USER MOD reduce.3.24.130724 H: found=0, std=0, add=735, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 738 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 161 TYR OH : rot 180:sc= 0.0306 USER MOD Set 1.2: A 185 GLN : amide:sc= -5.05! C(o=-8.5!,f=-8.6!) USER MOD Set 1.3: A 186 HIS : no HE2:sc= -3.44! C(o=-8.5!,f=-9.3!) USER MOD Set 2.1: A 170 ASN : amide:sc= -2.14! C(o=-3.5!,f=-11!) USER MOD Set 2.2: A 172 ASN : amide:sc= -1.41! C(o=-3.5!,f=-8.8!) USER MOD Set 3.1: A 171 GLN : amide:sc= -4.37! C(o=-8.9!,f=-13!) USER MOD Set 3.2: A 216 GLN : amide:sc= -4.57! C(o=-8.9!,f=-14!) USER MOD Set 4.1: A 152 ASN : amide:sc= -25.6! C(o=-34!,f=-37!) USER MOD Set 4.2: A 153 MET CE :methyl -164:sc= -8.56! (180deg=-8.29!) USER MOD Set 5.1: A 128 MET CE :methyl -157:sc= -2.36! (180deg=-3.35!) USER MOD Set 5.2: A 162 TYR OH : rot -155:sc= 1.15 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0.00619 USER MOD Single : A 133 MET CE :methyl -123:sc= -9.18! (180deg=-15.5!) USER MOD Single : A 134 SER OG : rot -47:sc= 0.189 USER MOD Single : A 139 HIS : no HE2:sc= -1.5 K(o=-1.5,f=-3.5) USER MOD Single : A 142 ASN : amide:sc= 0.301 X(o=0.3,f=0) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot -117:sc= 1.21 USER MOD Single : A 149 TYR OH : rot -94:sc= 1.16 USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 TYR OH : rot -61:sc= 0.929 USER MOD Single : A 158 ASN : amide:sc= -1.46! K(o=-1.5!,f=-0.6) USER MOD Single : A 159 GLN : amide:sc= -0.0117 X(o=-0.012,f=0) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 176 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 180 ASN : amide:sc= -2.65! K(o=-2.6!,f=-0.78) USER MOD Single : A 182 THR OG1 : rot -94:sc= -5.15! USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 THR OG1 : rot -41:sc= 0.797 USER MOD Single : A 189 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 THR OG1 : rot 95:sc= 0.576 USER MOD Single : A 196 ASN : amide:sc= -1.21! K(o=-1.2!,f=-0.037) USER MOD Single : A 198 THR OG1 : rot 180:sc= -0.0027 USER MOD Single : A 200 THR OG1 : rot 180:sc= 0 USER MOD Single : A 203 LYS NZ :NH3+ 138:sc= -1.58 (180deg=-4.2!) USER MOD Single : A 205 MET CE :methyl -140:sc= -10.6! (180deg=-17.9!) USER MOD Single : A 211 GLN : amide:sc= -0.564 K(o=-0.56,f=0) USER MOD Single : A 212 MET CE :methyl -119:sc= -10.2! (180deg=-13.4!) USER MOD Single : A 215 THR OG1 : rot 180:sc= 0 USER MOD Single : A 217 TYR OH : rot 180:sc= 0 USER MOD Single : A 218 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 219 GLN : amide:sc= -0.0038 K(o=-0.0038,f=-0.6) USER MOD Single : A 221 SER OG : rot -74:sc= 0.798 USER MOD Single : A 222 GLN : amide:sc= -0.828 K(o=-0.83,f=-1.4) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 GLN : amide:sc= -0.897 K(o=-0.9,f=0) USER MOD ----------------------------------------------------------------- ATOM 34 N TYR A 127 9.837 -10.025 2.376 1.00 0.57 N ATOM 35 CA TYR A 127 9.514 -8.670 1.981 1.00 0.44 C ATOM 36 C TYR A 127 9.078 -7.898 3.189 1.00 0.40 C ATOM 37 O TYR A 127 7.938 -8.012 3.644 1.00 0.60 O ATOM 38 CB TYR A 127 8.438 -8.615 0.890 1.00 0.46 C ATOM 39 CG TYR A 127 8.981 -8.853 -0.499 1.00 0.65 C ATOM 40 CD1 TYR A 127 9.631 -7.851 -1.205 1.00 1.10 C ATOM 41 CD2 TYR A 127 8.819 -10.086 -1.112 1.00 1.09 C ATOM 42 CE1 TYR A 127 10.101 -8.072 -2.485 1.00 1.26 C ATOM 43 CE2 TYR A 127 9.288 -10.320 -2.387 1.00 1.30 C ATOM 44 CZ TYR A 127 10.036 -9.275 -3.036 1.00 1.17 C ATOM 45 OH TYR A 127 10.379 -9.539 -4.352 1.00 1.41 O ATOM 0 HA TYR A 127 10.411 -8.222 1.553 1.00 0.44 H new ATOM 0 HB2 TYR A 127 7.673 -9.361 1.106 1.00 0.46 H new ATOM 0 HB3 TYR A 127 7.950 -7.641 0.920 1.00 0.46 H new ATOM 0 HD1 TYR A 127 9.772 -6.883 -0.747 1.00 1.10 H new ATOM 0 HD2 TYR A 127 8.315 -10.879 -0.580 1.00 1.09 H new ATOM 0 HE1 TYR A 127 10.527 -7.253 -3.044 1.00 1.26 H new ATOM 0 HE2 TYR A 127 9.100 -11.260 -2.885 1.00 1.30 H new ATOM 0 HH TYR A 127 10.253 -10.493 -4.538 1.00 1.41 H new ATOM 55 N MET A 128 10.040 -7.172 3.715 1.00 0.42 N ATOM 56 CA MET A 128 9.865 -6.265 4.827 1.00 0.37 C ATOM 57 C MET A 128 8.529 -5.553 4.776 1.00 0.31 C ATOM 58 O MET A 128 8.233 -4.809 3.839 1.00 0.30 O ATOM 59 CB MET A 128 11.011 -5.271 4.776 1.00 0.45 C ATOM 60 CG MET A 128 11.505 -4.860 6.131 1.00 0.90 C ATOM 61 SD MET A 128 10.550 -3.512 6.846 1.00 1.18 S ATOM 62 CE MET A 128 10.386 -2.446 5.413 1.00 0.45 C ATOM 0 H MET A 128 10.999 -7.198 3.368 1.00 0.42 H new ATOM 0 HA MET A 128 9.872 -6.822 5.764 1.00 0.37 H new ATOM 0 HB2 MET A 128 11.836 -5.708 4.214 1.00 0.45 H new ATOM 0 HB3 MET A 128 10.689 -4.384 4.231 1.00 0.45 H new ATOM 0 HG2 MET A 128 11.469 -5.719 6.801 1.00 0.90 H new ATOM 0 HG3 MET A 128 12.550 -4.558 6.055 1.00 0.90 H new ATOM 0 HE1 MET A 128 10.199 -1.423 5.740 1.00 0.45 H new ATOM 0 HE2 MET A 128 11.306 -2.478 4.829 1.00 0.45 H new ATOM 0 HE3 MET A 128 9.554 -2.788 4.798 1.00 0.45 H new ATOM 72 N LEU A 129 7.705 -5.827 5.772 1.00 0.32 N ATOM 73 CA LEU A 129 6.433 -5.158 5.905 1.00 0.28 C ATOM 74 C LEU A 129 6.665 -3.666 5.988 1.00 0.26 C ATOM 75 O LEU A 129 7.436 -3.199 6.826 1.00 0.30 O ATOM 76 CB LEU A 129 5.676 -5.665 7.146 1.00 0.33 C ATOM 77 CG LEU A 129 4.336 -4.990 7.440 1.00 0.35 C ATOM 78 CD1 LEU A 129 3.352 -5.995 8.007 1.00 0.87 C ATOM 79 CD2 LEU A 129 4.526 -3.860 8.428 1.00 0.80 C ATOM 0 H LEU A 129 7.900 -6.513 6.502 1.00 0.32 H new ATOM 0 HA LEU A 129 5.817 -5.378 5.033 1.00 0.28 H new ATOM 0 HB2 LEU A 129 5.503 -6.735 7.029 1.00 0.33 H new ATOM 0 HB3 LEU A 129 6.321 -5.540 8.016 1.00 0.33 H new ATOM 0 HG LEU A 129 3.941 -4.590 6.506 1.00 0.35 H new ATOM 0 HD11 LEU A 129 2.403 -5.500 8.211 1.00 0.87 H new ATOM 0 HD12 LEU A 129 3.195 -6.797 7.286 1.00 0.87 H new ATOM 0 HD13 LEU A 129 3.750 -6.412 8.932 1.00 0.87 H new ATOM 0 HD21 LEU A 129 3.565 -3.387 8.629 1.00 0.80 H new ATOM 0 HD22 LEU A 129 4.938 -4.254 9.357 1.00 0.80 H new ATOM 0 HD23 LEU A 129 5.212 -3.123 8.011 1.00 0.80 H new ATOM 91 N GLY A 130 6.035 -2.938 5.088 1.00 0.23 N ATOM 92 CA GLY A 130 6.041 -1.502 5.144 1.00 0.25 C ATOM 93 C GLY A 130 5.336 -1.031 6.378 1.00 0.21 C ATOM 94 O GLY A 130 4.161 -0.684 6.295 1.00 0.20 O ATOM 0 H GLY A 130 5.510 -3.328 4.305 1.00 0.23 H new ATOM 0 HA2 GLY A 130 7.067 -1.135 5.140 1.00 0.25 H new ATOM 0 HA3 GLY A 130 5.553 -1.094 4.259 1.00 0.25 H new ATOM 98 N SER A 131 6.061 -1.119 7.507 1.00 0.26 N ATOM 99 CA SER A 131 5.585 -0.765 8.858 1.00 0.31 C ATOM 100 C SER A 131 4.431 0.234 8.867 1.00 0.23 C ATOM 101 O SER A 131 4.634 1.438 9.042 1.00 0.29 O ATOM 102 CB SER A 131 6.755 -0.224 9.681 1.00 0.53 C ATOM 103 OG SER A 131 7.841 -1.143 9.686 1.00 1.41 O ATOM 0 H SER A 131 7.026 -1.449 7.505 1.00 0.26 H new ATOM 0 HA SER A 131 5.190 -1.680 9.300 1.00 0.31 H new ATOM 0 HB2 SER A 131 7.083 0.731 9.270 1.00 0.53 H new ATOM 0 HB3 SER A 131 6.429 -0.035 10.704 1.00 0.53 H new ATOM 0 HG SER A 131 8.578 -0.775 10.217 1.00 1.41 H new ATOM 109 N ALA A 132 3.223 -0.299 8.669 1.00 0.23 N ATOM 110 CA ALA A 132 1.990 0.486 8.594 1.00 0.24 C ATOM 111 C ALA A 132 2.144 1.756 7.757 1.00 0.21 C ATOM 112 O ALA A 132 1.449 2.753 7.989 1.00 0.31 O ATOM 113 CB ALA A 132 1.484 0.801 9.985 1.00 0.33 C ATOM 0 H ALA A 132 3.073 -1.301 8.555 1.00 0.23 H new ATOM 0 HA ALA A 132 1.249 -0.126 8.079 1.00 0.24 H new ATOM 0 HB1 ALA A 132 0.566 1.385 9.915 1.00 0.33 H new ATOM 0 HB2 ALA A 132 1.283 -0.128 10.518 1.00 0.33 H new ATOM 0 HB3 ALA A 132 2.238 1.373 10.526 1.00 0.33 H new ATOM 119 N MET A 133 3.008 1.672 6.742 1.00 0.16 N ATOM 120 CA MET A 133 3.199 2.738 5.763 1.00 0.21 C ATOM 121 C MET A 133 3.299 4.102 6.429 1.00 0.29 C ATOM 122 O MET A 133 3.802 4.240 7.546 1.00 0.55 O ATOM 123 CB MET A 133 2.041 2.720 4.753 1.00 0.20 C ATOM 124 CG MET A 133 2.144 1.582 3.754 1.00 0.26 C ATOM 125 SD MET A 133 0.573 1.113 2.993 1.00 0.41 S ATOM 126 CE MET A 133 0.045 2.643 2.254 1.00 0.22 C ATOM 0 H MET A 133 3.597 0.856 6.578 1.00 0.16 H new ATOM 0 HA MET A 133 4.141 2.560 5.244 1.00 0.21 H new ATOM 0 HB2 MET A 133 1.097 2.639 5.292 1.00 0.20 H new ATOM 0 HB3 MET A 133 2.020 3.668 4.215 1.00 0.20 H new ATOM 0 HG2 MET A 133 2.844 1.867 2.968 1.00 0.26 H new ATOM 0 HG3 MET A 133 2.565 0.711 4.256 1.00 0.26 H new ATOM 0 HE1 MET A 133 -0.939 2.912 2.638 1.00 0.22 H new ATOM 0 HE2 MET A 133 0.758 3.430 2.499 1.00 0.22 H new ATOM 0 HE3 MET A 133 -0.008 2.525 1.172 1.00 0.22 H new ATOM 136 N SER A 134 2.849 5.108 5.716 1.00 0.47 N ATOM 137 CA SER A 134 2.682 6.426 6.276 1.00 0.56 C ATOM 138 C SER A 134 1.188 6.709 6.385 1.00 0.61 C ATOM 139 O SER A 134 0.765 7.860 6.374 1.00 0.74 O ATOM 140 CB SER A 134 3.372 7.459 5.379 1.00 0.65 C ATOM 141 OG SER A 134 3.488 8.715 6.021 1.00 1.52 O ATOM 0 H SER A 134 2.589 5.035 4.732 1.00 0.47 H new ATOM 0 HA SER A 134 3.136 6.486 7.265 1.00 0.56 H new ATOM 0 HB2 SER A 134 4.363 7.098 5.104 1.00 0.65 H new ATOM 0 HB3 SER A 134 2.806 7.574 4.454 1.00 0.65 H new ATOM 0 HG SER A 134 2.628 8.956 6.425 1.00 1.52 H new ATOM 147 N ARG A 135 0.407 5.616 6.495 1.00 0.61 N ATOM 148 CA ARG A 135 -1.070 5.648 6.476 1.00 0.76 C ATOM 149 C ARG A 135 -1.633 6.601 5.431 1.00 0.75 C ATOM 150 O ARG A 135 -2.732 7.062 5.606 1.00 1.14 O ATOM 151 CB ARG A 135 -1.646 5.960 7.878 1.00 1.01 C ATOM 152 CG ARG A 135 -1.264 7.312 8.504 1.00 0.98 C ATOM 153 CD ARG A 135 -1.770 8.476 7.665 1.00 1.57 C ATOM 154 NE ARG A 135 -1.918 9.729 8.401 1.00 2.57 N ATOM 155 CZ ARG A 135 -2.132 10.910 7.813 1.00 3.27 C ATOM 156 NH1 ARG A 135 -2.186 10.999 6.489 1.00 3.37 N ATOM 157 NH2 ARG A 135 -2.316 11.997 8.549 1.00 4.17 N ATOM 0 H ARG A 135 0.788 4.676 6.601 1.00 0.61 H new ATOM 0 HA ARG A 135 -1.390 4.647 6.187 1.00 0.76 H new ATOM 0 HB2 ARG A 135 -2.733 5.910 7.817 1.00 1.01 H new ATOM 0 HB3 ARG A 135 -1.329 5.170 8.558 1.00 1.01 H new ATOM 0 HG2 ARG A 135 -1.679 7.379 9.510 1.00 0.98 H new ATOM 0 HG3 ARG A 135 -0.180 7.376 8.602 1.00 0.98 H new ATOM 0 HD2 ARG A 135 -1.083 8.635 6.834 1.00 1.57 H new ATOM 0 HD3 ARG A 135 -2.734 8.206 7.234 1.00 1.57 H new ATOM 0 HE ARG A 135 -1.855 9.701 9.419 1.00 2.57 H new ATOM 0 HH11 ARG A 135 -2.064 10.164 5.916 1.00 3.37 H new ATOM 0 HH12 ARG A 135 -2.350 11.903 6.045 1.00 3.37 H new ATOM 0 HH21 ARG A 135 -2.294 11.933 9.567 1.00 4.17 H new ATOM 0 HH22 ARG A 135 -2.479 12.897 8.098 1.00 4.17 H new ATOM 171 N PRO A 136 -0.982 6.737 4.261 1.00 0.54 N ATOM 172 CA PRO A 136 -1.115 7.882 3.335 1.00 0.50 C ATOM 173 C PRO A 136 -2.424 8.647 3.445 1.00 0.51 C ATOM 174 O PRO A 136 -2.419 9.861 3.651 1.00 0.57 O ATOM 175 CB PRO A 136 -1.011 7.199 1.963 1.00 0.55 C ATOM 176 CG PRO A 136 -0.908 5.750 2.293 1.00 0.62 C ATOM 177 CD PRO A 136 -0.217 5.712 3.605 1.00 0.59 C ATOM 0 HA PRO A 136 -0.365 8.645 3.542 1.00 0.50 H new ATOM 0 HB2 PRO A 136 -1.885 7.407 1.345 1.00 0.55 H new ATOM 0 HB3 PRO A 136 -0.139 7.546 1.409 1.00 0.55 H new ATOM 0 HG2 PRO A 136 -1.893 5.286 2.350 1.00 0.62 H new ATOM 0 HG3 PRO A 136 -0.344 5.210 1.533 1.00 0.62 H new ATOM 0 HD2 PRO A 136 -0.293 4.743 4.098 1.00 0.59 H new ATOM 0 HD3 PRO A 136 0.844 5.952 3.535 1.00 0.59 H new ATOM 185 N LEU A 137 -3.533 7.922 3.330 1.00 0.50 N ATOM 186 CA LEU A 137 -4.852 8.521 3.372 1.00 0.54 C ATOM 187 C LEU A 137 -4.991 9.492 2.202 1.00 0.58 C ATOM 188 O LEU A 137 -4.887 10.712 2.345 1.00 0.99 O ATOM 189 CB LEU A 137 -5.106 9.213 4.720 1.00 0.59 C ATOM 190 CG LEU A 137 -5.088 8.309 5.958 1.00 0.64 C ATOM 191 CD1 LEU A 137 -5.435 9.104 7.195 1.00 0.97 C ATOM 192 CD2 LEU A 137 -6.012 7.109 5.820 1.00 0.90 C ATOM 0 H LEU A 137 -3.537 6.910 3.206 1.00 0.50 H new ATOM 0 HA LEU A 137 -5.609 7.742 3.277 1.00 0.54 H new ATOM 0 HB2 LEU A 137 -4.354 9.991 4.853 1.00 0.59 H new ATOM 0 HB3 LEU A 137 -6.075 9.710 4.673 1.00 0.59 H new ATOM 0 HG LEU A 137 -4.075 7.919 6.053 1.00 0.64 H new ATOM 0 HD11 LEU A 137 -5.418 8.448 8.066 1.00 0.97 H new ATOM 0 HD12 LEU A 137 -4.707 9.904 7.329 1.00 0.97 H new ATOM 0 HD13 LEU A 137 -6.430 9.534 7.084 1.00 0.97 H new ATOM 0 HD21 LEU A 137 -5.960 6.504 6.725 1.00 0.90 H new ATOM 0 HD22 LEU A 137 -7.036 7.453 5.672 1.00 0.90 H new ATOM 0 HD23 LEU A 137 -5.704 6.509 4.964 1.00 0.90 H new ATOM 204 N ILE A 138 -5.202 8.897 1.037 1.00 0.55 N ATOM 205 CA ILE A 138 -5.171 9.593 -0.248 1.00 0.64 C ATOM 206 C ILE A 138 -6.270 10.642 -0.394 1.00 0.61 C ATOM 207 O ILE A 138 -6.150 11.533 -1.227 1.00 1.10 O ATOM 208 CB ILE A 138 -5.311 8.569 -1.395 1.00 0.91 C ATOM 209 CG1 ILE A 138 -4.440 7.350 -1.104 1.00 1.07 C ATOM 210 CG2 ILE A 138 -4.919 9.191 -2.728 1.00 1.17 C ATOM 211 CD1 ILE A 138 -2.967 7.674 -1.015 1.00 0.63 C ATOM 0 H ILE A 138 -5.403 7.901 0.953 1.00 0.55 H new ATOM 0 HA ILE A 138 -4.214 10.113 -0.295 1.00 0.64 H new ATOM 0 HB ILE A 138 -6.354 8.259 -1.461 1.00 0.91 H new ATOM 0 HG12 ILE A 138 -4.762 6.898 -0.166 1.00 1.07 H new ATOM 0 HG13 ILE A 138 -4.595 6.607 -1.886 1.00 1.07 H new ATOM 0 HG21 ILE A 138 -5.026 8.450 -3.521 1.00 1.17 H new ATOM 0 HG22 ILE A 138 -5.567 10.042 -2.937 1.00 1.17 H new ATOM 0 HG23 ILE A 138 -3.883 9.527 -2.682 1.00 1.17 H new ATOM 0 HD11 ILE A 138 -2.406 6.763 -0.806 1.00 0.63 H new ATOM 0 HD12 ILE A 138 -2.630 8.099 -1.961 1.00 0.63 H new ATOM 0 HD13 ILE A 138 -2.801 8.394 -0.214 1.00 0.63 H new ATOM 223 N HIS A 139 -7.325 10.524 0.425 1.00 0.40 N ATOM 224 CA HIS A 139 -8.557 11.352 0.378 1.00 0.41 C ATOM 225 C HIS A 139 -9.266 11.324 -0.979 1.00 0.46 C ATOM 226 O HIS A 139 -10.481 11.502 -1.043 1.00 0.82 O ATOM 227 CB HIS A 139 -8.365 12.796 0.918 1.00 0.53 C ATOM 228 CG HIS A 139 -7.047 13.443 0.621 1.00 0.65 C ATOM 229 ND1 HIS A 139 -5.910 13.185 1.357 1.00 0.86 N ATOM 230 CD2 HIS A 139 -6.672 14.312 -0.346 1.00 1.13 C ATOM 231 CE1 HIS A 139 -4.897 13.857 0.852 1.00 1.07 C ATOM 232 NE2 HIS A 139 -5.329 14.550 -0.184 1.00 1.28 N ATOM 0 H HIS A 139 -7.353 9.826 1.168 1.00 0.40 H new ATOM 0 HA HIS A 139 -9.234 10.863 1.078 1.00 0.41 H new ATOM 0 HB2 HIS A 139 -9.155 13.424 0.506 1.00 0.53 H new ATOM 0 HB3 HIS A 139 -8.502 12.779 1.999 1.00 0.53 H new ATOM 0 HD1 HIS A 139 -5.861 12.568 2.168 1.00 0.86 H new ATOM 0 HD2 HIS A 139 -7.311 14.739 -1.105 1.00 1.13 H new ATOM 0 HE1 HIS A 139 -3.883 13.843 1.223 1.00 1.07 H new ATOM 241 N PHE A 140 -8.513 11.106 -2.051 1.00 0.45 N ATOM 242 CA PHE A 140 -9.055 10.886 -3.391 1.00 0.41 C ATOM 243 C PHE A 140 -9.721 12.149 -3.931 1.00 0.46 C ATOM 244 O PHE A 140 -10.212 12.178 -5.060 1.00 0.64 O ATOM 245 CB PHE A 140 -10.048 9.708 -3.384 1.00 0.38 C ATOM 246 CG PHE A 140 -10.480 9.294 -4.762 1.00 0.70 C ATOM 247 CD1 PHE A 140 -9.580 8.746 -5.654 1.00 0.74 C ATOM 248 CD2 PHE A 140 -11.800 9.445 -5.156 1.00 1.23 C ATOM 249 CE1 PHE A 140 -9.984 8.356 -6.915 1.00 1.19 C ATOM 250 CE2 PHE A 140 -12.211 9.059 -6.414 1.00 1.74 C ATOM 251 CZ PHE A 140 -11.256 8.547 -7.322 1.00 1.70 C ATOM 0 H PHE A 140 -7.494 11.076 -2.016 1.00 0.45 H new ATOM 0 HA PHE A 140 -8.226 10.637 -4.053 1.00 0.41 H new ATOM 0 HB2 PHE A 140 -9.589 8.856 -2.882 1.00 0.38 H new ATOM 0 HB3 PHE A 140 -10.927 9.985 -2.802 1.00 0.38 H new ATOM 0 HD1 PHE A 140 -8.548 8.621 -5.362 1.00 0.74 H new ATOM 0 HD2 PHE A 140 -12.516 9.871 -4.469 1.00 1.23 H new ATOM 0 HE1 PHE A 140 -9.274 7.893 -7.584 1.00 1.19 H new ATOM 0 HE2 PHE A 140 -13.248 9.147 -6.702 1.00 1.74 H new ATOM 0 HZ PHE A 140 -11.543 8.310 -8.336 1.00 1.70 H new ATOM 261 N GLY A 141 -9.711 13.196 -3.126 1.00 0.47 N ATOM 262 CA GLY A 141 -10.451 14.384 -3.456 1.00 0.53 C ATOM 263 C GLY A 141 -11.934 14.186 -3.232 1.00 0.48 C ATOM 264 O GLY A 141 -12.732 15.079 -3.517 1.00 0.54 O ATOM 0 H GLY A 141 -9.199 13.241 -2.245 1.00 0.47 H new ATOM 0 HA2 GLY A 141 -10.097 15.217 -2.848 1.00 0.53 H new ATOM 0 HA3 GLY A 141 -10.270 14.650 -4.497 1.00 0.53 H new ATOM 268 N ASN A 142 -12.308 13.014 -2.712 1.00 0.41 N ATOM 269 CA ASN A 142 -13.698 12.683 -2.509 1.00 0.45 C ATOM 270 C ASN A 142 -13.855 12.083 -1.135 1.00 0.47 C ATOM 271 O ASN A 142 -13.482 10.946 -0.928 1.00 0.46 O ATOM 272 CB ASN A 142 -14.170 11.686 -3.570 1.00 0.48 C ATOM 273 CG ASN A 142 -14.328 12.311 -4.942 1.00 1.22 C ATOM 274 OD1 ASN A 142 -15.401 12.798 -5.297 1.00 1.71 O ATOM 275 ND2 ASN A 142 -13.255 12.308 -5.722 1.00 1.88 N ATOM 0 H ASN A 142 -11.655 12.284 -2.427 1.00 0.41 H new ATOM 0 HA ASN A 142 -14.304 13.585 -2.594 1.00 0.45 H new ATOM 0 HB2 ASN A 142 -13.457 10.864 -3.631 1.00 0.48 H new ATOM 0 HB3 ASN A 142 -15.123 11.258 -3.260 1.00 0.48 H new ATOM 0 HD21 ASN A 142 -13.301 12.720 -6.654 1.00 1.88 H new ATOM 0 HD22 ASN A 142 -12.384 11.894 -5.390 1.00 1.88 H new ATOM 282 N ASP A 143 -14.369 12.864 -0.201 1.00 0.54 N ATOM 283 CA ASP A 143 -14.476 12.451 1.192 1.00 0.57 C ATOM 284 C ASP A 143 -15.308 11.190 1.357 1.00 0.52 C ATOM 285 O ASP A 143 -15.153 10.472 2.343 1.00 0.52 O ATOM 286 CB ASP A 143 -15.054 13.566 2.058 1.00 0.72 C ATOM 287 CG ASP A 143 -16.572 13.579 2.104 1.00 1.04 C ATOM 288 OD1 ASP A 143 -17.196 14.174 1.199 1.00 1.14 O ATOM 289 OD2 ASP A 143 -17.145 13.003 3.052 1.00 1.39 O ATOM 0 H ASP A 143 -14.724 13.802 -0.384 1.00 0.54 H new ATOM 0 HA ASP A 143 -13.462 12.231 1.525 1.00 0.57 H new ATOM 0 HB2 ASP A 143 -14.670 13.462 3.073 1.00 0.72 H new ATOM 0 HB3 ASP A 143 -14.703 14.526 1.681 1.00 0.72 H new ATOM 294 N TYR A 144 -16.184 10.910 0.404 1.00 0.53 N ATOM 295 CA TYR A 144 -16.933 9.668 0.435 1.00 0.55 C ATOM 296 C TYR A 144 -15.972 8.507 0.220 1.00 0.45 C ATOM 297 O TYR A 144 -16.094 7.453 0.840 1.00 0.47 O ATOM 298 CB TYR A 144 -18.031 9.663 -0.624 1.00 0.63 C ATOM 299 CG TYR A 144 -18.966 8.480 -0.511 1.00 0.82 C ATOM 300 CD1 TYR A 144 -20.019 8.481 0.395 1.00 1.15 C ATOM 301 CD2 TYR A 144 -18.802 7.365 -1.321 1.00 0.90 C ATOM 302 CE1 TYR A 144 -20.879 7.403 0.490 1.00 1.41 C ATOM 303 CE2 TYR A 144 -19.654 6.283 -1.231 1.00 1.19 C ATOM 304 CZ TYR A 144 -20.681 6.303 -0.285 1.00 1.40 C ATOM 305 OH TYR A 144 -21.549 5.234 -0.236 1.00 1.70 O ATOM 0 H TYR A 144 -16.390 11.518 -0.389 1.00 0.53 H new ATOM 0 HA TYR A 144 -17.418 9.566 1.406 1.00 0.55 H new ATOM 0 HB2 TYR A 144 -18.609 10.583 -0.542 1.00 0.63 H new ATOM 0 HB3 TYR A 144 -17.572 9.662 -1.613 1.00 0.63 H new ATOM 0 HD1 TYR A 144 -20.168 9.338 1.035 1.00 1.15 H new ATOM 0 HD2 TYR A 144 -17.992 7.344 -2.035 1.00 0.90 H new ATOM 0 HE1 TYR A 144 -21.709 7.434 1.180 1.00 1.41 H new ATOM 0 HE2 TYR A 144 -19.528 5.432 -1.884 1.00 1.19 H new ATOM 0 HH TYR A 144 -21.249 4.540 -0.859 1.00 1.70 H new ATOM 315 N GLU A 145 -14.997 8.727 -0.643 1.00 0.39 N ATOM 316 CA GLU A 145 -13.923 7.775 -0.841 1.00 0.34 C ATOM 317 C GLU A 145 -12.877 7.914 0.223 1.00 0.33 C ATOM 318 O GLU A 145 -12.224 6.939 0.598 1.00 0.34 O ATOM 319 CB GLU A 145 -13.241 7.959 -2.154 1.00 0.34 C ATOM 320 CG GLU A 145 -13.974 7.337 -3.318 1.00 0.43 C ATOM 321 CD GLU A 145 -15.227 8.084 -3.721 1.00 1.12 C ATOM 322 OE1 GLU A 145 -16.292 7.825 -3.125 1.00 1.23 O ATOM 323 OE2 GLU A 145 -15.154 8.940 -4.623 1.00 2.20 O ATOM 0 H GLU A 145 -14.928 9.564 -1.222 1.00 0.39 H new ATOM 0 HA GLU A 145 -14.390 6.791 -0.803 1.00 0.34 H new ATOM 0 HB2 GLU A 145 -13.119 9.026 -2.342 1.00 0.34 H new ATOM 0 HB3 GLU A 145 -12.241 7.529 -2.096 1.00 0.34 H new ATOM 0 HG2 GLU A 145 -13.301 7.287 -4.174 1.00 0.43 H new ATOM 0 HG3 GLU A 145 -14.240 6.312 -3.061 1.00 0.43 H new ATOM 330 N ASP A 146 -12.691 9.141 0.672 1.00 0.37 N ATOM 331 CA ASP A 146 -11.761 9.422 1.731 1.00 0.45 C ATOM 332 C ASP A 146 -12.113 8.564 2.905 1.00 0.45 C ATOM 333 O ASP A 146 -11.269 7.997 3.586 1.00 0.49 O ATOM 334 CB ASP A 146 -11.807 10.889 2.142 1.00 0.56 C ATOM 335 CG ASP A 146 -10.956 11.199 3.362 1.00 1.11 C ATOM 336 OD1 ASP A 146 -9.734 11.394 3.210 1.00 1.44 O ATOM 337 OD2 ASP A 146 -11.497 11.230 4.479 1.00 1.40 O ATOM 0 H ASP A 146 -13.180 9.960 0.311 1.00 0.37 H new ATOM 0 HA ASP A 146 -10.752 9.208 1.380 1.00 0.45 H new ATOM 0 HB2 ASP A 146 -11.470 11.504 1.307 1.00 0.56 H new ATOM 0 HB3 ASP A 146 -12.840 11.169 2.348 1.00 0.56 H new ATOM 342 N ARG A 147 -13.394 8.438 3.067 1.00 0.47 N ATOM 343 CA ARG A 147 -13.969 7.660 4.121 1.00 0.52 C ATOM 344 C ARG A 147 -13.984 6.193 3.756 1.00 0.50 C ATOM 345 O ARG A 147 -13.864 5.328 4.618 1.00 0.54 O ATOM 346 CB ARG A 147 -15.377 8.204 4.392 1.00 0.57 C ATOM 347 CG ARG A 147 -16.419 7.145 4.755 1.00 0.66 C ATOM 348 CD ARG A 147 -16.986 6.481 3.509 1.00 0.69 C ATOM 349 NE ARG A 147 -17.468 5.121 3.763 1.00 1.11 N ATOM 350 CZ ARG A 147 -18.588 4.611 3.248 1.00 1.15 C ATOM 351 NH1 ARG A 147 -19.413 5.373 2.545 1.00 1.34 N ATOM 352 NH2 ARG A 147 -18.892 3.338 3.460 1.00 1.94 N ATOM 0 H ARG A 147 -14.082 8.881 2.459 1.00 0.47 H new ATOM 0 HA ARG A 147 -13.372 7.741 5.030 1.00 0.52 H new ATOM 0 HB2 ARG A 147 -15.320 8.930 5.203 1.00 0.57 H new ATOM 0 HB3 ARG A 147 -15.719 8.741 3.507 1.00 0.57 H new ATOM 0 HG2 ARG A 147 -15.966 6.391 5.398 1.00 0.66 H new ATOM 0 HG3 ARG A 147 -17.226 7.606 5.324 1.00 0.66 H new ATOM 0 HD2 ARG A 147 -17.805 7.086 3.121 1.00 0.69 H new ATOM 0 HD3 ARG A 147 -16.218 6.451 2.736 1.00 0.69 H new ATOM 0 HE ARG A 147 -16.910 4.525 4.374 1.00 1.11 H new ATOM 0 HH11 ARG A 147 -19.194 6.358 2.394 1.00 1.34 H new ATOM 0 HH12 ARG A 147 -20.267 4.975 2.155 1.00 1.34 H new ATOM 0 HH21 ARG A 147 -18.270 2.751 4.016 1.00 1.94 H new ATOM 0 HH22 ARG A 147 -19.748 2.946 3.067 1.00 1.94 H new ATOM 366 N TYR A 148 -14.116 5.929 2.476 1.00 0.45 N ATOM 367 CA TYR A 148 -14.216 4.577 1.980 1.00 0.46 C ATOM 368 C TYR A 148 -12.940 3.812 2.273 1.00 0.44 C ATOM 369 O TYR A 148 -12.937 2.592 2.366 1.00 0.57 O ATOM 370 CB TYR A 148 -14.521 4.620 0.481 1.00 0.47 C ATOM 371 CG TYR A 148 -14.910 3.305 -0.137 1.00 0.49 C ATOM 372 CD1 TYR A 148 -15.991 2.577 0.344 1.00 0.71 C ATOM 373 CD2 TYR A 148 -14.203 2.800 -1.216 1.00 0.38 C ATOM 374 CE1 TYR A 148 -16.353 1.378 -0.239 1.00 0.77 C ATOM 375 CE2 TYR A 148 -14.561 1.608 -1.803 1.00 0.43 C ATOM 376 CZ TYR A 148 -15.635 0.902 -1.313 1.00 0.60 C ATOM 377 OH TYR A 148 -15.984 -0.291 -1.900 1.00 0.68 O ATOM 0 H TYR A 148 -14.157 6.645 1.751 1.00 0.45 H new ATOM 0 HA TYR A 148 -15.027 4.052 2.485 1.00 0.46 H new ATOM 0 HB2 TYR A 148 -15.327 5.334 0.312 1.00 0.47 H new ATOM 0 HB3 TYR A 148 -13.643 5.001 -0.040 1.00 0.47 H new ATOM 0 HD1 TYR A 148 -16.556 2.953 1.184 1.00 0.71 H new ATOM 0 HD2 TYR A 148 -13.358 3.350 -1.602 1.00 0.38 H new ATOM 0 HE1 TYR A 148 -17.193 0.818 0.145 1.00 0.77 H new ATOM 0 HE2 TYR A 148 -14.001 1.228 -2.645 1.00 0.43 H new ATOM 0 HH TYR A 148 -15.251 -0.933 -1.796 1.00 0.68 H new ATOM 387 N TYR A 149 -11.860 4.554 2.399 1.00 0.41 N ATOM 388 CA TYR A 149 -10.577 4.002 2.736 1.00 0.43 C ATOM 389 C TYR A 149 -10.244 4.241 4.189 1.00 0.41 C ATOM 390 O TYR A 149 -9.481 3.510 4.789 1.00 0.40 O ATOM 391 CB TYR A 149 -9.528 4.574 1.818 1.00 0.54 C ATOM 392 CG TYR A 149 -9.069 5.963 2.128 1.00 0.67 C ATOM 393 CD1 TYR A 149 -8.431 6.253 3.311 1.00 1.40 C ATOM 394 CD2 TYR A 149 -9.286 6.983 1.225 1.00 0.97 C ATOM 395 CE1 TYR A 149 -8.022 7.527 3.598 1.00 2.09 C ATOM 396 CE2 TYR A 149 -8.876 8.263 1.502 1.00 1.54 C ATOM 397 CZ TYR A 149 -8.246 8.529 2.696 1.00 2.08 C ATOM 398 OH TYR A 149 -7.825 9.798 2.989 1.00 2.82 O ATOM 0 H TYR A 149 -11.854 5.566 2.268 1.00 0.41 H new ATOM 0 HA TYR A 149 -10.605 2.921 2.597 1.00 0.43 H new ATOM 0 HB2 TYR A 149 -8.661 3.914 1.835 1.00 0.54 H new ATOM 0 HB3 TYR A 149 -9.919 4.561 0.800 1.00 0.54 H new ATOM 0 HD1 TYR A 149 -8.250 5.463 4.025 1.00 1.40 H new ATOM 0 HD2 TYR A 149 -9.784 6.772 0.290 1.00 0.97 H new ATOM 0 HE1 TYR A 149 -7.525 7.740 4.533 1.00 2.09 H new ATOM 0 HE2 TYR A 149 -9.047 9.055 0.788 1.00 1.54 H new ATOM 0 HH TYR A 149 -8.558 10.298 3.404 1.00 2.82 H new ATOM 408 N ARG A 150 -10.800 5.304 4.746 1.00 0.45 N ATOM 409 CA ARG A 150 -10.544 5.649 6.129 1.00 0.48 C ATOM 410 C ARG A 150 -11.246 4.634 7.001 1.00 0.50 C ATOM 411 O ARG A 150 -11.019 4.515 8.208 1.00 0.60 O ATOM 412 CB ARG A 150 -11.027 7.076 6.384 1.00 0.56 C ATOM 413 CG ARG A 150 -12.300 7.177 7.214 1.00 0.59 C ATOM 414 CD ARG A 150 -12.924 8.559 7.134 1.00 1.15 C ATOM 415 NE ARG A 150 -11.973 9.627 7.420 1.00 1.83 N ATOM 416 CZ ARG A 150 -12.307 10.798 7.957 1.00 2.65 C ATOM 417 NH1 ARG A 150 -13.565 11.037 8.326 1.00 2.97 N ATOM 418 NH2 ARG A 150 -11.379 11.728 8.123 1.00 3.59 N ATOM 0 H ARG A 150 -11.431 5.941 4.260 1.00 0.45 H new ATOM 0 HA ARG A 150 -9.480 5.622 6.364 1.00 0.48 H new ATOM 0 HB2 ARG A 150 -10.235 7.629 6.889 1.00 0.56 H new ATOM 0 HB3 ARG A 150 -11.195 7.565 5.425 1.00 0.56 H new ATOM 0 HG2 ARG A 150 -13.019 6.434 6.867 1.00 0.59 H new ATOM 0 HG3 ARG A 150 -12.074 6.941 8.254 1.00 0.59 H new ATOM 0 HD2 ARG A 150 -13.341 8.707 6.138 1.00 1.15 H new ATOM 0 HD3 ARG A 150 -13.753 8.619 7.839 1.00 1.15 H new ATOM 0 HE ARG A 150 -10.991 9.467 7.195 1.00 1.83 H new ATOM 0 HH11 ARG A 150 -14.279 10.320 8.198 1.00 2.97 H new ATOM 0 HH12 ARG A 150 -13.814 11.937 8.737 1.00 2.97 H new ATOM 0 HH21 ARG A 150 -10.416 11.544 7.840 1.00 3.59 H new ATOM 0 HH22 ARG A 150 -11.627 12.628 8.534 1.00 3.59 H new ATOM 432 N GLU A 151 -12.101 3.901 6.332 1.00 0.44 N ATOM 433 CA GLU A 151 -12.795 2.791 6.896 1.00 0.48 C ATOM 434 C GLU A 151 -12.050 1.545 6.486 1.00 0.44 C ATOM 435 O GLU A 151 -12.191 0.480 7.089 1.00 0.50 O ATOM 436 CB GLU A 151 -14.231 2.775 6.359 1.00 0.54 C ATOM 437 CG GLU A 151 -14.409 1.981 5.078 1.00 0.49 C ATOM 438 CD GLU A 151 -15.848 1.587 4.848 1.00 0.60 C ATOM 439 OE1 GLU A 151 -16.670 2.474 4.560 1.00 0.73 O ATOM 440 OE2 GLU A 151 -16.166 0.387 4.986 1.00 0.83 O ATOM 0 H GLU A 151 -12.333 4.072 5.354 1.00 0.44 H new ATOM 0 HA GLU A 151 -12.842 2.853 7.983 1.00 0.48 H new ATOM 0 HB2 GLU A 151 -14.888 2.361 7.124 1.00 0.54 H new ATOM 0 HB3 GLU A 151 -14.553 3.802 6.184 1.00 0.54 H new ATOM 0 HG2 GLU A 151 -14.057 2.573 4.233 1.00 0.49 H new ATOM 0 HG3 GLU A 151 -13.790 1.084 5.119 1.00 0.49 H new ATOM 447 N ASN A 152 -11.264 1.692 5.428 1.00 0.40 N ATOM 448 CA ASN A 152 -10.709 0.554 4.780 1.00 0.43 C ATOM 449 C ASN A 152 -9.242 0.317 5.100 1.00 0.37 C ATOM 450 O ASN A 152 -8.662 -0.672 4.650 1.00 0.36 O ATOM 451 CB ASN A 152 -10.997 0.544 3.277 1.00 0.62 C ATOM 452 CG ASN A 152 -9.916 1.104 2.374 1.00 0.67 C ATOM 453 OD1 ASN A 152 -8.744 1.129 2.677 1.00 1.69 O ATOM 454 ND2 ASN A 152 -10.324 1.529 1.213 1.00 0.48 N ATOM 0 H ASN A 152 -11.009 2.590 5.017 1.00 0.40 H new ATOM 0 HA ASN A 152 -11.229 -0.304 5.205 1.00 0.43 H new ATOM 0 HB2 ASN A 152 -11.194 -0.485 2.975 1.00 0.62 H new ATOM 0 HB3 ASN A 152 -11.913 1.108 3.102 1.00 0.62 H new ATOM 0 HD21 ASN A 152 -9.651 1.892 0.538 1.00 0.48 H new ATOM 0 HD22 ASN A 152 -11.316 1.499 0.979 1.00 0.48 H new ATOM 461 N MET A 153 -8.629 1.209 5.851 1.00 0.35 N ATOM 462 CA MET A 153 -7.180 1.192 5.994 1.00 0.34 C ATOM 463 C MET A 153 -6.660 -0.041 6.701 1.00 0.33 C ATOM 464 O MET A 153 -5.459 -0.172 6.927 1.00 0.36 O ATOM 465 CB MET A 153 -6.634 2.436 6.692 1.00 0.36 C ATOM 466 CG MET A 153 -5.470 3.073 5.972 1.00 0.69 C ATOM 467 SD MET A 153 -5.952 4.069 4.558 1.00 0.61 S ATOM 468 CE MET A 153 -6.644 2.803 3.515 1.00 0.34 C ATOM 0 H MET A 153 -9.102 1.950 6.369 1.00 0.35 H new ATOM 0 HA MET A 153 -6.814 1.178 4.967 1.00 0.34 H new ATOM 0 HB2 MET A 153 -7.435 3.169 6.789 1.00 0.36 H new ATOM 0 HB3 MET A 153 -6.323 2.168 7.702 1.00 0.36 H new ATOM 0 HG2 MET A 153 -4.918 3.698 6.674 1.00 0.69 H new ATOM 0 HG3 MET A 153 -4.789 2.290 5.638 1.00 0.69 H new ATOM 0 HE1 MET A 153 -6.733 3.180 2.496 1.00 0.34 H new ATOM 0 HE2 MET A 153 -5.993 1.929 3.523 1.00 0.34 H new ATOM 0 HE3 MET A 153 -7.630 2.524 3.887 1.00 0.34 H new ATOM 478 N TYR A 154 -7.546 -0.914 7.086 1.00 0.33 N ATOM 479 CA TYR A 154 -7.143 -2.144 7.710 1.00 0.36 C ATOM 480 C TYR A 154 -7.467 -3.313 6.797 1.00 0.34 C ATOM 481 O TYR A 154 -7.564 -4.457 7.236 1.00 0.39 O ATOM 482 CB TYR A 154 -7.810 -2.257 9.077 1.00 0.47 C ATOM 483 CG TYR A 154 -7.259 -1.255 10.074 1.00 0.60 C ATOM 484 CD1 TYR A 154 -7.659 0.074 10.046 1.00 0.68 C ATOM 485 CD2 TYR A 154 -6.360 -1.647 11.063 1.00 0.76 C ATOM 486 CE1 TYR A 154 -7.179 0.985 10.971 1.00 0.83 C ATOM 487 CE2 TYR A 154 -5.875 -0.743 11.986 1.00 0.92 C ATOM 488 CZ TYR A 154 -6.212 0.598 11.870 1.00 0.95 C ATOM 489 OH TYR A 154 -5.812 1.475 12.866 1.00 1.10 O ATOM 0 H TYR A 154 -8.554 -0.798 6.979 1.00 0.33 H new ATOM 0 HA TYR A 154 -6.065 -2.158 7.871 1.00 0.36 H new ATOM 0 HB2 TYR A 154 -8.884 -2.104 8.968 1.00 0.47 H new ATOM 0 HB3 TYR A 154 -7.669 -3.266 9.465 1.00 0.47 H new ATOM 0 HD1 TYR A 154 -8.356 0.403 9.290 1.00 0.68 H new ATOM 0 HD2 TYR A 154 -6.037 -2.677 11.108 1.00 0.76 H new ATOM 0 HE1 TYR A 154 -7.562 1.995 10.987 1.00 0.83 H new ATOM 0 HE2 TYR A 154 -5.238 -1.077 12.792 1.00 0.92 H new ATOM 0 HH TYR A 154 -5.123 1.050 13.419 1.00 1.10 H new ATOM 499 N ARG A 155 -7.596 -3.015 5.503 1.00 0.30 N ATOM 500 CA ARG A 155 -7.879 -4.038 4.509 1.00 0.31 C ATOM 501 C ARG A 155 -7.424 -3.615 3.106 1.00 0.25 C ATOM 502 O ARG A 155 -6.823 -4.399 2.382 1.00 0.26 O ATOM 503 CB ARG A 155 -9.357 -4.390 4.547 1.00 0.41 C ATOM 504 CG ARG A 155 -10.270 -3.398 3.871 1.00 0.60 C ATOM 505 CD ARG A 155 -10.895 -2.447 4.870 1.00 0.43 C ATOM 506 NE ARG A 155 -11.251 -3.094 6.119 1.00 0.95 N ATOM 507 CZ ARG A 155 -12.484 -3.498 6.436 1.00 1.23 C ATOM 508 NH1 ARG A 155 -13.475 -3.396 5.558 1.00 1.36 N ATOM 509 NH2 ARG A 155 -12.721 -4.029 7.625 1.00 1.92 N ATOM 0 H ARG A 155 -7.508 -2.072 5.124 1.00 0.30 H new ATOM 0 HA ARG A 155 -7.304 -4.931 4.755 1.00 0.31 H new ATOM 0 HB2 ARG A 155 -9.494 -5.364 4.078 1.00 0.41 H new ATOM 0 HB3 ARG A 155 -9.664 -4.491 5.588 1.00 0.41 H new ATOM 0 HG2 ARG A 155 -9.707 -2.830 3.130 1.00 0.60 H new ATOM 0 HG3 ARG A 155 -11.055 -3.931 3.335 1.00 0.60 H new ATOM 0 HD2 ARG A 155 -10.199 -1.633 5.074 1.00 0.43 H new ATOM 0 HD3 ARG A 155 -11.787 -2.001 4.430 1.00 0.43 H new ATOM 0 HE ARG A 155 -10.509 -3.251 6.801 1.00 0.95 H new ATOM 0 HH11 ARG A 155 -13.298 -3.006 4.632 1.00 1.36 H new ATOM 0 HH12 ARG A 155 -14.413 -3.707 5.809 1.00 1.36 H new ATOM 0 HH21 ARG A 155 -11.962 -4.130 8.299 1.00 1.92 H new ATOM 0 HH22 ARG A 155 -13.663 -4.338 7.867 1.00 1.92 H new ATOM 523 N TYR A 156 -7.713 -2.379 2.731 1.00 0.26 N ATOM 524 CA TYR A 156 -7.171 -1.783 1.511 1.00 0.24 C ATOM 525 C TYR A 156 -6.208 -0.728 1.983 1.00 0.24 C ATOM 526 O TYR A 156 -6.296 0.443 1.631 1.00 0.29 O ATOM 527 CB TYR A 156 -8.286 -1.157 0.684 1.00 0.28 C ATOM 528 CG TYR A 156 -9.534 -2.003 0.596 1.00 0.33 C ATOM 529 CD1 TYR A 156 -9.462 -3.380 0.484 1.00 0.53 C ATOM 530 CD2 TYR A 156 -10.779 -1.413 0.606 1.00 0.43 C ATOM 531 CE1 TYR A 156 -10.608 -4.147 0.383 1.00 0.62 C ATOM 532 CE2 TYR A 156 -11.925 -2.164 0.513 1.00 0.49 C ATOM 533 CZ TYR A 156 -11.837 -3.530 0.398 1.00 0.56 C ATOM 534 OH TYR A 156 -12.987 -4.279 0.293 1.00 0.65 O ATOM 0 H TYR A 156 -8.327 -1.759 3.259 1.00 0.26 H new ATOM 0 HA TYR A 156 -6.685 -2.523 0.875 1.00 0.24 H new ATOM 0 HB2 TYR A 156 -8.545 -0.190 1.115 1.00 0.28 H new ATOM 0 HB3 TYR A 156 -7.915 -0.969 -0.324 1.00 0.28 H new ATOM 0 HD1 TYR A 156 -8.496 -3.863 0.475 1.00 0.53 H new ATOM 0 HD2 TYR A 156 -10.855 -0.339 0.689 1.00 0.43 H new ATOM 0 HE1 TYR A 156 -10.539 -5.221 0.293 1.00 0.62 H new ATOM 0 HE2 TYR A 156 -12.892 -1.683 0.530 1.00 0.49 H new ATOM 0 HH TYR A 156 -12.988 -4.759 -0.561 1.00 0.65 H new ATOM 544 N PRO A 157 -5.229 -1.182 2.742 1.00 0.21 N ATOM 545 CA PRO A 157 -4.883 -0.570 3.985 1.00 0.22 C ATOM 546 C PRO A 157 -3.668 0.330 3.974 1.00 0.23 C ATOM 547 O PRO A 157 -3.129 0.695 2.929 1.00 0.25 O ATOM 548 CB PRO A 157 -4.605 -1.844 4.750 1.00 0.21 C ATOM 549 CG PRO A 157 -3.720 -2.584 3.813 1.00 0.21 C ATOM 550 CD PRO A 157 -4.292 -2.289 2.445 1.00 0.22 C ATOM 0 HA PRO A 157 -5.640 0.117 4.363 1.00 0.22 H new ATOM 0 HB2 PRO A 157 -4.115 -1.648 5.704 1.00 0.21 H new ATOM 0 HB3 PRO A 157 -5.519 -2.396 4.969 1.00 0.21 H new ATOM 0 HG2 PRO A 157 -2.686 -2.247 3.893 1.00 0.21 H new ATOM 0 HG3 PRO A 157 -3.724 -3.654 4.023 1.00 0.21 H new ATOM 0 HD2 PRO A 157 -3.521 -1.992 1.734 1.00 0.22 H new ATOM 0 HD3 PRO A 157 -4.802 -3.153 2.020 1.00 0.22 H new ATOM 558 N ASN A 158 -3.251 0.677 5.180 1.00 0.24 N ATOM 559 CA ASN A 158 -2.087 1.495 5.381 1.00 0.27 C ATOM 560 C ASN A 158 -0.875 0.637 5.626 1.00 0.32 C ATOM 561 O ASN A 158 0.073 1.084 6.230 1.00 0.57 O ATOM 562 CB ASN A 158 -2.280 2.450 6.563 1.00 0.29 C ATOM 563 CG ASN A 158 -2.394 1.743 7.908 1.00 1.07 C ATOM 564 OD1 ASN A 158 -3.466 1.289 8.300 1.00 1.56 O ATOM 565 ND2 ASN A 158 -1.294 1.674 8.638 1.00 1.86 N ATOM 0 H ASN A 158 -3.717 0.395 6.042 1.00 0.24 H new ATOM 0 HA ASN A 158 -1.938 2.083 4.475 1.00 0.27 H new ATOM 0 HB2 ASN A 158 -1.441 3.145 6.598 1.00 0.29 H new ATOM 0 HB3 ASN A 158 -3.179 3.043 6.397 1.00 0.29 H new ATOM 0 HD21 ASN A 158 -1.319 1.233 9.558 1.00 1.86 H new ATOM 0 HD22 ASN A 158 -0.420 2.061 8.282 1.00 1.86 H new ATOM 572 N GLN A 159 -0.882 -0.585 5.152 1.00 0.22 N ATOM 573 CA GLN A 159 0.320 -1.398 5.260 1.00 0.23 C ATOM 574 C GLN A 159 0.659 -2.125 3.970 1.00 0.21 C ATOM 575 O GLN A 159 -0.211 -2.408 3.145 1.00 0.24 O ATOM 576 CB GLN A 159 0.220 -2.393 6.396 1.00 0.25 C ATOM 577 CG GLN A 159 -0.824 -3.479 6.184 1.00 0.25 C ATOM 578 CD GLN A 159 -0.928 -4.430 7.360 1.00 0.42 C ATOM 579 OE1 GLN A 159 -1.712 -4.212 8.283 1.00 0.87 O ATOM 580 NE2 GLN A 159 -0.139 -5.492 7.335 1.00 0.63 N ATOM 0 H GLN A 159 -1.678 -1.035 4.699 1.00 0.22 H new ATOM 0 HA GLN A 159 1.130 -0.699 5.469 1.00 0.23 H new ATOM 0 HB2 GLN A 159 1.193 -2.863 6.539 1.00 0.25 H new ATOM 0 HB3 GLN A 159 -0.013 -1.856 7.315 1.00 0.25 H new ATOM 0 HG2 GLN A 159 -1.795 -3.015 6.011 1.00 0.25 H new ATOM 0 HG3 GLN A 159 -0.576 -4.045 5.286 1.00 0.25 H new ATOM 0 HE21 GLN A 159 0.497 -5.636 6.551 1.00 0.63 H new ATOM 0 HE22 GLN A 159 -0.167 -6.166 8.100 1.00 0.63 H new ATOM 589 N VAL A 160 1.944 -2.445 3.825 1.00 0.20 N ATOM 590 CA VAL A 160 2.460 -3.072 2.632 1.00 0.18 C ATOM 591 C VAL A 160 3.596 -3.998 2.949 1.00 0.20 C ATOM 592 O VAL A 160 4.033 -4.088 4.084 1.00 0.26 O ATOM 593 CB VAL A 160 2.931 -2.078 1.567 1.00 0.20 C ATOM 594 CG1 VAL A 160 1.789 -1.746 0.654 1.00 0.22 C ATOM 595 CG2 VAL A 160 3.489 -0.814 2.183 1.00 0.23 C ATOM 0 H VAL A 160 2.650 -2.272 4.540 1.00 0.20 H new ATOM 0 HA VAL A 160 1.616 -3.628 2.224 1.00 0.18 H new ATOM 0 HB VAL A 160 3.735 -2.546 1.000 1.00 0.20 H new ATOM 0 HG11 VAL A 160 2.123 -1.038 -0.105 1.00 0.22 H new ATOM 0 HG12 VAL A 160 1.434 -2.656 0.170 1.00 0.22 H new ATOM 0 HG13 VAL A 160 0.978 -1.302 1.232 1.00 0.22 H new ATOM 0 HG21 VAL A 160 3.812 -0.136 1.393 1.00 0.23 H new ATOM 0 HG22 VAL A 160 2.718 -0.331 2.783 1.00 0.23 H new ATOM 0 HG23 VAL A 160 4.340 -1.063 2.817 1.00 0.23 H new ATOM 605 N TYR A 161 4.001 -4.750 1.957 1.00 0.20 N ATOM 606 CA TYR A 161 5.193 -5.567 2.047 1.00 0.24 C ATOM 607 C TYR A 161 6.083 -5.267 0.859 1.00 0.31 C ATOM 608 O TYR A 161 5.627 -5.210 -0.274 1.00 0.62 O ATOM 609 CB TYR A 161 4.822 -7.036 2.071 1.00 0.26 C ATOM 610 CG TYR A 161 3.967 -7.433 3.238 1.00 0.60 C ATOM 611 CD1 TYR A 161 2.610 -7.178 3.215 1.00 1.05 C ATOM 612 CD2 TYR A 161 4.502 -8.061 4.352 1.00 0.71 C ATOM 613 CE1 TYR A 161 1.804 -7.532 4.258 1.00 1.60 C ATOM 614 CE2 TYR A 161 3.696 -8.425 5.410 1.00 1.25 C ATOM 615 CZ TYR A 161 2.345 -8.159 5.358 1.00 1.70 C ATOM 616 OH TYR A 161 1.533 -8.516 6.409 1.00 2.25 O ATOM 0 H TYR A 161 3.516 -4.816 1.062 1.00 0.20 H new ATOM 0 HA TYR A 161 5.726 -5.337 2.969 1.00 0.24 H new ATOM 0 HB2 TYR A 161 4.296 -7.282 1.149 1.00 0.26 H new ATOM 0 HB3 TYR A 161 5.736 -7.630 2.085 1.00 0.26 H new ATOM 0 HD1 TYR A 161 2.178 -6.689 2.355 1.00 1.05 H new ATOM 0 HD2 TYR A 161 5.561 -8.267 4.392 1.00 0.71 H new ATOM 0 HE1 TYR A 161 0.745 -7.321 4.221 1.00 1.60 H new ATOM 0 HE2 TYR A 161 4.121 -8.915 6.274 1.00 1.25 H new ATOM 0 HH TYR A 161 2.070 -8.949 7.105 1.00 2.25 H new ATOM 626 N TYR A 162 7.342 -5.069 1.127 1.00 0.27 N ATOM 627 CA TYR A 162 8.282 -4.638 0.117 1.00 0.35 C ATOM 628 C TYR A 162 9.670 -4.927 0.592 1.00 0.41 C ATOM 629 O TYR A 162 9.884 -5.314 1.731 1.00 0.46 O ATOM 630 CB TYR A 162 8.121 -3.143 -0.212 1.00 0.41 C ATOM 631 CG TYR A 162 8.587 -2.205 0.884 1.00 0.47 C ATOM 632 CD1 TYR A 162 7.919 -2.138 2.105 1.00 0.62 C ATOM 633 CD2 TYR A 162 9.685 -1.385 0.700 1.00 0.79 C ATOM 634 CE1 TYR A 162 8.337 -1.277 3.106 1.00 0.78 C ATOM 635 CE2 TYR A 162 10.108 -0.528 1.693 1.00 0.92 C ATOM 636 CZ TYR A 162 9.448 -0.494 2.903 1.00 0.83 C ATOM 637 OH TYR A 162 9.872 0.391 3.869 1.00 1.03 O ATOM 0 H TYR A 162 7.752 -5.200 2.052 1.00 0.27 H new ATOM 0 HA TYR A 162 8.083 -5.188 -0.803 1.00 0.35 H new ATOM 0 HB2 TYR A 162 8.678 -2.922 -1.123 1.00 0.41 H new ATOM 0 HB3 TYR A 162 7.071 -2.941 -0.423 1.00 0.41 H new ATOM 0 HD1 TYR A 162 7.059 -2.769 2.274 1.00 0.62 H new ATOM 0 HD2 TYR A 162 10.220 -1.417 -0.238 1.00 0.79 H new ATOM 0 HE1 TYR A 162 7.794 -1.221 4.038 1.00 0.78 H new ATOM 0 HE2 TYR A 162 10.957 0.117 1.523 1.00 0.92 H new ATOM 0 HH TYR A 162 10.385 1.112 3.449 1.00 1.03 H new ATOM 647 N ARG A 163 10.606 -4.751 -0.277 1.00 0.49 N ATOM 648 CA ARG A 163 11.972 -5.040 0.049 1.00 0.56 C ATOM 649 C ARG A 163 12.610 -3.738 0.490 1.00 0.60 C ATOM 650 O ARG A 163 12.162 -2.680 0.063 1.00 0.68 O ATOM 651 CB ARG A 163 12.674 -5.580 -1.194 1.00 0.71 C ATOM 652 CG ARG A 163 13.772 -6.552 -0.869 1.00 0.89 C ATOM 653 CD ARG A 163 13.243 -7.972 -0.778 1.00 1.18 C ATOM 654 NE ARG A 163 14.317 -8.955 -0.705 1.00 1.82 N ATOM 655 CZ ARG A 163 14.386 -10.033 -1.483 1.00 2.23 C ATOM 656 NH1 ARG A 163 13.451 -10.261 -2.402 1.00 2.21 N ATOM 657 NH2 ARG A 163 15.392 -10.883 -1.352 1.00 3.01 N ATOM 0 H ARG A 163 10.455 -4.407 -1.225 1.00 0.49 H new ATOM 0 HA ARG A 163 12.048 -5.785 0.841 1.00 0.56 H new ATOM 0 HB2 ARG A 163 11.941 -6.069 -1.836 1.00 0.71 H new ATOM 0 HB3 ARG A 163 13.089 -4.747 -1.761 1.00 0.71 H new ATOM 0 HG2 ARG A 163 14.546 -6.498 -1.634 1.00 0.89 H new ATOM 0 HG3 ARG A 163 14.238 -6.274 0.076 1.00 0.89 H new ATOM 0 HD2 ARG A 163 12.607 -8.065 0.102 1.00 1.18 H new ATOM 0 HD3 ARG A 163 12.619 -8.182 -1.647 1.00 1.18 H new ATOM 0 HE ARG A 163 15.058 -8.809 -0.019 1.00 1.82 H new ATOM 0 HH11 ARG A 163 12.676 -9.608 -2.514 1.00 2.21 H new ATOM 0 HH12 ARG A 163 13.510 -11.089 -2.995 1.00 2.21 H new ATOM 0 HH21 ARG A 163 16.116 -10.713 -0.654 1.00 3.01 H new ATOM 0 HH22 ARG A 163 15.443 -11.708 -1.949 1.00 3.01 H new ATOM 671 N PRO A 164 13.676 -3.752 1.299 1.00 0.61 N ATOM 672 CA PRO A 164 14.166 -2.533 1.885 1.00 0.66 C ATOM 673 C PRO A 164 15.175 -1.915 0.968 1.00 0.65 C ATOM 674 O PRO A 164 16.322 -2.354 0.838 1.00 0.73 O ATOM 675 CB PRO A 164 14.844 -2.985 3.181 1.00 0.72 C ATOM 676 CG PRO A 164 14.761 -4.485 3.190 1.00 0.71 C ATOM 677 CD PRO A 164 14.431 -4.903 1.785 1.00 0.62 C ATOM 0 HA PRO A 164 13.382 -1.796 2.060 1.00 0.66 H new ATOM 0 HB2 PRO A 164 15.881 -2.651 3.216 1.00 0.72 H new ATOM 0 HB3 PRO A 164 14.343 -2.561 4.052 1.00 0.72 H new ATOM 0 HG2 PRO A 164 15.705 -4.924 3.514 1.00 0.71 H new ATOM 0 HG3 PRO A 164 13.995 -4.827 3.886 1.00 0.71 H new ATOM 0 HD2 PRO A 164 15.327 -5.084 1.191 1.00 0.62 H new ATOM 0 HD3 PRO A 164 13.841 -5.819 1.759 1.00 0.62 H new ATOM 685 N VAL A 165 14.689 -0.897 0.316 1.00 0.60 N ATOM 686 CA VAL A 165 15.342 -0.295 -0.796 1.00 0.63 C ATOM 687 C VAL A 165 15.997 1.002 -0.393 1.00 0.59 C ATOM 688 O VAL A 165 15.337 1.944 0.025 1.00 0.62 O ATOM 689 CB VAL A 165 14.315 0.007 -1.898 1.00 0.72 C ATOM 690 CG1 VAL A 165 13.147 0.783 -1.320 1.00 0.63 C ATOM 691 CG2 VAL A 165 14.957 0.803 -2.995 1.00 0.82 C ATOM 0 H VAL A 165 13.801 -0.455 0.556 1.00 0.60 H new ATOM 0 HA VAL A 165 16.101 -0.989 -1.159 1.00 0.63 H new ATOM 0 HB VAL A 165 13.951 -0.936 -2.307 1.00 0.72 H new ATOM 0 HG11 VAL A 165 12.424 0.993 -2.108 1.00 0.63 H new ATOM 0 HG12 VAL A 165 12.670 0.193 -0.537 1.00 0.63 H new ATOM 0 HG13 VAL A 165 13.507 1.722 -0.898 1.00 0.63 H new ATOM 0 HG21 VAL A 165 14.221 1.012 -3.771 1.00 0.82 H new ATOM 0 HG22 VAL A 165 15.334 1.742 -2.590 1.00 0.82 H new ATOM 0 HG23 VAL A 165 15.783 0.234 -3.422 1.00 0.82 H new ATOM 701 N ASP A 166 17.283 1.089 -0.553 1.00 0.68 N ATOM 702 CA ASP A 166 17.948 2.350 -0.351 1.00 0.72 C ATOM 703 C ASP A 166 17.754 3.191 -1.598 1.00 0.94 C ATOM 704 O ASP A 166 18.677 3.787 -2.151 1.00 1.54 O ATOM 705 CB ASP A 166 19.390 2.098 0.013 1.00 1.14 C ATOM 706 CG ASP A 166 20.195 1.453 -1.097 1.00 1.67 C ATOM 707 OD1 ASP A 166 19.791 0.376 -1.585 1.00 2.37 O ATOM 708 OD2 ASP A 166 21.223 2.029 -1.502 1.00 2.09 O ATOM 0 H ASP A 166 17.891 0.315 -0.820 1.00 0.68 H new ATOM 0 HA ASP A 166 17.526 2.913 0.481 1.00 0.72 H new ATOM 0 HB2 ASP A 166 19.857 3.044 0.286 1.00 1.14 H new ATOM 0 HB3 ASP A 166 19.426 1.458 0.895 1.00 1.14 H new ATOM 762 N ASN A 170 14.749 2.623 -8.259 1.00 0.82 N ATOM 763 CA ASN A 170 13.352 2.377 -8.575 1.00 0.65 C ATOM 764 C ASN A 170 12.696 1.531 -7.489 1.00 0.56 C ATOM 765 O ASN A 170 12.692 0.307 -7.579 1.00 0.77 O ATOM 766 CB ASN A 170 13.254 1.640 -9.922 1.00 0.84 C ATOM 767 CG ASN A 170 11.919 1.822 -10.609 1.00 1.23 C ATOM 768 OD1 ASN A 170 10.904 2.045 -9.966 1.00 1.94 O ATOM 769 ND2 ASN A 170 11.915 1.722 -11.927 1.00 1.70 N ATOM 0 HA ASN A 170 12.834 3.334 -8.635 1.00 0.65 H new ATOM 0 HB2 ASN A 170 14.045 1.996 -10.581 1.00 0.84 H new ATOM 0 HB3 ASN A 170 13.429 0.576 -9.760 1.00 0.84 H new ATOM 0 HD21 ASN A 170 11.043 1.832 -12.444 1.00 1.70 H new ATOM 0 HD22 ASN A 170 12.784 1.535 -12.427 1.00 1.70 H new ATOM 776 N GLN A 171 12.172 2.165 -6.439 1.00 0.41 N ATOM 777 CA GLN A 171 11.354 1.446 -5.486 1.00 0.37 C ATOM 778 C GLN A 171 9.977 1.326 -6.066 1.00 0.29 C ATOM 779 O GLN A 171 9.279 0.362 -5.802 1.00 0.34 O ATOM 780 CB GLN A 171 11.341 2.137 -4.126 1.00 0.57 C ATOM 781 CG GLN A 171 10.290 1.607 -3.154 1.00 1.32 C ATOM 782 CD GLN A 171 10.305 0.095 -3.001 1.00 2.56 C ATOM 783 OE1 GLN A 171 11.322 -0.554 -3.219 1.00 3.22 O ATOM 784 NE2 GLN A 171 9.180 -0.469 -2.592 1.00 3.29 N ATOM 0 H GLN A 171 12.301 3.156 -6.237 1.00 0.41 H new ATOM 0 HA GLN A 171 11.767 0.453 -5.310 1.00 0.37 H new ATOM 0 HB2 GLN A 171 12.325 2.031 -3.670 1.00 0.57 H new ATOM 0 HB3 GLN A 171 11.173 3.203 -4.277 1.00 0.57 H new ATOM 0 HG2 GLN A 171 10.449 2.064 -2.177 1.00 1.32 H new ATOM 0 HG3 GLN A 171 9.303 1.919 -3.495 1.00 1.32 H new ATOM 0 HE21 GLN A 171 8.354 0.105 -2.421 1.00 3.29 H new ATOM 0 HE22 GLN A 171 9.138 -1.478 -2.447 1.00 3.29 H new ATOM 793 N ASN A 172 9.633 2.295 -6.919 1.00 0.35 N ATOM 794 CA ASN A 172 8.438 2.234 -7.761 1.00 0.42 C ATOM 795 C ASN A 172 8.306 0.858 -8.419 1.00 0.42 C ATOM 796 O ASN A 172 7.207 0.395 -8.737 1.00 0.48 O ATOM 797 CB ASN A 172 8.516 3.345 -8.819 1.00 0.47 C ATOM 798 CG ASN A 172 7.680 3.067 -10.058 1.00 0.54 C ATOM 799 OD1 ASN A 172 6.496 3.390 -10.114 1.00 1.24 O ATOM 800 ND2 ASN A 172 8.301 2.485 -11.070 1.00 1.02 N ATOM 0 H ASN A 172 10.179 3.147 -7.044 1.00 0.35 H new ATOM 0 HA ASN A 172 7.552 2.386 -7.145 1.00 0.42 H new ATOM 0 HB2 ASN A 172 8.188 4.284 -8.373 1.00 0.47 H new ATOM 0 HB3 ASN A 172 9.556 3.480 -9.116 1.00 0.47 H new ATOM 0 HD21 ASN A 172 7.796 2.290 -11.934 1.00 1.02 H new ATOM 0 HD22 ASN A 172 9.285 2.231 -10.986 1.00 1.02 H new ATOM 807 N ASN A 173 9.439 0.197 -8.558 1.00 0.40 N ATOM 808 CA ASN A 173 9.490 -1.134 -9.138 1.00 0.50 C ATOM 809 C ASN A 173 8.941 -2.148 -8.141 1.00 0.44 C ATOM 810 O ASN A 173 7.961 -2.868 -8.404 1.00 0.46 O ATOM 811 CB ASN A 173 10.928 -1.490 -9.490 1.00 0.63 C ATOM 812 CG ASN A 173 11.005 -2.618 -10.500 1.00 0.77 C ATOM 813 OD1 ASN A 173 11.013 -3.794 -10.133 1.00 1.33 O ATOM 814 ND2 ASN A 173 11.066 -2.272 -11.778 1.00 1.44 N ATOM 0 H ASN A 173 10.347 0.564 -8.274 1.00 0.40 H new ATOM 0 HA ASN A 173 8.885 -1.153 -10.044 1.00 0.50 H new ATOM 0 HB2 ASN A 173 11.431 -0.610 -9.891 1.00 0.63 H new ATOM 0 HB3 ASN A 173 11.462 -1.778 -8.584 1.00 0.63 H new ATOM 0 HD21 ASN A 173 11.122 -2.991 -12.499 1.00 1.44 H new ATOM 0 HD22 ASN A 173 11.057 -1.286 -12.041 1.00 1.44 H new ATOM 821 N PHE A 174 9.557 -2.161 -6.961 1.00 0.42 N ATOM 822 CA PHE A 174 9.118 -3.031 -5.881 1.00 0.42 C ATOM 823 C PHE A 174 7.716 -2.667 -5.444 1.00 0.33 C ATOM 824 O PHE A 174 7.057 -3.434 -4.762 1.00 0.34 O ATOM 825 CB PHE A 174 10.049 -2.921 -4.683 1.00 0.49 C ATOM 826 CG PHE A 174 11.264 -3.792 -4.767 1.00 0.60 C ATOM 827 CD1 PHE A 174 11.136 -5.161 -4.920 1.00 1.03 C ATOM 828 CD2 PHE A 174 12.533 -3.242 -4.696 1.00 1.56 C ATOM 829 CE1 PHE A 174 12.252 -5.968 -4.998 1.00 1.38 C ATOM 830 CE2 PHE A 174 13.653 -4.045 -4.775 1.00 1.90 C ATOM 831 CZ PHE A 174 13.519 -5.401 -4.917 1.00 1.53 C ATOM 0 H PHE A 174 10.362 -1.577 -6.732 1.00 0.42 H new ATOM 0 HA PHE A 174 9.132 -4.054 -6.256 1.00 0.42 H new ATOM 0 HB2 PHE A 174 10.366 -1.884 -4.578 1.00 0.49 H new ATOM 0 HB3 PHE A 174 9.494 -3.178 -3.781 1.00 0.49 H new ATOM 0 HD1 PHE A 174 10.152 -5.602 -4.979 1.00 1.03 H new ATOM 0 HD2 PHE A 174 12.647 -2.175 -4.578 1.00 1.56 H new ATOM 0 HE1 PHE A 174 12.142 -7.035 -5.121 1.00 1.38 H new ATOM 0 HE2 PHE A 174 14.637 -3.603 -4.725 1.00 1.90 H new ATOM 0 HZ PHE A 174 14.396 -6.029 -4.966 1.00 1.53 H new ATOM 841 N VAL A 175 7.285 -1.476 -5.817 1.00 0.29 N ATOM 842 CA VAL A 175 5.939 -1.034 -5.543 1.00 0.25 C ATOM 843 C VAL A 175 4.945 -1.876 -6.275 1.00 0.25 C ATOM 844 O VAL A 175 4.114 -2.500 -5.658 1.00 0.28 O ATOM 845 CB VAL A 175 5.709 0.394 -5.972 1.00 0.26 C ATOM 846 CG1 VAL A 175 4.273 0.793 -5.664 1.00 0.26 C ATOM 847 CG2 VAL A 175 6.700 1.283 -5.286 1.00 0.33 C ATOM 0 H VAL A 175 7.858 -0.795 -6.315 1.00 0.29 H new ATOM 0 HA VAL A 175 5.810 -1.120 -4.464 1.00 0.25 H new ATOM 0 HB VAL A 175 5.856 0.497 -7.047 1.00 0.26 H new ATOM 0 HG11 VAL A 175 4.108 1.825 -5.974 1.00 0.26 H new ATOM 0 HG12 VAL A 175 3.590 0.138 -6.204 1.00 0.26 H new ATOM 0 HG13 VAL A 175 4.092 0.703 -4.593 1.00 0.26 H new ATOM 0 HG21 VAL A 175 6.537 2.316 -5.594 1.00 0.33 H new ATOM 0 HG22 VAL A 175 6.575 1.202 -4.206 1.00 0.33 H new ATOM 0 HG23 VAL A 175 7.711 0.979 -5.558 1.00 0.33 H new ATOM 857 N HIS A 176 5.022 -1.856 -7.598 1.00 0.27 N ATOM 858 CA HIS A 176 4.198 -2.721 -8.428 1.00 0.33 C ATOM 859 C HIS A 176 4.117 -4.113 -7.809 1.00 0.28 C ATOM 860 O HIS A 176 3.058 -4.725 -7.779 1.00 0.29 O ATOM 861 CB HIS A 176 4.778 -2.790 -9.843 1.00 0.41 C ATOM 862 CG HIS A 176 4.056 -3.733 -10.758 1.00 1.16 C ATOM 863 ND1 HIS A 176 4.676 -4.803 -11.367 1.00 2.23 N ATOM 864 CD2 HIS A 176 2.771 -3.759 -11.175 1.00 1.62 C ATOM 865 CE1 HIS A 176 3.805 -5.446 -12.116 1.00 2.89 C ATOM 866 NE2 HIS A 176 2.643 -4.835 -12.017 1.00 2.52 N ATOM 0 H HIS A 176 5.651 -1.246 -8.121 1.00 0.27 H new ATOM 0 HA HIS A 176 3.190 -2.311 -8.487 1.00 0.33 H new ATOM 0 HB2 HIS A 176 4.759 -1.792 -10.280 1.00 0.41 H new ATOM 0 HB3 HIS A 176 5.824 -3.091 -9.781 1.00 0.41 H new ATOM 0 HD2 HIS A 176 1.992 -3.064 -10.898 1.00 1.62 H new ATOM 0 HE1 HIS A 176 4.009 -6.325 -12.710 1.00 2.89 H new ATOM 0 HE2 HIS A 176 1.785 -5.117 -12.491 1.00 2.52 H new ATOM 875 N ASP A 177 5.237 -4.566 -7.258 1.00 0.26 N ATOM 876 CA ASP A 177 5.306 -5.879 -6.618 1.00 0.27 C ATOM 877 C ASP A 177 4.728 -5.857 -5.198 1.00 0.24 C ATOM 878 O ASP A 177 4.211 -6.866 -4.712 1.00 0.31 O ATOM 879 CB ASP A 177 6.752 -6.377 -6.590 1.00 0.36 C ATOM 880 CG ASP A 177 6.861 -7.837 -6.188 1.00 0.49 C ATOM 881 OD1 ASP A 177 6.523 -8.710 -7.019 1.00 0.66 O ATOM 882 OD2 ASP A 177 7.282 -8.124 -5.049 1.00 0.64 O ATOM 0 H ASP A 177 6.113 -4.044 -7.240 1.00 0.26 H new ATOM 0 HA ASP A 177 4.698 -6.564 -7.209 1.00 0.27 H new ATOM 0 HB2 ASP A 177 7.198 -6.241 -7.575 1.00 0.36 H new ATOM 0 HB3 ASP A 177 7.328 -5.768 -5.893 1.00 0.36 H new ATOM 887 N CYS A 178 4.804 -4.707 -4.546 1.00 0.26 N ATOM 888 CA CYS A 178 4.278 -4.533 -3.198 1.00 0.29 C ATOM 889 C CYS A 178 2.760 -4.405 -3.257 1.00 0.27 C ATOM 890 O CYS A 178 2.046 -4.960 -2.436 1.00 0.32 O ATOM 891 CB CYS A 178 4.866 -3.291 -2.517 1.00 0.41 C ATOM 892 SG CYS A 178 3.816 -1.809 -2.660 1.00 0.64 S ATOM 0 H CYS A 178 5.232 -3.867 -4.935 1.00 0.26 H new ATOM 0 HA CYS A 178 4.562 -5.407 -2.612 1.00 0.29 H new ATOM 0 HB2 CYS A 178 5.029 -3.509 -1.462 1.00 0.41 H new ATOM 0 HB3 CYS A 178 5.842 -3.077 -2.952 1.00 0.41 H new ATOM 897 N VAL A 179 2.250 -3.676 -4.237 1.00 0.23 N ATOM 898 CA VAL A 179 0.821 -3.637 -4.431 1.00 0.20 C ATOM 899 C VAL A 179 0.393 -5.031 -4.868 1.00 0.21 C ATOM 900 O VAL A 179 -0.693 -5.502 -4.574 1.00 0.28 O ATOM 901 CB VAL A 179 0.348 -2.569 -5.467 1.00 0.19 C ATOM 902 CG1 VAL A 179 -0.762 -1.718 -4.893 1.00 0.67 C ATOM 903 CG2 VAL A 179 1.457 -1.643 -5.901 1.00 0.57 C ATOM 0 H VAL A 179 2.795 -3.117 -4.894 1.00 0.23 H new ATOM 0 HA VAL A 179 0.354 -3.339 -3.492 1.00 0.20 H new ATOM 0 HB VAL A 179 -0.000 -3.133 -6.332 1.00 0.19 H new ATOM 0 HG11 VAL A 179 -1.075 -0.981 -5.633 1.00 0.67 H new ATOM 0 HG12 VAL A 179 -1.609 -2.352 -4.632 1.00 0.67 H new ATOM 0 HG13 VAL A 179 -0.403 -1.206 -4.000 1.00 0.67 H new ATOM 0 HG21 VAL A 179 1.069 -0.923 -6.621 1.00 0.57 H new ATOM 0 HG22 VAL A 179 1.849 -1.113 -5.033 1.00 0.57 H new ATOM 0 HG23 VAL A 179 2.256 -2.223 -6.363 1.00 0.57 H new ATOM 913 N ASN A 180 1.302 -5.732 -5.511 1.00 0.23 N ATOM 914 CA ASN A 180 1.031 -7.091 -5.930 1.00 0.24 C ATOM 915 C ASN A 180 1.011 -8.064 -4.766 1.00 0.25 C ATOM 916 O ASN A 180 0.451 -9.146 -4.882 1.00 0.26 O ATOM 917 CB ASN A 180 2.068 -7.571 -6.941 1.00 0.25 C ATOM 918 CG ASN A 180 1.723 -7.235 -8.384 1.00 0.48 C ATOM 919 OD1 ASN A 180 2.612 -7.073 -9.221 1.00 1.17 O ATOM 920 ND2 ASN A 180 0.440 -7.142 -8.689 1.00 1.33 N ATOM 0 H ASN A 180 2.230 -5.386 -5.754 1.00 0.23 H new ATOM 0 HA ASN A 180 0.041 -7.071 -6.387 1.00 0.24 H new ATOM 0 HB2 ASN A 180 3.033 -7.127 -6.696 1.00 0.25 H new ATOM 0 HB3 ASN A 180 2.180 -8.651 -6.847 1.00 0.25 H new ATOM 0 HD21 ASN A 180 0.157 -6.929 -9.646 1.00 1.33 H new ATOM 0 HD22 ASN A 180 -0.267 -7.283 -7.968 1.00 1.33 H new ATOM 927 N ILE A 181 1.655 -7.722 -3.667 1.00 0.28 N ATOM 928 CA ILE A 181 1.628 -8.593 -2.511 1.00 0.29 C ATOM 929 C ILE A 181 0.575 -8.161 -1.491 1.00 0.27 C ATOM 930 O ILE A 181 -0.049 -8.988 -0.843 1.00 0.36 O ATOM 931 CB ILE A 181 3.016 -8.732 -1.822 1.00 0.34 C ATOM 932 CG1 ILE A 181 3.705 -7.404 -1.519 1.00 0.42 C ATOM 933 CG2 ILE A 181 3.943 -9.615 -2.630 1.00 0.52 C ATOM 934 CD1 ILE A 181 3.031 -6.636 -0.423 1.00 0.77 C ATOM 0 H ILE A 181 2.194 -6.864 -3.551 1.00 0.28 H new ATOM 0 HA ILE A 181 1.354 -9.575 -2.896 1.00 0.29 H new ATOM 0 HB ILE A 181 2.804 -9.197 -0.859 1.00 0.34 H new ATOM 0 HG12 ILE A 181 4.741 -7.593 -1.239 1.00 0.42 H new ATOM 0 HG13 ILE A 181 3.725 -6.796 -2.423 1.00 0.42 H new ATOM 0 HG21 ILE A 181 4.905 -9.693 -2.123 1.00 0.52 H new ATOM 0 HG22 ILE A 181 3.504 -10.608 -2.730 1.00 0.52 H new ATOM 0 HG23 ILE A 181 4.088 -9.181 -3.619 1.00 0.52 H new ATOM 0 HD11 ILE A 181 3.565 -5.701 -0.252 1.00 0.77 H new ATOM 0 HD12 ILE A 181 2.002 -6.419 -0.710 1.00 0.77 H new ATOM 0 HD13 ILE A 181 3.035 -7.229 0.492 1.00 0.77 H new ATOM 946 N THR A 182 0.385 -6.863 -1.373 1.00 0.27 N ATOM 947 CA THR A 182 -0.329 -6.275 -0.260 1.00 0.24 C ATOM 948 C THR A 182 -1.806 -6.188 -0.489 1.00 0.26 C ATOM 949 O THR A 182 -2.611 -6.400 0.424 1.00 0.30 O ATOM 950 CB THR A 182 0.253 -4.888 0.014 1.00 0.22 C ATOM 951 OG1 THR A 182 0.744 -4.832 1.352 1.00 0.46 O ATOM 952 CG2 THR A 182 -0.766 -3.788 -0.217 1.00 0.30 C ATOM 0 H THR A 182 0.725 -6.182 -2.052 1.00 0.27 H new ATOM 0 HA THR A 182 -0.198 -6.926 0.605 1.00 0.24 H new ATOM 0 HB THR A 182 1.071 -4.723 -0.687 1.00 0.22 H new ATOM 0 HG1 THR A 182 0.050 -4.468 1.940 1.00 0.46 H new ATOM 0 HG21 THR A 182 -0.310 -2.820 -0.011 1.00 0.30 H new ATOM 0 HG22 THR A 182 -1.104 -3.816 -1.253 1.00 0.30 H new ATOM 0 HG23 THR A 182 -1.618 -3.936 0.446 1.00 0.30 H new ATOM 960 N VAL A 183 -2.167 -5.873 -1.696 1.00 0.26 N ATOM 961 CA VAL A 183 -3.542 -5.762 -2.031 1.00 0.28 C ATOM 962 C VAL A 183 -4.027 -7.169 -2.160 1.00 0.29 C ATOM 963 O VAL A 183 -5.131 -7.512 -1.774 1.00 0.32 O ATOM 964 CB VAL A 183 -3.686 -4.936 -3.320 1.00 0.28 C ATOM 965 CG1 VAL A 183 -2.589 -3.921 -3.344 1.00 0.26 C ATOM 966 CG2 VAL A 183 -3.672 -5.792 -4.575 1.00 0.29 C ATOM 0 H VAL A 183 -1.521 -5.689 -2.463 1.00 0.26 H new ATOM 0 HA VAL A 183 -4.139 -5.238 -1.284 1.00 0.28 H new ATOM 0 HB VAL A 183 -4.659 -4.446 -3.315 1.00 0.28 H new ATOM 0 HG11 VAL A 183 -2.669 -3.321 -4.250 1.00 0.26 H new ATOM 0 HG12 VAL A 183 -2.673 -3.274 -2.471 1.00 0.26 H new ATOM 0 HG13 VAL A 183 -1.624 -4.428 -3.328 1.00 0.26 H new ATOM 0 HG21 VAL A 183 -3.777 -5.153 -5.452 1.00 0.29 H new ATOM 0 HG22 VAL A 183 -2.730 -6.337 -4.633 1.00 0.29 H new ATOM 0 HG23 VAL A 183 -4.499 -6.501 -4.541 1.00 0.29 H new ATOM 976 N LYS A 184 -3.071 -7.989 -2.559 1.00 0.30 N ATOM 977 CA LYS A 184 -3.256 -9.392 -2.775 1.00 0.32 C ATOM 978 C LYS A 184 -3.398 -10.152 -1.480 1.00 0.32 C ATOM 979 O LYS A 184 -4.335 -10.908 -1.320 1.00 0.38 O ATOM 980 CB LYS A 184 -2.076 -9.917 -3.551 1.00 0.34 C ATOM 981 CG LYS A 184 -2.396 -10.176 -4.997 1.00 0.37 C ATOM 982 CD LYS A 184 -3.041 -8.964 -5.631 1.00 1.01 C ATOM 983 CE LYS A 184 -2.181 -8.372 -6.732 1.00 1.37 C ATOM 984 NZ LYS A 184 -2.970 -7.497 -7.645 1.00 2.14 N ATOM 0 H LYS A 184 -2.118 -7.675 -2.744 1.00 0.30 H new ATOM 0 HA LYS A 184 -4.181 -9.536 -3.334 1.00 0.32 H new ATOM 0 HB2 LYS A 184 -1.258 -9.200 -3.488 1.00 0.34 H new ATOM 0 HB3 LYS A 184 -1.726 -10.841 -3.090 1.00 0.34 H new ATOM 0 HG2 LYS A 184 -1.483 -10.431 -5.536 1.00 0.37 H new ATOM 0 HG3 LYS A 184 -3.064 -11.033 -5.078 1.00 0.37 H new ATOM 0 HD2 LYS A 184 -4.012 -9.243 -6.040 1.00 1.01 H new ATOM 0 HD3 LYS A 184 -3.222 -8.208 -4.867 1.00 1.01 H new ATOM 0 HE2 LYS A 184 -1.370 -7.795 -6.288 1.00 1.37 H new ATOM 0 HE3 LYS A 184 -1.723 -9.177 -7.307 1.00 1.37 H new ATOM 0 HZ1 LYS A 184 -2.346 -7.113 -8.383 1.00 2.14 H new ATOM 0 HZ2 LYS A 184 -3.729 -8.053 -8.089 1.00 2.14 H new ATOM 0 HZ3 LYS A 184 -3.387 -6.714 -7.102 1.00 2.14 H new ATOM 998 N GLN A 185 -2.483 -9.944 -0.549 1.00 0.31 N ATOM 999 CA GLN A 185 -2.560 -10.606 0.746 1.00 0.39 C ATOM 1000 C GLN A 185 -3.961 -10.422 1.328 1.00 0.38 C ATOM 1001 O GLN A 185 -4.472 -11.270 2.046 1.00 0.44 O ATOM 1002 CB GLN A 185 -1.526 -10.021 1.707 1.00 0.56 C ATOM 1003 CG GLN A 185 -1.959 -8.704 2.313 1.00 1.32 C ATOM 1004 CD GLN A 185 -1.232 -8.368 3.592 1.00 1.75 C ATOM 1005 OE1 GLN A 185 -1.069 -7.198 3.933 1.00 2.11 O ATOM 1006 NE2 GLN A 185 -0.786 -9.389 4.306 1.00 2.02 N ATOM 0 H GLN A 185 -1.680 -9.325 -0.663 1.00 0.31 H new ATOM 0 HA GLN A 185 -2.352 -11.668 0.612 1.00 0.39 H new ATOM 0 HB2 GLN A 185 -1.335 -10.737 2.506 1.00 0.56 H new ATOM 0 HB3 GLN A 185 -0.585 -9.878 1.176 1.00 0.56 H new ATOM 0 HG2 GLN A 185 -1.793 -7.907 1.589 1.00 1.32 H new ATOM 0 HG3 GLN A 185 -3.030 -8.738 2.510 1.00 1.32 H new ATOM 0 HE21 GLN A 185 -0.944 -10.344 3.984 1.00 2.02 H new ATOM 0 HE22 GLN A 185 -0.284 -9.221 5.178 1.00 2.02 H new ATOM 1015 N HIS A 186 -4.575 -9.310 0.945 1.00 0.36 N ATOM 1016 CA HIS A 186 -5.874 -8.907 1.433 1.00 0.44 C ATOM 1017 C HIS A 186 -7.004 -9.376 0.520 1.00 0.51 C ATOM 1018 O HIS A 186 -8.147 -9.508 0.944 1.00 0.67 O ATOM 1019 CB HIS A 186 -5.893 -7.392 1.542 1.00 0.49 C ATOM 1020 CG HIS A 186 -5.286 -6.881 2.811 1.00 0.55 C ATOM 1021 ND1 HIS A 186 -4.074 -6.223 2.849 1.00 0.73 N ATOM 1022 CD2 HIS A 186 -5.727 -6.921 4.094 1.00 1.09 C ATOM 1023 CE1 HIS A 186 -3.798 -5.883 4.094 1.00 0.65 C ATOM 1024 NE2 HIS A 186 -4.782 -6.293 4.867 1.00 0.91 N ATOM 0 H HIS A 186 -4.171 -8.656 0.274 1.00 0.36 H new ATOM 0 HA HIS A 186 -6.039 -9.370 2.406 1.00 0.44 H new ATOM 0 HB2 HIS A 186 -5.356 -6.967 0.694 1.00 0.49 H new ATOM 0 HB3 HIS A 186 -6.923 -7.043 1.474 1.00 0.49 H new ATOM 0 HD1 HIS A 186 -3.483 -6.029 2.040 1.00 0.73 H new ATOM 0 HD2 HIS A 186 -6.649 -7.364 4.442 1.00 1.09 H new ATOM 0 HE1 HIS A 186 -2.914 -5.357 4.423 1.00 0.65 H new ATOM 1033 N THR A 187 -6.681 -9.649 -0.724 1.00 0.48 N ATOM 1034 CA THR A 187 -7.691 -10.001 -1.709 1.00 0.59 C ATOM 1035 C THR A 187 -7.429 -11.390 -2.256 1.00 0.62 C ATOM 1036 O THR A 187 -7.979 -11.778 -3.290 1.00 0.80 O ATOM 1037 CB THR A 187 -7.746 -8.983 -2.876 1.00 0.72 C ATOM 1038 OG1 THR A 187 -8.858 -9.270 -3.734 1.00 0.89 O ATOM 1039 CG2 THR A 187 -6.462 -8.999 -3.697 1.00 0.75 C ATOM 0 H THR A 187 -5.726 -9.635 -1.083 1.00 0.48 H new ATOM 0 HA THR A 187 -8.656 -9.981 -1.203 1.00 0.59 H new ATOM 0 HB THR A 187 -7.863 -7.992 -2.437 1.00 0.72 H new ATOM 0 HG1 THR A 187 -8.935 -10.239 -3.856 1.00 0.89 H new ATOM 0 HG21 THR A 187 -6.538 -8.272 -4.506 1.00 0.75 H new ATOM 0 HG22 THR A 187 -5.618 -8.742 -3.057 1.00 0.75 H new ATOM 0 HG23 THR A 187 -6.310 -9.994 -4.116 1.00 0.75 H new ATOM 1047 N VAL A 188 -6.586 -12.149 -1.566 1.00 0.55 N ATOM 1048 CA VAL A 188 -6.268 -13.494 -2.019 1.00 0.63 C ATOM 1049 C VAL A 188 -6.086 -14.443 -0.843 1.00 0.66 C ATOM 1050 O VAL A 188 -6.620 -15.550 -0.840 1.00 0.78 O ATOM 1051 CB VAL A 188 -5.034 -13.545 -2.983 1.00 0.69 C ATOM 1052 CG1 VAL A 188 -5.018 -12.330 -3.894 1.00 0.66 C ATOM 1053 CG2 VAL A 188 -3.704 -13.666 -2.246 1.00 0.84 C ATOM 0 H VAL A 188 -6.119 -11.862 -0.706 1.00 0.55 H new ATOM 0 HA VAL A 188 -7.125 -13.829 -2.603 1.00 0.63 H new ATOM 0 HB VAL A 188 -5.148 -14.449 -3.581 1.00 0.69 H new ATOM 0 HG11 VAL A 188 -4.154 -12.383 -4.556 1.00 0.66 H new ATOM 0 HG12 VAL A 188 -5.931 -12.310 -4.489 1.00 0.66 H new ATOM 0 HG13 VAL A 188 -4.958 -11.424 -3.291 1.00 0.66 H new ATOM 0 HG21 VAL A 188 -2.889 -13.697 -2.969 1.00 0.84 H new ATOM 0 HG22 VAL A 188 -3.573 -12.807 -1.588 1.00 0.84 H new ATOM 0 HG23 VAL A 188 -3.698 -14.581 -1.654 1.00 0.84 H new ATOM 1063 N THR A 189 -5.360 -13.999 0.164 1.00 0.65 N ATOM 1064 CA THR A 189 -5.251 -14.744 1.396 1.00 0.79 C ATOM 1065 C THR A 189 -6.326 -14.251 2.343 1.00 0.83 C ATOM 1066 O THR A 189 -6.600 -14.841 3.388 1.00 1.04 O ATOM 1067 CB THR A 189 -3.860 -14.551 2.033 1.00 0.88 C ATOM 1068 OG1 THR A 189 -2.848 -14.682 1.025 1.00 0.90 O ATOM 1069 CG2 THR A 189 -3.616 -15.575 3.130 1.00 1.12 C ATOM 0 H THR A 189 -4.837 -13.124 0.150 1.00 0.65 H new ATOM 0 HA THR A 189 -5.380 -15.807 1.193 1.00 0.79 H new ATOM 0 HB THR A 189 -3.820 -13.555 2.474 1.00 0.88 H new ATOM 0 HG1 THR A 189 -1.964 -14.557 1.430 1.00 0.90 H new ATOM 0 HG21 THR A 189 -2.628 -15.417 3.562 1.00 1.12 H new ATOM 0 HG22 THR A 189 -4.374 -15.465 3.906 1.00 1.12 H new ATOM 0 HG23 THR A 189 -3.671 -16.579 2.709 1.00 1.12 H new ATOM 1077 N THR A 190 -6.963 -13.161 1.936 1.00 0.73 N ATOM 1078 CA THR A 190 -7.903 -12.490 2.784 1.00 0.76 C ATOM 1079 C THR A 190 -9.291 -12.338 2.133 1.00 0.80 C ATOM 1080 O THR A 190 -10.265 -11.980 2.801 1.00 1.06 O ATOM 1081 CB THR A 190 -7.314 -11.140 3.266 1.00 0.90 C ATOM 1082 OG1 THR A 190 -6.284 -11.373 4.234 1.00 1.00 O ATOM 1083 CG2 THR A 190 -8.356 -10.215 3.859 1.00 0.93 C ATOM 0 H THR A 190 -6.836 -12.732 1.019 1.00 0.73 H new ATOM 0 HA THR A 190 -8.072 -13.115 3.661 1.00 0.76 H new ATOM 0 HB THR A 190 -6.907 -10.647 2.384 1.00 0.90 H new ATOM 0 HG1 THR A 190 -5.412 -11.389 3.787 1.00 1.00 H new ATOM 0 HG21 THR A 190 -7.880 -9.287 4.177 1.00 0.93 H new ATOM 0 HG22 THR A 190 -9.116 -9.994 3.109 1.00 0.93 H new ATOM 0 HG23 THR A 190 -8.823 -10.696 4.718 1.00 0.93 H new ATOM 1141 N GLY A 194 -14.175 -12.417 3.697 1.00 0.89 N ATOM 1142 CA GLY A 194 -15.310 -11.666 3.242 1.00 0.84 C ATOM 1143 C GLY A 194 -14.831 -10.345 2.723 1.00 0.70 C ATOM 1144 O GLY A 194 -15.553 -9.349 2.733 1.00 0.98 O ATOM 0 HA2 GLY A 194 -15.836 -12.212 2.459 1.00 0.84 H new ATOM 0 HA3 GLY A 194 -16.018 -11.518 4.058 1.00 0.84 H new ATOM 1148 N GLU A 195 -13.578 -10.344 2.285 1.00 0.54 N ATOM 1149 CA GLU A 195 -12.942 -9.132 1.818 1.00 0.62 C ATOM 1150 C GLU A 195 -12.899 -9.162 0.299 1.00 0.62 C ATOM 1151 O GLU A 195 -12.169 -9.950 -0.292 1.00 0.88 O ATOM 1152 CB GLU A 195 -11.528 -9.013 2.401 1.00 0.91 C ATOM 1153 CG GLU A 195 -10.970 -7.614 2.386 1.00 1.17 C ATOM 1154 CD GLU A 195 -11.721 -6.692 3.322 1.00 1.69 C ATOM 1155 OE1 GLU A 195 -11.386 -6.663 4.523 1.00 2.30 O ATOM 1156 OE2 GLU A 195 -12.666 -6.015 2.876 1.00 1.98 O ATOM 0 H GLU A 195 -12.986 -11.174 2.246 1.00 0.54 H new ATOM 0 HA GLU A 195 -13.511 -8.263 2.148 1.00 0.62 H new ATOM 0 HB2 GLU A 195 -11.539 -9.377 3.428 1.00 0.91 H new ATOM 0 HB3 GLU A 195 -10.859 -9.665 1.839 1.00 0.91 H new ATOM 0 HG2 GLU A 195 -9.918 -7.641 2.671 1.00 1.17 H new ATOM 0 HG3 GLU A 195 -11.016 -7.217 1.372 1.00 1.17 H new ATOM 1163 N ASN A 196 -13.713 -8.331 -0.319 1.00 0.61 N ATOM 1164 CA ASN A 196 -13.827 -8.302 -1.767 1.00 0.66 C ATOM 1165 C ASN A 196 -13.385 -6.966 -2.290 1.00 0.54 C ATOM 1166 O ASN A 196 -13.789 -5.925 -1.778 1.00 0.57 O ATOM 1167 CB ASN A 196 -15.253 -8.549 -2.236 1.00 0.92 C ATOM 1168 CG ASN A 196 -15.753 -9.957 -1.964 1.00 1.42 C ATOM 1169 OD1 ASN A 196 -16.946 -10.169 -1.767 1.00 2.09 O ATOM 1170 ND2 ASN A 196 -14.853 -10.929 -1.947 1.00 2.16 N ATOM 0 H ASN A 196 -14.312 -7.660 0.162 1.00 0.61 H new ATOM 0 HA ASN A 196 -13.191 -9.100 -2.150 1.00 0.66 H new ATOM 0 HB2 ASN A 196 -15.916 -7.837 -1.744 1.00 0.92 H new ATOM 0 HB3 ASN A 196 -15.312 -8.353 -3.307 1.00 0.92 H new ATOM 0 HD21 ASN A 196 -15.143 -11.890 -1.766 1.00 2.16 H new ATOM 0 HD22 ASN A 196 -13.870 -10.716 -2.115 1.00 2.16 H new ATOM 1177 N PHE A 197 -12.574 -7.000 -3.317 1.00 0.51 N ATOM 1178 CA PHE A 197 -11.979 -5.815 -3.837 1.00 0.42 C ATOM 1179 C PHE A 197 -12.567 -5.480 -5.190 1.00 0.43 C ATOM 1180 O PHE A 197 -12.633 -6.331 -6.082 1.00 0.47 O ATOM 1181 CB PHE A 197 -10.488 -6.051 -3.980 1.00 0.55 C ATOM 1182 CG PHE A 197 -9.744 -6.223 -2.686 1.00 1.16 C ATOM 1183 CD1 PHE A 197 -10.256 -7.010 -1.669 1.00 1.81 C ATOM 1184 CD2 PHE A 197 -8.521 -5.615 -2.492 1.00 2.03 C ATOM 1185 CE1 PHE A 197 -9.571 -7.182 -0.492 1.00 2.73 C ATOM 1186 CE2 PHE A 197 -7.828 -5.789 -1.314 1.00 2.99 C ATOM 1187 CZ PHE A 197 -8.355 -6.569 -0.314 1.00 3.21 C ATOM 0 H PHE A 197 -12.313 -7.854 -3.810 1.00 0.51 H new ATOM 0 HA PHE A 197 -12.171 -4.983 -3.160 1.00 0.42 H new ATOM 0 HB2 PHE A 197 -10.333 -6.940 -4.591 1.00 0.55 H new ATOM 0 HB3 PHE A 197 -10.053 -5.212 -4.523 1.00 0.55 H new ATOM 0 HD1 PHE A 197 -11.211 -7.497 -1.804 1.00 1.81 H new ATOM 0 HD2 PHE A 197 -8.102 -4.996 -3.272 1.00 2.03 H new ATOM 0 HE1 PHE A 197 -9.987 -7.798 0.292 1.00 2.73 H new ATOM 0 HE2 PHE A 197 -6.869 -5.311 -1.177 1.00 2.99 H new ATOM 0 HZ PHE A 197 -7.814 -6.700 0.611 1.00 3.21 H new ATOM 1197 N THR A 198 -13.001 -4.253 -5.343 1.00 0.47 N ATOM 1198 CA THR A 198 -13.359 -3.755 -6.643 1.00 0.50 C ATOM 1199 C THR A 198 -12.220 -2.889 -7.141 1.00 0.48 C ATOM 1200 O THR A 198 -11.340 -2.542 -6.366 1.00 0.45 O ATOM 1201 CB THR A 198 -14.686 -2.959 -6.620 1.00 0.54 C ATOM 1202 OG1 THR A 198 -15.098 -2.651 -7.956 1.00 0.61 O ATOM 1203 CG2 THR A 198 -14.553 -1.671 -5.824 1.00 0.49 C ATOM 0 H THR A 198 -13.114 -3.583 -4.582 1.00 0.47 H new ATOM 0 HA THR A 198 -13.522 -4.597 -7.316 1.00 0.50 H new ATOM 0 HB THR A 198 -15.436 -3.585 -6.136 1.00 0.54 H new ATOM 0 HG1 THR A 198 -15.939 -2.149 -7.931 1.00 0.61 H new ATOM 0 HG21 THR A 198 -15.505 -1.139 -5.830 1.00 0.49 H new ATOM 0 HG22 THR A 198 -14.275 -1.905 -4.796 1.00 0.49 H new ATOM 0 HG23 THR A 198 -13.784 -1.043 -6.274 1.00 0.49 H new ATOM 1211 N GLU A 199 -12.202 -2.575 -8.424 1.00 0.51 N ATOM 1212 CA GLU A 199 -11.136 -1.765 -8.989 1.00 0.50 C ATOM 1213 C GLU A 199 -11.045 -0.417 -8.297 1.00 0.44 C ATOM 1214 O GLU A 199 -10.061 0.270 -8.436 1.00 0.43 O ATOM 1215 CB GLU A 199 -11.325 -1.523 -10.471 1.00 0.53 C ATOM 1216 CG GLU A 199 -10.019 -1.259 -11.188 1.00 0.54 C ATOM 1217 CD GLU A 199 -10.236 -0.765 -12.596 1.00 0.58 C ATOM 1218 OE1 GLU A 199 -10.326 0.463 -12.796 1.00 0.62 O ATOM 1219 OE2 GLU A 199 -10.298 -1.606 -13.518 1.00 0.76 O ATOM 0 H GLU A 199 -12.913 -2.868 -9.095 1.00 0.51 H new ATOM 0 HA GLU A 199 -10.217 -2.330 -8.834 1.00 0.50 H new ATOM 0 HB2 GLU A 199 -11.812 -2.390 -10.918 1.00 0.53 H new ATOM 0 HB3 GLU A 199 -11.992 -0.673 -10.615 1.00 0.53 H new ATOM 0 HG2 GLU A 199 -9.442 -0.521 -10.630 1.00 0.54 H new ATOM 0 HG3 GLU A 199 -9.428 -2.174 -11.212 1.00 0.54 H new ATOM 1226 N THR A 200 -12.088 -0.035 -7.591 1.00 0.44 N ATOM 1227 CA THR A 200 -12.058 1.136 -6.749 1.00 0.38 C ATOM 1228 C THR A 200 -11.367 0.811 -5.443 1.00 0.33 C ATOM 1229 O THR A 200 -10.514 1.547 -5.012 1.00 0.28 O ATOM 1230 CB THR A 200 -13.461 1.670 -6.440 1.00 0.42 C ATOM 1231 OG1 THR A 200 -14.131 2.009 -7.660 1.00 0.51 O ATOM 1232 CG2 THR A 200 -13.375 2.883 -5.527 1.00 0.45 C ATOM 0 H THR A 200 -12.980 -0.530 -7.587 1.00 0.44 H new ATOM 0 HA THR A 200 -11.514 1.906 -7.295 1.00 0.38 H new ATOM 0 HB THR A 200 -14.031 0.895 -5.928 1.00 0.42 H new ATOM 0 HG1 THR A 200 -15.028 2.348 -7.457 1.00 0.51 H new ATOM 0 HG21 THR A 200 -14.379 3.252 -5.316 1.00 0.45 H new ATOM 0 HG22 THR A 200 -12.888 2.602 -4.593 1.00 0.45 H new ATOM 0 HG23 THR A 200 -12.796 3.666 -6.016 1.00 0.45 H new ATOM 1240 N ASP A 201 -11.692 -0.343 -4.867 1.00 0.37 N ATOM 1241 CA ASP A 201 -11.089 -0.774 -3.601 1.00 0.34 C ATOM 1242 C ASP A 201 -9.638 -1.003 -3.864 1.00 0.31 C ATOM 1243 O ASP A 201 -8.767 -0.918 -3.000 1.00 0.28 O ATOM 1244 CB ASP A 201 -11.674 -2.085 -3.061 1.00 0.37 C ATOM 1245 CG ASP A 201 -13.132 -2.010 -2.665 1.00 0.41 C ATOM 1246 OD1 ASP A 201 -13.477 -1.137 -1.850 1.00 0.56 O ATOM 1247 OD2 ASP A 201 -13.938 -2.799 -3.182 1.00 0.50 O ATOM 0 H ASP A 201 -12.370 -1.000 -5.254 1.00 0.37 H new ATOM 0 HA ASP A 201 -11.284 -0.001 -2.858 1.00 0.34 H new ATOM 0 HB2 ASP A 201 -11.557 -2.859 -3.819 1.00 0.37 H new ATOM 0 HB3 ASP A 201 -11.092 -2.397 -2.194 1.00 0.37 H new ATOM 1252 N ILE A 202 -9.407 -1.298 -5.098 1.00 0.35 N ATOM 1253 CA ILE A 202 -8.115 -1.595 -5.566 1.00 0.36 C ATOM 1254 C ILE A 202 -7.446 -0.379 -6.041 1.00 0.33 C ATOM 1255 O ILE A 202 -6.248 -0.227 -5.875 1.00 0.34 O ATOM 1256 CB ILE A 202 -8.219 -2.603 -6.691 1.00 0.44 C ATOM 1257 CG1 ILE A 202 -7.279 -3.740 -6.452 1.00 0.50 C ATOM 1258 CG2 ILE A 202 -7.894 -1.983 -8.041 1.00 0.48 C ATOM 1259 CD1 ILE A 202 -6.859 -3.831 -5.030 1.00 0.59 C ATOM 0 H ILE A 202 -10.131 -1.338 -5.816 1.00 0.35 H new ATOM 0 HA ILE A 202 -7.524 -2.011 -4.750 1.00 0.36 H new ATOM 0 HB ILE A 202 -9.250 -2.957 -6.708 1.00 0.44 H new ATOM 0 HG12 ILE A 202 -7.758 -4.673 -6.748 1.00 0.50 H new ATOM 0 HG13 ILE A 202 -6.398 -3.620 -7.082 1.00 0.50 H new ATOM 0 HG21 ILE A 202 -7.981 -2.741 -8.820 1.00 0.48 H new ATOM 0 HG22 ILE A 202 -8.591 -1.171 -8.246 1.00 0.48 H new ATOM 0 HG23 ILE A 202 -6.876 -1.592 -8.027 1.00 0.48 H new ATOM 0 HD11 ILE A 202 -6.177 -4.672 -4.905 1.00 0.59 H new ATOM 0 HD12 ILE A 202 -6.356 -2.909 -4.740 1.00 0.59 H new ATOM 0 HD13 ILE A 202 -7.736 -3.979 -4.400 1.00 0.59 H new ATOM 1271 N LYS A 203 -8.225 0.514 -6.605 1.00 0.33 N ATOM 1272 CA LYS A 203 -7.652 1.715 -7.071 1.00 0.33 C ATOM 1273 C LYS A 203 -7.176 2.464 -5.865 1.00 0.28 C ATOM 1274 O LYS A 203 -6.374 3.380 -5.928 1.00 0.32 O ATOM 1275 CB LYS A 203 -8.615 2.537 -7.886 1.00 0.33 C ATOM 1276 CG LYS A 203 -9.613 3.335 -7.084 1.00 0.29 C ATOM 1277 CD LYS A 203 -10.613 4.064 -7.979 1.00 0.34 C ATOM 1278 CE LYS A 203 -9.983 5.229 -8.743 1.00 1.13 C ATOM 1279 NZ LYS A 203 -9.106 4.787 -9.860 1.00 1.93 N ATOM 0 H LYS A 203 -9.231 0.420 -6.742 1.00 0.33 H new ATOM 0 HA LYS A 203 -6.825 1.494 -7.746 1.00 0.33 H new ATOM 0 HB2 LYS A 203 -8.044 3.223 -8.512 1.00 0.33 H new ATOM 0 HB3 LYS A 203 -9.160 1.872 -8.556 1.00 0.33 H new ATOM 0 HG2 LYS A 203 -10.150 2.670 -6.408 1.00 0.29 H new ATOM 0 HG3 LYS A 203 -9.084 4.060 -6.465 1.00 0.29 H new ATOM 0 HD2 LYS A 203 -11.040 3.357 -8.690 1.00 0.34 H new ATOM 0 HD3 LYS A 203 -11.435 4.438 -7.369 1.00 0.34 H new ATOM 0 HE2 LYS A 203 -10.774 5.866 -9.140 1.00 1.13 H new ATOM 0 HE3 LYS A 203 -9.401 5.837 -8.051 1.00 1.13 H new ATOM 0 HZ1 LYS A 203 -9.272 5.390 -10.691 1.00 1.93 H new ATOM 0 HZ2 LYS A 203 -8.110 4.863 -9.570 1.00 1.93 H new ATOM 0 HZ3 LYS A 203 -9.322 3.799 -10.101 1.00 1.93 H new ATOM 1293 N ILE A 204 -7.717 1.988 -4.768 1.00 0.24 N ATOM 1294 CA ILE A 204 -7.377 2.381 -3.455 1.00 0.22 C ATOM 1295 C ILE A 204 -6.004 1.886 -3.132 1.00 0.22 C ATOM 1296 O ILE A 204 -5.132 2.667 -2.883 1.00 0.25 O ATOM 1297 CB ILE A 204 -8.362 1.779 -2.478 1.00 0.24 C ATOM 1298 CG1 ILE A 204 -9.714 2.451 -2.610 1.00 0.27 C ATOM 1299 CG2 ILE A 204 -7.812 1.803 -1.080 1.00 0.32 C ATOM 1300 CD1 ILE A 204 -10.689 2.102 -1.529 1.00 0.30 C ATOM 0 H ILE A 204 -8.447 1.276 -4.789 1.00 0.24 H new ATOM 0 HA ILE A 204 -7.406 3.468 -3.382 1.00 0.22 H new ATOM 0 HB ILE A 204 -8.516 0.727 -2.720 1.00 0.24 H new ATOM 0 HG12 ILE A 204 -9.570 3.531 -2.617 1.00 0.27 H new ATOM 0 HG13 ILE A 204 -10.147 2.181 -3.573 1.00 0.27 H new ATOM 0 HG21 ILE A 204 -8.538 1.365 -0.396 1.00 0.32 H new ATOM 0 HG22 ILE A 204 -6.886 1.229 -1.043 1.00 0.32 H new ATOM 0 HG23 ILE A 204 -7.612 2.833 -0.786 1.00 0.32 H new ATOM 0 HD11 ILE A 204 -11.628 2.627 -1.703 1.00 0.30 H new ATOM 0 HD12 ILE A 204 -10.868 1.027 -1.534 1.00 0.30 H new ATOM 0 HD13 ILE A 204 -10.282 2.398 -0.562 1.00 0.30 H new ATOM 1312 N MET A 205 -5.790 0.585 -3.167 1.00 0.21 N ATOM 1313 CA MET A 205 -4.467 0.076 -2.885 1.00 0.21 C ATOM 1314 C MET A 205 -3.494 0.497 -3.949 1.00 0.22 C ATOM 1315 O MET A 205 -2.292 0.453 -3.774 1.00 0.26 O ATOM 1316 CB MET A 205 -4.456 -1.432 -2.698 1.00 0.22 C ATOM 1317 CG MET A 205 -4.361 -1.850 -1.244 1.00 0.27 C ATOM 1318 SD MET A 205 -5.333 -3.316 -0.902 1.00 0.32 S ATOM 1319 CE MET A 205 -6.850 -2.840 -1.717 1.00 0.42 C ATOM 0 H MET A 205 -6.495 -0.120 -3.382 1.00 0.21 H new ATOM 0 HA MET A 205 -4.151 0.513 -1.938 1.00 0.21 H new ATOM 0 HB2 MET A 205 -5.363 -1.853 -3.132 1.00 0.22 H new ATOM 0 HB3 MET A 205 -3.614 -1.854 -3.247 1.00 0.22 H new ATOM 0 HG2 MET A 205 -3.318 -2.039 -0.988 1.00 0.27 H new ATOM 0 HG3 MET A 205 -4.702 -1.033 -0.609 1.00 0.27 H new ATOM 0 HE1 MET A 205 -7.701 -3.154 -1.113 1.00 0.42 H new ATOM 0 HE2 MET A 205 -6.872 -1.757 -1.840 1.00 0.42 H new ATOM 0 HE3 MET A 205 -6.903 -3.318 -2.695 1.00 0.42 H new ATOM 1329 N GLU A 206 -4.000 0.990 -5.026 1.00 0.23 N ATOM 1330 CA GLU A 206 -3.128 1.449 -6.038 1.00 0.28 C ATOM 1331 C GLU A 206 -2.826 2.894 -5.732 1.00 0.30 C ATOM 1332 O GLU A 206 -1.751 3.400 -5.999 1.00 0.38 O ATOM 1333 CB GLU A 206 -3.705 1.236 -7.434 1.00 0.32 C ATOM 1334 CG GLU A 206 -3.960 -0.236 -7.713 1.00 0.34 C ATOM 1335 CD GLU A 206 -4.090 -0.566 -9.187 1.00 0.49 C ATOM 1336 OE1 GLU A 206 -5.134 -0.222 -9.790 1.00 0.54 O ATOM 1337 OE2 GLU A 206 -3.139 -1.135 -9.760 1.00 0.90 O ATOM 0 H GLU A 206 -4.996 1.083 -5.223 1.00 0.23 H new ATOM 0 HA GLU A 206 -2.202 0.874 -6.043 1.00 0.28 H new ATOM 0 HB2 GLU A 206 -4.637 1.793 -7.532 1.00 0.32 H new ATOM 0 HB3 GLU A 206 -3.016 1.634 -8.178 1.00 0.32 H new ATOM 0 HG2 GLU A 206 -3.145 -0.823 -7.289 1.00 0.34 H new ATOM 0 HG3 GLU A 206 -4.872 -0.541 -7.200 1.00 0.34 H new ATOM 1344 N ARG A 207 -3.756 3.536 -5.061 1.00 0.26 N ATOM 1345 CA ARG A 207 -3.561 4.906 -4.695 1.00 0.30 C ATOM 1346 C ARG A 207 -2.869 5.015 -3.352 1.00 0.31 C ATOM 1347 O ARG A 207 -2.070 5.915 -3.156 1.00 0.40 O ATOM 1348 CB ARG A 207 -4.892 5.665 -4.708 1.00 0.33 C ATOM 1349 CG ARG A 207 -5.858 5.247 -3.616 1.00 0.38 C ATOM 1350 CD ARG A 207 -7.263 5.671 -3.942 1.00 0.84 C ATOM 1351 NE ARG A 207 -8.156 5.696 -2.784 1.00 1.28 N ATOM 1352 CZ ARG A 207 -9.479 5.833 -2.893 1.00 1.93 C ATOM 1353 NH1 ARG A 207 -10.030 5.933 -4.099 1.00 2.42 N ATOM 1354 NH2 ARG A 207 -10.248 5.870 -1.808 1.00 2.55 N ATOM 0 H ARG A 207 -4.643 3.130 -4.764 1.00 0.26 H new ATOM 0 HA ARG A 207 -2.909 5.370 -5.435 1.00 0.30 H new ATOM 0 HB2 ARG A 207 -4.690 6.732 -4.610 1.00 0.33 H new ATOM 0 HB3 ARG A 207 -5.371 5.519 -5.676 1.00 0.33 H new ATOM 0 HG2 ARG A 207 -5.822 4.165 -3.489 1.00 0.38 H new ATOM 0 HG3 ARG A 207 -5.553 5.689 -2.668 1.00 0.38 H new ATOM 0 HD2 ARG A 207 -7.238 6.664 -4.391 1.00 0.84 H new ATOM 0 HD3 ARG A 207 -7.673 4.993 -4.690 1.00 0.84 H new ATOM 0 HE ARG A 207 -7.750 5.605 -1.853 1.00 1.28 H new ATOM 0 HH11 ARG A 207 -9.442 5.905 -4.932 1.00 2.42 H new ATOM 0 HH12 ARG A 207 -11.040 6.038 -4.191 1.00 2.42 H new ATOM 0 HH21 ARG A 207 -9.827 5.793 -0.882 1.00 2.55 H new ATOM 0 HH22 ARG A 207 -11.258 5.975 -1.902 1.00 2.55 H new ATOM 1368 N VAL A 208 -3.143 4.102 -2.423 1.00 0.29 N ATOM 1369 CA VAL A 208 -2.428 4.136 -1.171 1.00 0.31 C ATOM 1370 C VAL A 208 -1.069 3.573 -1.325 1.00 0.34 C ATOM 1371 O VAL A 208 -0.095 4.238 -1.065 1.00 0.50 O ATOM 1372 CB VAL A 208 -3.073 3.420 0.042 1.00 0.44 C ATOM 1373 CG1 VAL A 208 -3.793 4.388 0.953 1.00 0.30 C ATOM 1374 CG2 VAL A 208 -3.974 2.299 -0.373 1.00 0.80 C ATOM 0 H VAL A 208 -3.833 3.357 -2.516 1.00 0.29 H new ATOM 0 HA VAL A 208 -2.436 5.201 -0.938 1.00 0.31 H new ATOM 0 HB VAL A 208 -2.252 2.981 0.610 1.00 0.44 H new ATOM 0 HG11 VAL A 208 -4.230 3.843 1.790 1.00 0.30 H new ATOM 0 HG12 VAL A 208 -3.086 5.127 1.330 1.00 0.30 H new ATOM 0 HG13 VAL A 208 -4.583 4.893 0.396 1.00 0.30 H new ATOM 0 HG21 VAL A 208 -4.402 1.829 0.513 1.00 0.80 H new ATOM 0 HG22 VAL A 208 -4.776 2.690 -0.999 1.00 0.80 H new ATOM 0 HG23 VAL A 208 -3.401 1.561 -0.935 1.00 0.80 H new ATOM 1384 N VAL A 209 -1.018 2.360 -1.794 1.00 0.28 N ATOM 1385 CA VAL A 209 0.161 1.568 -1.690 1.00 0.31 C ATOM 1386 C VAL A 209 1.013 1.657 -2.948 1.00 0.29 C ATOM 1387 O VAL A 209 2.234 1.554 -2.853 1.00 0.30 O ATOM 1388 CB VAL A 209 -0.153 0.101 -1.293 1.00 0.38 C ATOM 1389 CG1 VAL A 209 -1.618 -0.198 -1.207 1.00 0.89 C ATOM 1390 CG2 VAL A 209 0.570 -0.878 -2.188 1.00 0.88 C ATOM 0 H VAL A 209 -1.798 1.896 -2.260 1.00 0.28 H new ATOM 0 HA VAL A 209 0.755 1.986 -0.877 1.00 0.31 H new ATOM 0 HB VAL A 209 0.228 -0.024 -0.279 1.00 0.38 H new ATOM 0 HG11 VAL A 209 -1.760 -1.241 -0.925 1.00 0.89 H new ATOM 0 HG12 VAL A 209 -2.078 0.446 -0.458 1.00 0.89 H new ATOM 0 HG13 VAL A 209 -2.084 -0.017 -2.176 1.00 0.89 H new ATOM 0 HG21 VAL A 209 0.329 -1.896 -1.883 1.00 0.88 H new ATOM 0 HG22 VAL A 209 0.258 -0.725 -3.221 1.00 0.88 H new ATOM 0 HG23 VAL A 209 1.645 -0.720 -2.106 1.00 0.88 H new ATOM 1400 N GLU A 210 0.423 1.898 -4.127 1.00 0.28 N ATOM 1401 CA GLU A 210 1.268 2.133 -5.279 1.00 0.29 C ATOM 1402 C GLU A 210 1.922 3.479 -5.098 1.00 0.24 C ATOM 1403 O GLU A 210 3.074 3.687 -5.451 1.00 0.25 O ATOM 1404 CB GLU A 210 0.523 2.080 -6.605 1.00 0.34 C ATOM 1405 CG GLU A 210 1.439 2.176 -7.812 1.00 0.63 C ATOM 1406 CD GLU A 210 0.684 2.384 -9.106 1.00 0.87 C ATOM 1407 OE1 GLU A 210 0.420 3.549 -9.464 1.00 1.62 O ATOM 1408 OE2 GLU A 210 0.344 1.378 -9.767 1.00 1.16 O ATOM 0 H GLU A 210 -0.583 1.932 -4.294 1.00 0.28 H new ATOM 0 HA GLU A 210 2.005 1.331 -5.330 1.00 0.29 H new ATOM 0 HB2 GLU A 210 -0.042 1.150 -6.659 1.00 0.34 H new ATOM 0 HB3 GLU A 210 -0.200 2.895 -6.640 1.00 0.34 H new ATOM 0 HG2 GLU A 210 2.137 3.000 -7.668 1.00 0.63 H new ATOM 0 HG3 GLU A 210 2.032 1.265 -7.885 1.00 0.63 H new ATOM 1415 N GLN A 211 1.182 4.386 -4.491 1.00 0.23 N ATOM 1416 CA GLN A 211 1.721 5.677 -4.158 1.00 0.23 C ATOM 1417 C GLN A 211 2.629 5.572 -2.955 1.00 0.22 C ATOM 1418 O GLN A 211 3.631 6.261 -2.868 1.00 0.25 O ATOM 1419 CB GLN A 211 0.609 6.662 -3.838 1.00 0.29 C ATOM 1420 CG GLN A 211 1.081 8.041 -3.387 1.00 0.34 C ATOM 1421 CD GLN A 211 1.955 8.760 -4.401 1.00 0.79 C ATOM 1422 OE1 GLN A 211 2.845 9.527 -4.029 1.00 1.49 O ATOM 1423 NE2 GLN A 211 1.700 8.543 -5.681 1.00 1.68 N ATOM 0 H GLN A 211 0.208 4.247 -4.221 1.00 0.23 H new ATOM 0 HA GLN A 211 2.284 6.032 -5.021 1.00 0.23 H new ATOM 0 HB2 GLN A 211 -0.017 6.780 -4.722 1.00 0.29 H new ATOM 0 HB3 GLN A 211 -0.020 6.236 -3.056 1.00 0.29 H new ATOM 0 HG2 GLN A 211 0.209 8.659 -3.172 1.00 0.34 H new ATOM 0 HG3 GLN A 211 1.636 7.936 -2.455 1.00 0.34 H new ATOM 0 HE21 GLN A 211 0.955 7.901 -5.951 1.00 1.68 H new ATOM 0 HE22 GLN A 211 2.249 9.018 -6.398 1.00 1.68 H new ATOM 1432 N MET A 212 2.270 4.719 -2.010 1.00 0.27 N ATOM 1433 CA MET A 212 3.017 4.655 -0.780 1.00 0.32 C ATOM 1434 C MET A 212 4.325 3.939 -0.980 1.00 0.25 C ATOM 1435 O MET A 212 5.363 4.376 -0.509 1.00 0.22 O ATOM 1436 CB MET A 212 2.245 4.027 0.356 1.00 0.48 C ATOM 1437 CG MET A 212 2.216 4.904 1.603 1.00 1.72 C ATOM 1438 SD MET A 212 3.815 5.066 2.406 1.00 1.89 S ATOM 1439 CE MET A 212 4.456 3.427 2.142 1.00 0.30 C ATOM 0 H MET A 212 1.481 4.076 -2.074 1.00 0.27 H new ATOM 0 HA MET A 212 3.213 5.688 -0.494 1.00 0.32 H new ATOM 0 HB2 MET A 212 1.223 3.831 0.031 1.00 0.48 H new ATOM 0 HB3 MET A 212 2.691 3.064 0.604 1.00 0.48 H new ATOM 0 HG2 MET A 212 1.853 5.895 1.331 1.00 1.72 H new ATOM 0 HG3 MET A 212 1.502 4.487 2.314 1.00 1.72 H new ATOM 0 HE1 MET A 212 4.643 2.950 3.104 1.00 0.30 H new ATOM 0 HE2 MET A 212 3.731 2.839 1.580 1.00 0.30 H new ATOM 0 HE3 MET A 212 5.388 3.487 1.580 1.00 0.30 H new ATOM 1449 N CYS A 213 4.294 2.837 -1.671 1.00 0.27 N ATOM 1450 CA CYS A 213 5.519 2.165 -1.988 1.00 0.24 C ATOM 1451 C CYS A 213 6.361 3.059 -2.907 1.00 0.23 C ATOM 1452 O CYS A 213 7.588 3.051 -2.841 1.00 0.25 O ATOM 1453 CB CYS A 213 5.232 0.804 -2.599 1.00 0.27 C ATOM 1454 SG CYS A 213 4.650 -0.447 -1.423 1.00 0.68 S ATOM 0 H CYS A 213 3.447 2.390 -2.021 1.00 0.27 H new ATOM 0 HA CYS A 213 6.095 1.983 -1.081 1.00 0.24 H new ATOM 0 HB2 CYS A 213 4.483 0.923 -3.382 1.00 0.27 H new ATOM 0 HB3 CYS A 213 6.140 0.438 -3.079 1.00 0.27 H new ATOM 1459 N ILE A 214 5.690 3.839 -3.763 1.00 0.23 N ATOM 1460 CA ILE A 214 6.364 4.878 -4.548 1.00 0.24 C ATOM 1461 C ILE A 214 6.974 5.886 -3.607 1.00 0.25 C ATOM 1462 O ILE A 214 8.092 6.354 -3.798 1.00 0.30 O ATOM 1463 CB ILE A 214 5.376 5.607 -5.496 1.00 0.24 C ATOM 1464 CG1 ILE A 214 5.602 5.187 -6.945 1.00 0.30 C ATOM 1465 CG2 ILE A 214 5.507 7.119 -5.374 1.00 0.26 C ATOM 1466 CD1 ILE A 214 5.592 3.700 -7.139 1.00 0.34 C ATOM 0 H ILE A 214 4.686 3.771 -3.929 1.00 0.23 H new ATOM 0 HA ILE A 214 7.132 4.401 -5.157 1.00 0.24 H new ATOM 0 HB ILE A 214 4.368 5.320 -5.197 1.00 0.24 H new ATOM 0 HG12 ILE A 214 4.829 5.633 -7.570 1.00 0.30 H new ATOM 0 HG13 ILE A 214 6.558 5.585 -7.287 1.00 0.30 H new ATOM 0 HG21 ILE A 214 4.802 7.601 -6.051 1.00 0.26 H new ATOM 0 HG22 ILE A 214 5.291 7.421 -4.349 1.00 0.26 H new ATOM 0 HG23 ILE A 214 6.522 7.418 -5.634 1.00 0.26 H new ATOM 0 HD11 ILE A 214 5.758 3.469 -8.191 1.00 0.34 H new ATOM 0 HD12 ILE A 214 6.383 3.250 -6.539 1.00 0.34 H new ATOM 0 HD13 ILE A 214 4.628 3.299 -6.828 1.00 0.34 H new ATOM 1478 N THR A 215 6.202 6.221 -2.597 1.00 0.25 N ATOM 1479 CA THR A 215 6.655 7.067 -1.542 1.00 0.27 C ATOM 1480 C THR A 215 7.938 6.496 -0.963 1.00 0.26 C ATOM 1481 O THR A 215 8.864 7.218 -0.721 1.00 0.33 O ATOM 1482 CB THR A 215 5.553 7.227 -0.472 1.00 0.29 C ATOM 1483 OG1 THR A 215 5.080 8.579 -0.446 1.00 0.37 O ATOM 1484 CG2 THR A 215 6.033 6.805 0.898 1.00 0.31 C ATOM 0 H THR A 215 5.237 5.906 -2.494 1.00 0.25 H new ATOM 0 HA THR A 215 6.870 8.064 -1.927 1.00 0.27 H new ATOM 0 HB THR A 215 4.729 6.567 -0.744 1.00 0.29 H new ATOM 0 HG1 THR A 215 4.381 8.668 0.235 1.00 0.37 H new ATOM 0 HG21 THR A 215 5.228 6.933 1.621 1.00 0.31 H new ATOM 0 HG22 THR A 215 6.334 5.758 0.872 1.00 0.31 H new ATOM 0 HG23 THR A 215 6.884 7.419 1.190 1.00 0.31 H new ATOM 1492 N GLN A 216 7.985 5.187 -0.769 1.00 0.23 N ATOM 1493 CA GLN A 216 9.217 4.513 -0.356 1.00 0.25 C ATOM 1494 C GLN A 216 10.377 4.706 -1.340 1.00 0.31 C ATOM 1495 O GLN A 216 11.530 4.659 -0.931 1.00 0.39 O ATOM 1496 CB GLN A 216 8.997 3.029 -0.152 1.00 0.25 C ATOM 1497 CG GLN A 216 7.775 2.711 0.697 1.00 0.28 C ATOM 1498 CD GLN A 216 7.336 1.269 0.587 1.00 0.88 C ATOM 1499 OE1 GLN A 216 7.560 0.616 -0.428 1.00 1.69 O ATOM 1500 NE2 GLN A 216 6.666 0.776 1.615 1.00 1.58 N ATOM 0 H GLN A 216 7.186 4.565 -0.890 1.00 0.23 H new ATOM 0 HA GLN A 216 9.493 4.984 0.588 1.00 0.25 H new ATOM 0 HB2 GLN A 216 8.890 2.548 -1.124 1.00 0.25 H new ATOM 0 HB3 GLN A 216 9.880 2.600 0.321 1.00 0.25 H new ATOM 0 HG2 GLN A 216 7.995 2.939 1.740 1.00 0.28 H new ATOM 0 HG3 GLN A 216 6.952 3.359 0.396 1.00 0.28 H new ATOM 0 HE21 GLN A 216 6.501 1.352 2.440 1.00 1.58 H new ATOM 0 HE22 GLN A 216 6.314 -0.181 1.583 1.00 1.58 H new ATOM 1509 N TYR A 217 10.104 4.914 -2.629 1.00 0.38 N ATOM 1510 CA TYR A 217 11.188 5.227 -3.562 1.00 0.49 C ATOM 1511 C TYR A 217 11.944 6.434 -3.029 1.00 0.49 C ATOM 1512 O TYR A 217 13.170 6.501 -3.076 1.00 0.57 O ATOM 1513 CB TYR A 217 10.669 5.520 -4.976 1.00 0.73 C ATOM 1514 CG TYR A 217 11.744 6.035 -5.910 1.00 0.85 C ATOM 1515 CD1 TYR A 217 12.877 5.279 -6.187 1.00 0.97 C ATOM 1516 CD2 TYR A 217 11.614 7.271 -6.527 1.00 1.07 C ATOM 1517 CE1 TYR A 217 13.847 5.745 -7.055 1.00 1.18 C ATOM 1518 CE2 TYR A 217 12.579 7.744 -7.392 1.00 1.29 C ATOM 1519 CZ TYR A 217 13.744 6.985 -7.592 1.00 1.31 C ATOM 1520 OH TYR A 217 14.656 7.443 -8.520 1.00 1.56 O ATOM 0 H TYR A 217 9.172 4.874 -3.042 1.00 0.38 H new ATOM 0 HA TYR A 217 11.843 4.359 -3.637 1.00 0.49 H new ATOM 0 HB2 TYR A 217 10.239 4.610 -5.394 1.00 0.73 H new ATOM 0 HB3 TYR A 217 9.866 6.254 -4.917 1.00 0.73 H new ATOM 0 HD1 TYR A 217 13.001 4.314 -5.718 1.00 0.97 H new ATOM 0 HD2 TYR A 217 10.741 7.874 -6.326 1.00 1.07 H new ATOM 0 HE1 TYR A 217 14.690 5.118 -7.306 1.00 1.18 H new ATOM 0 HE2 TYR A 217 12.441 8.683 -7.907 1.00 1.29 H new ATOM 0 HH TYR A 217 14.417 8.354 -8.791 1.00 1.56 H new ATOM 1530 N GLN A 218 11.178 7.370 -2.493 1.00 0.46 N ATOM 1531 CA GLN A 218 11.737 8.566 -1.872 1.00 0.51 C ATOM 1532 C GLN A 218 11.894 8.414 -0.343 1.00 0.50 C ATOM 1533 O GLN A 218 12.776 9.028 0.253 1.00 0.61 O ATOM 1534 CB GLN A 218 10.865 9.789 -2.203 1.00 0.53 C ATOM 1535 CG GLN A 218 9.376 9.487 -2.305 1.00 0.48 C ATOM 1536 CD GLN A 218 8.506 10.729 -2.290 1.00 0.72 C ATOM 1537 OE1 GLN A 218 8.105 11.209 -1.228 1.00 1.31 O ATOM 1538 NE2 GLN A 218 8.193 11.251 -3.465 1.00 1.52 N ATOM 0 H GLN A 218 10.159 7.326 -2.474 1.00 0.46 H new ATOM 0 HA GLN A 218 12.736 8.711 -2.283 1.00 0.51 H new ATOM 0 HB2 GLN A 218 11.018 10.548 -1.436 1.00 0.53 H new ATOM 0 HB3 GLN A 218 11.203 10.217 -3.147 1.00 0.53 H new ATOM 0 HG2 GLN A 218 9.188 8.932 -3.224 1.00 0.48 H new ATOM 0 HG3 GLN A 218 9.087 8.840 -1.477 1.00 0.48 H new ATOM 0 HE21 GLN A 218 8.545 10.825 -4.322 1.00 1.52 H new ATOM 0 HE22 GLN A 218 7.600 12.080 -3.513 1.00 1.52 H new ATOM 1547 N GLN A 219 11.066 7.573 0.275 1.00 0.40 N ATOM 1548 CA GLN A 219 10.965 7.522 1.734 1.00 0.41 C ATOM 1549 C GLN A 219 11.800 6.405 2.311 1.00 0.39 C ATOM 1550 O GLN A 219 12.190 6.438 3.473 1.00 0.46 O ATOM 1551 CB GLN A 219 9.523 7.394 2.238 1.00 0.45 C ATOM 1552 CG GLN A 219 9.062 5.960 2.411 1.00 0.44 C ATOM 1553 CD GLN A 219 8.007 5.803 3.493 1.00 0.81 C ATOM 1554 OE1 GLN A 219 7.213 6.707 3.749 1.00 1.64 O ATOM 1555 NE2 GLN A 219 8.005 4.653 4.153 1.00 1.26 N ATOM 0 H GLN A 219 10.455 6.917 -0.212 1.00 0.40 H new ATOM 0 HA GLN A 219 11.352 8.480 2.081 1.00 0.41 H new ATOM 0 HB2 GLN A 219 9.434 7.912 3.193 1.00 0.45 H new ATOM 0 HB3 GLN A 219 8.857 7.898 1.538 1.00 0.45 H new ATOM 0 HG2 GLN A 219 8.661 5.596 1.465 1.00 0.44 H new ATOM 0 HG3 GLN A 219 9.921 5.335 2.655 1.00 0.44 H new ATOM 0 HE21 GLN A 219 8.679 3.926 3.913 1.00 1.26 H new ATOM 0 HE22 GLN A 219 7.330 4.495 4.901 1.00 1.26 H new ATOM 1564 N GLU A 220 12.054 5.395 1.516 1.00 0.35 N ATOM 1565 CA GLU A 220 12.877 4.312 1.965 1.00 0.39 C ATOM 1566 C GLU A 220 14.309 4.611 1.648 1.00 0.48 C ATOM 1567 O GLU A 220 15.210 3.961 2.139 1.00 0.55 O ATOM 1568 CB GLU A 220 12.456 2.994 1.357 1.00 0.50 C ATOM 1569 CG GLU A 220 13.246 1.833 1.904 1.00 1.11 C ATOM 1570 CD GLU A 220 12.854 1.452 3.313 1.00 2.32 C ATOM 1571 OE1 GLU A 220 11.866 2.015 3.828 1.00 2.80 O ATOM 1572 OE2 GLU A 220 13.521 0.576 3.904 1.00 3.07 O ATOM 0 H GLU A 220 11.703 5.305 0.562 1.00 0.35 H new ATOM 0 HA GLU A 220 12.757 4.215 3.044 1.00 0.39 H new ATOM 0 HB2 GLU A 220 11.395 2.831 1.548 1.00 0.50 H new ATOM 0 HB3 GLU A 220 12.582 3.039 0.275 1.00 0.50 H new ATOM 0 HG2 GLU A 220 13.110 0.971 1.251 1.00 1.11 H new ATOM 0 HG3 GLU A 220 14.307 2.083 1.885 1.00 1.11 H new ATOM 1579 N SER A 221 14.547 5.641 0.872 1.00 0.52 N ATOM 1580 CA SER A 221 15.900 6.080 0.741 1.00 0.63 C ATOM 1581 C SER A 221 16.325 6.640 2.091 1.00 0.68 C ATOM 1582 O SER A 221 17.503 6.794 2.392 1.00 0.81 O ATOM 1583 CB SER A 221 16.066 7.134 -0.325 1.00 0.70 C ATOM 1584 OG SER A 221 15.528 8.384 0.083 1.00 0.86 O ATOM 0 H SER A 221 13.850 6.167 0.345 1.00 0.52 H new ATOM 0 HA SER A 221 16.520 5.236 0.439 1.00 0.63 H new ATOM 0 HB2 SER A 221 17.124 7.252 -0.558 1.00 0.70 H new ATOM 0 HB3 SER A 221 15.572 6.807 -1.240 1.00 0.70 H new ATOM 0 HG SER A 221 14.549 8.345 0.052 1.00 0.86 H new ATOM 1590 N GLN A 222 15.302 6.950 2.882 1.00 0.62 N ATOM 1591 CA GLN A 222 15.447 7.455 4.228 1.00 0.66 C ATOM 1592 C GLN A 222 15.578 6.294 5.204 1.00 0.60 C ATOM 1593 O GLN A 222 16.571 6.168 5.922 1.00 0.63 O ATOM 1594 CB GLN A 222 14.203 8.265 4.583 1.00 0.71 C ATOM 1595 CG GLN A 222 13.739 9.178 3.464 1.00 0.88 C ATOM 1596 CD GLN A 222 12.503 9.981 3.831 1.00 0.95 C ATOM 1597 OE1 GLN A 222 11.667 9.536 4.618 1.00 1.36 O ATOM 1598 NE2 GLN A 222 12.377 11.165 3.255 1.00 1.60 N ATOM 0 H GLN A 222 14.330 6.852 2.590 1.00 0.62 H new ATOM 0 HA GLN A 222 16.338 8.080 4.290 1.00 0.66 H new ATOM 0 HB2 GLN A 222 13.395 7.581 4.842 1.00 0.71 H new ATOM 0 HB3 GLN A 222 14.410 8.865 5.469 1.00 0.71 H new ATOM 0 HG2 GLN A 222 14.546 9.862 3.202 1.00 0.88 H new ATOM 0 HG3 GLN A 222 13.528 8.580 2.578 1.00 0.88 H new ATOM 0 HE21 GLN A 222 13.093 11.496 2.609 1.00 1.60 H new ATOM 0 HE22 GLN A 222 11.564 11.747 3.457 1.00 1.60 H new ATOM 1607 N ALA A 223 14.563 5.439 5.212 1.00 0.56 N ATOM 1608 CA ALA A 223 14.519 4.321 6.139 1.00 0.54 C ATOM 1609 C ALA A 223 15.528 3.257 5.779 1.00 0.53 C ATOM 1610 O ALA A 223 16.163 2.690 6.658 1.00 0.60 O ATOM 1611 CB ALA A 223 13.143 3.699 6.194 1.00 0.59 C ATOM 0 H ALA A 223 13.760 5.501 4.586 1.00 0.56 H new ATOM 0 HA ALA A 223 14.767 4.726 7.120 1.00 0.54 H new ATOM 0 HB1 ALA A 223 13.148 2.866 6.897 1.00 0.59 H new ATOM 0 HB2 ALA A 223 12.419 4.446 6.521 1.00 0.59 H new ATOM 0 HB3 ALA A 223 12.868 3.336 5.204 1.00 0.59 H new ATOM 1617 N ALA A 224 15.696 2.980 4.494 1.00 0.54 N ATOM 1618 CA ALA A 224 16.643 1.966 4.093 1.00 0.64 C ATOM 1619 C ALA A 224 18.043 2.534 4.116 1.00 0.74 C ATOM 1620 O ALA A 224 19.014 1.844 3.831 1.00 0.89 O ATOM 1621 CB ALA A 224 16.341 1.376 2.742 1.00 0.77 C ATOM 0 H ALA A 224 15.197 3.436 3.730 1.00 0.54 H new ATOM 0 HA ALA A 224 16.560 1.151 4.812 1.00 0.64 H new ATOM 0 HB1 ALA A 224 17.089 0.621 2.499 1.00 0.77 H new ATOM 0 HB2 ALA A 224 15.353 0.916 2.758 1.00 0.77 H new ATOM 0 HB3 ALA A 224 16.362 2.163 1.988 1.00 0.77 H new ATOM 1627 N TYR A 225 18.138 3.814 4.426 1.00 0.72 N ATOM 1628 CA TYR A 225 19.422 4.421 4.653 1.00 0.85 C ATOM 1629 C TYR A 225 19.813 4.101 6.070 1.00 0.89 C ATOM 1630 O TYR A 225 20.962 3.795 6.393 1.00 1.06 O ATOM 1631 CB TYR A 225 19.373 5.932 4.449 1.00 0.85 C ATOM 1632 CG TYR A 225 20.635 6.626 4.891 1.00 0.97 C ATOM 1633 CD1 TYR A 225 21.761 6.641 4.077 1.00 1.21 C ATOM 1634 CD2 TYR A 225 20.698 7.277 6.113 1.00 0.95 C ATOM 1635 CE1 TYR A 225 22.917 7.284 4.474 1.00 1.36 C ATOM 1636 CE2 TYR A 225 21.849 7.924 6.516 1.00 1.11 C ATOM 1637 CZ TYR A 225 22.969 7.888 5.714 1.00 1.29 C ATOM 1638 OH TYR A 225 24.106 8.567 6.095 1.00 1.47 O ATOM 0 H TYR A 225 17.342 4.444 4.524 1.00 0.72 H new ATOM 0 HA TYR A 225 20.150 4.032 3.941 1.00 0.85 H new ATOM 0 HB2 TYR A 225 19.198 6.145 3.395 1.00 0.85 H new ATOM 0 HB3 TYR A 225 18.527 6.341 5.002 1.00 0.85 H new ATOM 0 HD1 TYR A 225 21.732 6.142 3.119 1.00 1.21 H new ATOM 0 HD2 TYR A 225 19.833 7.278 6.760 1.00 0.95 H new ATOM 0 HE1 TYR A 225 23.775 7.314 3.818 1.00 1.36 H new ATOM 0 HE2 TYR A 225 21.872 8.456 7.456 1.00 1.11 H new ATOM 0 HH TYR A 225 23.981 8.935 6.995 1.00 1.47 H new ATOM 1648 N GLN A 226 18.800 4.176 6.896 1.00 0.77 N ATOM 1649 CA GLN A 226 18.880 3.834 8.288 1.00 0.84 C ATOM 1650 C GLN A 226 19.136 2.330 8.464 1.00 0.88 C ATOM 1651 O GLN A 226 20.073 1.926 9.151 1.00 0.96 O ATOM 1652 CB GLN A 226 17.564 4.244 8.942 1.00 0.81 C ATOM 1653 CG GLN A 226 16.957 3.160 9.779 1.00 1.19 C ATOM 1654 CD GLN A 226 15.628 3.546 10.402 1.00 1.90 C ATOM 1655 OE1 GLN A 226 14.768 2.697 10.629 1.00 2.75 O ATOM 1656 NE2 GLN A 226 15.450 4.828 10.681 1.00 2.24 N ATOM 0 H GLN A 226 17.872 4.486 6.607 1.00 0.77 H new ATOM 0 HA GLN A 226 19.712 4.357 8.760 1.00 0.84 H new ATOM 0 HB2 GLN A 226 17.734 5.123 9.564 1.00 0.81 H new ATOM 0 HB3 GLN A 226 16.856 4.535 8.166 1.00 0.81 H new ATOM 0 HG2 GLN A 226 16.816 2.272 9.162 1.00 1.19 H new ATOM 0 HG3 GLN A 226 17.655 2.890 10.571 1.00 1.19 H new ATOM 0 HE21 GLN A 226 16.188 5.502 10.477 1.00 2.24 H new ATOM 0 HE22 GLN A 226 14.575 5.142 11.100 1.00 2.24 H new