 167 17.817 4.271 -3.897 1.00 1.81 C ATOM 716 O GLN A 167 18.670 5.068 -4.289 1.00 2.58 O ATOM 717 CB GLN A 167 17.440 5.764 -1.893 1.00 2.18 C ATOM 718 CG GLN A 167 18.886 5.920 -1.443 1.00 2.69 C ATOM 719 CD GLN A 167 19.202 7.317 -0.949 1.00 3.47 C ATOM 720 OE1 GLN A 167 18.600 8.299 -1.384 1.00 4.04 O ATOM 721 NE2 GLN A 167 20.162 7.419 -0.046 1.00 3.91 N ATOM 0 H GLN A 167 16.553 3.031 -1.129 1.00 1.12 H new ATOM 0 HA GLN A 167 16.041 4.444 -2.777 1.00 1.74 H new ATOM 0 HB2 GLN A 167 17.202 6.571 -2.586 1.00 2.18 H new ATOM 0 HB3 GLN A 167 16.791 5.887 -1.026 1.00 2.18 H new ATOM 0 HG2 GLN A 167 19.093 5.203 -0.648 1.00 2.69 H new ATOM 0 HG3 GLN A 167 19.548 5.675 -2.273 1.00 2.69 H new ATOM 0 HE21 GLN A 167 20.637 6.581 0.290 1.00 3.91 H new ATOM 0 HE22 GLN A 167 20.427 8.335 0.315 1.00 3.91 H new ATOM 730 N TYR A 168 17.448 3.213 -4.594 1.00 1.22 N ATOM 731 CA TYR A 168 18.029 2.916 -5.883 1.00 1.24 C ATOM 732 C TYR A 168 17.068 3.379 -6.968 1.00 1.21 C ATOM 733 O TYR A 168 17.139 2.964 -8.122 1.00 1.69 O ATOM 734 CB TYR A 168 18.429 1.421 -5.970 1.00 1.31 C ATOM 735 CG TYR A 168 17.358 0.386 -6.264 1.00 1.32 C ATOM 736 CD1 TYR A 168 17.010 0.057 -7.568 1.00 1.80 C ATOM 737 CD2 TYR A 168 16.752 -0.319 -5.234 1.00 1.79 C ATOM 738 CE1 TYR A 168 16.085 -0.930 -7.834 1.00 2.42 C ATOM 739 CE2 TYR A 168 15.816 -1.301 -5.493 1.00 2.41 C ATOM 740 CZ TYR A 168 15.487 -1.604 -6.796 1.00 2.62 C ATOM 741 OH TYR A 168 14.563 -2.588 -7.061 1.00 3.47 O ATOM 0 H TYR A 168 16.744 2.543 -4.284 1.00 1.22 H new ATOM 0 HA TYR A 168 18.961 3.462 -6.031 1.00 1.24 H new ATOM 0 HB2 TYR A 168 19.194 1.330 -6.741 1.00 1.31 H new ATOM 0 HB3 TYR A 168 18.896 1.150 -5.023 1.00 1.31 H new ATOM 0 HD1 TYR A 168 17.473 0.584 -8.389 1.00 1.80 H new ATOM 0 HD2 TYR A 168 17.017 -0.096 -4.211 1.00 1.79 H new ATOM 0 HE1 TYR A 168 15.831 -1.173 -8.855 1.00 2.42 H new ATOM 0 HE2 TYR A 168 15.344 -1.829 -4.678 1.00 2.41 H new ATOM 0 HH TYR A 168 14.260 -2.988 -6.219 1.00 3.47 H new ATOM 751 N SER A 169 16.176 4.280 -6.544 1.00 1.36 N ATOM 752 CA SER A 169 15.246 4.981 -7.422 1.00 1.47 C ATOM 753 C SER A 169 14.154 4.058 -7.938 1.00 1.09 C ATOM 754 O SER A 169 13.259 4.494 -8.659 1.00 1.13 O ATOM 755 CB SER A 169 15.991 5.644 -8.594 1.00 1.88 C ATOM 756 OG SER A 169 15.115 6.425 -9.395 1.00 2.77 O ATOM 0 H SER A 169 16.082 4.544 -5.563 1.00 1.36 H new ATOM 0 HA SER A 169 14.767 5.761 -6.830 1.00 1.47 H new ATOM 0 HB2 SER A 169 16.791 6.275 -8.207 1.00 1.88 H new ATOM 0 HB3 SER A 169 16.460 4.876 -9.209 1.00 1.88 H new ATOM 0 HG SER A 169 14.241 5.985 -9.449 1.00 2.77 H new ATOM 762 N ASN A 170 14.187 2.791 -7.542 1.00 0.82 N ATOM 763 CA ASN A 170 13.240 1.839 -8.095 1.00 0.65 C ATOM 764 C ASN A 170 12.533 1.090 -6.989 1.00 0.56 C ATOM 765 O ASN A 170 12.496 -0.139 -6.972 1.00 0.77 O ATOM 766 CB ASN A 170 13.904 0.851 -9.058 1.00 0.84 C ATOM 767 CG ASN A 170 14.291 1.455 -10.401 1.00 1.23 C ATOM 768 OD1 ASN A 170 14.618 2.633 -10.507 1.00 1.94 O ATOM 769 ND2 ASN A 170 14.260 0.638 -11.443 1.00 1.70 N ATOM 0 H ASN A 170 14.841 2.409 -6.859 1.00 0.82 H new ATOM 0 HA ASN A 170 12.510 2.412 -8.666 1.00 0.65 H new ATOM 0 HB2 ASN A 170 14.797 0.443 -8.584 1.00 0.84 H new ATOM 0 HB3 ASN A 170 13.225 0.016 -9.230 1.00 0.84 H new ATOM 0 HD21 ASN A 170 14.513 0.983 -12.369 1.00 1.70 H new ATOM 0 HD22 ASN A 170 13.983 -0.336 -11.319 1.00 1.70 H new ATOM 776 N GLN A 171 11.971 1.839 -6.061 1.00 0.41 N ATOM 777 CA GLN A 171 11.096 1.266 -5.068 1.00 0.37 C ATOM 778 C GLN A 171 9.818 0.913 -5.781 1.00 0.29 C ATOM 779 O GLN A 171 9.196 -0.084 -5.487 1.00 0.34 O ATOM 780 CB GLN A 171 10.820 2.255 -3.927 1.00 0.57 C ATOM 781 CG GLN A 171 9.832 3.356 -4.286 1.00 1.32 C ATOM 782 CD GLN A 171 10.254 4.171 -5.501 1.00 2.56 C ATOM 783 OE1 GLN A 171 9.418 4.586 -6.304 1.00 3.22 O ATOM 784 NE2 GLN A 171 11.545 4.455 -5.620 1.00 3.29 N ATOM 0 H GLN A 171 12.107 2.846 -5.977 1.00 0.41 H new ATOM 0 HA GLN A 171 11.555 0.388 -4.613 1.00 0.37 H new ATOM 0 HB2 GLN A 171 10.438 1.704 -3.067 1.00 0.57 H new ATOM 0 HB3 GLN A 171 11.761 2.712 -3.620 1.00 0.57 H new ATOM 0 HG2 GLN A 171 8.856 2.910 -4.477 1.00 1.32 H new ATOM 0 HG3 GLN A 171 9.716 4.023 -3.432 1.00 1.32 H new ATOM 0 HE21 GLN A 171 12.211 4.095 -4.937 1.00 3.29 H new ATOM 0 HE22 GLN A 171 11.871 5.033 -6.395 1.00 3.29 H new ATOM 793 N ASN A 172 9.490 1.760 -6.760 1.00 0.35 N ATOM 794 CA ASN A 172 8.352 1.615 -7.653 1.00 0.42 C ATOM 795 C ASN A 172 8.309 0.228 -8.254 1.00 0.42 C ATOM 796 O ASN A 172 7.242 -0.328 -8.513 1.00 0.48 O ATOM 797 CB ASN A 172 8.469 2.696 -8.731 1.00 0.47 C ATOM 798 CG ASN A 172 7.732 2.358 -10.018 1.00 0.54 C ATOM 799 OD1 ASN A 172 8.288 1.727 -10.916 1.00 1.24 O ATOM 800 ND2 ASN A 172 6.483 2.789 -10.121 1.00 1.02 N ATOM 0 H ASN A 172 10.037 2.599 -6.955 1.00 0.35 H new ATOM 0 HA ASN A 172 7.418 1.740 -7.105 1.00 0.42 H new ATOM 0 HB2 ASN A 172 8.080 3.634 -8.336 1.00 0.47 H new ATOM 0 HB3 ASN A 172 9.523 2.858 -8.958 1.00 0.47 H new ATOM 0 HD21 ASN A 172 5.947 2.601 -10.968 1.00 1.02 H new ATOM 0 HD22 ASN A 172 6.058 3.309 -9.353 1.00 1.02 H new ATOM 807 N ASN A 173 9.482 -0.327 -8.420 1.00 0.40 N ATOM 808 CA ASN A 173 9.629 -1.689 -8.895 1.00 0.50 C ATOM 809 C ASN A 173 9.112 -2.642 -7.820 1.00 0.44 C ATOM 810 O ASN A 173 8.227 -3.482 -8.059 1.00 0.46 O ATOM 811 CB ASN A 173 11.102 -1.949 -9.189 1.00 0.63 C ATOM 812 CG ASN A 173 11.326 -3.171 -10.057 1.00 0.77 C ATOM 813 OD1 ASN A 173 10.481 -3.528 -10.874 1.00 1.33 O ATOM 814 ND2 ASN A 173 12.472 -3.819 -9.887 1.00 1.44 N ATOM 0 H ASN A 173 10.365 0.148 -8.231 1.00 0.40 H new ATOM 0 HA ASN A 173 9.056 -1.847 -9.809 1.00 0.50 H new ATOM 0 HB2 ASN A 173 11.528 -1.076 -9.684 1.00 0.63 H new ATOM 0 HB3 ASN A 173 11.638 -2.075 -8.248 1.00 0.63 H new ATOM 0 HD21 ASN A 173 12.678 -4.647 -10.446 1.00 1.44 H new ATOM 0 HD22 ASN A 173 13.147 -3.489 -9.197 1.00 1.44 H new ATOM 821 N PHE A 174 9.616 -2.440 -6.606 1.00 0.42 N ATOM 822 CA PHE A 174 9.188 -3.226 -5.461 1.00 0.42 C ATOM 823 C PHE A 174 7.754 -2.890 -5.087 1.00 0.33 C ATOM 824 O PHE A 174 7.126 -3.593 -4.304 1.00 0.34 O ATOM 825 CB PHE A 174 10.088 -2.957 -4.262 1.00 0.49 C ATOM 826 CG PHE A 174 11.406 -3.670 -4.318 1.00 0.60 C ATOM 827 CD1 PHE A 174 11.465 -5.021 -4.618 1.00 1.03 C ATOM 828 CD2 PHE A 174 12.591 -2.993 -4.070 1.00 1.56 C ATOM 829 CE1 PHE A 174 12.676 -5.680 -4.673 1.00 1.38 C ATOM 830 CE2 PHE A 174 13.805 -3.649 -4.120 1.00 1.90 C ATOM 831 CZ PHE A 174 13.851 -4.988 -4.422 1.00 1.53 C ATOM 0 H PHE A 174 10.323 -1.736 -6.393 1.00 0.42 H new ATOM 0 HA PHE A 174 9.253 -4.279 -5.736 1.00 0.42 H new ATOM 0 HB2 PHE A 174 10.269 -1.885 -4.190 1.00 0.49 H new ATOM 0 HB3 PHE A 174 9.564 -3.254 -3.353 1.00 0.49 H new ATOM 0 HD1 PHE A 174 10.552 -5.565 -4.811 1.00 1.03 H new ATOM 0 HD2 PHE A 174 12.564 -1.939 -3.835 1.00 1.56 H new ATOM 0 HE1 PHE A 174 12.709 -6.733 -4.911 1.00 1.38 H new ATOM 0 HE2 PHE A 174 14.719 -3.109 -3.922 1.00 1.90 H new ATOM 0 HZ PHE A 174 14.801 -5.501 -4.464 1.00 1.53 H new ATOM 841 N VAL A 175 7.255 -1.803 -5.644 1.00 0.29 N ATOM 842 CA VAL A 175 5.918 -1.341 -5.353 1.00 0.25 C ATOM 843 C VAL A 175 4.895 -2.175 -6.057 1.00 0.25 C ATOM 844 O VAL A 175 4.074 -2.782 -5.412 1.00 0.28 O ATOM 845 CB VAL A 175 5.696 0.100 -5.769 1.00 0.26 C ATOM 846 CG1 VAL A 175 4.251 0.475 -5.508 1.00 0.26 C ATOM 847 CG2 VAL A 175 6.638 1.006 -5.030 1.00 0.33 C ATOM 0 H VAL A 175 7.765 -1.220 -6.308 1.00 0.29 H new ATOM 0 HA VAL A 175 5.809 -1.424 -4.272 1.00 0.25 H new ATOM 0 HB VAL A 175 5.900 0.213 -6.834 1.00 0.26 H new ATOM 0 HG11 VAL A 175 4.084 1.510 -5.805 1.00 0.26 H new ATOM 0 HG12 VAL A 175 3.596 -0.178 -6.085 1.00 0.26 H new ATOM 0 HG13 VAL A 175 4.032 0.362 -4.446 1.00 0.26 H new ATOM 0 HG21 VAL A 175 6.468 2.038 -5.338 1.00 0.33 H new ATOM 0 HG22 VAL A 175 6.465 0.914 -3.958 1.00 0.33 H new ATOM 0 HG23 VAL A 175 7.666 0.725 -5.257 1.00 0.33 H new ATOM 857 N HIS A 176 4.925 -2.179 -7.383 1.00 0.27 N ATOM 858 CA HIS A 176 4.033 -3.038 -8.151 1.00 0.33 C ATOM 859 C HIS A 176 4.088 -4.450 -7.585 1.00 0.28 C ATOM 860 O HIS A 176 3.100 -5.163 -7.576 1.00 0.29 O ATOM 861 CB HIS A 176 4.412 -3.041 -9.635 1.00 0.41 C ATOM 862 CG HIS A 176 3.419 -3.752 -10.507 1.00 1.16 C ATOM 863 ND1 HIS A 176 3.705 -4.913 -11.188 1.00 2.23 N ATOM 864 CD2 HIS A 176 2.134 -3.449 -10.815 1.00 1.62 C ATOM 865 CE1 HIS A 176 2.644 -5.292 -11.876 1.00 2.89 C ATOM 866 NE2 HIS A 176 1.677 -4.420 -11.669 1.00 2.52 N ATOM 0 H HIS A 176 5.551 -1.603 -7.945 1.00 0.27 H new ATOM 0 HA HIS A 176 3.017 -2.652 -8.072 1.00 0.33 H new ATOM 0 HB2 HIS A 176 4.512 -2.011 -9.978 1.00 0.41 H new ATOM 0 HB3 HIS A 176 5.388 -3.512 -9.751 1.00 0.41 H new ATOM 0 HD2 HIS A 176 1.573 -2.599 -10.454 1.00 1.62 H new ATOM 0 HE1 HIS A 176 2.579 -6.169 -12.503 1.00 2.89 H new ATOM 0 HE2 HIS A 176 0.743 -4.461 -12.077 1.00 2.52 H new ATOM 875 N ASP A 177 5.254 -4.810 -7.069 1.00 0.26 N ATOM 876 CA ASP A 177 5.462 -6.101 -6.429 1.00 0.27 C ATOM 877 C ASP A 177 4.842 -6.139 -5.022 1.00 0.24 C ATOM 878 O ASP A 177 4.378 -7.184 -4.564 1.00 0.31 O ATOM 879 CB ASP A 177 6.967 -6.378 -6.381 1.00 0.36 C ATOM 880 CG ASP A 177 7.315 -7.823 -6.096 1.00 0.49 C ATOM 881 OD1 ASP A 177 6.796 -8.715 -6.798 1.00 0.66 O ATOM 882 OD2 ASP A 177 8.135 -8.069 -5.191 1.00 0.64 O ATOM 0 H ASP A 177 6.083 -4.215 -7.082 1.00 0.26 H new ATOM 0 HA ASP A 177 4.963 -6.879 -7.007 1.00 0.27 H new ATOM 0 HB2 ASP A 177 7.410 -6.089 -7.334 1.00 0.36 H new ATOM 0 HB3 ASP A 177 7.418 -5.748 -5.615 1.00 0.36 H new ATOM 887 N CYS A 178 4.790 -4.985 -4.368 1.00 0.26 N ATOM 888 CA CYS A 178 4.241 -4.869 -3.017 1.00 0.29 C ATOM 889 C CYS A 178 2.724 -4.730 -3.072 1.00 0.27 C ATOM 890 O CYS A 178 2.017 -5.265 -2.240 1.00 0.32 O ATOM 891 CB CYS A 178 4.823 -3.659 -2.270 1.00 0.41 C ATOM 892 SG CYS A 178 3.834 -2.137 -2.451 1.00 0.64 S ATOM 0 H CYS A 178 5.126 -4.103 -4.756 1.00 0.26 H new ATOM 0 HA CYS A 178 4.515 -5.777 -2.479 1.00 0.29 H new ATOM 0 HB2 CYS A 178 4.906 -3.903 -1.211 1.00 0.41 H new ATOM 0 HB3 CYS A 178 5.833 -3.470 -2.634 1.00 0.41 H new ATOM 897 N VAL A 179 2.208 -4.004 -4.040 1.00 0.23 N ATOM 898 CA VAL A 179 0.770 -3.943 -4.198 1.00 0.20 C ATOM 899 C VAL A 179 0.315 -5.326 -4.618 1.00 0.21 C ATOM 900 O VAL A 179 -0.667 -5.860 -4.123 1.00 0.28 O ATOM 901 CB VAL A 179 0.311 -2.883 -5.243 1.00 0.19 C ATOM 902 CG1 VAL A 179 -0.829 -2.045 -4.713 1.00 0.67 C ATOM 903 CG2 VAL A 179 1.422 -1.949 -5.627 1.00 0.57 C ATOM 0 H VAL A 179 2.746 -3.460 -4.715 1.00 0.23 H new ATOM 0 HA VAL A 179 0.322 -3.634 -3.254 1.00 0.20 H new ATOM 0 HB VAL A 179 -0.009 -3.450 -6.118 1.00 0.19 H new ATOM 0 HG11 VAL A 179 -1.125 -1.315 -5.467 1.00 0.67 H new ATOM 0 HG12 VAL A 179 -1.676 -2.690 -4.479 1.00 0.67 H new ATOM 0 HG13 VAL A 179 -0.509 -1.525 -3.810 1.00 0.67 H new ATOM 0 HG21 VAL A 179 1.055 -1.228 -6.357 1.00 0.57 H new ATOM 0 HG22 VAL A 179 1.776 -1.421 -4.742 1.00 0.57 H new ATOM 0 HG23 VAL A 179 2.243 -2.519 -6.061 1.00 0.57 H new ATOM 913 N ASN A 180 1.102 -5.945 -5.466 1.00 0.23 N ATOM 914 CA ASN A 180 0.815 -7.291 -5.909 1.00 0.24 C ATOM 915 C ASN A 180 0.783 -8.267 -4.756 1.00 0.25 C ATOM 916 O ASN A 180 0.055 -9.253 -4.797 1.00 0.26 O ATOM 917 CB ASN A 180 1.848 -7.747 -6.930 1.00 0.25 C ATOM 918 CG ASN A 180 1.436 -7.450 -8.362 1.00 0.48 C ATOM 919 OD1 ASN A 180 0.709 -6.494 -8.632 1.00 1.17 O ATOM 920 ND2 ASN A 180 1.898 -8.272 -9.292 1.00 1.33 N ATOM 0 H ASN A 180 1.948 -5.538 -5.864 1.00 0.23 H new ATOM 0 HA ASN A 180 -0.173 -7.274 -6.369 1.00 0.24 H new ATOM 0 HB2 ASN A 180 2.799 -7.256 -6.722 1.00 0.25 H new ATOM 0 HB3 ASN A 180 2.012 -8.819 -6.819 1.00 0.25 H new ATOM 0 HD21 ASN A 180 1.654 -8.123 -10.271 1.00 1.33 H new ATOM 0 HD22 ASN A 180 2.498 -9.054 -9.029 1.00 1.33 H new ATOM 927 N ILE A 181 1.563 -8.012 -3.729 1.00 0.28 N ATOM 928 CA ILE A 181 1.520 -8.880 -2.580 1.00 0.29 C ATOM 929 C ILE A 181 0.452 -8.447 -1.584 1.00 0.27 C ATOM 930 O ILE A 181 -0.282 -9.272 -1.088 1.00 0.36 O ATOM 931 CB ILE A 181 2.887 -9.036 -1.856 1.00 0.34 C ATOM 932 CG1 ILE A 181 3.559 -7.722 -1.459 1.00 0.42 C ATOM 933 CG2 ILE A 181 3.852 -9.865 -2.675 1.00 0.52 C ATOM 934 CD1 ILE A 181 2.905 -7.043 -0.289 1.00 0.77 C ATOM 0 H ILE A 181 2.217 -7.232 -3.667 1.00 0.28 H new ATOM 0 HA ILE A 181 1.261 -9.860 -2.981 1.00 0.29 H new ATOM 0 HB ILE A 181 2.640 -9.549 -0.926 1.00 0.34 H new ATOM 0 HG12 ILE A 181 4.604 -7.916 -1.218 1.00 0.42 H new ATOM 0 HG13 ILE A 181 3.549 -7.045 -2.314 1.00 0.42 H new ATOM 0 HG21 ILE A 181 4.798 -9.955 -2.141 1.00 0.52 H new ATOM 0 HG22 ILE A 181 3.431 -10.857 -2.838 1.00 0.52 H new ATOM 0 HG23 ILE A 181 4.023 -9.381 -3.636 1.00 0.52 H new ATOM 0 HD11 ILE A 181 3.434 -6.117 -0.063 1.00 0.77 H new ATOM 0 HD12 ILE A 181 1.867 -6.817 -0.533 1.00 0.77 H new ATOM 0 HD13 ILE A 181 2.939 -7.701 0.579 1.00 0.77 H new ATOM 946 N THR A 182 0.336 -7.149 -1.361 1.00 0.27 N ATOM 947 CA THR A 182 -0.325 -6.598 -0.184 1.00 0.24 C ATOM 948 C THR A 182 -1.807 -6.487 -0.333 1.00 0.26 C ATOM 949 O THR A 182 -2.563 -6.689 0.622 1.00 0.30 O ATOM 950 CB THR A 182 0.265 -5.212 0.119 1.00 0.22 C ATOM 951 OG1 THR A 182 0.843 -5.200 1.427 1.00 0.46 O ATOM 952 CG2 THR A 182 -0.783 -4.119 0.005 1.00 0.30 C ATOM 0 H THR A 182 0.701 -6.439 -1.996 1.00 0.27 H new ATOM 0 HA THR A 182 -0.146 -7.291 0.638 1.00 0.24 H new ATOM 0 HB THR A 182 1.038 -5.011 -0.622 1.00 0.22 H new ATOM 0 HG1 THR A 182 0.158 -4.960 2.085 1.00 0.46 H new ATOM 0 HG21 THR A 182 -0.328 -3.154 0.226 1.00 0.30 H new ATOM 0 HG22 THR A 182 -1.187 -4.106 -1.007 1.00 0.30 H new ATOM 0 HG23 THR A 182 -1.588 -4.312 0.714 1.00 0.30 H new ATOM 960 N VAL A 183 -2.217 -6.155 -1.511 1.00 0.26 N ATOM 961 CA VAL A 183 -3.596 -5.976 -1.767 1.00 0.28 C ATOM 962 C VAL A 183 -4.170 -7.361 -1.785 1.00 0.29 C ATOM 963 O VAL A 183 -5.208 -7.630 -1.217 1.00 0.32 O ATOM 964 CB VAL A 183 -3.749 -5.221 -3.091 1.00 0.28 C ATOM 965 CG1 VAL A 183 -2.651 -4.207 -3.177 1.00 0.26 C ATOM 966 CG2 VAL A 183 -3.709 -6.152 -4.277 1.00 0.29 C ATOM 0 H VAL A 183 -1.607 -6.002 -2.314 1.00 0.26 H new ATOM 0 HA VAL A 183 -4.123 -5.379 -1.023 1.00 0.28 H new ATOM 0 HB VAL A 183 -4.722 -4.731 -3.114 1.00 0.28 H new ATOM 0 HG11 VAL A 183 -2.738 -3.655 -4.113 1.00 0.26 H new ATOM 0 HG12 VAL A 183 -2.729 -3.515 -2.339 1.00 0.26 H new ATOM 0 HG13 VAL A 183 -1.686 -4.712 -3.142 1.00 0.26 H new ATOM 0 HG21 VAL A 183 -3.821 -5.576 -5.196 1.00 0.29 H new ATOM 0 HG22 VAL A 183 -2.755 -6.680 -4.293 1.00 0.29 H new ATOM 0 HG23 VAL A 183 -4.522 -6.874 -4.200 1.00 0.29 H new ATOM 976 N LYS A 184 -3.343 -8.244 -2.317 1.00 0.30 N ATOM 977 CA LYS A 184 -3.578 -9.661 -2.358 1.00 0.32 C ATOM 978 C LYS A 184 -3.594 -10.243 -0.966 1.00 0.32 C ATOM 979 O LYS A 184 -4.467 -11.016 -0.597 1.00 0.38 O ATOM 980 CB LYS A 184 -2.452 -10.280 -3.157 1.00 0.34 C ATOM 981 CG LYS A 184 -2.843 -10.584 -4.574 1.00 0.37 C ATOM 982 CD LYS A 184 -3.403 -9.352 -5.248 1.00 1.01 C ATOM 983 CE LYS A 184 -2.549 -8.918 -6.427 1.00 1.37 C ATOM 984 NZ LYS A 184 -2.451 -9.976 -7.468 1.00 2.14 N ATOM 0 H LYS A 184 -2.458 -7.974 -2.746 1.00 0.30 H new ATOM 0 HA LYS A 184 -4.546 -9.867 -2.814 1.00 0.32 H new ATOM 0 HB2 LYS A 184 -1.598 -9.603 -3.158 1.00 0.34 H new ATOM 0 HB3 LYS A 184 -2.129 -11.199 -2.669 1.00 0.34 H new ATOM 0 HG2 LYS A 184 -1.976 -10.945 -5.127 1.00 0.37 H new ATOM 0 HG3 LYS A 184 -3.585 -11.382 -4.589 1.00 0.37 H new ATOM 0 HD2 LYS A 184 -4.418 -9.554 -5.589 1.00 1.01 H new ATOM 0 HD3 LYS A 184 -3.465 -8.539 -4.525 1.00 1.01 H new ATOM 0 HE2 LYS A 184 -2.972 -8.015 -6.867 1.00 1.37 H new ATOM 0 HE3 LYS A 184 -1.549 -8.663 -6.075 1.00 1.37 H new ATOM 0 HZ1 LYS A 184 -2.283 -9.536 -8.395 1.00 2.14 H new ATOM 0 HZ2 LYS A 184 -1.663 -10.615 -7.240 1.00 2.14 H new ATOM 0 HZ3 LYS A 184 -3.339 -10.517 -7.498 1.00 2.14 H new ATOM 998 N GLN A 185 -2.595 -9.867 -0.218 1.00 0.31 N ATOM 999 CA GLN A 185 -2.494 -10.180 1.184 1.00 0.39 C ATOM 1000 C GLN A 185 -3.811 -9.951 1.875 1.00 0.38 C ATOM 1001 O GLN A 185 -4.249 -10.744 2.695 1.00 0.44 O ATOM 1002 CB GLN A 185 -1.419 -9.278 1.773 1.00 0.56 C ATOM 1003 CG GLN A 185 -0.060 -9.885 1.653 1.00 1.32 C ATOM 1004 CD GLN A 185 0.338 -10.665 2.894 1.00 1.75 C ATOM 1005 OE1 GLN A 185 0.016 -10.278 4.018 1.00 2.11 O ATOM 1006 NE2 GLN A 185 0.979 -11.805 2.695 1.00 2.02 N ATOM 0 H GLN A 185 -1.809 -9.322 -0.572 1.00 0.31 H new ATOM 0 HA GLN A 185 -2.233 -11.229 1.323 1.00 0.39 H new ATOM 0 HB2 GLN A 185 -1.433 -8.315 1.263 1.00 0.56 H new ATOM 0 HB3 GLN A 185 -1.640 -9.086 2.823 1.00 0.56 H new ATOM 0 HG2 GLN A 185 -0.036 -10.547 0.788 1.00 1.32 H new ATOM 0 HG3 GLN A 185 0.672 -9.098 1.472 1.00 1.32 H new ATOM 0 HE21 GLN A 185 1.229 -12.091 1.748 1.00 2.02 H new ATOM 0 HE22 GLN A 185 1.224 -12.398 3.488 1.00 2.02 H new ATOM 1015 N HIS A 186 -4.429 -8.861 1.505 1.00 0.36 N ATOM 1016 CA HIS A 186 -5.653 -8.421 2.114 1.00 0.44 C ATOM 1017 C HIS A 186 -6.906 -8.774 1.323 1.00 0.51 C ATOM 1018 O HIS A 186 -8.015 -8.465 1.759 1.00 0.67 O ATOM 1019 CB HIS A 186 -5.577 -6.943 2.336 1.00 0.49 C ATOM 1020 CG HIS A 186 -4.875 -6.584 3.603 1.00 0.55 C ATOM 1021 ND1 HIS A 186 -3.583 -6.109 3.635 1.00 0.73 N ATOM 1022 CD2 HIS A 186 -5.282 -6.647 4.892 1.00 1.09 C ATOM 1023 CE1 HIS A 186 -3.228 -5.895 4.887 1.00 0.65 C ATOM 1024 NE2 HIS A 186 -4.240 -6.214 5.671 1.00 0.91 N ATOM 0 H HIS A 186 -4.092 -8.247 0.763 1.00 0.36 H new ATOM 0 HA HIS A 186 -5.749 -8.955 3.059 1.00 0.44 H new ATOM 0 HB2 HIS A 186 -5.060 -6.480 1.496 1.00 0.49 H new ATOM 0 HB3 HIS A 186 -6.586 -6.531 2.356 1.00 0.49 H new ATOM 0 HD1 HIS A 186 -2.993 -5.948 2.819 1.00 0.73 H new ATOM 0 HD2 HIS A 186 -6.249 -6.977 5.242 1.00 1.09 H new ATOM 0 HE1 HIS A 186 -2.269 -5.521 5.215 1.00 0.65 H new ATOM 1033 N THR A 187 -6.756 -9.407 0.171 1.00 0.48 N ATOM 1034 CA THR A 187 -7.918 -9.732 -0.635 1.00 0.59 C ATOM 1035 C THR A 187 -7.849 -11.150 -1.221 1.00 0.62 C ATOM 1036 O THR A 187 -8.698 -11.533 -2.028 1.00 0.80 O ATOM 1037 CB THR A 187 -8.145 -8.685 -1.753 1.00 0.72 C ATOM 1038 OG1 THR A 187 -9.457 -8.838 -2.311 1.00 0.89 O ATOM 1039 CG2 THR A 187 -7.103 -8.800 -2.856 1.00 0.75 C ATOM 0 H THR A 187 -5.861 -9.700 -0.220 1.00 0.48 H new ATOM 0 HA THR A 187 -8.776 -9.704 0.037 1.00 0.59 H new ATOM 0 HB THR A 187 -8.049 -7.697 -1.302 1.00 0.72 H new ATOM 0 HG1 THR A 187 -9.584 -8.186 -3.032 1.00 0.89 H new ATOM 0 HG21 THR A 187 -7.298 -8.048 -3.621 1.00 0.75 H new ATOM 0 HG22 THR A 187 -6.110 -8.642 -2.436 1.00 0.75 H new ATOM 0 HG23 THR A 187 -7.154 -9.793 -3.303 1.00 0.75 H new ATOM 1047 N VAL A 188 -6.867 -11.954 -0.795 1.00 0.55 N ATOM 1048 CA VAL A 188 -6.652 -13.275 -1.421 1.00 0.63 C ATOM 1049 C VAL A 188 -6.057 -14.290 -0.441 1.00 0.66 C ATOM 1050 O VAL A 188 -6.365 -15.477 -0.505 1.00 0.78 O ATOM 1051 CB VAL A 188 -5.754 -13.206 -2.702 1.00 0.69 C ATOM 1052 CG1 VAL A 188 -5.873 -11.858 -3.389 1.00 0.66 C ATOM 1053 CG2 VAL A 188 -4.293 -13.526 -2.414 1.00 0.84 C ATOM 0 H VAL A 188 -6.221 -11.726 -0.039 1.00 0.55 H new ATOM 0 HA VAL A 188 -7.645 -13.610 -1.720 1.00 0.63 H new ATOM 0 HB VAL A 188 -6.128 -13.977 -3.376 1.00 0.69 H new ATOM 0 HG11 VAL A 188 -5.237 -11.843 -4.274 1.00 0.66 H new ATOM 0 HG12 VAL A 188 -6.909 -11.690 -3.683 1.00 0.66 H new ATOM 0 HG13 VAL A 188 -5.558 -11.071 -2.703 1.00 0.66 H new ATOM 0 HG21 VAL A 188 -3.718 -13.463 -3.338 1.00 0.84 H new ATOM 0 HG22 VAL A 188 -3.899 -12.811 -1.692 1.00 0.84 H new ATOM 0 HG23 VAL A 188 -4.215 -14.534 -2.006 1.00 0.84 H new ATOM 1063 N THR A 189 -5.214 -13.817 0.462 1.00 0.65 N ATOM 1064 CA THR A 189 -4.567 -14.676 1.450 1.00 0.79 C ATOM 1065 C THR A 189 -5.251 -14.458 2.784 1.00 0.83 C ATOM 1066 O THR A 189 -4.772 -14.862 3.845 1.00 1.04 O ATOM 1067 CB THR A 189 -3.079 -14.297 1.582 1.00 0.88 C ATOM 1068 OG1 THR A 189 -2.515 -14.091 0.280 1.00 0.90 O ATOM 1069 CG2 THR A 189 -2.292 -15.379 2.307 1.00 1.12 C ATOM 0 H THR A 189 -4.957 -12.832 0.534 1.00 0.65 H new ATOM 0 HA THR A 189 -4.643 -15.719 1.141 1.00 0.79 H new ATOM 0 HB THR A 189 -3.017 -13.379 2.166 1.00 0.88 H new ATOM 0 HG1 THR A 189 -1.570 -13.849 0.368 1.00 0.90 H new ATOM 0 HG21 THR A 189 -1.247 -15.080 2.383 1.00 1.12 H new ATOM 0 HG22 THR A 189 -2.703 -15.519 3.307 1.00 1.12 H new ATOM 0 HG23 THR A 189 -2.362 -16.314 1.751 1.00 1.12 H new ATOM 1077 N THR A 190 -6.434 -13.896 2.672 1.00 0.73 N ATOM 1078 CA THR A 190 -7.002 -13.052 3.653 1.00 0.76 C ATOM 1079 C THR A 190 -7.812 -12.083 2.870 1.00 0.80 C ATOM 1080 O THR A 190 -7.284 -11.210 2.229 1.00 1.06 O ATOM 1081 CB THR A 190 -5.923 -12.300 4.480 1.00 0.90 C ATOM 1082 OG1 THR A 190 -5.530 -13.077 5.616 1.00 1.00 O ATOM 1083 CG2 THR A 190 -6.399 -10.926 4.924 1.00 0.93 C ATOM 0 H THR A 190 -7.034 -14.031 1.858 1.00 0.73 H new ATOM 0 HA THR A 190 -7.583 -13.620 4.379 1.00 0.76 H new ATOM 0 HB THR A 190 -5.061 -12.155 3.829 1.00 0.90 H new ATOM 0 HG1 THR A 190 -5.152 -13.929 5.314 1.00 1.00 H new ATOM 0 HG21 THR A 190 -5.613 -10.437 5.499 1.00 0.93 H new ATOM 0 HG22 THR A 190 -6.637 -10.323 4.048 1.00 0.93 H new ATOM 0 HG23 THR A 190 -7.289 -11.032 5.544 1.00 0.93 H new ATOM 1091 N THR A 191 -9.074 -12.353 2.790 1.00 0.99 N ATOM 1092 CA THR A 191 -10.008 -11.359 2.364 1.00 1.23 C ATOM 1093 C THR A 191 -10.458 -10.632 3.614 1.00 1.92 C ATOM 1094 O THR A 191 -11.522 -10.047 3.670 1.00 2.15 O ATOM 1095 CB THR A 191 -11.199 -11.999 1.644 1.00 1.39 C ATOM 1096 OG1 THR A 191 -11.721 -13.062 2.440 1.00 1.97 O ATOM 1097 CG2 THR A 191 -10.792 -12.538 0.285 1.00 1.11 C ATOM 0 H THR A 191 -9.485 -13.259 3.015 1.00 0.99 H new ATOM 0 HA THR A 191 -9.550 -10.670 1.654 1.00 1.23 H new ATOM 0 HB THR A 191 -11.961 -11.234 1.496 1.00 1.39 H new ATOM 0 HG1 THR A 191 -12.113 -13.745 1.857 1.00 1.97 H new ATOM 0 HG21 THR A 191 -11.658 -12.986 -0.203 1.00 1.11 H new ATOM 0 HG22 THR A 191 -10.410 -11.723 -0.330 1.00 1.11 H new ATOM 0 HG23 THR A 191 -10.015 -13.292 0.410 1.00 1.11 H new ATOM 1105 N THR A 192 -9.626 -10.772 4.648 1.00 2.28 N ATOM 1106 CA THR A 192 -9.808 -10.160 5.962 1.00 3.04 C ATOM 1107 C THR A 192 -11.037 -10.726 6.648 1.00 2.58 C ATOM 1108 O THR A 192 -11.248 -10.516 7.843 1.00 3.13 O ATOM 1109 CB THR A 192 -9.899 -8.614 5.895 1.00 3.85 C ATOM 1110 OG1 THR A 192 -11.189 -8.192 5.430 1.00 4.36 O ATOM 1111 CG2 THR A 192 -8.833 -8.061 4.966 1.00 3.79 C ATOM 0 H THR A 192 -8.777 -11.335 4.589 1.00 2.28 H new ATOM 0 HA THR A 192 -8.921 -10.405 6.546 1.00 3.04 H new ATOM 0 HB THR A 192 -9.743 -8.231 6.903 1.00 3.85 H new ATOM 0 HG1 THR A 192 -11.595 -8.908 4.897 1.00 4.36 H new ATOM 0 HG21 THR A 192 -8.910 -6.974 4.930 1.00 3.79 H new ATOM 0 HG22 THR A 192 -7.847 -8.343 5.335 1.00 3.79 H new ATOM 0 HG23 THR A 192 -8.976 -8.468 3.965 1.00 3.79 H new ATOM 1119 N LYS A 193 -11.801 -11.509 5.891 1.00 1.64 N ATOM 1120 CA LYS A 193 -13.146 -11.927 6.320 1.00 1.28 C ATOM 1121 C LYS A 193 -13.937 -12.521 5.153 1.00 0.90 C ATOM 1122 O LYS A 193 -14.692 -13.480 5.313 1.00 0.99 O ATOM 1123 CB LYS A 193 -13.934 -10.709 6.862 1.00 1.60 C ATOM 1124 CG LYS A 193 -14.680 -9.924 5.781 1.00 1.66 C ATOM 1125 CD LYS A 193 -14.469 -8.425 5.863 1.00 1.62 C ATOM 1126 CE LYS A 193 -15.471 -7.694 4.981 1.00 1.60 C ATOM 1127 NZ LYS A 193 -15.394 -6.216 5.137 1.00 2.07 N ATOM 0 H LYS A 193 -11.519 -11.869 4.979 1.00 1.64 H new ATOM 0 HA LYS A 193 -13.022 -12.680 7.098 1.00 1.28 H new ATOM 0 HB2 LYS A 193 -14.651 -11.054 7.607 1.00 1.60 H new ATOM 0 HB3 LYS A 193 -13.242 -10.039 7.372 1.00 1.60 H new ATOM 0 HG2 LYS A 193 -14.356 -10.275 4.801 1.00 1.66 H new ATOM 0 HG3 LYS A 193 -15.746 -10.137 5.860 1.00 1.66 H new ATOM 0 HD2 LYS A 193 -14.576 -8.093 6.896 1.00 1.62 H new ATOM 0 HD3 LYS A 193 -13.454 -8.178 5.552 1.00 1.62 H new ATOM 0 HE2 LYS A 193 -15.292 -7.956 3.938 1.00 1.60 H new ATOM 0 HE3 LYS A 193 -16.479 -8.030 5.225 1.00 1.60 H new ATOM 0 HZ1 LYS A 193 -16.209 -5.774 4.666 1.00 2.07 H new ATOM 0 HZ2 LYS A 193 -15.405 -5.973 6.148 1.00 2.07 H new ATOM 0 HZ3 LYS A 193 -14.514 -5.867 4.706 1.00 2.07 H new ATOM 1141 N GLY A 194 -13.736 -11.936 3.986 1.00 0.89 N ATOM 1142 CA GLY A 194 -14.626 -12.132 2.861 1.00 0.84 C ATOM 1143 C GLY A 194 -14.771 -10.828 2.108 1.00 0.70 C ATOM 1144 O GLY A 194 -15.861 -10.437 1.699 1.00 0.98 O ATOM 0 H GLY A 194 -12.952 -11.313 3.794 1.00 0.89 H new ATOM 0 HA2 GLY A 194 -14.232 -12.905 2.201 1.00 0.84 H new ATOM 0 HA3 GLY A 194 -15.600 -12.475 3.208 1.00 0.84 H new ATOM 1148 N GLU A 195 -13.642 -10.155 1.964 1.00 0.54 N ATOM 1149 CA GLU A 195 -13.554 -8.837 1.364 1.00 0.62 C ATOM 1150 C GLU A 195 -13.039 -8.949 -0.058 1.00 0.62 C ATOM 1151 O GLU A 195 -11.913 -9.397 -0.291 1.00 0.88 O ATOM 1152 CB GLU A 195 -12.576 -8.013 2.198 1.00 0.91 C ATOM 1153 CG GLU A 195 -12.522 -6.540 1.907 1.00 1.17 C ATOM 1154 CD GLU A 195 -13.741 -5.803 2.404 1.00 1.69 C ATOM 1155 OE1 GLU A 195 -14.777 -5.821 1.717 1.00 1.98 O ATOM 1156 OE2 GLU A 195 -13.672 -5.217 3.498 1.00 2.30 O ATOM 0 H GLU A 195 -12.740 -10.520 2.269 1.00 0.54 H new ATOM 0 HA GLU A 195 -14.536 -8.364 1.340 1.00 0.62 H new ATOM 0 HB2 GLU A 195 -12.830 -8.144 3.250 1.00 0.91 H new ATOM 0 HB3 GLU A 195 -11.577 -8.425 2.058 1.00 0.91 H new ATOM 0 HG2 GLU A 195 -11.632 -6.115 2.370 1.00 1.17 H new ATOM 0 HG3 GLU A 195 -12.425 -6.390 0.832 1.00 1.17 H new ATOM 1163 N ASN A 196 -13.869 -8.553 -0.999 1.00 0.61 N ATOM 1164 CA ASN A 196 -13.487 -8.571 -2.399 1.00 0.66 C ATOM 1165 C ASN A 196 -13.177 -7.173 -2.867 1.00 0.54 C ATOM 1166 O ASN A 196 -13.819 -6.210 -2.452 1.00 0.57 O ATOM 1167 CB ASN A 196 -14.587 -9.158 -3.273 1.00 0.92 C ATOM 1168 CG ASN A 196 -14.716 -10.661 -3.113 1.00 1.42 C ATOM 1169 OD1 ASN A 196 -14.092 -11.431 -3.844 1.00 2.09 O ATOM 1170 ND2 ASN A 196 -15.524 -11.087 -2.156 1.00 2.16 N ATOM 0 H ASN A 196 -14.815 -8.214 -0.822 1.00 0.61 H new ATOM 0 HA ASN A 196 -12.602 -9.201 -2.490 1.00 0.66 H new ATOM 0 HB2 ASN A 196 -15.537 -8.686 -3.022 1.00 0.92 H new ATOM 0 HB3 ASN A 196 -14.381 -8.923 -4.317 1.00 0.92 H new ATOM 0 HD21 ASN A 196 -15.649 -12.088 -2.002 1.00 2.16 H new ATOM 0 HD22 ASN A 196 -16.022 -10.415 -1.573 1.00 2.16 H new ATOM 1177 N PHE A 197 -12.203 -7.058 -3.735 1.00 0.51 N ATOM 1178 CA PHE A 197 -11.774 -5.775 -4.200 1.00 0.42 C ATOM 1179 C PHE A 197 -12.187 -5.553 -5.646 1.00 0.43 C ATOM 1180 O PHE A 197 -12.120 -6.454 -6.483 1.00 0.47 O ATOM 1181 CB PHE A 197 -10.264 -5.644 -4.032 1.00 0.55 C ATOM 1182 CG PHE A 197 -9.445 -6.525 -4.931 1.00 1.16 C ATOM 1183 CD1 PHE A 197 -9.764 -7.860 -5.135 1.00 1.81 C ATOM 1184 CD2 PHE A 197 -8.350 -6.004 -5.570 1.00 2.03 C ATOM 1185 CE1 PHE A 197 -8.995 -8.652 -5.964 1.00 2.73 C ATOM 1186 CE2 PHE A 197 -7.572 -6.787 -6.402 1.00 2.99 C ATOM 1187 CZ PHE A 197 -7.896 -8.114 -6.599 1.00 3.21 C ATOM 0 H PHE A 197 -11.693 -7.847 -4.132 1.00 0.51 H new ATOM 0 HA PHE A 197 -12.259 -5.004 -3.602 1.00 0.42 H new ATOM 0 HB2 PHE A 197 -9.983 -4.606 -4.211 1.00 0.55 H new ATOM 0 HB3 PHE A 197 -10.008 -5.869 -2.997 1.00 0.55 H new ATOM 0 HD1 PHE A 197 -10.624 -8.285 -4.639 1.00 1.81 H new ATOM 0 HD2 PHE A 197 -8.091 -4.966 -5.421 1.00 2.03 H new ATOM 0 HE1 PHE A 197 -9.254 -9.690 -6.115 1.00 2.73 H new ATOM 0 HE2 PHE A 197 -6.712 -6.361 -6.897 1.00 2.99 H new ATOM 0 HZ PHE A 197 -7.291 -8.729 -7.248 1.00 3.21 H new ATOM 1197 N THR A 198 -12.662 -4.360 -5.911 1.00 0.47 N ATOM 1198 CA THR A 198 -12.979 -3.943 -7.252 1.00 0.50 C ATOM 1199 C THR A 198 -11.884 -3.018 -7.749 1.00 0.48 C ATOM 1200 O THR A 198 -11.034 -2.654 -6.978 1.00 0.45 O ATOM 1201 CB THR A 198 -14.370 -3.270 -7.307 1.00 0.54 C ATOM 1202 OG1 THR A 198 -14.701 -2.877 -8.645 1.00 0.61 O ATOM 1203 CG2 THR A 198 -14.421 -2.055 -6.396 1.00 0.49 C ATOM 0 H THR A 198 -12.839 -3.651 -5.200 1.00 0.47 H new ATOM 0 HA THR A 198 -13.028 -4.813 -7.907 1.00 0.50 H new ATOM 0 HB THR A 198 -15.100 -4.004 -6.964 1.00 0.54 H new ATOM 0 HG1 THR A 198 -15.586 -2.456 -8.653 1.00 0.61 H new ATOM 0 HG21 THR A 198 -15.410 -1.599 -6.452 1.00 0.49 H new ATOM 0 HG22 THR A 198 -14.221 -2.361 -5.369 1.00 0.49 H new ATOM 0 HG23 THR A 198 -13.669 -1.332 -6.712 1.00 0.49 H new ATOM 1211 N GLU A 199 -11.849 -2.700 -9.033 1.00 0.51 N ATOM 1212 CA GLU A 199 -10.849 -1.775 -9.567 1.00 0.50 C ATOM 1213 C GLU A 199 -10.916 -0.409 -8.881 1.00 0.44 C ATOM 1214 O GLU A 199 -10.063 0.425 -9.100 1.00 0.43 O ATOM 1215 CB GLU A 199 -11.024 -1.578 -11.062 1.00 0.53 C ATOM 1216 CG GLU A 199 -9.723 -1.281 -11.781 1.00 0.54 C ATOM 1217 CD GLU A 199 -9.911 -1.180 -13.278 1.00 0.58 C ATOM 1218 OE1 GLU A 199 -9.973 -2.237 -13.944 1.00 0.76 O ATOM 1219 OE2 GLU A 199 -10.023 -0.047 -13.796 1.00 0.62 O ATOM 0 H GLU A 199 -12.499 -3.066 -9.729 1.00 0.51 H new ATOM 0 HA GLU A 199 -9.876 -2.226 -9.369 1.00 0.50 H new ATOM 0 HB2 GLU A 199 -11.472 -2.475 -11.490 1.00 0.53 H new ATOM 0 HB3 GLU A 199 -11.722 -0.759 -11.235 1.00 0.53 H new ATOM 0 HG2 GLU A 199 -9.306 -0.347 -11.405 1.00 0.54 H new ATOM 0 HG3 GLU A 199 -8.999 -2.065 -11.559 1.00 0.54 H new ATOM 1226 N THR A 200 -11.953 -0.184 -8.096 1.00 0.44 N ATOM 1227 CA THR A 200 -12.038 0.964 -7.216 1.00 0.38 C ATOM 1228 C THR A 200 -11.405 0.622 -5.873 1.00 0.33 C ATOM 1229 O THR A 200 -10.722 1.435 -5.258 1.00 0.28 O ATOM 1230 CB THR A 200 -13.496 1.404 -6.988 1.00 0.42 C ATOM 1231 OG1 THR A 200 -14.038 1.966 -8.193 1.00 0.51 O ATOM 1232 CG2 THR A 200 -13.573 2.410 -5.853 1.00 0.45 C ATOM 0 H THR A 200 -12.766 -0.798 -8.052 1.00 0.44 H new ATOM 0 HA THR A 200 -11.505 1.788 -7.692 1.00 0.38 H new ATOM 0 HB THR A 200 -14.086 0.529 -6.715 1.00 0.42 H new ATOM 0 HG1 THR A 200 -14.966 2.241 -8.037 1.00 0.51 H new ATOM 0 HG21 THR A 200 -14.610 2.712 -5.704 1.00 0.45 H new ATOM 0 HG22 THR A 200 -13.192 1.956 -4.938 1.00 0.45 H new ATOM 0 HG23 THR A 200 -12.973 3.285 -6.101 1.00 0.45 H new ATOM 1240 N ASP A 201 -11.597 -0.614 -5.457 1.00 0.37 N ATOM 1241 CA ASP A 201 -11.018 -1.088 -4.215 1.00 0.34 C ATOM 1242 C ASP A 201 -9.546 -1.247 -4.448 1.00 0.31 C ATOM 1243 O ASP A 201 -8.709 -1.117 -3.564 1.00 0.28 O ATOM 1244 CB ASP A 201 -11.618 -2.409 -3.753 1.00 0.37 C ATOM 1245 CG ASP A 201 -13.063 -2.288 -3.338 1.00 0.41 C ATOM 1246 OD1 ASP A 201 -13.439 -1.249 -2.771 1.00 0.56 O ATOM 1247 OD2 ASP A 201 -13.829 -3.240 -3.573 1.00 0.50 O ATOM 0 H ASP A 201 -12.149 -1.308 -5.960 1.00 0.37 H new ATOM 0 HA ASP A 201 -11.228 -0.367 -3.425 1.00 0.34 H new ATOM 0 HB2 ASP A 201 -11.537 -3.139 -4.558 1.00 0.37 H new ATOM 0 HB3 ASP A 201 -11.036 -2.792 -2.915 1.00 0.37 H new ATOM 1252 N ILE A 202 -9.268 -1.507 -5.693 1.00 0.35 N ATOM 1253 CA ILE A 202 -7.947 -1.664 -6.183 1.00 0.36 C ATOM 1254 C ILE A 202 -7.370 -0.348 -6.497 1.00 0.33 C ATOM 1255 O ILE A 202 -6.218 -0.102 -6.196 1.00 0.34 O ATOM 1256 CB ILE A 202 -7.935 -2.509 -7.455 1.00 0.44 C ATOM 1257 CG1 ILE A 202 -6.989 -3.656 -7.319 1.00 0.50 C ATOM 1258 CG2 ILE A 202 -7.509 -1.714 -8.681 1.00 0.48 C ATOM 1259 CD1 ILE A 202 -6.220 -3.650 -6.030 1.00 0.59 C ATOM 0 H ILE A 202 -9.984 -1.617 -6.411 1.00 0.35 H new ATOM 0 HA ILE A 202 -7.361 -2.162 -5.411 1.00 0.36 H new ATOM 0 HB ILE A 202 -8.959 -2.857 -7.589 1.00 0.44 H new ATOM 0 HG12 ILE A 202 -7.548 -4.589 -7.395 1.00 0.50 H new ATOM 0 HG13 ILE A 202 -6.286 -3.637 -8.152 1.00 0.50 H new ATOM 0 HG21 ILE A 202 -7.518 -2.363 -9.557 1.00 0.48 H new ATOM 0 HG22 ILE A 202 -8.201 -0.886 -8.836 1.00 0.48 H new ATOM 0 HG23 ILE A 202 -6.503 -1.323 -8.530 1.00 0.48 H new ATOM 0 HD11 ILE A 202 -5.553 -4.512 -6.000 1.00 0.59 H new ATOM 0 HD12 ILE A 202 -5.633 -2.734 -5.961 1.00 0.59 H new ATOM 0 HD13 ILE A 202 -6.915 -3.700 -5.192 1.00 0.59 H new ATOM 1271 N LYS A 203 -8.179 0.520 -7.089 1.00 0.33 N ATOM 1272 CA LYS A 203 -7.659 1.783 -7.488 1.00 0.33 C ATOM 1273 C LYS A 203 -7.161 2.454 -6.249 1.00 0.28 C ATOM 1274 O LYS A 203 -6.300 3.305 -6.274 1.00 0.32 O ATOM 1275 CB LYS A 203 -8.683 2.639 -8.189 1.00 0.33 C ATOM 1276 CG LYS A 203 -9.698 3.268 -7.265 1.00 0.29 C ATOM 1277 CD LYS A 203 -10.819 3.945 -8.031 1.00 0.34 C ATOM 1278 CE LYS A 203 -10.421 5.316 -8.544 1.00 1.13 C ATOM 1279 NZ LYS A 203 -11.533 5.957 -9.294 1.00 1.93 N ATOM 0 H LYS A 203 -9.166 0.364 -7.291 1.00 0.33 H new ATOM 0 HA LYS A 203 -6.858 1.638 -8.213 1.00 0.33 H new ATOM 0 HB2 LYS A 203 -8.168 3.428 -8.736 1.00 0.33 H new ATOM 0 HB3 LYS A 203 -9.207 2.030 -8.926 1.00 0.33 H new ATOM 0 HG2 LYS A 203 -10.116 2.503 -6.611 1.00 0.29 H new ATOM 0 HG3 LYS A 203 -9.203 3.999 -6.625 1.00 0.29 H new ATOM 0 HD2 LYS A 203 -11.113 3.316 -8.872 1.00 0.34 H new ATOM 0 HD3 LYS A 203 -11.691 4.041 -7.385 1.00 0.34 H new ATOM 0 HE2 LYS A 203 -10.132 5.950 -7.706 1.00 1.13 H new ATOM 0 HE3 LYS A 203 -9.548 5.225 -9.191 1.00 1.13 H new ATOM 0 HZ1 LYS A 203 -11.230 6.893 -9.632 1.00 1.93 H new ATOM 0 HZ2 LYS A 203 -11.791 5.362 -10.107 1.00 1.93 H new ATOM 0 HZ3 LYS A 203 -12.357 6.065 -8.668 1.00 1.93 H new ATOM 1293 N ILE A 204 -7.722 1.956 -5.164 1.00 0.24 N ATOM 1294 CA ILE A 204 -7.352 2.273 -3.836 1.00 0.22 C ATOM 1295 C ILE A 204 -5.975 1.724 -3.565 1.00 0.22 C ATOM 1296 O ILE A 204 -5.051 2.467 -3.426 1.00 0.25 O ATOM 1297 CB ILE A 204 -8.337 1.637 -2.860 1.00 0.24 C ATOM 1298 CG1 ILE A 204 -9.492 2.546 -2.549 1.00 0.27 C ATOM 1299 CG2 ILE A 204 -7.639 1.254 -1.591 1.00 0.32 C ATOM 1300 CD1 ILE A 204 -10.710 1.793 -2.098 1.00 0.30 C ATOM 0 H ILE A 204 -8.488 1.284 -5.210 1.00 0.24 H new ATOM 0 HA ILE A 204 -7.359 3.355 -3.708 1.00 0.22 H new ATOM 0 HB ILE A 204 -8.736 0.745 -3.342 1.00 0.24 H new ATOM 0 HG12 ILE A 204 -9.196 3.251 -1.772 1.00 0.27 H new ATOM 0 HG13 ILE A 204 -9.738 3.132 -3.435 1.00 0.27 H new ATOM 0 HG21 ILE A 204 -8.355 0.802 -0.904 1.00 0.32 H new ATOM 0 HG22 ILE A 204 -6.847 0.539 -1.813 1.00 0.32 H new ATOM 0 HG23 ILE A 204 -7.207 2.143 -1.131 1.00 0.32 H new ATOM 0 HD11 ILE A 204 -11.515 2.497 -1.886 1.00 0.30 H new ATOM 0 HD12 ILE A 204 -11.025 1.107 -2.884 1.00 0.30 H new ATOM 0 HD13 ILE A 204 -10.475 1.228 -1.196 1.00 0.30 H new ATOM 1312 N MET A 205 -5.810 0.417 -3.554 1.00 0.21 N ATOM 1313 CA MET A 205 -4.542 -0.122 -3.147 1.00 0.21 C ATOM 1314 C MET A 205 -3.477 0.275 -4.115 1.00 0.22 C ATOM 1315 O MET A 205 -2.303 0.261 -3.816 1.00 0.26 O ATOM 1316 CB MET A 205 -4.596 -1.628 -2.979 1.00 0.22 C ATOM 1317 CG MET A 205 -4.610 -2.043 -1.524 1.00 0.27 C ATOM 1318 SD MET A 205 -5.629 -3.499 -1.232 1.00 0.32 S ATOM 1319 CE MET A 205 -7.003 -3.163 -2.327 1.00 0.42 C ATOM 0 H MET A 205 -6.518 -0.269 -3.815 1.00 0.21 H new ATOM 0 HA MET A 205 -4.298 0.297 -2.171 1.00 0.21 H new ATOM 0 HB2 MET A 205 -5.487 -2.015 -3.474 1.00 0.22 H new ATOM 0 HB3 MET A 205 -3.736 -2.078 -3.475 1.00 0.22 H new ATOM 0 HG2 MET A 205 -3.590 -2.246 -1.198 1.00 0.27 H new ATOM 0 HG3 MET A 205 -4.980 -1.217 -0.917 1.00 0.27 H new ATOM 0 HE1 MET A 205 -7.871 -3.741 -2.009 1.00 0.42 H new ATOM 0 HE2 MET A 205 -7.243 -2.100 -2.294 1.00 0.42 H new ATOM 0 HE3 MET A 205 -6.734 -3.443 -3.345 1.00 0.42 H new ATOM 1329 N GLU A 206 -3.898 0.726 -5.248 1.00 0.23 N ATOM 1330 CA GLU A 206 -2.973 1.115 -6.238 1.00 0.28 C ATOM 1331 C GLU A 206 -2.667 2.587 -6.051 1.00 0.30 C ATOM 1332 O GLU A 206 -1.587 3.062 -6.330 1.00 0.38 O ATOM 1333 CB GLU A 206 -3.501 0.764 -7.610 1.00 0.32 C ATOM 1334 CG GLU A 206 -3.870 -0.705 -7.663 1.00 0.34 C ATOM 1335 CD GLU A 206 -3.970 -1.248 -9.069 1.00 0.49 C ATOM 1336 OE1 GLU A 206 -4.770 -0.719 -9.863 1.00 0.54 O ATOM 1337 OE2 GLU A 206 -3.231 -2.203 -9.394 1.00 0.90 O ATOM 0 H GLU A 206 -4.880 0.832 -5.505 1.00 0.23 H new ATOM 0 HA GLU A 206 -2.032 0.573 -6.142 1.00 0.28 H new ATOM 0 HB2 GLU A 206 -4.374 1.375 -7.840 1.00 0.32 H new ATOM 0 HB3 GLU A 206 -2.748 0.986 -8.366 1.00 0.32 H new ATOM 0 HG2 GLU A 206 -3.125 -1.279 -7.112 1.00 0.34 H new ATOM 0 HG3 GLU A 206 -4.824 -0.851 -7.156 1.00 0.34 H new ATOM 1344 N ARG A 207 -3.599 3.297 -5.464 1.00 0.26 N ATOM 1345 CA ARG A 207 -3.394 4.703 -5.206 1.00 0.30 C ATOM 1346 C ARG A 207 -2.841 4.911 -3.814 1.00 0.31 C ATOM 1347 O ARG A 207 -2.189 5.905 -3.525 1.00 0.40 O ATOM 1348 CB ARG A 207 -4.710 5.458 -5.343 1.00 0.33 C ATOM 1349 CG ARG A 207 -5.686 5.145 -4.230 1.00 0.38 C ATOM 1350 CD ARG A 207 -7.032 5.763 -4.483 1.00 0.84 C ATOM 1351 NE ARG A 207 -7.000 7.216 -4.335 1.00 1.28 N ATOM 1352 CZ ARG A 207 -6.865 8.078 -5.349 1.00 1.93 C ATOM 1353 NH1 ARG A 207 -6.815 7.647 -6.604 1.00 2.42 N ATOM 1354 NH2 ARG A 207 -6.806 9.378 -5.104 1.00 2.55 N ATOM 0 H ARG A 207 -4.500 2.930 -5.158 1.00 0.26 H new ATOM 0 HA ARG A 207 -2.678 5.084 -5.935 1.00 0.30 H new ATOM 0 HB2 ARG A 207 -4.509 6.529 -5.353 1.00 0.33 H new ATOM 0 HB3 ARG A 207 -5.167 5.210 -6.301 1.00 0.33 H new ATOM 0 HG2 ARG A 207 -5.794 4.065 -4.133 1.00 0.38 H new ATOM 0 HG3 ARG A 207 -5.289 5.512 -3.284 1.00 0.38 H new ATOM 0 HD2 ARG A 207 -7.366 5.508 -5.489 1.00 0.84 H new ATOM 0 HD3 ARG A 207 -7.761 5.343 -3.789 1.00 0.84 H new ATOM 0 HE ARG A 207 -7.087 7.600 -3.394 1.00 1.28 H new ATOM 0 HH11 ARG A 207 -6.880 6.649 -6.803 1.00 2.42 H new ATOM 0 HH12 ARG A 207 -6.712 8.314 -7.369 1.00 2.42 H new ATOM 0 HH21 ARG A 207 -6.863 9.719 -4.145 1.00 2.55 H new ATOM 0 HH22 ARG A 207 -6.703 10.038 -5.875 1.00 2.55 H new ATOM 1368 N VAL A 208 -3.143 3.979 -2.945 1.00 0.29 N ATOM 1369 CA VAL A 208 -2.784 4.095 -1.564 1.00 0.31 C ATOM 1370 C VAL A 208 -1.521 3.335 -1.277 1.00 0.34 C ATOM 1371 O VAL A 208 -0.642 3.813 -0.587 1.00 0.50 O ATOM 1372 CB VAL A 208 -3.935 3.621 -0.650 1.00 0.44 C ATOM 1373 CG1 VAL A 208 -3.786 4.145 0.755 1.00 0.30 C ATOM 1374 CG2 VAL A 208 -5.255 4.069 -1.221 1.00 0.80 C ATOM 0 H VAL A 208 -3.644 3.122 -3.180 1.00 0.29 H new ATOM 0 HA VAL A 208 -2.601 5.148 -1.350 1.00 0.31 H new ATOM 0 HB VAL A 208 -3.898 2.533 -0.606 1.00 0.44 H new ATOM 0 HG11 VAL A 208 -4.615 3.789 1.366 1.00 0.30 H new ATOM 0 HG12 VAL A 208 -2.846 3.791 1.178 1.00 0.30 H new ATOM 0 HG13 VAL A 208 -3.789 5.235 0.739 1.00 0.30 H new ATOM 0 HG21 VAL A 208 -6.065 3.733 -0.573 1.00 0.80 H new ATOM 0 HG22 VAL A 208 -5.272 5.157 -1.288 1.00 0.80 H new ATOM 0 HG23 VAL A 208 -5.385 3.642 -2.216 1.00 0.80 H new ATOM 1384 N VAL A 209 -1.437 2.174 -1.867 1.00 0.28 N ATOM 1385 CA VAL A 209 -0.349 1.262 -1.649 1.00 0.31 C ATOM 1386 C VAL A 209 0.700 1.403 -2.741 1.00 0.29 C ATOM 1387 O VAL A 209 1.892 1.381 -2.448 1.00 0.30 O ATOM 1388 CB VAL A 209 -0.863 -0.186 -1.582 1.00 0.38 C ATOM 1389 CG1 VAL A 209 0.244 -1.173 -1.846 1.00 0.89 C ATOM 1390 CG2 VAL A 209 -1.534 -0.462 -0.248 1.00 0.88 C ATOM 0 H VAL A 209 -2.136 1.829 -2.525 1.00 0.28 H new ATOM 0 HA VAL A 209 0.115 1.509 -0.694 1.00 0.31 H new ATOM 0 HB VAL A 209 -1.609 -0.310 -2.367 1.00 0.38 H new ATOM 0 HG11 VAL A 209 -0.152 -2.187 -1.791 1.00 0.89 H new ATOM 0 HG12 VAL A 209 0.658 -0.998 -2.839 1.00 0.89 H new ATOM 0 HG13 VAL A 209 1.028 -1.049 -1.099 1.00 0.89 H new ATOM 0 HG21 VAL A 209 -1.889 -1.492 -0.225 1.00 0.88 H new ATOM 0 HG22 VAL A 209 -0.817 -0.307 0.559 1.00 0.88 H new ATOM 0 HG23 VAL A 209 -2.378 0.215 -0.118 1.00 0.88 H new ATOM 1400 N GLU A 210 0.279 1.583 -3.999 1.00 0.28 N ATOM 1401 CA GLU A 210 1.247 1.727 -5.064 1.00 0.29 C ATOM 1402 C GLU A 210 1.895 3.082 -4.936 1.00 0.24 C ATOM 1403 O GLU A 210 3.076 3.262 -5.214 1.00 0.25 O ATOM 1404 CB GLU A 210 0.600 1.559 -6.425 1.00 0.34 C ATOM 1405 CG GLU A 210 1.570 1.596 -7.593 1.00 0.63 C ATOM 1406 CD GLU A 210 0.878 1.402 -8.927 1.00 0.87 C ATOM 1407 OE1 GLU A 210 0.670 0.238 -9.329 1.00 1.16 O ATOM 1408 OE2 GLU A 210 0.524 2.410 -9.574 1.00 1.62 O ATOM 0 H GLU A 210 -0.698 1.630 -4.288 1.00 0.28 H new ATOM 0 HA GLU A 210 2.002 0.946 -4.977 1.00 0.29 H new ATOM 0 HB2 GLU A 210 0.065 0.610 -6.444 1.00 0.34 H new ATOM 0 HB3 GLU A 210 -0.142 2.346 -6.560 1.00 0.34 H new ATOM 0 HG2 GLU A 210 2.095 2.551 -7.595 1.00 0.63 H new ATOM 0 HG3 GLU A 210 2.323 0.819 -7.461 1.00 0.63 H new ATOM 1415 N GLN A 211 1.116 4.030 -4.464 1.00 0.23 N ATOM 1416 CA GLN A 211 1.652 5.327 -4.161 1.00 0.23 C ATOM 1417 C GLN A 211 2.395 5.293 -2.848 1.00 0.22 C ATOM 1418 O GLN A 211 3.328 6.049 -2.657 1.00 0.25 O ATOM 1419 CB GLN A 211 0.572 6.370 -4.060 1.00 0.29 C ATOM 1420 CG GLN A 211 1.094 7.763 -3.735 1.00 0.34 C ATOM 1421 CD GLN A 211 0.067 8.858 -3.966 1.00 0.79 C ATOM 1422 OE1 GLN A 211 0.420 10.004 -4.241 1.00 1.49 O ATOM 1423 NE2 GLN A 211 -1.207 8.514 -3.871 1.00 1.68 N ATOM 0 H GLN A 211 0.118 3.923 -4.285 1.00 0.23 H new ATOM 0 HA GLN A 211 2.325 5.589 -4.977 1.00 0.23 H new ATOM 0 HB2 GLN A 211 0.026 6.407 -5.003 1.00 0.29 H new ATOM 0 HB3 GLN A 211 -0.140 6.070 -3.291 1.00 0.29 H new ATOM 0 HG2 GLN A 211 1.415 7.789 -2.694 1.00 0.34 H new ATOM 0 HG3 GLN A 211 1.974 7.965 -4.345 1.00 0.34 H new ATOM 0 HE21 GLN A 211 -1.460 7.553 -3.641 1.00 1.68 H new ATOM 0 HE22 GLN A 211 -1.936 9.210 -4.028 1.00 1.68 H new ATOM 1432 N MET A 212 1.973 4.447 -1.914 1.00 0.27 N ATOM 1433 CA MET A 212 2.676 4.396 -0.655 1.00 0.32 C ATOM 1434 C MET A 212 4.008 3.731 -0.828 1.00 0.25 C ATOM 1435 O MET A 212 5.025 4.240 -0.398 1.00 0.22 O ATOM 1436 CB MET A 212 1.907 3.707 0.444 1.00 0.48 C ATOM 1437 CG MET A 212 1.745 4.581 1.681 1.00 1.72 C ATOM 1438 SD MET A 212 3.248 4.788 2.640 1.00 1.89 S ATOM 1439 CE MET A 212 4.087 3.270 2.239 1.00 0.30 C ATOM 0 H MET A 212 1.179 3.814 -2.005 1.00 0.27 H new ATOM 0 HA MET A 212 2.806 5.433 -0.344 1.00 0.32 H new ATOM 0 HB2 MET A 212 0.922 3.424 0.072 1.00 0.48 H new ATOM 0 HB3 MET A 212 2.420 2.786 0.719 1.00 0.48 H new ATOM 0 HG2 MET A 212 1.386 5.563 1.373 1.00 1.72 H new ATOM 0 HG3 MET A 212 0.977 4.147 2.321 1.00 1.72 H new ATOM 0 HE1 MET A 212 4.358 2.751 3.158 1.00 0.30 H new ATOM 0 HE2 MET A 212 3.428 2.636 1.645 1.00 0.30 H new ATOM 0 HE3 MET A 212 4.989 3.492 1.668 1.00 0.30 H new ATOM 1449 N CYS A 213 4.020 2.588 -1.458 1.00 0.27 N ATOM 1450 CA CYS A 213 5.270 1.953 -1.756 1.00 0.24 C ATOM 1451 C CYS A 213 6.120 2.886 -2.631 1.00 0.23 C ATOM 1452 O CYS A 213 7.343 2.805 -2.624 1.00 0.25 O ATOM 1453 CB CYS A 213 5.040 0.601 -2.411 1.00 0.27 C ATOM 1454 SG CYS A 213 4.725 -0.767 -1.257 1.00 0.68 S ATOM 0 H CYS A 213 3.190 2.085 -1.770 1.00 0.27 H new ATOM 0 HA CYS A 213 5.818 1.765 -0.832 1.00 0.24 H new ATOM 0 HB2 CYS A 213 4.194 0.684 -3.093 1.00 0.27 H new ATOM 0 HB3 CYS A 213 5.913 0.353 -3.015 1.00 0.27 H new ATOM 1459 N ILE A 214 5.459 3.785 -3.372 1.00 0.23 N ATOM 1460 CA ILE A 214 6.155 4.855 -4.091 1.00 0.24 C ATOM 1461 C ILE A 214 6.574 5.957 -3.133 1.00 0.25 C ATOM 1462 O ILE A 214 7.571 6.616 -3.344 1.00 0.30 O ATOM 1463 CB ILE A 214 5.286 5.491 -5.203 1.00 0.24 C ATOM 1464 CG1 ILE A 214 5.813 5.125 -6.583 1.00 0.30 C ATOM 1465 CG2 ILE A 214 5.265 7.001 -5.058 1.00 0.26 C ATOM 1466 CD1 ILE A 214 6.009 3.652 -6.750 1.00 0.34 C ATOM 0 H ILE A 214 4.446 3.791 -3.488 1.00 0.23 H new ATOM 0 HA ILE A 214 7.026 4.390 -4.553 1.00 0.24 H new ATOM 0 HB ILE A 214 4.273 5.101 -5.098 1.00 0.24 H new ATOM 0 HG12 ILE A 214 5.117 5.484 -7.341 1.00 0.30 H new ATOM 0 HG13 ILE A 214 6.761 5.636 -6.754 1.00 0.30 H new ATOM 0 HG21 ILE A 214 4.650 7.434 -5.847 1.00 0.26 H new ATOM 0 HG22 ILE A 214 4.849 7.267 -4.086 1.00 0.26 H new ATOM 0 HG23 ILE A 214 6.281 7.388 -5.136 1.00 0.26 H new ATOM 0 HD11 ILE A 214 6.386 3.446 -7.752 1.00 0.34 H new ATOM 0 HD12 ILE A 214 6.727 3.294 -6.012 1.00 0.34 H new ATOM 0 HD13 ILE A 214 5.057 3.140 -6.608 1.00 0.34 H new ATOM 1478 N THR A 215 5.783 6.198 -2.107 1.00 0.25 N ATOM 1479 CA THR A 215 6.161 7.153 -1.098 1.00 0.27 C ATOM 1480 C THR A 215 7.477 6.692 -0.521 1.00 0.26 C ATOM 1481 O THR A 215 8.291 7.485 -0.108 1.00 0.33 O ATOM 1482 CB THR A 215 5.107 7.272 0.023 1.00 0.29 C ATOM 1483 OG1 THR A 215 4.939 8.644 0.409 1.00 0.37 O ATOM 1484 CG2 THR A 215 5.531 6.463 1.229 1.00 0.31 C ATOM 0 H THR A 215 4.881 5.747 -1.955 1.00 0.25 H new ATOM 0 HA THR A 215 6.242 8.141 -1.550 1.00 0.27 H new ATOM 0 HB THR A 215 4.161 6.887 -0.357 1.00 0.29 H new ATOM 0 HG1 THR A 215 5.567 9.204 -0.093 1.00 0.37 H new ATOM 0 HG21 THR A 215 4.779 6.556 2.012 1.00 0.31 H new ATOM 0 HG22 THR A 215 5.633 5.415 0.947 1.00 0.31 H new ATOM 0 HG23 THR A 215 6.487 6.834 1.598 1.00 0.31 H new ATOM 1492 N GLN A 216 7.651 5.379 -0.476 1.00 0.23 N ATOM 1493 CA GLN A 216 8.927 4.794 -0.137 1.00 0.25 C ATOM 1494 C GLN A 216 10.045 5.253 -1.086 1.00 0.31 C ATOM 1495 O GLN A 216 11.176 5.322 -0.662 1.00 0.39 O ATOM 1496 CB GLN A 216 8.827 3.272 -0.061 1.00 0.25 C ATOM 1497 CG GLN A 216 7.607 2.816 0.726 1.00 0.28 C ATOM 1498 CD GLN A 216 7.703 1.395 1.231 1.00 0.88 C ATOM 1499 OE1 GLN A 216 8.162 1.152 2.344 1.00 1.69 O ATOM 1500 NE2 GLN A 216 7.268 0.450 0.418 1.00 1.58 N ATOM 0 H GLN A 216 6.915 4.700 -0.672 1.00 0.23 H new ATOM 0 HA GLN A 216 9.201 5.156 0.854 1.00 0.25 H new ATOM 0 HB2 GLN A 216 8.781 2.862 -1.070 1.00 0.25 H new ATOM 0 HB3 GLN A 216 9.728 2.873 0.405 1.00 0.25 H new ATOM 0 HG2 GLN A 216 7.463 3.484 1.575 1.00 0.28 H new ATOM 0 HG3 GLN A 216 6.723 2.908 0.094 1.00 0.28 H new ATOM 0 HE21 GLN A 216 6.894 0.698 -0.498 1.00 1.58 H new ATOM 0 HE22 GLN A 216 7.306 -0.528 0.706 1.00 1.58 H new ATOM 1509 N TYR A 217 9.730 5.618 -2.343 1.00 0.38 N ATOM 1510 CA TYR A 217 10.728 6.252 -3.246 1.00 0.49 C ATOM 1511 C TYR A 217 11.472 7.320 -2.471 1.00 0.49 C ATOM 1512 O TYR A 217 12.692 7.460 -2.520 1.00 0.57 O ATOM 1513 CB TYR A 217 10.048 6.962 -4.437 1.00 0.73 C ATOM 1514 CG TYR A 217 10.952 7.893 -5.228 1.00 0.85 C ATOM 1515 CD1 TYR A 217 11.861 7.383 -6.147 1.00 0.97 C ATOM 1516 CD2 TYR A 217 10.899 9.271 -5.055 1.00 1.07 C ATOM 1517 CE1 TYR A 217 12.687 8.219 -6.870 1.00 1.18 C ATOM 1518 CE2 TYR A 217 11.723 10.114 -5.775 1.00 1.29 C ATOM 1519 CZ TYR A 217 12.596 9.607 -6.673 1.00 1.31 C ATOM 1520 OH TYR A 217 13.439 10.417 -7.401 1.00 1.56 O ATOM 0 H TYR A 217 8.807 5.490 -2.759 1.00 0.38 H new ATOM 0 HA TYR A 217 11.387 5.467 -3.615 1.00 0.49 H new ATOM 0 HB2 TYR A 217 9.650 6.205 -5.113 1.00 0.73 H new ATOM 0 HB3 TYR A 217 9.199 7.534 -4.063 1.00 0.73 H new ATOM 0 HD1 TYR A 217 11.922 6.315 -6.298 1.00 0.97 H new ATOM 0 HD2 TYR A 217 10.201 9.690 -4.345 1.00 1.07 H new ATOM 0 HE1 TYR A 217 13.394 7.812 -7.578 1.00 1.18 H new ATOM 0 HE2 TYR A 217 11.669 11.181 -5.620 1.00 1.29 H new ATOM 0 HH TYR A 217 13.272 11.355 -7.170 1.00 1.56 H new ATOM 1530 N GLN A 218 10.657 8.089 -1.780 1.00 0.46 N ATOM 1531 CA GLN A 218 11.099 9.215 -0.981 1.00 0.51 C ATOM 1532 C GLN A 218 11.278 8.834 0.494 1.00 0.50 C ATOM 1533 O GLN A 218 12.055 9.461 1.206 1.00 0.61 O ATOM 1534 CB GLN A 218 10.074 10.355 -1.115 1.00 0.53 C ATOM 1535 CG GLN A 218 8.678 9.881 -1.470 1.00 0.48 C ATOM 1536 CD GLN A 218 7.603 10.918 -1.218 1.00 0.72 C ATOM 1537 OE1 GLN A 218 6.462 10.579 -0.899 1.00 1.31 O ATOM 1538 NE2 GLN A 218 7.948 12.184 -1.364 1.00 1.52 N ATOM 0 H GLN A 218 9.647 7.947 -1.757 1.00 0.46 H new ATOM 0 HA GLN A 218 12.072 9.539 -1.349 1.00 0.51 H new ATOM 0 HB2 GLN A 218 10.033 10.907 -0.176 1.00 0.53 H new ATOM 0 HB3 GLN A 218 10.417 11.052 -1.880 1.00 0.53 H new ATOM 0 HG2 GLN A 218 8.657 9.596 -2.522 1.00 0.48 H new ATOM 0 HG3 GLN A 218 8.450 8.985 -0.892 1.00 0.48 H new ATOM 0 HE21 GLN A 218 8.903 12.425 -1.629 1.00 1.52 H new ATOM 0 HE22 GLN A 218 7.260 12.921 -1.212 1.00 1.52 H new ATOM 1547 N GLN A 219 10.568 7.801 0.943 1.00 0.40 N ATOM 1548 CA GLN A 219 10.488 7.498 2.366 1.00 0.41 C ATOM 1549 C GLN A 219 11.447 6.388 2.751 1.00 0.39 C ATOM 1550 O GLN A 219 11.867 6.289 3.905 1.00 0.46 O ATOM 1551 CB GLN A 219 9.063 7.166 2.831 1.00 0.45 C ATOM 1552 CG GLN A 219 8.718 5.694 2.790 1.00 0.44 C ATOM 1553 CD GLN A 219 7.497 5.349 3.624 1.00 0.81 C ATOM 1554 OE1 GLN A 219 6.795 4.385 3.343 1.00 1.64 O ATOM 1555 NE2 GLN A 219 7.225 6.142 4.649 1.00 1.26 N ATOM 0 H GLN A 219 10.043 7.164 0.344 1.00 0.40 H new ATOM 0 HA GLN A 219 10.785 8.410 2.883 1.00 0.41 H new ATOM 0 HB2 GLN A 219 8.933 7.529 3.851 1.00 0.45 H new ATOM 0 HB3 GLN A 219 8.354 7.710 2.207 1.00 0.45 H new ATOM 0 HG2 GLN A 219 8.542 5.396 1.756 1.00 0.44 H new ATOM 0 HG3 GLN A 219 9.571 5.116 3.147 1.00 0.44 H new ATOM 0 HE21 GLN A 219 7.831 6.936 4.854 1.00 1.26 H new ATOM 0 HE22 GLN A 219 6.409 5.959 5.233 1.00 1.26 H new ATOM 1564 N GLU A 220 11.795 5.550 1.795 1.00 0.35 N ATOM 1565 CA GLU A 220 12.754 4.506 2.055 1.00 0.39 C ATOM 1566 C GLU A 220 14.116 5.087 2.039 1.00 0.48 C ATOM 1567 O GLU A 220 15.010 4.627 2.732 1.00 0.55 O ATOM 1568 CB GLU A 220 12.752 3.393 1.032 1.00 0.50 C ATOM 1569 CG GLU A 220 13.930 3.482 0.051 1.00 1.11 C ATOM 1570 CD GLU A 220 13.641 4.197 -1.260 1.00 2.32 C ATOM 1571 OE1 GLU A 220 12.861 3.680 -2.083 1.00 2.80 O ATOM 1572 OE2 GLU A 220 14.232 5.264 -1.489 1.00 3.07 O ATOM 0 H GLU A 220 11.430 5.574 0.843 1.00 0.35 H new ATOM 0 HA GLU A 220 12.473 4.083 3.020 1.00 0.39 H new ATOM 0 HB2 GLU A 220 12.786 2.433 1.547 1.00 0.50 H new ATOM 0 HB3 GLU A 220 11.817 3.422 0.473 1.00 0.50 H new ATOM 0 HG2 GLU A 220 14.756 3.992 0.548 1.00 1.11 H new ATOM 0 HG3 GLU A 220 14.269 2.471 -0.174 1.00 1.11 H new ATOM 1579 N SER A 221 14.288 6.099 1.230 1.00 0.52 N ATOM 1580 CA SER A 221 15.577 6.665 1.072 1.00 0.63 C ATOM 1581 C SER A 221 15.973 7.316 2.400 1.00 0.68 C ATOM 1582 O SER A 221 17.068 7.847 2.590 1.00 0.81 O ATOM 1583 CB SER A 221 15.566 7.631 -0.093 1.00 0.70 C ATOM 1584 OG SER A 221 14.877 8.830 0.213 1.00 0.86 O ATOM 0 H SER A 221 13.550 6.537 0.679 1.00 0.52 H new ATOM 0 HA SER A 221 16.326 5.910 0.834 1.00 0.63 H new ATOM 0 HB2 SER A 221 16.592 7.866 -0.378 1.00 0.70 H new ATOM 0 HB3 SER A 221 15.097 7.154 -0.954 1.00 0.70 H new ATOM 0 HG SER A 221 13.972 8.617 0.522 1.00 0.86 H new ATOM 1590 N GLN A 222 14.995 7.270 3.297 1.00 0.62 N ATOM 1591 CA GLN A 222 15.125 7.610 4.686 1.00 0.66 C ATOM 1592 C GLN A 222 15.356 6.348 5.529 1.00 0.60 C ATOM 1593 O GLN A 222 16.442 6.136 6.074 1.00 0.63 O ATOM 1594 CB GLN A 222 13.812 8.248 5.111 1.00 0.71 C ATOM 1595 CG GLN A 222 13.212 9.151 4.043 1.00 0.88 C ATOM 1596 CD GLN A 222 11.922 9.817 4.487 1.00 0.95 C ATOM 1597 OE1 GLN A 222 11.589 10.919 4.048 1.00 1.36 O ATOM 1598 NE2 GLN A 222 11.185 9.150 5.360 1.00 1.60 N ATOM 0 H GLN A 222 14.049 6.979 3.051 1.00 0.62 H new ATOM 0 HA GLN A 222 15.970 8.282 4.832 1.00 0.66 H new ATOM 0 HB2 GLN A 222 13.097 7.463 5.358 1.00 0.71 H new ATOM 0 HB3 GLN A 222 13.974 8.828 6.019 1.00 0.71 H new ATOM 0 HG2 GLN A 222 13.937 9.919 3.775 1.00 0.88 H new ATOM 0 HG3 GLN A 222 13.021 8.565 3.144 1.00 0.88 H new ATOM 0 HE21 GLN A 222 11.496 8.240 5.700 1.00 1.60 H new ATOM 0 HE22 GLN A 222 10.306 9.546 5.693 1.00 1.60 H new ATOM 1607 N ALA A 223 14.331 5.487 5.588 1.00 0.56 N ATOM 1608 CA ALA A 223 14.362 4.307 6.455 1.00 0.54 C ATOM 1609 C ALA A 223 15.153 3.180 5.847 1.00 0.53 C ATOM 1610 O ALA A 223 15.952 2.547 6.522 1.00 0.60 O ATOM 1611 CB ALA A 223 12.971 3.794 6.753 1.00 0.59 C ATOM 0 H ALA A 223 13.473 5.587 5.046 1.00 0.56 H new ATOM 0 HA ALA A 223 14.842 4.633 7.378 1.00 0.54 H new ATOM 0 HB1 ALA A 223 13.037 2.918 7.399 1.00 0.59 H new ATOM 0 HB2 ALA A 223 12.396 4.572 7.254 1.00 0.59 H new ATOM 0 HB3 ALA A 223 12.476 3.521 5.821 1.00 0.59 H new ATOM 1617 N ALA A 224 14.933 2.914 4.575 1.00 0.54 N ATOM 1618 CA ALA A 224 15.635 1.838 3.919 1.00 0.64 C ATOM 1619 C ALA A 224 17.053 2.263 3.619 1.00 0.74 C ATOM 1620 O ALA A 224 17.849 1.491 3.109 1.00 0.89 O ATOM 1621 CB ALA A 224 14.933 1.362 2.671 1.00 0.77 C ATOM 0 H ALA A 224 14.279 3.425 3.982 1.00 0.54 H new ATOM 0 HA ALA A 224 15.651 0.988 4.601 1.00 0.64 H new ATOM 0 HB1 ALA A 224 15.505 0.552 2.218 1.00 0.77 H new ATOM 0 HB2 ALA A 224 13.937 1.003 2.929 1.00 0.77 H new ATOM 0 HB3 ALA A 224 14.850 2.187 1.963 1.00 0.77 H new ATOM 1627 N TYR A 225 17.352 3.510 3.934 1.00 0.72 N ATOM 1628 CA TYR A 225 18.709 3.992 3.889 1.00 0.85 C ATOM 1629 C TYR A 225 19.359 3.649 5.205 1.00 0.89 C ATOM 1630 O TYR A 225 20.470 3.119 5.271 1.00 1.06 O ATOM 1631 CB TYR A 225 18.759 5.501 3.663 1.00 0.85 C ATOM 1632 CG TYR A 225 20.158 6.053 3.775 1.00 0.97 C ATOM 1633 CD1 TYR A 225 21.057 5.958 2.716 1.00 1.21 C ATOM 1634 CD2 TYR A 225 20.576 6.692 4.934 1.00 0.95 C ATOM 1635 CE1 TYR A 225 22.332 6.480 2.817 1.00 1.36 C ATOM 1636 CE2 TYR A 225 21.848 7.221 5.038 1.00 1.11 C ATOM 1637 CZ TYR A 225 22.752 7.029 3.986 1.00 1.29 C ATOM 1638 OH TYR A 225 23.988 7.643 4.078 1.00 1.47 O ATOM 0 H TYR A 225 16.665 4.206 4.224 1.00 0.72 H new ATOM 0 HA TYR A 225 19.235 3.523 3.057 1.00 0.85 H new ATOM 0 HB2 TYR A 225 18.358 5.731 2.676 1.00 0.85 H new ATOM 0 HB3 TYR A 225 18.117 5.996 4.391 1.00 0.85 H new ATOM 0 HD1 TYR A 225 20.753 5.469 1.802 1.00 1.21 H new ATOM 0 HD2 TYR A 225 19.896 6.777 5.768 1.00 0.95 H new ATOM 0 HE1 TYR A 225 22.996 6.451 1.965 1.00 1.36 H new ATOM 0 HE2 TYR A 225 22.141 7.775 5.918 1.00 1.11 H new ATOM 0 HH TYR A 225 24.119 7.979 4.989 1.00 1.47 H new ATOM 1648 N GLN A 226 18.624 3.977 6.245 1.00 0.77 N ATOM 1649 CA GLN A 226 18.967 3.633 7.605 1.00 0.84 C ATOM 1650 C GLN A 226 19.201 2.126 7.742 1.00 0.88 C ATOM 1651 O GLN A 226 20.193 1.686 8.319 1.00 0.96 O ATOM 1652 CB GLN A 226 17.813 4.079 8.502 1.00 0.81 C ATOM 1653 CG GLN A 226 17.305 2.993 9.414 1.00 1.19 C ATOM 1654 CD GLN A 226 16.105 3.414 10.240 1.00 1.90 C ATOM 1655 OE1 GLN A 226 15.303 4.241 9.812 1.00 2.75 O ATOM 1656 NE2 GLN A 226 15.963 2.837 11.422 1.00 2.24 N ATOM 0 H GLN A 226 17.753 4.502 6.166 1.00 0.77 H new ATOM 0 HA GLN A 226 19.891 4.133 7.897 1.00 0.84 H new ATOM 0 HB2 GLN A 226 18.139 4.926 9.106 1.00 0.81 H new ATOM 0 HB3 GLN A 226 16.992 4.430 7.877 1.00 0.81 H new ATOM 0 HG2 GLN A 226 17.038 2.122 8.816 1.00 1.19 H new ATOM 0 HG3 GLN A 226 18.108 2.686 10.084 1.00 1.19 H new ATOM 0 HE21 GLN A 226 16.650 2.155 11.742 1.00 2.24 H new ATOM 0 HE22 GLN A 226 15.166 3.074 12.013 1.00 2.24 H new ATOM 1665 N ARG A 227 18.275 1.347 7.203 1.00 0.86 N ATOM 1666 CA ARG A 227 18.319 -0.098 7.329 1.00 0.95 C ATOM 1667 C ARG A 227 19.175 -0.708 6.227 1.00 1.02 C ATOM 1668 O ARG A 227 20.084 -1.490 6.497 1.00 1.10 O ATOM 1669 CB ARG A 227 16.902 -0.681 7.283 1.00 0.98 C ATOM 1670 CG ARG A 227 16.161 -0.390 5.994 1.00 0.90 C ATOM 1671 CD ARG A 227 14.867 -1.153 5.897 1.00 0.98 C ATOM 1672 NE ARG A 227 15.121 -2.593 5.813 1.00 1.84 N ATOM 1673 CZ ARG A 227 14.748 -3.484 6.729 1.00 2.35 C ATOM 1674 NH1 ARG A 227 14.022 -3.113 7.778 1.00 2.51 N ATOM 1675 NH2 ARG A 227 15.101 -4.758 6.586 1.00 3.26 N ATOM 0 H ARG A 227 17.479 1.697 6.670 1.00 0.86 H new ATOM 0 HA ARG A 227 18.768 -0.344 8.291 1.00 0.95 H new ATOM 0 HB2 ARG A 227 16.959 -1.761 7.422 1.00 0.98 H new ATOM 0 HB3 ARG A 227 16.328 -0.282 8.119 1.00 0.98 H new ATOM 0 HG2 ARG A 227 15.956 0.679 5.928 1.00 0.90 H new ATOM 0 HG3 ARG A 227 16.796 -0.646 5.146 1.00 0.90 H new ATOM 0 HD2 ARG A 227 14.246 -0.938 6.767 1.00 0.98 H new ATOM 0 HD3 ARG A 227 14.310 -0.825 5.019 1.00 0.98 H new ATOM 0 HE ARG A 227 15.620 -2.938 4.993 1.00 1.84 H new ATOM 0 HH11 ARG A 227 13.745 -2.137 7.887 1.00 2.51 H new ATOM 0 HH12 ARG A 227 13.741 -3.804 8.474 1.00 2.51 H new ATOM 0 HH21 ARG A 227 15.654 -5.047 5.779 1.00 3.26 H new ATOM 0 HH22 ARG A 227 14.819 -5.447 7.284 1.00 3.26 H new ATOM 1689 N ALA A 228 18.874 -0.306 4.996 1.00 1.03 N ATOM 1690 CA ALA A 228 19.505 -0.829 3.798 1.00 1.15 C ATOM 1691 C ALA A 228 19.477 -2.357 3.769 1.00 1.22 C ATOM 1692 O ALA A 228 20.503 -2.990 4.096 1.00 1.61 O ATOM 1693 CB ALA A 228 20.921 -0.294 3.676 1.00 1.25 C ATOM 0 H ALA A 228 18.170 0.407 4.804 1.00 1.03 H new ATOM 0 HA ALA A 228 18.935 -0.487 2.934 1.00 1.15 H new ATOM 0 HB1 ALA A 228 21.384 -0.693 2.774 1.00 1.25 H new ATOM 0 HB2 ALA A 228 20.895 0.794 3.620 1.00 1.25 H new ATOM 0 HB3 ALA A 228 21.501 -0.599 4.547 1.00 1.25 H new TER 1699 ALA A 228