USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 646 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: B 221 TYR OH : rot -148:sc= 0.857 USER MOD Set 1.2: B 245 THR OG1 : rot 85:sc= 1.54 USER MOD Set 2.1: A 7 THR OG1 : rot -170:sc= 0.00774 USER MOD Set 2.2: B 213 ASN : amide:sc= 0.00862 X(o=0.016,f=0.045) USER MOD Set 3.1: A 6 TYR OH : rot 180:sc= -2.07! USER MOD Set 3.2: B 212 ASN : amide:sc= -10.8! C(o=-13!,f=-18!) USER MOD Set 4.1: A 12 ASN : amide:sc= -4.65! C(o=-4.6!,f=-11!) USER MOD Set 4.2: B 206 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= -3.39! USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 150:sc= -3.1! USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.913 K(o=-0.91,f=-0.38) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 68:sc= -1.08! USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.108 USER MOD Single : A 27 MET CE :methyl -135:sc= -1.38 (180deg=-4.13!) USER MOD Single : A 28 THR OG1 : rot -175:sc= -1.28 USER MOD Single : A 40 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0368) USER MOD Single : A 44 ASN : amide:sc= -1.54! K(o=-1.5!,f=-0.79) USER MOD Single : A 45 THR OG1 : rot 87:sc= 0.987 USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 205 THR OG1 : rot 180:sc= -3.88! USER MOD Single : B 207 THR OG1 : rot -118:sc= 0.00661 USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 211 THR OG1 : rot 160:sc= -3.16 USER MOD Single : B 214 SER OG : rot 180:sc= 0 USER MOD Single : B 215 ASN : amide:sc= -1.39 K(o=-1.4,f=-0.13) USER MOD Single : B 218 SER OG : rot 180:sc= 0 USER MOD Single : B 223 THR OG1 : rot 180:sc= 0 USER MOD Single : B 225 THR OG1 : rot 180:sc= -1.05 USER MOD Single : B 227 MET CE :methyl -139:sc= -1.36 (180deg=-4.28!) USER MOD Single : B 228 THR OG1 : rot -94:sc= -1.01 USER MOD Single : B 240 LYS NZ :NH3+ -179:sc= -1.14 (180deg=-1.15) USER MOD Single : B 244 ASN : amide:sc= -1.28! K(o=-1.3!,f=-0.68) USER MOD ----------------------------------------------------------------- ATOM 25 N LYS A 3 -1.339 -20.054 -6.220 1.00 0.00 N ATOM 26 CA LYS A 3 -0.317 -19.747 -5.232 1.00 0.00 C ATOM 27 C LYS A 3 -0.814 -18.618 -4.327 1.00 0.00 C ATOM 28 O LYS A 3 -1.842 -18.002 -4.603 1.00 0.00 O ATOM 29 CB LYS A 3 1.017 -19.444 -5.918 1.00 0.00 C ATOM 30 CG LYS A 3 1.545 -20.675 -6.657 1.00 0.00 C ATOM 31 CD LYS A 3 1.107 -21.963 -5.959 1.00 0.00 C ATOM 32 CE LYS A 3 1.808 -23.181 -6.564 1.00 0.00 C ATOM 33 NZ LYS A 3 1.532 -24.392 -5.760 1.00 0.00 N ATOM 0 HA LYS A 3 -0.131 -20.611 -4.593 1.00 0.00 H new ATOM 0 HB2 LYS A 3 0.890 -18.620 -6.621 1.00 0.00 H new ATOM 0 HB3 LYS A 3 1.747 -19.120 -5.176 1.00 0.00 H new ATOM 0 HG2 LYS A 3 1.180 -20.671 -7.684 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.633 -20.635 -6.706 1.00 0.00 H new ATOM 0 HD2 LYS A 3 1.335 -21.899 -4.895 1.00 0.00 H new ATOM 0 HD3 LYS A 3 0.027 -22.080 -6.048 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.467 -23.332 -7.588 1.00 0.00 H new ATOM 0 HE3 LYS A 3 2.883 -23.004 -6.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 2.016 -25.209 -6.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 1.879 -24.251 -4.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.507 -24.569 -5.739 1.00 0.00 H new ATOM 47 N ALA A 4 -0.060 -18.381 -3.263 1.00 0.00 N ATOM 48 CA ALA A 4 -0.410 -17.338 -2.314 1.00 0.00 C ATOM 49 C ALA A 4 0.536 -16.149 -2.498 1.00 0.00 C ATOM 50 O ALA A 4 1.618 -16.117 -1.916 1.00 0.00 O ATOM 51 CB ALA A 4 -0.366 -17.903 -0.894 1.00 0.00 C ATOM 0 H ALA A 4 0.792 -18.894 -3.037 1.00 0.00 H new ATOM 0 HA ALA A 4 -1.425 -16.983 -2.492 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -0.629 -17.120 -0.183 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.076 -18.725 -0.807 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.638 -18.267 -0.678 1.00 0.00 H new ATOM 57 N THR A 5 0.093 -15.201 -3.311 1.00 0.00 N ATOM 58 CA THR A 5 0.886 -14.014 -3.579 1.00 0.00 C ATOM 59 C THR A 5 0.009 -12.762 -3.518 1.00 0.00 C ATOM 60 O THR A 5 -1.215 -12.852 -3.594 1.00 0.00 O ATOM 61 CB THR A 5 1.580 -14.204 -4.929 1.00 0.00 C ATOM 62 OG1 THR A 5 0.507 -14.294 -5.862 1.00 0.00 O ATOM 63 CG2 THR A 5 2.285 -15.558 -5.039 1.00 0.00 C ATOM 0 H THR A 5 -0.805 -15.231 -3.793 1.00 0.00 H new ATOM 0 HA THR A 5 1.654 -13.872 -2.819 1.00 0.00 H new ATOM 0 HB THR A 5 2.305 -13.404 -5.080 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.868 -14.417 -6.765 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.761 -15.642 -6.016 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.041 -15.639 -4.258 1.00 0.00 H new ATOM 0 HG23 THR A 5 1.555 -16.359 -4.921 1.00 0.00 H new ATOM 71 N TYR A 6 0.670 -11.621 -3.381 1.00 0.00 N ATOM 72 CA TYR A 6 -0.034 -10.352 -3.309 1.00 0.00 C ATOM 73 C TYR A 6 0.673 -9.285 -4.147 1.00 0.00 C ATOM 74 O TYR A 6 1.901 -9.245 -4.202 1.00 0.00 O ATOM 75 CB TYR A 6 0.001 -9.934 -1.838 1.00 0.00 C ATOM 76 CG TYR A 6 -1.332 -10.113 -1.109 1.00 0.00 C ATOM 77 CD1 TYR A 6 -1.741 -11.373 -0.718 1.00 0.00 C ATOM 78 CD2 TYR A 6 -2.125 -9.017 -0.841 1.00 0.00 C ATOM 79 CE1 TYR A 6 -2.995 -11.541 -0.032 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.380 -9.185 -0.154 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.754 -10.439 0.216 1.00 0.00 C ATOM 82 OH TYR A 6 -4.938 -10.599 0.865 1.00 0.00 O ATOM 0 H TYR A 6 1.686 -11.549 -3.318 1.00 0.00 H new ATOM 0 HA TYR A 6 -1.050 -10.454 -3.691 1.00 0.00 H new ATOM 0 HB2 TYR A 6 0.766 -10.516 -1.324 1.00 0.00 H new ATOM 0 HB3 TYR A 6 0.300 -8.888 -1.775 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -1.120 -12.232 -0.927 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -1.805 -8.032 -1.146 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -3.327 -12.521 0.279 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -4.009 -8.334 0.062 1.00 0.00 H new ATOM 0 HH TYR A 6 -5.372 -9.727 0.973 1.00 0.00 H new ATOM 92 N THR A 7 -0.134 -8.445 -4.780 1.00 0.00 N ATOM 93 CA THR A 7 0.399 -7.381 -5.613 1.00 0.00 C ATOM 94 C THR A 7 0.020 -6.015 -5.039 1.00 0.00 C ATOM 95 O THR A 7 -1.141 -5.613 -5.096 1.00 0.00 O ATOM 96 CB THR A 7 -0.104 -7.601 -7.041 1.00 0.00 C ATOM 97 OG1 THR A 7 0.105 -8.991 -7.273 1.00 0.00 O ATOM 98 CG2 THR A 7 0.777 -6.912 -8.085 1.00 0.00 C ATOM 0 H THR A 7 -1.152 -8.480 -4.732 1.00 0.00 H new ATOM 0 HA THR A 7 1.489 -7.400 -5.631 1.00 0.00 H new ATOM 0 HB THR A 7 -1.125 -7.230 -7.127 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.044 -9.190 -8.221 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.376 -7.100 -9.081 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.793 -5.839 -7.897 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.791 -7.306 -8.022 1.00 0.00 H new ATOM 106 N VAL A 8 1.022 -5.336 -4.498 1.00 0.00 N ATOM 107 CA VAL A 8 0.808 -4.023 -3.914 1.00 0.00 C ATOM 108 C VAL A 8 1.316 -2.952 -4.880 1.00 0.00 C ATOM 109 O VAL A 8 2.494 -2.938 -5.234 1.00 0.00 O ATOM 110 CB VAL A 8 1.470 -3.949 -2.536 1.00 0.00 C ATOM 111 CG1 VAL A 8 1.449 -2.519 -1.995 1.00 0.00 C ATOM 112 CG2 VAL A 8 0.806 -4.917 -1.556 1.00 0.00 C ATOM 0 H VAL A 8 1.984 -5.671 -4.452 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.256 -3.842 -3.758 1.00 0.00 H new ATOM 0 HB VAL A 8 2.512 -4.249 -2.648 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.925 -2.494 -1.015 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.989 -1.864 -2.678 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.417 -2.179 -1.906 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.295 -4.844 -0.585 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.249 -4.662 -1.451 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.897 -5.936 -1.933 1.00 0.00 H new ATOM 122 N THR A 9 0.402 -2.078 -5.278 1.00 0.00 N ATOM 123 CA THR A 9 0.744 -1.005 -6.196 1.00 0.00 C ATOM 124 C THR A 9 0.556 0.355 -5.521 1.00 0.00 C ATOM 125 O THR A 9 -0.476 0.607 -4.901 1.00 0.00 O ATOM 126 CB THR A 9 -0.102 -1.177 -7.460 1.00 0.00 C ATOM 127 OG1 THR A 9 -0.016 -2.569 -7.750 1.00 0.00 O ATOM 128 CG2 THR A 9 0.525 -0.502 -8.681 1.00 0.00 C ATOM 0 H THR A 9 -0.574 -2.091 -4.982 1.00 0.00 H new ATOM 0 HA THR A 9 1.795 -1.049 -6.481 1.00 0.00 H new ATOM 0 HB THR A 9 -1.097 -0.765 -7.289 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.538 -2.768 -8.555 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.115 -0.654 -9.550 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.631 0.566 -8.492 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.506 -0.936 -8.873 1.00 0.00 H new ATOM 136 N VAL A 10 1.572 1.194 -5.662 1.00 0.00 N ATOM 137 CA VAL A 10 1.532 2.522 -5.071 1.00 0.00 C ATOM 138 C VAL A 10 1.826 3.564 -6.153 1.00 0.00 C ATOM 139 O VAL A 10 2.881 3.527 -6.786 1.00 0.00 O ATOM 140 CB VAL A 10 2.499 2.598 -3.889 1.00 0.00 C ATOM 141 CG1 VAL A 10 2.979 4.033 -3.664 1.00 0.00 C ATOM 142 CG2 VAL A 10 1.861 2.028 -2.621 1.00 0.00 C ATOM 0 H VAL A 10 2.427 0.981 -6.176 1.00 0.00 H new ATOM 0 HA VAL A 10 0.539 2.735 -4.675 1.00 0.00 H new ATOM 0 HB VAL A 10 3.370 1.988 -4.129 1.00 0.00 H new ATOM 0 HG11 VAL A 10 3.665 4.059 -2.818 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.491 4.390 -4.558 1.00 0.00 H new ATOM 0 HG13 VAL A 10 2.123 4.675 -3.456 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.570 2.094 -1.796 1.00 0.00 H new ATOM 0 HG22 VAL A 10 0.965 2.599 -2.376 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.593 0.985 -2.786 1.00 0.00 H new ATOM 152 N THR A 11 0.876 4.469 -6.331 1.00 0.00 N ATOM 153 CA THR A 11 1.021 5.520 -7.324 1.00 0.00 C ATOM 154 C THR A 11 0.828 6.894 -6.679 1.00 0.00 C ATOM 155 O THR A 11 -0.037 7.066 -5.822 1.00 0.00 O ATOM 156 CB THR A 11 0.032 5.238 -8.457 1.00 0.00 C ATOM 157 OG1 THR A 11 0.498 4.019 -9.029 1.00 0.00 O ATOM 158 CG2 THR A 11 0.144 6.251 -9.598 1.00 0.00 C ATOM 0 H THR A 11 0.003 4.497 -5.805 1.00 0.00 H new ATOM 0 HA THR A 11 2.027 5.531 -7.744 1.00 0.00 H new ATOM 0 HB THR A 11 -0.984 5.247 -8.062 1.00 0.00 H new ATOM 0 HG1 THR A 11 -0.261 3.519 -9.397 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.579 6.005 -10.375 1.00 0.00 H new ATOM 0 HG22 THR A 11 -0.059 7.252 -9.217 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.150 6.219 -10.016 1.00 0.00 H new ATOM 166 N ASN A 12 1.652 7.837 -7.114 1.00 0.00 N ATOM 167 CA ASN A 12 1.584 9.190 -6.590 1.00 0.00 C ATOM 168 C ASN A 12 0.825 10.078 -7.578 1.00 0.00 C ATOM 169 O ASN A 12 1.315 10.355 -8.671 1.00 0.00 O ATOM 170 CB ASN A 12 2.984 9.779 -6.403 1.00 0.00 C ATOM 171 CG ASN A 12 3.959 8.722 -5.882 1.00 0.00 C ATOM 172 OD1 ASN A 12 3.592 7.599 -5.575 1.00 0.00 O ATOM 173 ND2 ASN A 12 5.219 9.141 -5.803 1.00 0.00 N ATOM 0 H ASN A 12 2.370 7.690 -7.823 1.00 0.00 H new ATOM 0 HA ASN A 12 1.077 9.153 -5.626 1.00 0.00 H new ATOM 0 HB2 ASN A 12 3.345 10.176 -7.352 1.00 0.00 H new ATOM 0 HB3 ASN A 12 2.940 10.614 -5.704 1.00 0.00 H new ATOM 0 HD21 ASN A 12 5.947 8.509 -5.469 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.458 10.094 -6.076 1.00 0.00 H new ATOM 180 N ASN A 13 -0.358 10.500 -7.156 1.00 0.00 N ATOM 181 CA ASN A 13 -1.190 11.351 -7.990 1.00 0.00 C ATOM 182 C ASN A 13 -0.578 12.752 -8.052 1.00 0.00 C ATOM 183 O ASN A 13 -0.958 13.562 -8.896 1.00 0.00 O ATOM 184 CB ASN A 13 -2.602 11.476 -7.414 1.00 0.00 C ATOM 185 CG ASN A 13 -3.631 10.823 -8.339 1.00 0.00 C ATOM 186 OD1 ASN A 13 -4.015 11.365 -9.363 1.00 0.00 O ATOM 187 ND2 ASN A 13 -4.056 9.634 -7.922 1.00 0.00 N ATOM 0 H ASN A 13 -0.760 10.269 -6.248 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.244 10.902 -8.982 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.641 11.006 -6.431 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -2.850 12.528 -7.274 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.745 9.118 -8.469 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.693 9.238 -7.055 1.00 0.00 H new ATOM 194 N SER A 14 0.358 12.994 -7.146 1.00 0.00 N ATOM 195 CA SER A 14 1.026 14.283 -7.088 1.00 0.00 C ATOM 196 C SER A 14 2.158 14.333 -8.116 1.00 0.00 C ATOM 197 O SER A 14 2.424 15.383 -8.700 1.00 0.00 O ATOM 198 CB SER A 14 1.571 14.558 -5.684 1.00 0.00 C ATOM 199 OG SER A 14 2.944 14.192 -5.564 1.00 0.00 O ATOM 0 H SER A 14 0.669 12.320 -6.447 1.00 0.00 H new ATOM 0 HA SER A 14 0.296 15.057 -7.324 1.00 0.00 H new ATOM 0 HB2 SER A 14 1.456 15.617 -5.451 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.983 14.005 -4.952 1.00 0.00 H new ATOM 0 HG SER A 14 3.256 14.384 -4.655 1.00 0.00 H new ATOM 205 N ASN A 15 2.794 13.187 -8.305 1.00 0.00 N ATOM 206 CA ASN A 15 3.891 13.087 -9.253 1.00 0.00 C ATOM 207 C ASN A 15 3.451 12.240 -10.448 1.00 0.00 C ATOM 208 O ASN A 15 4.187 12.109 -11.425 1.00 0.00 O ATOM 209 CB ASN A 15 5.108 12.413 -8.617 1.00 0.00 C ATOM 210 CG ASN A 15 6.391 13.183 -8.937 1.00 0.00 C ATOM 211 OD1 ASN A 15 6.458 14.397 -8.834 1.00 0.00 O ATOM 212 ND2 ASN A 15 7.402 12.414 -9.327 1.00 0.00 N ATOM 0 H ASN A 15 2.571 12.319 -7.818 1.00 0.00 H new ATOM 0 HA ASN A 15 4.160 14.096 -9.566 1.00 0.00 H new ATOM 0 HB2 ASN A 15 4.974 12.356 -7.537 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.193 11.389 -8.982 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.301 12.834 -9.561 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.279 11.404 -9.392 1.00 0.00 H new ATOM 219 N GLY A 16 2.254 11.685 -10.332 1.00 0.00 N ATOM 220 CA GLY A 16 1.708 10.854 -11.390 1.00 0.00 C ATOM 221 C GLY A 16 2.584 9.622 -11.628 1.00 0.00 C ATOM 222 O GLY A 16 2.507 8.997 -12.683 1.00 0.00 O ATOM 0 H GLY A 16 1.646 11.795 -9.520 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.698 10.541 -11.126 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.632 11.434 -12.310 1.00 0.00 H new ATOM 226 N VAL A 17 3.395 9.312 -10.628 1.00 0.00 N ATOM 227 CA VAL A 17 4.286 8.167 -10.715 1.00 0.00 C ATOM 228 C VAL A 17 3.578 6.933 -10.153 1.00 0.00 C ATOM 229 O VAL A 17 3.122 6.941 -9.010 1.00 0.00 O ATOM 230 CB VAL A 17 5.606 8.475 -10.005 1.00 0.00 C ATOM 231 CG1 VAL A 17 6.424 7.200 -9.790 1.00 0.00 C ATOM 232 CG2 VAL A 17 6.413 9.520 -10.778 1.00 0.00 C ATOM 0 H VAL A 17 3.454 9.833 -9.753 1.00 0.00 H new ATOM 0 HA VAL A 17 4.535 7.954 -11.755 1.00 0.00 H new ATOM 0 HB VAL A 17 5.370 8.891 -9.025 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.357 7.447 -9.284 1.00 0.00 H new ATOM 0 HG12 VAL A 17 5.854 6.501 -9.179 1.00 0.00 H new ATOM 0 HG13 VAL A 17 6.645 6.742 -10.754 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.346 9.721 -10.252 1.00 0.00 H new ATOM 0 HG22 VAL A 17 6.633 9.144 -11.777 1.00 0.00 H new ATOM 0 HG23 VAL A 17 5.835 10.441 -10.856 1.00 0.00 H new ATOM 242 N SER A 18 3.510 5.900 -10.980 1.00 0.00 N ATOM 243 CA SER A 18 2.867 4.661 -10.579 1.00 0.00 C ATOM 244 C SER A 18 3.900 3.535 -10.501 1.00 0.00 C ATOM 245 O SER A 18 4.832 3.488 -11.302 1.00 0.00 O ATOM 246 CB SER A 18 1.744 4.285 -11.548 1.00 0.00 C ATOM 247 OG SER A 18 1.895 4.922 -12.813 1.00 0.00 O ATOM 0 H SER A 18 3.890 5.896 -11.927 1.00 0.00 H new ATOM 0 HA SER A 18 2.426 4.809 -9.593 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.731 3.204 -11.686 1.00 0.00 H new ATOM 0 HB3 SER A 18 0.783 4.563 -11.115 1.00 0.00 H new ATOM 0 HG SER A 18 1.160 4.655 -13.403 1.00 0.00 H new ATOM 253 N VAL A 19 3.699 2.657 -9.530 1.00 0.00 N ATOM 254 CA VAL A 19 4.601 1.534 -9.338 1.00 0.00 C ATOM 255 C VAL A 19 3.829 0.364 -8.726 1.00 0.00 C ATOM 256 O VAL A 19 2.856 0.567 -8.002 1.00 0.00 O ATOM 257 CB VAL A 19 5.801 1.966 -8.491 1.00 0.00 C ATOM 258 CG1 VAL A 19 6.856 0.862 -8.432 1.00 0.00 C ATOM 259 CG2 VAL A 19 6.401 3.272 -9.018 1.00 0.00 C ATOM 0 H VAL A 19 2.925 2.700 -8.867 1.00 0.00 H new ATOM 0 HA VAL A 19 4.999 1.196 -10.295 1.00 0.00 H new ATOM 0 HB VAL A 19 5.448 2.145 -7.475 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.697 1.195 -7.824 1.00 0.00 H new ATOM 0 HG12 VAL A 19 6.421 -0.034 -7.989 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.203 0.637 -9.440 1.00 0.00 H new ATOM 0 HG21 VAL A 19 7.252 3.557 -8.399 1.00 0.00 H new ATOM 0 HG22 VAL A 19 6.732 3.131 -10.047 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.647 4.059 -8.984 1.00 0.00 H new ATOM 269 N ASP A 20 4.293 -0.838 -9.041 1.00 0.00 N ATOM 270 CA ASP A 20 3.658 -2.042 -8.532 1.00 0.00 C ATOM 271 C ASP A 20 4.723 -2.956 -7.923 1.00 0.00 C ATOM 272 O ASP A 20 5.867 -2.968 -8.374 1.00 0.00 O ATOM 273 CB ASP A 20 2.959 -2.812 -9.653 1.00 0.00 C ATOM 274 CG ASP A 20 2.625 -1.984 -10.896 1.00 0.00 C ATOM 275 OD1 ASP A 20 3.588 -1.551 -11.565 1.00 0.00 O ATOM 276 OD2 ASP A 20 1.414 -1.802 -11.149 1.00 0.00 O ATOM 0 H ASP A 20 5.101 -1.003 -9.642 1.00 0.00 H new ATOM 0 HA ASP A 20 2.922 -1.745 -7.785 1.00 0.00 H new ATOM 0 HB2 ASP A 20 3.594 -3.647 -9.951 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.036 -3.238 -9.260 1.00 0.00 H new ATOM 281 N TYR A 21 4.308 -3.700 -6.908 1.00 0.00 N ATOM 282 CA TYR A 21 5.212 -4.616 -6.234 1.00 0.00 C ATOM 283 C TYR A 21 4.519 -5.945 -5.927 1.00 0.00 C ATOM 284 O TYR A 21 3.459 -5.966 -5.302 1.00 0.00 O ATOM 285 CB TYR A 21 5.594 -3.937 -4.916 1.00 0.00 C ATOM 286 CG TYR A 21 6.139 -2.518 -5.083 1.00 0.00 C ATOM 287 CD1 TYR A 21 5.325 -1.519 -5.576 1.00 0.00 C ATOM 288 CD2 TYR A 21 7.446 -2.237 -4.739 1.00 0.00 C ATOM 289 CE1 TYR A 21 5.839 -0.183 -5.733 1.00 0.00 C ATOM 290 CE2 TYR A 21 7.960 -0.901 -4.896 1.00 0.00 C ATOM 291 CZ TYR A 21 7.131 0.061 -5.385 1.00 0.00 C ATOM 292 OH TYR A 21 7.617 1.322 -5.533 1.00 0.00 O ATOM 0 H TYR A 21 3.358 -3.687 -6.536 1.00 0.00 H new ATOM 0 HA TYR A 21 6.078 -4.831 -6.860 1.00 0.00 H new ATOM 0 HB2 TYR A 21 4.718 -3.905 -4.268 1.00 0.00 H new ATOM 0 HB3 TYR A 21 6.343 -4.546 -4.409 1.00 0.00 H new ATOM 0 HD1 TYR A 21 4.302 -1.739 -5.844 1.00 0.00 H new ATOM 0 HD2 TYR A 21 8.083 -3.019 -4.352 1.00 0.00 H new ATOM 0 HE1 TYR A 21 5.212 0.608 -6.119 1.00 0.00 H new ATOM 0 HE2 TYR A 21 8.981 -0.668 -4.632 1.00 0.00 H new ATOM 0 HH TYR A 21 7.174 1.920 -4.896 1.00 0.00 H new ATOM 302 N GLU A 22 5.145 -7.021 -6.381 1.00 0.00 N ATOM 303 CA GLU A 22 4.600 -8.351 -6.162 1.00 0.00 C ATOM 304 C GLU A 22 5.338 -9.044 -5.014 1.00 0.00 C ATOM 305 O GLU A 22 6.508 -9.397 -5.147 1.00 0.00 O ATOM 306 CB GLU A 22 4.667 -9.187 -7.441 1.00 0.00 C ATOM 307 CG GLU A 22 4.268 -10.639 -7.169 1.00 0.00 C ATOM 308 CD GLU A 22 4.668 -11.545 -8.335 1.00 0.00 C ATOM 309 OE1 GLU A 22 3.979 -11.468 -9.375 1.00 0.00 O ATOM 310 OE2 GLU A 22 5.653 -12.295 -8.160 1.00 0.00 O ATOM 0 H GLU A 22 6.023 -6.999 -6.899 1.00 0.00 H new ATOM 0 HA GLU A 22 3.550 -8.252 -5.886 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.005 -8.759 -8.194 1.00 0.00 H new ATOM 0 HB3 GLU A 22 5.677 -9.154 -7.849 1.00 0.00 H new ATOM 0 HG2 GLU A 22 4.747 -10.986 -6.253 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.192 -10.700 -7.009 1.00 0.00 H new ATOM 317 N THR A 23 4.622 -9.217 -3.913 1.00 0.00 N ATOM 318 CA THR A 23 5.193 -9.862 -2.743 1.00 0.00 C ATOM 319 C THR A 23 4.179 -10.816 -2.111 1.00 0.00 C ATOM 320 O THR A 23 3.039 -10.432 -1.849 1.00 0.00 O ATOM 321 CB THR A 23 5.675 -8.768 -1.789 1.00 0.00 C ATOM 322 OG1 THR A 23 6.485 -9.463 -0.844 1.00 0.00 O ATOM 323 CG2 THR A 23 4.539 -8.183 -0.948 1.00 0.00 C ATOM 0 H THR A 23 3.652 -8.922 -3.806 1.00 0.00 H new ATOM 0 HA THR A 23 6.049 -10.481 -3.011 1.00 0.00 H new ATOM 0 HB THR A 23 6.150 -7.971 -2.361 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.840 -8.828 -0.188 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.935 -7.411 -0.288 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.787 -7.747 -1.605 1.00 0.00 H new ATOM 0 HG23 THR A 23 4.085 -8.973 -0.350 1.00 0.00 H new ATOM 331 N GLU A 24 4.628 -12.042 -1.883 1.00 0.00 N ATOM 332 CA GLU A 24 3.773 -13.054 -1.287 1.00 0.00 C ATOM 333 C GLU A 24 3.893 -13.018 0.238 1.00 0.00 C ATOM 334 O GLU A 24 4.807 -13.614 0.807 1.00 0.00 O ATOM 335 CB GLU A 24 4.108 -14.444 -1.831 1.00 0.00 C ATOM 336 CG GLU A 24 5.615 -14.705 -1.780 1.00 0.00 C ATOM 337 CD GLU A 24 5.910 -16.201 -1.667 1.00 0.00 C ATOM 338 OE1 GLU A 24 4.949 -16.949 -1.384 1.00 0.00 O ATOM 339 OE2 GLU A 24 7.089 -16.564 -1.866 1.00 0.00 O ATOM 0 H GLU A 24 5.573 -12.357 -2.101 1.00 0.00 H new ATOM 0 HA GLU A 24 2.740 -12.834 -1.556 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.584 -15.202 -1.249 1.00 0.00 H new ATOM 0 HB3 GLU A 24 3.755 -14.531 -2.859 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.087 -14.305 -2.677 1.00 0.00 H new ATOM 0 HG3 GLU A 24 6.050 -14.180 -0.929 1.00 0.00 H new ATOM 346 N THR A 25 2.957 -12.314 0.857 1.00 0.00 N ATOM 347 CA THR A 25 2.946 -12.192 2.304 1.00 0.00 C ATOM 348 C THR A 25 1.535 -12.425 2.849 1.00 0.00 C ATOM 349 O THR A 25 0.617 -11.666 2.545 1.00 0.00 O ATOM 350 CB THR A 25 3.520 -10.821 2.668 1.00 0.00 C ATOM 351 OG1 THR A 25 2.879 -9.925 1.765 1.00 0.00 O ATOM 352 CG2 THR A 25 5.006 -10.699 2.324 1.00 0.00 C ATOM 0 H THR A 25 2.200 -11.822 0.382 1.00 0.00 H new ATOM 0 HA THR A 25 3.570 -12.955 2.770 1.00 0.00 H new ATOM 0 HB THR A 25 3.378 -10.639 3.733 1.00 0.00 H new ATOM 0 HG1 THR A 25 3.192 -9.012 1.933 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.364 -9.708 2.602 1.00 0.00 H new ATOM 0 HG22 THR A 25 5.569 -11.455 2.871 1.00 0.00 H new ATOM 0 HG23 THR A 25 5.145 -10.847 1.253 1.00 0.00 H new ATOM 360 N PRO A 26 1.405 -13.504 3.664 1.00 0.00 N ATOM 361 CA PRO A 26 0.121 -13.847 4.254 1.00 0.00 C ATOM 362 C PRO A 26 -0.227 -12.894 5.401 1.00 0.00 C ATOM 363 O PRO A 26 -0.891 -11.880 5.191 1.00 0.00 O ATOM 364 CB PRO A 26 0.268 -15.291 4.705 1.00 0.00 C ATOM 365 CG PRO A 26 1.763 -15.557 4.775 1.00 0.00 C ATOM 366 CD PRO A 26 2.471 -14.425 4.047 1.00 0.00 C ATOM 0 HA PRO A 26 -0.706 -13.746 3.551 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.202 -15.446 5.676 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -0.217 -15.970 4.004 1.00 0.00 H new ATOM 0 HG2 PRO A 26 2.093 -15.610 5.812 1.00 0.00 H new ATOM 0 HG3 PRO A 26 2.002 -16.516 4.315 1.00 0.00 H new ATOM 0 HD2 PRO A 26 3.203 -13.937 4.691 1.00 0.00 H new ATOM 0 HD3 PRO A 26 3.010 -14.792 3.173 1.00 0.00 H new ATOM 374 N MET A 27 0.238 -13.255 6.588 1.00 0.00 N ATOM 375 CA MET A 27 -0.016 -12.445 7.768 1.00 0.00 C ATOM 376 C MET A 27 0.846 -11.182 7.761 1.00 0.00 C ATOM 377 O MET A 27 0.455 -10.156 8.317 1.00 0.00 O ATOM 378 CB MET A 27 0.289 -13.264 9.023 1.00 0.00 C ATOM 379 CG MET A 27 -0.353 -14.651 8.943 1.00 0.00 C ATOM 380 SD MET A 27 0.710 -15.861 9.713 1.00 0.00 S ATOM 381 CE MET A 27 2.218 -15.574 8.802 1.00 0.00 C ATOM 0 H MET A 27 0.789 -14.097 6.758 1.00 0.00 H new ATOM 0 HA MET A 27 -1.064 -12.147 7.763 1.00 0.00 H new ATOM 0 HB2 MET A 27 1.368 -13.365 9.142 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.081 -12.738 9.903 1.00 0.00 H new ATOM 0 HG2 MET A 27 -1.324 -14.640 9.438 1.00 0.00 H new ATOM 0 HG3 MET A 27 -0.529 -14.920 7.901 1.00 0.00 H new ATOM 0 HE1 MET A 27 2.652 -16.529 8.507 1.00 0.00 H new ATOM 0 HE2 MET A 27 1.999 -14.985 7.912 1.00 0.00 H new ATOM 0 HE3 MET A 27 2.925 -15.033 9.430 1.00 0.00 H new ATOM 391 N THR A 28 2.005 -11.296 7.127 1.00 0.00 N ATOM 392 CA THR A 28 2.925 -10.176 7.041 1.00 0.00 C ATOM 393 C THR A 28 2.200 -8.927 6.533 1.00 0.00 C ATOM 394 O THR A 28 2.620 -7.805 6.811 1.00 0.00 O ATOM 395 CB THR A 28 4.101 -10.597 6.157 1.00 0.00 C ATOM 396 OG1 THR A 28 3.659 -11.804 5.544 1.00 0.00 O ATOM 397 CG2 THR A 28 5.325 -11.019 6.973 1.00 0.00 C ATOM 0 H THR A 28 2.327 -12.148 6.668 1.00 0.00 H new ATOM 0 HA THR A 28 3.316 -9.910 8.023 1.00 0.00 H new ATOM 0 HB THR A 28 4.372 -9.773 5.496 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.389 -12.188 5.014 1.00 0.00 H new ATOM 0 HG21 THR A 28 6.130 -11.308 6.298 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.653 -10.185 7.594 1.00 0.00 H new ATOM 0 HG23 THR A 28 5.064 -11.865 7.609 1.00 0.00 H new ATOM 405 N LEU A 29 1.124 -9.166 5.798 1.00 0.00 N ATOM 406 CA LEU A 29 0.337 -8.074 5.248 1.00 0.00 C ATOM 407 C LEU A 29 -0.289 -7.275 6.394 1.00 0.00 C ATOM 408 O LEU A 29 -0.372 -6.050 6.327 1.00 0.00 O ATOM 409 CB LEU A 29 -0.685 -8.606 4.241 1.00 0.00 C ATOM 410 CG LEU A 29 -0.139 -8.954 2.853 1.00 0.00 C ATOM 411 CD1 LEU A 29 -1.127 -9.830 2.081 1.00 0.00 C ATOM 412 CD2 LEU A 29 0.235 -7.689 2.078 1.00 0.00 C ATOM 0 H LEU A 29 0.779 -10.098 5.570 1.00 0.00 H new ATOM 0 HA LEU A 29 0.974 -7.388 4.690 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.150 -9.498 4.661 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.472 -7.861 4.124 1.00 0.00 H new ATOM 0 HG LEU A 29 0.775 -9.534 2.980 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.716 -10.063 1.099 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.300 -10.755 2.631 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.070 -9.297 1.962 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.620 -7.964 1.096 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.648 -7.061 1.959 1.00 0.00 H new ATOM 0 HD23 LEU A 29 1.000 -7.139 2.626 1.00 0.00 H new ATOM 424 N LEU A 30 -0.711 -8.002 7.418 1.00 0.00 N ATOM 425 CA LEU A 30 -1.325 -7.376 8.576 1.00 0.00 C ATOM 426 C LEU A 30 -0.234 -6.798 9.478 1.00 0.00 C ATOM 427 O LEU A 30 -0.491 -5.892 10.269 1.00 0.00 O ATOM 428 CB LEU A 30 -2.254 -8.362 9.289 1.00 0.00 C ATOM 429 CG LEU A 30 -3.197 -9.164 8.391 1.00 0.00 C ATOM 430 CD1 LEU A 30 -4.175 -9.994 9.226 1.00 0.00 C ATOM 431 CD2 LEU A 30 -3.922 -8.250 7.401 1.00 0.00 C ATOM 0 H LEU A 30 -0.640 -9.018 7.470 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.957 -6.543 8.267 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.641 -9.063 9.856 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -2.855 -7.808 10.010 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.599 -9.862 7.806 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.834 -10.555 8.563 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.618 -10.688 9.856 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.770 -9.331 9.854 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.586 -8.846 6.775 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.506 -7.511 7.949 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.191 -7.741 6.773 1.00 0.00 H new ATOM 443 N VAL A 31 0.963 -7.346 9.329 1.00 0.00 N ATOM 444 CA VAL A 31 2.096 -6.895 10.121 1.00 0.00 C ATOM 445 C VAL A 31 2.398 -5.434 9.786 1.00 0.00 C ATOM 446 O VAL A 31 2.400 -5.047 8.618 1.00 0.00 O ATOM 447 CB VAL A 31 3.294 -7.820 9.892 1.00 0.00 C ATOM 448 CG1 VAL A 31 4.535 -7.301 10.622 1.00 0.00 C ATOM 449 CG2 VAL A 31 2.969 -9.254 10.316 1.00 0.00 C ATOM 0 H VAL A 31 1.173 -8.098 8.672 1.00 0.00 H new ATOM 0 HA VAL A 31 1.862 -6.943 11.185 1.00 0.00 H new ATOM 0 HB VAL A 31 3.512 -7.827 8.824 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.372 -7.976 10.443 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.786 -6.307 10.252 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.333 -7.250 11.692 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.837 -9.890 10.143 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.712 -9.271 11.375 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.126 -9.624 9.732 1.00 0.00 H new ATOM 459 N PRO A 32 2.650 -4.638 10.860 1.00 0.00 N ATOM 460 CA PRO A 32 2.952 -3.227 10.692 1.00 0.00 C ATOM 461 C PRO A 32 4.376 -3.029 10.167 1.00 0.00 C ATOM 462 O PRO A 32 4.602 -2.224 9.264 1.00 0.00 O ATOM 463 CB PRO A 32 2.736 -2.612 12.064 1.00 0.00 C ATOM 464 CG PRO A 32 2.773 -3.769 13.050 1.00 0.00 C ATOM 465 CD PRO A 32 2.657 -5.061 12.257 1.00 0.00 C ATOM 0 HA PRO A 32 2.315 -2.747 9.950 1.00 0.00 H new ATOM 0 HB2 PRO A 32 3.512 -1.881 12.291 1.00 0.00 H new ATOM 0 HB3 PRO A 32 1.781 -2.089 12.112 1.00 0.00 H new ATOM 0 HG2 PRO A 32 3.701 -3.754 13.622 1.00 0.00 H new ATOM 0 HG3 PRO A 32 1.956 -3.686 13.767 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.493 -5.729 12.464 1.00 0.00 H new ATOM 0 HD3 PRO A 32 1.746 -5.602 12.512 1.00 0.00 H new ATOM 473 N GLU A 33 5.298 -3.778 10.753 1.00 0.00 N ATOM 474 CA GLU A 33 6.694 -3.696 10.355 1.00 0.00 C ATOM 475 C GLU A 33 6.846 -4.056 8.875 1.00 0.00 C ATOM 476 O GLU A 33 7.686 -3.490 8.179 1.00 0.00 O ATOM 477 CB GLU A 33 7.568 -4.594 11.232 1.00 0.00 C ATOM 478 CG GLU A 33 7.109 -4.551 12.691 1.00 0.00 C ATOM 479 CD GLU A 33 8.235 -4.981 13.633 1.00 0.00 C ATOM 480 OE1 GLU A 33 8.476 -6.206 13.706 1.00 0.00 O ATOM 481 OE2 GLU A 33 8.829 -4.077 14.258 1.00 0.00 O ATOM 0 H GLU A 33 5.106 -4.445 11.501 1.00 0.00 H new ATOM 0 HA GLU A 33 7.032 -2.669 10.495 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.526 -5.619 10.864 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.608 -4.273 11.165 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.784 -3.542 12.944 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.248 -5.206 12.825 1.00 0.00 H new ATOM 488 N VAL A 34 6.021 -4.998 8.441 1.00 0.00 N ATOM 489 CA VAL A 34 6.053 -5.441 7.058 1.00 0.00 C ATOM 490 C VAL A 34 5.278 -4.448 6.190 1.00 0.00 C ATOM 491 O VAL A 34 5.742 -4.060 5.119 1.00 0.00 O ATOM 492 CB VAL A 34 5.518 -6.871 6.954 1.00 0.00 C ATOM 493 CG1 VAL A 34 5.363 -7.292 5.491 1.00 0.00 C ATOM 494 CG2 VAL A 34 6.416 -7.849 7.714 1.00 0.00 C ATOM 0 H VAL A 34 5.327 -5.466 9.023 1.00 0.00 H new ATOM 0 HA VAL A 34 7.078 -5.464 6.688 1.00 0.00 H new ATOM 0 HB VAL A 34 4.531 -6.895 7.416 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.981 -8.312 5.444 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.665 -6.620 4.991 1.00 0.00 H new ATOM 0 HG13 VAL A 34 6.332 -7.244 4.994 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.013 -8.858 7.624 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.422 -7.821 7.294 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.454 -7.566 8.766 1.00 0.00 H new ATOM 504 N ALA A 35 4.110 -4.065 6.685 1.00 0.00 N ATOM 505 CA ALA A 35 3.266 -3.125 5.968 1.00 0.00 C ATOM 506 C ALA A 35 3.982 -1.776 5.869 1.00 0.00 C ATOM 507 O ALA A 35 4.014 -1.162 4.804 1.00 0.00 O ATOM 508 CB ALA A 35 1.911 -3.015 6.670 1.00 0.00 C ATOM 0 H ALA A 35 3.729 -4.389 7.574 1.00 0.00 H new ATOM 0 HA ALA A 35 3.079 -3.475 4.953 1.00 0.00 H new ATOM 0 HB1 ALA A 35 1.278 -2.309 6.131 1.00 0.00 H new ATOM 0 HB2 ALA A 35 1.430 -3.993 6.688 1.00 0.00 H new ATOM 0 HB3 ALA A 35 2.058 -2.664 7.691 1.00 0.00 H new ATOM 514 N ALA A 36 4.538 -1.354 6.995 1.00 0.00 N ATOM 515 CA ALA A 36 5.252 -0.089 7.050 1.00 0.00 C ATOM 516 C ALA A 36 6.412 -0.120 6.052 1.00 0.00 C ATOM 517 O ALA A 36 6.583 0.811 5.265 1.00 0.00 O ATOM 518 CB ALA A 36 5.722 0.171 8.482 1.00 0.00 C ATOM 0 H ALA A 36 4.509 -1.866 7.877 1.00 0.00 H new ATOM 0 HA ALA A 36 4.596 0.735 6.768 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.257 1.120 8.523 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.859 0.213 9.146 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.385 -0.634 8.799 1.00 0.00 H new ATOM 524 N GLU A 37 7.177 -1.199 6.117 1.00 0.00 N ATOM 525 CA GLU A 37 8.316 -1.363 5.228 1.00 0.00 C ATOM 526 C GLU A 37 7.847 -1.450 3.775 1.00 0.00 C ATOM 527 O GLU A 37 8.527 -0.968 2.870 1.00 0.00 O ATOM 528 CB GLU A 37 9.140 -2.593 5.614 1.00 0.00 C ATOM 529 CG GLU A 37 10.116 -2.267 6.747 1.00 0.00 C ATOM 530 CD GLU A 37 11.508 -2.825 6.448 1.00 0.00 C ATOM 531 OE1 GLU A 37 11.938 -2.683 5.283 1.00 0.00 O ATOM 532 OE2 GLU A 37 12.111 -3.380 7.392 1.00 0.00 O ATOM 0 H GLU A 37 7.031 -1.968 6.771 1.00 0.00 H new ATOM 0 HA GLU A 37 8.960 -0.489 5.329 1.00 0.00 H new ATOM 0 HB2 GLU A 37 8.474 -3.398 5.924 1.00 0.00 H new ATOM 0 HB3 GLU A 37 9.692 -2.952 4.746 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.174 -1.187 6.882 1.00 0.00 H new ATOM 0 HG3 GLU A 37 9.746 -2.686 7.683 1.00 0.00 H new ATOM 539 N VAL A 38 6.690 -2.069 3.596 1.00 0.00 N ATOM 540 CA VAL A 38 6.121 -2.226 2.268 1.00 0.00 C ATOM 541 C VAL A 38 5.674 -0.860 1.745 1.00 0.00 C ATOM 542 O VAL A 38 6.069 -0.449 0.654 1.00 0.00 O ATOM 543 CB VAL A 38 4.989 -3.254 2.301 1.00 0.00 C ATOM 544 CG1 VAL A 38 3.916 -2.921 1.263 1.00 0.00 C ATOM 545 CG2 VAL A 38 5.528 -4.672 2.096 1.00 0.00 C ATOM 0 H VAL A 38 6.130 -2.468 4.349 1.00 0.00 H new ATOM 0 HA VAL A 38 6.869 -2.610 1.575 1.00 0.00 H new ATOM 0 HB VAL A 38 4.527 -3.211 3.287 1.00 0.00 H new ATOM 0 HG11 VAL A 38 3.123 -3.667 1.307 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.500 -1.936 1.473 1.00 0.00 H new ATOM 0 HG13 VAL A 38 4.360 -2.922 0.268 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.702 -5.383 2.124 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.028 -4.735 1.130 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.238 -4.909 2.888 1.00 0.00 H new ATOM 555 N ILE A 39 4.857 -0.194 2.546 1.00 0.00 N ATOM 556 CA ILE A 39 4.351 1.117 2.177 1.00 0.00 C ATOM 557 C ILE A 39 5.529 2.060 1.920 1.00 0.00 C ATOM 558 O ILE A 39 5.551 2.773 0.918 1.00 0.00 O ATOM 559 CB ILE A 39 3.373 1.631 3.235 1.00 0.00 C ATOM 560 CG1 ILE A 39 2.120 0.754 3.297 1.00 0.00 C ATOM 561 CG2 ILE A 39 3.028 3.103 2.996 1.00 0.00 C ATOM 562 CD1 ILE A 39 1.173 1.066 2.136 1.00 0.00 C ATOM 0 H ILE A 39 4.532 -0.537 3.450 1.00 0.00 H new ATOM 0 HA ILE A 39 3.781 1.058 1.250 1.00 0.00 H new ATOM 0 HB ILE A 39 3.861 1.567 4.208 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.406 -0.297 3.265 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.605 0.916 4.244 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.331 3.442 3.762 1.00 0.00 H new ATOM 0 HG22 ILE A 39 3.938 3.702 3.042 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.569 3.214 2.014 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.291 0.429 2.204 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.870 2.112 2.185 1.00 0.00 H new ATOM 0 HD13 ILE A 39 1.683 0.880 1.191 1.00 0.00 H new ATOM 574 N LYS A 40 6.480 2.031 2.843 1.00 0.00 N ATOM 575 CA LYS A 40 7.657 2.874 2.729 1.00 0.00 C ATOM 576 C LYS A 40 8.509 2.396 1.550 1.00 0.00 C ATOM 577 O LYS A 40 9.017 3.207 0.777 1.00 0.00 O ATOM 578 CB LYS A 40 8.416 2.919 4.057 1.00 0.00 C ATOM 579 CG LYS A 40 9.925 2.991 3.824 1.00 0.00 C ATOM 580 CD LYS A 40 10.562 1.602 3.914 1.00 0.00 C ATOM 581 CE LYS A 40 11.995 1.619 3.380 1.00 0.00 C ATOM 582 NZ LYS A 40 12.852 2.480 4.223 1.00 0.00 N ATOM 0 H LYS A 40 6.459 1.437 3.672 1.00 0.00 H new ATOM 0 HA LYS A 40 7.368 3.904 2.519 1.00 0.00 H new ATOM 0 HB2 LYS A 40 8.092 3.784 4.636 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.177 2.034 4.646 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.125 3.424 2.844 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.379 3.652 4.562 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.561 1.264 4.950 1.00 0.00 H new ATOM 0 HD3 LYS A 40 9.967 0.888 3.345 1.00 0.00 H new ATOM 0 HE2 LYS A 40 12.394 0.605 3.362 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.002 1.983 2.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.844 2.375 3.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.562 3.473 4.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.753 2.199 5.219 1.00 0.00 H new ATOM 596 N ASP A 41 8.640 1.082 1.451 1.00 0.00 N ATOM 597 CA ASP A 41 9.421 0.485 0.381 1.00 0.00 C ATOM 598 C ASP A 41 8.846 0.922 -0.969 1.00 0.00 C ATOM 599 O ASP A 41 9.591 1.294 -1.873 1.00 0.00 O ATOM 600 CB ASP A 41 9.368 -1.042 0.445 1.00 0.00 C ATOM 601 CG ASP A 41 9.859 -1.760 -0.814 1.00 0.00 C ATOM 602 OD1 ASP A 41 11.056 -1.593 -1.132 1.00 0.00 O ATOM 603 OD2 ASP A 41 9.026 -2.459 -1.429 1.00 0.00 O ATOM 0 H ASP A 41 8.218 0.413 2.095 1.00 0.00 H new ATOM 0 HA ASP A 41 10.454 0.814 0.494 1.00 0.00 H new ATOM 0 HB2 ASP A 41 9.967 -1.376 1.292 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.340 -1.347 0.641 1.00 0.00 H new ATOM 608 N LEU A 42 7.526 0.860 -1.060 1.00 0.00 N ATOM 609 CA LEU A 42 6.842 1.245 -2.284 1.00 0.00 C ATOM 610 C LEU A 42 7.160 2.707 -2.603 1.00 0.00 C ATOM 611 O LEU A 42 7.590 3.025 -3.711 1.00 0.00 O ATOM 612 CB LEU A 42 5.344 0.951 -2.176 1.00 0.00 C ATOM 613 CG LEU A 42 4.915 -0.475 -2.524 1.00 0.00 C ATOM 614 CD1 LEU A 42 4.560 -1.266 -1.263 1.00 0.00 C ATOM 615 CD2 LEU A 42 3.768 -0.470 -3.537 1.00 0.00 C ATOM 0 H LEU A 42 6.912 0.549 -0.307 1.00 0.00 H new ATOM 0 HA LEU A 42 7.201 0.650 -3.124 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.024 1.167 -1.157 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.810 1.640 -2.831 1.00 0.00 H new ATOM 0 HG LEU A 42 5.759 -0.980 -2.993 1.00 0.00 H new ATOM 0 HD11 LEU A 42 4.259 -2.276 -1.540 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.429 -1.314 -0.607 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.739 -0.772 -0.743 1.00 0.00 H new ATOM 0 HD21 LEU A 42 3.482 -1.496 -3.768 1.00 0.00 H new ATOM 0 HD22 LEU A 42 2.913 0.059 -3.116 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.091 0.030 -4.450 1.00 0.00 H new ATOM 627 N VAL A 43 6.937 3.558 -1.612 1.00 0.00 N ATOM 628 CA VAL A 43 7.195 4.979 -1.773 1.00 0.00 C ATOM 629 C VAL A 43 8.689 5.198 -2.013 1.00 0.00 C ATOM 630 O VAL A 43 9.075 5.923 -2.929 1.00 0.00 O ATOM 631 CB VAL A 43 6.664 5.747 -0.560 1.00 0.00 C ATOM 632 CG1 VAL A 43 7.541 6.964 -0.256 1.00 0.00 C ATOM 633 CG2 VAL A 43 5.206 6.161 -0.768 1.00 0.00 C ATOM 0 H VAL A 43 6.580 3.291 -0.695 1.00 0.00 H new ATOM 0 HA VAL A 43 6.667 5.367 -2.644 1.00 0.00 H new ATOM 0 HB VAL A 43 6.703 5.081 0.302 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.142 7.493 0.610 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.558 6.635 -0.044 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.548 7.632 -1.117 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.854 6.705 0.108 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.131 6.802 -1.647 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.593 5.272 -0.914 1.00 0.00 H new ATOM 643 N ASN A 44 9.491 4.558 -1.174 1.00 0.00 N ATOM 644 CA ASN A 44 10.935 4.674 -1.283 1.00 0.00 C ATOM 645 C ASN A 44 11.371 4.262 -2.691 1.00 0.00 C ATOM 646 O ASN A 44 12.264 4.875 -3.273 1.00 0.00 O ATOM 647 CB ASN A 44 11.639 3.756 -0.282 1.00 0.00 C ATOM 648 CG ASN A 44 12.068 4.530 0.965 1.00 0.00 C ATOM 649 OD1 ASN A 44 13.237 4.608 1.307 1.00 0.00 O ATOM 650 ND2 ASN A 44 11.061 5.097 1.624 1.00 0.00 N ATOM 0 H ASN A 44 9.168 3.957 -0.416 1.00 0.00 H new ATOM 0 HA ASN A 44 11.206 5.709 -1.075 1.00 0.00 H new ATOM 0 HB2 ASN A 44 10.971 2.943 0.002 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.512 3.303 -0.751 1.00 0.00 H new ATOM 0 HD21 ASN A 44 11.245 5.636 2.470 1.00 0.00 H new ATOM 0 HD22 ASN A 44 10.105 4.993 1.283 1.00 0.00 H new ATOM 657 N THR A 45 10.719 3.225 -3.197 1.00 0.00 N ATOM 658 CA THR A 45 11.027 2.723 -4.525 1.00 0.00 C ATOM 659 C THR A 45 10.449 3.652 -5.594 1.00 0.00 C ATOM 660 O THR A 45 11.111 3.950 -6.587 1.00 0.00 O ATOM 661 CB THR A 45 10.505 1.288 -4.621 1.00 0.00 C ATOM 662 OG1 THR A 45 11.355 0.550 -3.746 1.00 0.00 O ATOM 663 CG2 THR A 45 10.757 0.664 -5.996 1.00 0.00 C ATOM 0 H THR A 45 9.979 2.719 -2.711 1.00 0.00 H new ATOM 0 HA THR A 45 12.103 2.706 -4.701 1.00 0.00 H new ATOM 0 HB THR A 45 9.436 1.276 -4.406 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.998 0.589 -2.834 1.00 0.00 H new ATOM 0 HG21 THR A 45 10.367 -0.354 -6.011 1.00 0.00 H new ATOM 0 HG22 THR A 45 10.255 1.256 -6.762 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.828 0.645 -6.196 1.00 0.00 H new ATOM 925 N LYS B 203 -2.681 18.236 -7.114 1.00 0.00 N ATOM 926 CA LYS B 203 -3.087 17.769 -5.798 1.00 0.00 C ATOM 927 C LYS B 203 -2.134 16.664 -5.339 1.00 0.00 C ATOM 928 O LYS B 203 -1.545 15.964 -6.162 1.00 0.00 O ATOM 929 CB LYS B 203 -4.557 17.348 -5.808 1.00 0.00 C ATOM 930 CG LYS B 203 -5.233 17.685 -4.477 1.00 0.00 C ATOM 931 CD LYS B 203 -6.749 17.797 -4.645 1.00 0.00 C ATOM 932 CE LYS B 203 -7.237 19.205 -4.302 1.00 0.00 C ATOM 933 NZ LYS B 203 -7.066 20.110 -5.461 1.00 0.00 N ATOM 0 HA LYS B 203 -3.016 18.576 -5.069 1.00 0.00 H new ATOM 0 HB2 LYS B 203 -5.078 17.852 -6.622 1.00 0.00 H new ATOM 0 HB3 LYS B 203 -4.631 16.277 -5.997 1.00 0.00 H new ATOM 0 HG2 LYS B 203 -5.001 16.914 -3.742 1.00 0.00 H new ATOM 0 HG3 LYS B 203 -4.836 18.624 -4.091 1.00 0.00 H new ATOM 0 HD2 LYS B 203 -7.023 17.553 -5.671 1.00 0.00 H new ATOM 0 HD3 LYS B 203 -7.244 17.070 -4.001 1.00 0.00 H new ATOM 0 HE2 LYS B 203 -8.287 19.172 -4.011 1.00 0.00 H new ATOM 0 HE3 LYS B 203 -6.682 19.591 -3.447 1.00 0.00 H new ATOM 0 HZ1 LYS B 203 -7.402 21.062 -5.211 1.00 0.00 H new ATOM 0 HZ2 LYS B 203 -6.060 20.155 -5.721 1.00 0.00 H new ATOM 0 HZ3 LYS B 203 -7.615 19.749 -6.267 1.00 0.00 H new ATOM 947 N ALA B 204 -2.012 16.540 -4.025 1.00 0.00 N ATOM 948 CA ALA B 204 -1.140 15.531 -3.447 1.00 0.00 C ATOM 949 C ALA B 204 -1.987 14.361 -2.944 1.00 0.00 C ATOM 950 O ALA B 204 -2.678 14.478 -1.933 1.00 0.00 O ATOM 951 CB ALA B 204 -0.298 16.161 -2.335 1.00 0.00 C ATOM 0 H ALA B 204 -2.502 17.121 -3.345 1.00 0.00 H new ATOM 0 HA ALA B 204 -0.452 15.142 -4.197 1.00 0.00 H new ATOM 0 HB1 ALA B 204 0.356 15.405 -1.901 1.00 0.00 H new ATOM 0 HB2 ALA B 204 0.306 16.969 -2.749 1.00 0.00 H new ATOM 0 HB3 ALA B 204 -0.955 16.559 -1.562 1.00 0.00 H new ATOM 957 N THR B 205 -1.906 13.256 -3.672 1.00 0.00 N ATOM 958 CA THR B 205 -2.656 12.066 -3.313 1.00 0.00 C ATOM 959 C THR B 205 -1.893 10.807 -3.735 1.00 0.00 C ATOM 960 O THR B 205 -1.018 10.868 -4.597 1.00 0.00 O ATOM 961 CB THR B 205 -4.045 12.174 -3.944 1.00 0.00 C ATOM 962 OG1 THR B 205 -3.783 12.463 -5.314 1.00 0.00 O ATOM 963 CG2 THR B 205 -4.821 13.395 -3.446 1.00 0.00 C ATOM 0 H THR B 205 -1.331 13.161 -4.509 1.00 0.00 H new ATOM 0 HA THR B 205 -2.779 11.987 -2.233 1.00 0.00 H new ATOM 0 HB THR B 205 -4.614 11.270 -3.727 1.00 0.00 H new ATOM 0 HG1 THR B 205 -4.631 12.548 -5.798 1.00 0.00 H new ATOM 0 HG21 THR B 205 -5.800 13.424 -3.925 1.00 0.00 H new ATOM 0 HG22 THR B 205 -4.948 13.330 -2.365 1.00 0.00 H new ATOM 0 HG23 THR B 205 -4.269 14.302 -3.692 1.00 0.00 H new ATOM 971 N TYR B 206 -2.253 9.699 -3.105 1.00 0.00 N ATOM 972 CA TYR B 206 -1.613 8.428 -3.405 1.00 0.00 C ATOM 973 C TYR B 206 -2.649 7.308 -3.527 1.00 0.00 C ATOM 974 O TYR B 206 -3.618 7.270 -2.771 1.00 0.00 O ATOM 975 CB TYR B 206 -0.694 8.129 -2.219 1.00 0.00 C ATOM 976 CG TYR B 206 0.753 8.581 -2.424 1.00 0.00 C ATOM 977 CD1 TYR B 206 1.094 9.908 -2.252 1.00 0.00 C ATOM 978 CD2 TYR B 206 1.719 7.662 -2.782 1.00 0.00 C ATOM 979 CE1 TYR B 206 2.455 10.334 -2.445 1.00 0.00 C ATOM 980 CE2 TYR B 206 3.081 8.088 -2.975 1.00 0.00 C ATOM 981 CZ TYR B 206 3.382 9.403 -2.796 1.00 0.00 C ATOM 982 OH TYR B 206 4.669 9.804 -2.979 1.00 0.00 O ATOM 0 H TYR B 206 -2.978 9.654 -2.389 1.00 0.00 H new ATOM 0 HA TYR B 206 -1.072 8.484 -4.350 1.00 0.00 H new ATOM 0 HB2 TYR B 206 -1.094 8.617 -1.330 1.00 0.00 H new ATOM 0 HB3 TYR B 206 -0.705 7.056 -2.025 1.00 0.00 H new ATOM 0 HD1 TYR B 206 0.338 10.627 -1.972 1.00 0.00 H new ATOM 0 HD2 TYR B 206 1.453 6.624 -2.917 1.00 0.00 H new ATOM 0 HE1 TYR B 206 2.734 11.369 -2.314 1.00 0.00 H new ATOM 0 HE2 TYR B 206 3.846 7.380 -3.256 1.00 0.00 H new ATOM 0 HH TYR B 206 5.220 9.032 -3.226 1.00 0.00 H new ATOM 992 N THR B 207 -2.406 6.424 -4.483 1.00 0.00 N ATOM 993 CA THR B 207 -3.306 5.307 -4.714 1.00 0.00 C ATOM 994 C THR B 207 -2.588 3.981 -4.451 1.00 0.00 C ATOM 995 O THR B 207 -1.729 3.571 -5.229 1.00 0.00 O ATOM 996 CB THR B 207 -3.855 5.427 -6.136 1.00 0.00 C ATOM 997 OG1 THR B 207 -4.135 6.818 -6.283 1.00 0.00 O ATOM 998 CG2 THR B 207 -5.220 4.754 -6.296 1.00 0.00 C ATOM 0 H THR B 207 -1.599 6.458 -5.106 1.00 0.00 H new ATOM 0 HA THR B 207 -4.148 5.329 -4.022 1.00 0.00 H new ATOM 0 HB THR B 207 -3.148 4.984 -6.837 1.00 0.00 H new ATOM 0 HG1 THR B 207 -5.094 6.944 -6.441 1.00 0.00 H new ATOM 0 HG21 THR B 207 -5.564 4.869 -7.324 1.00 0.00 H new ATOM 0 HG22 THR B 207 -5.133 3.694 -6.059 1.00 0.00 H new ATOM 0 HG23 THR B 207 -5.937 5.220 -5.620 1.00 0.00 H new ATOM 1006 N VAL B 208 -2.968 3.348 -3.350 1.00 0.00 N ATOM 1007 CA VAL B 208 -2.371 2.078 -2.975 1.00 0.00 C ATOM 1008 C VAL B 208 -3.320 0.940 -3.356 1.00 0.00 C ATOM 1009 O VAL B 208 -4.457 0.892 -2.889 1.00 0.00 O ATOM 1010 CB VAL B 208 -2.015 2.086 -1.486 1.00 0.00 C ATOM 1011 CG1 VAL B 208 -1.565 0.699 -1.023 1.00 0.00 C ATOM 1012 CG2 VAL B 208 -0.949 3.139 -1.183 1.00 0.00 C ATOM 0 H VAL B 208 -3.681 3.691 -2.707 1.00 0.00 H new ATOM 0 HA VAL B 208 -1.439 1.920 -3.518 1.00 0.00 H new ATOM 0 HB VAL B 208 -2.913 2.350 -0.928 1.00 0.00 H new ATOM 0 HG11 VAL B 208 -1.318 0.732 0.038 1.00 0.00 H new ATOM 0 HG12 VAL B 208 -2.370 -0.018 -1.186 1.00 0.00 H new ATOM 0 HG13 VAL B 208 -0.686 0.393 -1.591 1.00 0.00 H new ATOM 0 HG21 VAL B 208 -0.715 3.124 -0.119 1.00 0.00 H new ATOM 0 HG22 VAL B 208 -0.048 2.920 -1.756 1.00 0.00 H new ATOM 0 HG23 VAL B 208 -1.323 4.125 -1.458 1.00 0.00 H new ATOM 1022 N THR B 209 -2.818 0.053 -4.202 1.00 0.00 N ATOM 1023 CA THR B 209 -3.608 -1.082 -4.652 1.00 0.00 C ATOM 1024 C THR B 209 -3.140 -2.365 -3.964 1.00 0.00 C ATOM 1025 O THR B 209 -1.949 -2.535 -3.703 1.00 0.00 O ATOM 1026 CB THR B 209 -3.518 -1.144 -6.178 1.00 0.00 C ATOM 1027 OG1 THR B 209 -3.438 0.221 -6.577 1.00 0.00 O ATOM 1028 CG2 THR B 209 -4.815 -1.644 -6.821 1.00 0.00 C ATOM 0 H THR B 209 -1.875 0.096 -4.588 1.00 0.00 H new ATOM 0 HA THR B 209 -4.657 -0.968 -4.377 1.00 0.00 H new ATOM 0 HB THR B 209 -2.694 -1.796 -6.467 1.00 0.00 H new ATOM 0 HG1 THR B 209 -3.375 0.273 -7.554 1.00 0.00 H new ATOM 0 HG21 THR B 209 -4.698 -1.669 -7.904 1.00 0.00 H new ATOM 0 HG22 THR B 209 -5.039 -2.647 -6.457 1.00 0.00 H new ATOM 0 HG23 THR B 209 -5.633 -0.972 -6.560 1.00 0.00 H new ATOM 1036 N VAL B 210 -4.099 -3.236 -3.689 1.00 0.00 N ATOM 1037 CA VAL B 210 -3.801 -4.498 -3.035 1.00 0.00 C ATOM 1038 C VAL B 210 -4.649 -5.606 -3.663 1.00 0.00 C ATOM 1039 O VAL B 210 -5.875 -5.585 -3.562 1.00 0.00 O ATOM 1040 CB VAL B 210 -4.007 -4.368 -1.525 1.00 0.00 C ATOM 1041 CG1 VAL B 210 -4.217 -5.740 -0.880 1.00 0.00 C ATOM 1042 CG2 VAL B 210 -2.839 -3.628 -0.872 1.00 0.00 C ATOM 0 H VAL B 210 -5.085 -3.092 -3.908 1.00 0.00 H new ATOM 0 HA VAL B 210 -2.755 -4.767 -3.183 1.00 0.00 H new ATOM 0 HB VAL B 210 -4.909 -3.779 -1.361 1.00 0.00 H new ATOM 0 HG11 VAL B 210 -4.361 -5.619 0.194 1.00 0.00 H new ATOM 0 HG12 VAL B 210 -5.097 -6.215 -1.313 1.00 0.00 H new ATOM 0 HG13 VAL B 210 -3.342 -6.365 -1.061 1.00 0.00 H new ATOM 0 HG21 VAL B 210 -3.012 -3.550 0.201 1.00 0.00 H new ATOM 0 HG22 VAL B 210 -1.915 -4.177 -1.052 1.00 0.00 H new ATOM 0 HG23 VAL B 210 -2.757 -2.629 -1.300 1.00 0.00 H new ATOM 1052 N THR B 211 -3.964 -6.547 -4.295 1.00 0.00 N ATOM 1053 CA THR B 211 -4.639 -7.661 -4.938 1.00 0.00 C ATOM 1054 C THR B 211 -4.047 -8.989 -4.464 1.00 0.00 C ATOM 1055 O THR B 211 -2.827 -9.142 -4.400 1.00 0.00 O ATOM 1056 CB THR B 211 -4.547 -7.459 -6.452 1.00 0.00 C ATOM 1057 OG1 THR B 211 -5.315 -6.283 -6.693 1.00 0.00 O ATOM 1058 CG2 THR B 211 -5.281 -8.550 -7.234 1.00 0.00 C ATOM 0 H THR B 211 -2.947 -6.561 -4.376 1.00 0.00 H new ATOM 0 HA THR B 211 -5.693 -7.696 -4.664 1.00 0.00 H new ATOM 0 HB THR B 211 -3.499 -7.440 -6.752 1.00 0.00 H new ATOM 0 HG1 THR B 211 -5.060 -5.897 -7.557 1.00 0.00 H new ATOM 0 HG21 THR B 211 -5.184 -8.359 -8.303 1.00 0.00 H new ATOM 0 HG22 THR B 211 -4.847 -9.521 -6.998 1.00 0.00 H new ATOM 0 HG23 THR B 211 -6.336 -8.548 -6.959 1.00 0.00 H new ATOM 1066 N ASN B 212 -4.936 -9.918 -4.146 1.00 0.00 N ATOM 1067 CA ASN B 212 -4.517 -11.229 -3.680 1.00 0.00 C ATOM 1068 C ASN B 212 -4.522 -12.208 -4.856 1.00 0.00 C ATOM 1069 O ASN B 212 -5.573 -12.721 -5.236 1.00 0.00 O ATOM 1070 CB ASN B 212 -5.473 -11.766 -2.613 1.00 0.00 C ATOM 1071 CG ASN B 212 -5.898 -10.656 -1.650 1.00 0.00 C ATOM 1072 OD1 ASN B 212 -5.378 -9.552 -1.664 1.00 0.00 O ATOM 1073 ND2 ASN B 212 -6.872 -11.009 -0.815 1.00 0.00 N ATOM 0 H ASN B 212 -5.946 -9.789 -4.202 1.00 0.00 H new ATOM 0 HA ASN B 212 -3.519 -11.133 -3.253 1.00 0.00 H new ATOM 0 HB2 ASN B 212 -6.354 -12.195 -3.091 1.00 0.00 H new ATOM 0 HB3 ASN B 212 -4.989 -12.569 -2.057 1.00 0.00 H new ATOM 0 HD21 ASN B 212 -7.227 -10.339 -0.133 1.00 0.00 H new ATOM 0 HD22 ASN B 212 -7.263 -11.950 -0.857 1.00 0.00 H new ATOM 1080 N ASN B 213 -3.335 -12.437 -5.398 1.00 0.00 N ATOM 1081 CA ASN B 213 -3.189 -13.346 -6.522 1.00 0.00 C ATOM 1082 C ASN B 213 -3.633 -14.748 -6.100 1.00 0.00 C ATOM 1083 O ASN B 213 -3.828 -15.622 -6.944 1.00 0.00 O ATOM 1084 CB ASN B 213 -1.731 -13.429 -6.978 1.00 0.00 C ATOM 1085 CG ASN B 213 -1.554 -12.814 -8.367 1.00 0.00 C ATOM 1086 OD1 ASN B 213 -1.798 -13.437 -9.387 1.00 0.00 O ATOM 1087 ND2 ASN B 213 -1.118 -11.557 -8.351 1.00 0.00 N ATOM 0 H ASN B 213 -2.466 -12.009 -5.080 1.00 0.00 H new ATOM 0 HA ASN B 213 -3.802 -12.970 -7.341 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -1.093 -12.910 -6.263 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -1.410 -14.471 -6.994 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -0.969 -11.058 -9.228 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -0.933 -11.093 -7.462 1.00 0.00 H new ATOM 1094 N SER B 214 -3.780 -14.919 -4.794 1.00 0.00 N ATOM 1095 CA SER B 214 -4.198 -16.200 -4.251 1.00 0.00 C ATOM 1096 C SER B 214 -5.716 -16.347 -4.364 1.00 0.00 C ATOM 1097 O SER B 214 -6.222 -17.443 -4.601 1.00 0.00 O ATOM 1098 CB SER B 214 -3.758 -16.349 -2.793 1.00 0.00 C ATOM 1099 OG SER B 214 -4.818 -16.069 -1.884 1.00 0.00 O ATOM 0 H SER B 214 -3.617 -14.192 -4.097 1.00 0.00 H new ATOM 0 HA SER B 214 -3.719 -16.989 -4.830 1.00 0.00 H new ATOM 0 HB2 SER B 214 -3.396 -17.363 -2.626 1.00 0.00 H new ATOM 0 HB3 SER B 214 -2.924 -15.676 -2.596 1.00 0.00 H new ATOM 0 HG SER B 214 -4.497 -16.177 -0.964 1.00 0.00 H new ATOM 1105 N ASN B 215 -6.402 -15.226 -4.189 1.00 0.00 N ATOM 1106 CA ASN B 215 -7.852 -15.217 -4.268 1.00 0.00 C ATOM 1107 C ASN B 215 -8.285 -14.452 -5.521 1.00 0.00 C ATOM 1108 O ASN B 215 -9.478 -14.329 -5.796 1.00 0.00 O ATOM 1109 CB ASN B 215 -8.466 -14.518 -3.054 1.00 0.00 C ATOM 1110 CG ASN B 215 -9.651 -15.315 -2.503 1.00 0.00 C ATOM 1111 OD1 ASN B 215 -9.572 -16.508 -2.264 1.00 0.00 O ATOM 1112 ND2 ASN B 215 -10.752 -14.590 -2.319 1.00 0.00 N ATOM 0 H ASN B 215 -5.980 -14.318 -3.993 1.00 0.00 H new ATOM 0 HA ASN B 215 -8.194 -16.251 -4.300 1.00 0.00 H new ATOM 0 HB2 ASN B 215 -7.710 -14.400 -2.277 1.00 0.00 H new ATOM 0 HB3 ASN B 215 -8.795 -13.517 -3.334 1.00 0.00 H new ATOM 0 HD21 ASN B 215 -11.598 -15.030 -1.957 1.00 0.00 H new ATOM 0 HD22 ASN B 215 -10.750 -13.594 -2.540 1.00 0.00 H new ATOM 1119 N GLY B 216 -7.292 -13.959 -6.247 1.00 0.00 N ATOM 1120 CA GLY B 216 -7.555 -13.210 -7.465 1.00 0.00 C ATOM 1121 C GLY B 216 -8.419 -11.980 -7.176 1.00 0.00 C ATOM 1122 O GLY B 216 -9.000 -11.397 -8.089 1.00 0.00 O ATOM 0 H GLY B 216 -6.304 -14.063 -6.015 1.00 0.00 H new ATOM 0 HA2 GLY B 216 -6.613 -12.899 -7.916 1.00 0.00 H new ATOM 0 HA3 GLY B 216 -8.059 -13.851 -8.189 1.00 0.00 H new ATOM 1126 N VAL B 217 -8.475 -11.623 -5.901 1.00 0.00 N ATOM 1127 CA VAL B 217 -9.257 -10.472 -5.481 1.00 0.00 C ATOM 1128 C VAL B 217 -8.373 -9.224 -5.504 1.00 0.00 C ATOM 1129 O VAL B 217 -7.315 -9.195 -4.876 1.00 0.00 O ATOM 1130 CB VAL B 217 -9.882 -10.737 -4.110 1.00 0.00 C ATOM 1131 CG1 VAL B 217 -10.490 -9.461 -3.528 1.00 0.00 C ATOM 1132 CG2 VAL B 217 -10.924 -11.854 -4.188 1.00 0.00 C ATOM 0 H VAL B 217 -7.992 -12.110 -5.146 1.00 0.00 H new ATOM 0 HA VAL B 217 -10.082 -10.298 -6.172 1.00 0.00 H new ATOM 0 HB VAL B 217 -9.088 -11.066 -3.439 1.00 0.00 H new ATOM 0 HG11 VAL B 217 -10.927 -9.678 -2.553 1.00 0.00 H new ATOM 0 HG12 VAL B 217 -9.712 -8.705 -3.417 1.00 0.00 H new ATOM 0 HG13 VAL B 217 -11.265 -9.088 -4.198 1.00 0.00 H new ATOM 0 HG21 VAL B 217 -11.352 -12.022 -3.200 1.00 0.00 H new ATOM 0 HG22 VAL B 217 -11.714 -11.567 -4.882 1.00 0.00 H new ATOM 0 HG23 VAL B 217 -10.449 -12.771 -4.538 1.00 0.00 H new ATOM 1142 N SER B 218 -8.839 -8.221 -6.234 1.00 0.00 N ATOM 1143 CA SER B 218 -8.105 -6.973 -6.347 1.00 0.00 C ATOM 1144 C SER B 218 -8.861 -5.854 -5.628 1.00 0.00 C ATOM 1145 O SER B 218 -10.089 -5.870 -5.566 1.00 0.00 O ATOM 1146 CB SER B 218 -7.873 -6.601 -7.813 1.00 0.00 C ATOM 1147 OG SER B 218 -8.830 -7.210 -8.676 1.00 0.00 O ATOM 0 H SER B 218 -9.717 -8.248 -6.753 1.00 0.00 H new ATOM 0 HA SER B 218 -7.131 -7.105 -5.876 1.00 0.00 H new ATOM 0 HB2 SER B 218 -7.922 -5.518 -7.924 1.00 0.00 H new ATOM 0 HB3 SER B 218 -6.870 -6.907 -8.110 1.00 0.00 H new ATOM 0 HG SER B 218 -8.649 -6.947 -9.603 1.00 0.00 H new ATOM 1153 N VAL B 219 -8.096 -4.907 -5.104 1.00 0.00 N ATOM 1154 CA VAL B 219 -8.679 -3.783 -4.392 1.00 0.00 C ATOM 1155 C VAL B 219 -7.731 -2.585 -4.478 1.00 0.00 C ATOM 1156 O VAL B 219 -6.524 -2.728 -4.287 1.00 0.00 O ATOM 1157 CB VAL B 219 -9.004 -4.186 -2.953 1.00 0.00 C ATOM 1158 CG1 VAL B 219 -9.424 -2.970 -2.125 1.00 0.00 C ATOM 1159 CG2 VAL B 219 -10.081 -5.272 -2.918 1.00 0.00 C ATOM 0 H VAL B 219 -7.078 -4.895 -5.159 1.00 0.00 H new ATOM 0 HA VAL B 219 -9.622 -3.486 -4.852 1.00 0.00 H new ATOM 0 HB VAL B 219 -8.099 -4.598 -2.507 1.00 0.00 H new ATOM 0 HG11 VAL B 219 -9.650 -3.284 -1.106 1.00 0.00 H new ATOM 0 HG12 VAL B 219 -8.612 -2.243 -2.109 1.00 0.00 H new ATOM 0 HG13 VAL B 219 -10.310 -2.516 -2.569 1.00 0.00 H new ATOM 0 HG21 VAL B 219 -10.293 -5.540 -1.883 1.00 0.00 H new ATOM 0 HG22 VAL B 219 -10.990 -4.899 -3.390 1.00 0.00 H new ATOM 0 HG23 VAL B 219 -9.728 -6.152 -3.456 1.00 0.00 H new ATOM 1169 N ASP B 220 -8.313 -1.429 -4.766 1.00 0.00 N ATOM 1170 CA ASP B 220 -7.535 -0.208 -4.879 1.00 0.00 C ATOM 1171 C ASP B 220 -8.109 0.847 -3.931 1.00 0.00 C ATOM 1172 O ASP B 220 -9.319 0.901 -3.716 1.00 0.00 O ATOM 1173 CB ASP B 220 -7.594 0.353 -6.301 1.00 0.00 C ATOM 1174 CG ASP B 220 -8.042 -0.644 -7.371 1.00 0.00 C ATOM 1175 OD1 ASP B 220 -9.117 -1.249 -7.168 1.00 0.00 O ATOM 1176 OD2 ASP B 220 -7.299 -0.779 -8.368 1.00 0.00 O ATOM 0 H ASP B 220 -9.314 -1.313 -4.924 1.00 0.00 H new ATOM 0 HA ASP B 220 -6.501 -0.443 -4.626 1.00 0.00 H new ATOM 0 HB2 ASP B 220 -8.274 1.205 -6.312 1.00 0.00 H new ATOM 0 HB3 ASP B 220 -6.607 0.730 -6.568 1.00 0.00 H new ATOM 1181 N TYR B 221 -7.215 1.660 -3.389 1.00 0.00 N ATOM 1182 CA TYR B 221 -7.617 2.711 -2.469 1.00 0.00 C ATOM 1183 C TYR B 221 -6.803 3.984 -2.701 1.00 0.00 C ATOM 1184 O TYR B 221 -5.574 3.943 -2.730 1.00 0.00 O ATOM 1185 CB TYR B 221 -7.322 2.178 -1.066 1.00 0.00 C ATOM 1186 CG TYR B 221 -8.527 1.532 -0.379 1.00 0.00 C ATOM 1187 CD1 TYR B 221 -9.601 2.309 0.004 1.00 0.00 C ATOM 1188 CD2 TYR B 221 -8.538 0.173 -0.142 1.00 0.00 C ATOM 1189 CE1 TYR B 221 -10.735 1.700 0.651 1.00 0.00 C ATOM 1190 CE2 TYR B 221 -9.672 -0.436 0.505 1.00 0.00 C ATOM 1191 CZ TYR B 221 -10.714 0.358 0.870 1.00 0.00 C ATOM 1192 OH TYR B 221 -11.785 -0.217 1.480 1.00 0.00 O ATOM 0 H TYR B 221 -6.212 1.612 -3.569 1.00 0.00 H new ATOM 0 HA TYR B 221 -8.669 2.962 -2.608 1.00 0.00 H new ATOM 0 HB2 TYR B 221 -6.517 1.446 -1.129 1.00 0.00 H new ATOM 0 HB3 TYR B 221 -6.960 2.998 -0.446 1.00 0.00 H new ATOM 0 HD1 TYR B 221 -9.592 3.373 -0.181 1.00 0.00 H new ATOM 0 HD2 TYR B 221 -7.697 -0.434 -0.441 1.00 0.00 H new ATOM 0 HE1 TYR B 221 -11.583 2.296 0.955 1.00 0.00 H new ATOM 0 HE2 TYR B 221 -9.694 -1.499 0.696 1.00 0.00 H new ATOM 0 HH TYR B 221 -11.485 -0.981 2.015 1.00 0.00 H new ATOM 1202 N GLU B 222 -7.520 5.087 -2.860 1.00 0.00 N ATOM 1203 CA GLU B 222 -6.880 6.370 -3.089 1.00 0.00 C ATOM 1204 C GLU B 222 -6.889 7.204 -1.806 1.00 0.00 C ATOM 1205 O GLU B 222 -7.952 7.597 -1.324 1.00 0.00 O ATOM 1206 CB GLU B 222 -7.555 7.124 -4.237 1.00 0.00 C ATOM 1207 CG GLU B 222 -6.879 8.476 -4.478 1.00 0.00 C ATOM 1208 CD GLU B 222 -7.201 9.008 -5.876 1.00 0.00 C ATOM 1209 OE1 GLU B 222 -7.033 8.223 -6.834 1.00 0.00 O ATOM 1210 OE2 GLU B 222 -7.607 10.187 -5.955 1.00 0.00 O ATOM 0 H GLU B 222 -8.539 5.118 -2.835 1.00 0.00 H new ATOM 0 HA GLU B 222 -5.844 6.190 -3.376 1.00 0.00 H new ATOM 0 HB2 GLU B 222 -7.511 6.524 -5.146 1.00 0.00 H new ATOM 0 HB3 GLU B 222 -8.609 7.277 -4.006 1.00 0.00 H new ATOM 0 HG2 GLU B 222 -7.212 9.192 -3.727 1.00 0.00 H new ATOM 0 HG3 GLU B 222 -5.800 8.373 -4.364 1.00 0.00 H new ATOM 1217 N THR B 223 -5.695 7.449 -1.289 1.00 0.00 N ATOM 1218 CA THR B 223 -5.552 8.230 -0.071 1.00 0.00 C ATOM 1219 C THR B 223 -4.366 9.188 -0.187 1.00 0.00 C ATOM 1220 O THR B 223 -3.404 8.907 -0.900 1.00 0.00 O ATOM 1221 CB THR B 223 -5.435 7.256 1.104 1.00 0.00 C ATOM 1222 OG1 THR B 223 -5.847 8.021 2.233 1.00 0.00 O ATOM 1223 CG2 THR B 223 -3.983 6.886 1.414 1.00 0.00 C ATOM 0 H THR B 223 -4.817 7.121 -1.691 1.00 0.00 H new ATOM 0 HA THR B 223 -6.424 8.862 0.098 1.00 0.00 H new ATOM 0 HB THR B 223 -6.001 6.351 0.883 1.00 0.00 H new ATOM 0 HG1 THR B 223 -5.803 7.465 3.039 1.00 0.00 H new ATOM 0 HG21 THR B 223 -3.956 6.193 2.255 1.00 0.00 H new ATOM 0 HG22 THR B 223 -3.533 6.414 0.540 1.00 0.00 H new ATOM 0 HG23 THR B 223 -3.424 7.787 1.668 1.00 0.00 H new ATOM 1231 N GLU B 224 -4.472 10.300 0.525 1.00 0.00 N ATOM 1232 CA GLU B 224 -3.420 11.301 0.511 1.00 0.00 C ATOM 1233 C GLU B 224 -2.617 11.246 1.813 1.00 0.00 C ATOM 1234 O GLU B 224 -3.002 11.854 2.810 1.00 0.00 O ATOM 1235 CB GLU B 224 -3.996 12.699 0.282 1.00 0.00 C ATOM 1236 CG GLU B 224 -5.507 12.716 0.520 1.00 0.00 C ATOM 1237 CD GLU B 224 -6.084 14.113 0.284 1.00 0.00 C ATOM 1238 OE1 GLU B 224 -5.595 15.050 0.951 1.00 0.00 O ATOM 1239 OE2 GLU B 224 -7.003 14.212 -0.559 1.00 0.00 O ATOM 0 H GLU B 224 -5.271 10.530 1.116 1.00 0.00 H new ATOM 0 HA GLU B 224 -2.747 11.081 -0.318 1.00 0.00 H new ATOM 0 HB2 GLU B 224 -3.511 13.410 0.951 1.00 0.00 H new ATOM 0 HB3 GLU B 224 -3.781 13.022 -0.737 1.00 0.00 H new ATOM 0 HG2 GLU B 224 -5.992 12.001 -0.145 1.00 0.00 H new ATOM 0 HG3 GLU B 224 -5.722 12.398 1.540 1.00 0.00 H new ATOM 1246 N THR B 225 -1.515 10.511 1.760 1.00 0.00 N ATOM 1247 CA THR B 225 -0.654 10.369 2.922 1.00 0.00 C ATOM 1248 C THR B 225 0.811 10.566 2.528 1.00 0.00 C ATOM 1249 O THR B 225 1.412 9.694 1.901 1.00 0.00 O ATOM 1250 CB THR B 225 -0.936 9.004 3.554 1.00 0.00 C ATOM 1251 OG1 THR B 225 -0.891 8.097 2.456 1.00 0.00 O ATOM 1252 CG2 THR B 225 -2.369 8.885 4.077 1.00 0.00 C ATOM 0 H THR B 225 -1.199 10.008 0.931 1.00 0.00 H new ATOM 0 HA THR B 225 -0.863 11.138 3.666 1.00 0.00 H new ATOM 0 HB THR B 225 -0.236 8.832 4.372 1.00 0.00 H new ATOM 0 HG1 THR B 225 -1.062 7.187 2.776 1.00 0.00 H new ATOM 0 HG21 THR B 225 -2.516 7.898 4.515 1.00 0.00 H new ATOM 0 HG22 THR B 225 -2.544 9.648 4.835 1.00 0.00 H new ATOM 0 HG23 THR B 225 -3.070 9.024 3.254 1.00 0.00 H new ATOM 1260 N PRO B 226 1.358 11.746 2.922 1.00 0.00 N ATOM 1261 CA PRO B 226 2.742 12.069 2.617 1.00 0.00 C ATOM 1262 C PRO B 226 3.699 11.285 3.518 1.00 0.00 C ATOM 1263 O PRO B 226 4.244 10.261 3.109 1.00 0.00 O ATOM 1264 CB PRO B 226 2.846 13.573 2.807 1.00 0.00 C ATOM 1265 CG PRO B 226 1.649 13.971 3.656 1.00 0.00 C ATOM 1266 CD PRO B 226 0.677 12.803 3.666 1.00 0.00 C ATOM 0 HA PRO B 226 3.026 11.789 1.603 1.00 0.00 H new ATOM 0 HB2 PRO B 226 3.781 13.840 3.300 1.00 0.00 H new ATOM 0 HB3 PRO B 226 2.833 14.090 1.847 1.00 0.00 H new ATOM 0 HG2 PRO B 226 1.964 14.214 4.671 1.00 0.00 H new ATOM 0 HG3 PRO B 226 1.171 14.862 3.249 1.00 0.00 H new ATOM 0 HD2 PRO B 226 0.449 12.487 4.684 1.00 0.00 H new ATOM 0 HD3 PRO B 226 -0.269 13.071 3.196 1.00 0.00 H new ATOM 1274 N MET B 227 3.874 11.796 4.727 1.00 0.00 N ATOM 1275 CA MET B 227 4.755 11.156 5.690 1.00 0.00 C ATOM 1276 C MET B 227 4.119 9.885 6.256 1.00 0.00 C ATOM 1277 O MET B 227 4.823 8.942 6.615 1.00 0.00 O ATOM 1278 CB MET B 227 5.057 12.130 6.831 1.00 0.00 C ATOM 1279 CG MET B 227 5.456 13.504 6.290 1.00 0.00 C ATOM 1280 SD MET B 227 4.855 14.786 7.376 1.00 0.00 S ATOM 1281 CE MET B 227 3.128 14.342 7.452 1.00 0.00 C ATOM 0 H MET B 227 3.421 12.646 5.063 1.00 0.00 H new ATOM 0 HA MET B 227 5.679 10.880 5.182 1.00 0.00 H new ATOM 0 HB2 MET B 227 4.180 12.228 7.471 1.00 0.00 H new ATOM 0 HB3 MET B 227 5.861 11.732 7.450 1.00 0.00 H new ATOM 0 HG2 MET B 227 6.541 13.569 6.203 1.00 0.00 H new ATOM 0 HG3 MET B 227 5.047 13.643 5.289 1.00 0.00 H new ATOM 0 HE1 MET B 227 2.518 15.244 7.408 1.00 0.00 H new ATOM 0 HE2 MET B 227 2.881 13.695 6.610 1.00 0.00 H new ATOM 0 HE3 MET B 227 2.929 13.815 8.385 1.00 0.00 H new ATOM 1291 N THR B 228 2.797 9.901 6.319 1.00 0.00 N ATOM 1292 CA THR B 228 2.058 8.762 6.836 1.00 0.00 C ATOM 1293 C THR B 228 2.478 7.481 6.112 1.00 0.00 C ATOM 1294 O THR B 228 2.615 6.429 6.735 1.00 0.00 O ATOM 1295 CB THR B 228 0.564 9.069 6.708 1.00 0.00 C ATOM 1296 OG1 THR B 228 0.516 10.210 5.854 1.00 0.00 O ATOM 1297 CG2 THR B 228 -0.047 9.562 8.021 1.00 0.00 C ATOM 0 H THR B 228 2.217 10.685 6.020 1.00 0.00 H new ATOM 0 HA THR B 228 2.281 8.592 7.889 1.00 0.00 H new ATOM 0 HB THR B 228 0.037 8.175 6.375 1.00 0.00 H new ATOM 0 HG1 THR B 228 0.489 11.025 6.398 1.00 0.00 H new ATOM 0 HG21 THR B 228 -1.108 9.765 7.875 1.00 0.00 H new ATOM 0 HG22 THR B 228 0.074 8.797 8.788 1.00 0.00 H new ATOM 0 HG23 THR B 228 0.457 10.475 8.337 1.00 0.00 H new ATOM 1305 N LEU B 229 2.672 7.613 4.809 1.00 0.00 N ATOM 1306 CA LEU B 229 3.075 6.479 3.994 1.00 0.00 C ATOM 1307 C LEU B 229 4.311 5.824 4.613 1.00 0.00 C ATOM 1308 O LEU B 229 4.455 4.604 4.579 1.00 0.00 O ATOM 1309 CB LEU B 229 3.271 6.908 2.538 1.00 0.00 C ATOM 1310 CG LEU B 229 2.004 6.973 1.682 1.00 0.00 C ATOM 1311 CD1 LEU B 229 2.260 7.737 0.382 1.00 0.00 C ATOM 1312 CD2 LEU B 229 1.446 5.572 1.423 1.00 0.00 C ATOM 0 H LEU B 229 2.558 8.488 4.297 1.00 0.00 H new ATOM 0 HA LEU B 229 2.289 5.724 3.977 1.00 0.00 H new ATOM 0 HB2 LEU B 229 3.742 7.891 2.530 1.00 0.00 H new ATOM 0 HB3 LEU B 229 3.969 6.216 2.067 1.00 0.00 H new ATOM 0 HG LEU B 229 1.245 7.525 2.236 1.00 0.00 H new ATOM 0 HD11 LEU B 229 1.344 7.769 -0.208 1.00 0.00 H new ATOM 0 HD12 LEU B 229 2.578 8.754 0.614 1.00 0.00 H new ATOM 0 HD13 LEU B 229 3.041 7.234 -0.188 1.00 0.00 H new ATOM 0 HD21 LEU B 229 0.546 5.646 0.813 1.00 0.00 H new ATOM 0 HD22 LEU B 229 2.192 4.974 0.899 1.00 0.00 H new ATOM 0 HD23 LEU B 229 1.202 5.096 2.373 1.00 0.00 H new ATOM 1324 N LEU B 230 5.172 6.665 5.167 1.00 0.00 N ATOM 1325 CA LEU B 230 6.391 6.185 5.793 1.00 0.00 C ATOM 1326 C LEU B 230 6.072 5.686 7.204 1.00 0.00 C ATOM 1327 O LEU B 230 6.797 4.857 7.753 1.00 0.00 O ATOM 1328 CB LEU B 230 7.476 7.262 5.754 1.00 0.00 C ATOM 1329 CG LEU B 230 7.668 7.973 4.412 1.00 0.00 C ATOM 1330 CD1 LEU B 230 8.816 8.981 4.483 1.00 0.00 C ATOM 1331 CD2 LEU B 230 7.862 6.961 3.280 1.00 0.00 C ATOM 0 H LEU B 230 5.049 7.677 5.195 1.00 0.00 H new ATOM 0 HA LEU B 230 6.795 5.339 5.237 1.00 0.00 H new ATOM 0 HB2 LEU B 230 7.243 8.012 6.510 1.00 0.00 H new ATOM 0 HB3 LEU B 230 8.424 6.805 6.040 1.00 0.00 H new ATOM 0 HG LEU B 230 6.761 8.536 4.191 1.00 0.00 H new ATOM 0 HD11 LEU B 230 8.930 9.471 3.516 1.00 0.00 H new ATOM 0 HD12 LEU B 230 8.597 9.729 5.245 1.00 0.00 H new ATOM 0 HD13 LEU B 230 9.740 8.462 4.738 1.00 0.00 H new ATOM 0 HD21 LEU B 230 7.996 7.491 2.337 1.00 0.00 H new ATOM 0 HD22 LEU B 230 8.743 6.353 3.483 1.00 0.00 H new ATOM 0 HD23 LEU B 230 6.985 6.318 3.213 1.00 0.00 H new ATOM 1343 N VAL B 231 4.986 6.210 7.752 1.00 0.00 N ATOM 1344 CA VAL B 231 4.561 5.828 9.087 1.00 0.00 C ATOM 1345 C VAL B 231 4.084 4.375 9.070 1.00 0.00 C ATOM 1346 O VAL B 231 3.360 3.965 8.164 1.00 0.00 O ATOM 1347 CB VAL B 231 3.495 6.801 9.596 1.00 0.00 C ATOM 1348 CG1 VAL B 231 2.972 6.373 10.968 1.00 0.00 C ATOM 1349 CG2 VAL B 231 4.034 8.232 9.637 1.00 0.00 C ATOM 0 H VAL B 231 4.387 6.897 7.295 1.00 0.00 H new ATOM 0 HA VAL B 231 5.396 5.888 9.785 1.00 0.00 H new ATOM 0 HB VAL B 231 2.659 6.778 8.897 1.00 0.00 H new ATOM 0 HG11 VAL B 231 2.216 7.081 11.306 1.00 0.00 H new ATOM 0 HG12 VAL B 231 2.531 5.379 10.895 1.00 0.00 H new ATOM 0 HG13 VAL B 231 3.796 6.353 11.681 1.00 0.00 H new ATOM 0 HG21 VAL B 231 3.257 8.903 10.002 1.00 0.00 H new ATOM 0 HG22 VAL B 231 4.895 8.277 10.304 1.00 0.00 H new ATOM 0 HG23 VAL B 231 4.335 8.536 8.634 1.00 0.00 H new ATOM 1359 N PRO B 232 4.521 3.615 10.110 1.00 0.00 N ATOM 1360 CA PRO B 232 4.146 2.215 10.223 1.00 0.00 C ATOM 1361 C PRO B 232 2.694 2.072 10.682 1.00 0.00 C ATOM 1362 O PRO B 232 1.955 1.235 10.166 1.00 0.00 O ATOM 1363 CB PRO B 232 5.141 1.619 11.205 1.00 0.00 C ATOM 1364 CG PRO B 232 5.740 2.796 11.958 1.00 0.00 C ATOM 1365 CD PRO B 232 5.379 4.065 11.201 1.00 0.00 C ATOM 0 HA PRO B 232 4.186 1.690 9.268 1.00 0.00 H new ATOM 0 HB2 PRO B 232 4.648 0.928 11.889 1.00 0.00 H new ATOM 0 HB3 PRO B 232 5.914 1.055 10.684 1.00 0.00 H new ATOM 0 HG2 PRO B 232 5.352 2.835 12.976 1.00 0.00 H new ATOM 0 HG3 PRO B 232 6.822 2.691 12.033 1.00 0.00 H new ATOM 0 HD2 PRO B 232 4.861 4.776 11.845 1.00 0.00 H new ATOM 0 HD3 PRO B 232 6.269 4.567 10.823 1.00 0.00 H new ATOM 1373 N GLU B 233 2.328 2.901 11.648 1.00 0.00 N ATOM 1374 CA GLU B 233 0.977 2.877 12.183 1.00 0.00 C ATOM 1375 C GLU B 233 -0.037 3.187 11.079 1.00 0.00 C ATOM 1376 O GLU B 233 -1.139 2.641 11.072 1.00 0.00 O ATOM 1377 CB GLU B 233 0.832 3.855 13.351 1.00 0.00 C ATOM 1378 CG GLU B 233 2.077 3.835 14.240 1.00 0.00 C ATOM 1379 CD GLU B 233 1.761 4.366 15.639 1.00 0.00 C ATOM 1380 OE1 GLU B 233 0.780 3.863 16.229 1.00 0.00 O ATOM 1381 OE2 GLU B 233 2.506 5.264 16.087 1.00 0.00 O ATOM 0 H GLU B 233 2.943 3.594 12.074 1.00 0.00 H new ATOM 0 HA GLU B 233 0.776 1.876 12.564 1.00 0.00 H new ATOM 0 HB2 GLU B 233 0.670 4.863 12.968 1.00 0.00 H new ATOM 0 HB3 GLU B 233 -0.046 3.594 13.942 1.00 0.00 H new ATOM 0 HG2 GLU B 233 2.461 2.817 14.312 1.00 0.00 H new ATOM 0 HG3 GLU B 233 2.862 4.440 13.786 1.00 0.00 H new ATOM 1388 N VAL B 234 0.372 4.064 10.174 1.00 0.00 N ATOM 1389 CA VAL B 234 -0.486 4.453 9.069 1.00 0.00 C ATOM 1390 C VAL B 234 -0.380 3.410 7.954 1.00 0.00 C ATOM 1391 O VAL B 234 -1.393 2.970 7.413 1.00 0.00 O ATOM 1392 CB VAL B 234 -0.129 5.865 8.601 1.00 0.00 C ATOM 1393 CG1 VAL B 234 -0.873 6.222 7.312 1.00 0.00 C ATOM 1394 CG2 VAL B 234 -0.410 6.893 9.698 1.00 0.00 C ATOM 0 H VAL B 234 1.286 4.516 10.184 1.00 0.00 H new ATOM 0 HA VAL B 234 -1.528 4.484 9.388 1.00 0.00 H new ATOM 0 HB VAL B 234 0.940 5.886 8.387 1.00 0.00 H new ATOM 0 HG11 VAL B 234 -0.601 7.231 7.002 1.00 0.00 H new ATOM 0 HG12 VAL B 234 -0.601 5.516 6.528 1.00 0.00 H new ATOM 0 HG13 VAL B 234 -1.948 6.174 7.487 1.00 0.00 H new ATOM 0 HG21 VAL B 234 -0.148 7.888 9.340 1.00 0.00 H new ATOM 0 HG22 VAL B 234 -1.468 6.868 9.958 1.00 0.00 H new ATOM 0 HG23 VAL B 234 0.185 6.656 10.580 1.00 0.00 H new ATOM 1404 N ALA B 235 0.854 3.044 7.644 1.00 0.00 N ATOM 1405 CA ALA B 235 1.106 2.061 6.605 1.00 0.00 C ATOM 1406 C ALA B 235 0.510 0.716 7.026 1.00 0.00 C ATOM 1407 O ALA B 235 -0.154 0.052 6.231 1.00 0.00 O ATOM 1408 CB ALA B 235 2.610 1.974 6.337 1.00 0.00 C ATOM 0 H ALA B 235 1.692 3.411 8.095 1.00 0.00 H new ATOM 0 HA ALA B 235 0.626 2.357 5.672 1.00 0.00 H new ATOM 0 HB1 ALA B 235 2.799 1.236 5.557 1.00 0.00 H new ATOM 0 HB2 ALA B 235 2.979 2.947 6.013 1.00 0.00 H new ATOM 0 HB3 ALA B 235 3.126 1.677 7.250 1.00 0.00 H new ATOM 1414 N ALA B 236 0.768 0.355 8.274 1.00 0.00 N ATOM 1415 CA ALA B 236 0.266 -0.899 8.810 1.00 0.00 C ATOM 1416 C ALA B 236 -1.255 -0.944 8.647 1.00 0.00 C ATOM 1417 O ALA B 236 -1.802 -1.937 8.168 1.00 0.00 O ATOM 1418 CB ALA B 236 0.701 -1.041 10.271 1.00 0.00 C ATOM 0 H ALA B 236 1.318 0.909 8.930 1.00 0.00 H new ATOM 0 HA ALA B 236 0.682 -1.745 8.263 1.00 0.00 H new ATOM 0 HB1 ALA B 236 0.324 -1.982 10.673 1.00 0.00 H new ATOM 0 HB2 ALA B 236 1.789 -1.031 10.329 1.00 0.00 H new ATOM 0 HB3 ALA B 236 0.299 -0.211 10.853 1.00 0.00 H new ATOM 1424 N GLU B 237 -1.895 0.142 9.055 1.00 0.00 N ATOM 1425 CA GLU B 237 -3.341 0.238 8.961 1.00 0.00 C ATOM 1426 C GLU B 237 -3.775 0.296 7.494 1.00 0.00 C ATOM 1427 O GLU B 237 -4.819 -0.243 7.131 1.00 0.00 O ATOM 1428 CB GLU B 237 -3.862 1.450 9.735 1.00 0.00 C ATOM 1429 CG GLU B 237 -4.325 1.048 11.137 1.00 0.00 C ATOM 1430 CD GLU B 237 -5.647 1.731 11.495 1.00 0.00 C ATOM 1431 OE1 GLU B 237 -6.584 1.618 10.675 1.00 0.00 O ATOM 1432 OE2 GLU B 237 -5.690 2.349 12.580 1.00 0.00 O ATOM 0 H GLU B 237 -1.438 0.963 9.452 1.00 0.00 H new ATOM 0 HA GLU B 237 -3.775 -0.654 9.413 1.00 0.00 H new ATOM 0 HB2 GLU B 237 -3.078 2.203 9.809 1.00 0.00 H new ATOM 0 HB3 GLU B 237 -4.690 1.905 9.191 1.00 0.00 H new ATOM 0 HG2 GLU B 237 -4.445 -0.034 11.188 1.00 0.00 H new ATOM 0 HG3 GLU B 237 -3.562 1.319 11.867 1.00 0.00 H new ATOM 1439 N VAL B 238 -2.950 0.954 6.692 1.00 0.00 N ATOM 1440 CA VAL B 238 -3.235 1.089 5.274 1.00 0.00 C ATOM 1441 C VAL B 238 -3.167 -0.288 4.611 1.00 0.00 C ATOM 1442 O VAL B 238 -4.101 -0.697 3.923 1.00 0.00 O ATOM 1443 CB VAL B 238 -2.281 2.104 4.644 1.00 0.00 C ATOM 1444 CG1 VAL B 238 -1.981 1.743 3.187 1.00 0.00 C ATOM 1445 CG2 VAL B 238 -2.840 3.525 4.752 1.00 0.00 C ATOM 0 H VAL B 238 -2.085 1.399 6.998 1.00 0.00 H new ATOM 0 HA VAL B 238 -4.244 1.473 5.122 1.00 0.00 H new ATOM 0 HB VAL B 238 -1.343 2.070 5.199 1.00 0.00 H new ATOM 0 HG11 VAL B 238 -1.300 2.481 2.762 1.00 0.00 H new ATOM 0 HG12 VAL B 238 -1.520 0.756 3.144 1.00 0.00 H new ATOM 0 HG13 VAL B 238 -2.909 1.735 2.616 1.00 0.00 H new ATOM 0 HG21 VAL B 238 -2.141 4.226 4.296 1.00 0.00 H new ATOM 0 HG22 VAL B 238 -3.798 3.579 4.235 1.00 0.00 H new ATOM 0 HG23 VAL B 238 -2.979 3.782 5.802 1.00 0.00 H new ATOM 1455 N ILE B 239 -2.053 -0.966 4.841 1.00 0.00 N ATOM 1456 CA ILE B 239 -1.850 -2.289 4.275 1.00 0.00 C ATOM 1457 C ILE B 239 -2.951 -3.226 4.775 1.00 0.00 C ATOM 1458 O ILE B 239 -3.597 -3.909 3.980 1.00 0.00 O ATOM 1459 CB ILE B 239 -0.435 -2.788 4.572 1.00 0.00 C ATOM 1460 CG1 ILE B 239 0.613 -1.908 3.889 1.00 0.00 C ATOM 1461 CG2 ILE B 239 -0.283 -4.262 4.191 1.00 0.00 C ATOM 1462 CD1 ILE B 239 0.609 -2.128 2.374 1.00 0.00 C ATOM 0 H ILE B 239 -1.280 -0.624 5.412 1.00 0.00 H new ATOM 0 HA ILE B 239 -1.928 -2.255 3.188 1.00 0.00 H new ATOM 0 HB ILE B 239 -0.265 -2.713 5.646 1.00 0.00 H new ATOM 0 HG12 ILE B 239 0.412 -0.859 4.109 1.00 0.00 H new ATOM 0 HG13 ILE B 239 1.601 -2.134 4.291 1.00 0.00 H new ATOM 0 HG21 ILE B 239 0.732 -4.592 4.412 1.00 0.00 H new ATOM 0 HG22 ILE B 239 -0.992 -4.861 4.763 1.00 0.00 H new ATOM 0 HG23 ILE B 239 -0.481 -4.385 3.126 1.00 0.00 H new ATOM 0 HD11 ILE B 239 1.363 -1.491 1.912 1.00 0.00 H new ATOM 0 HD12 ILE B 239 0.834 -3.172 2.157 1.00 0.00 H new ATOM 0 HD13 ILE B 239 -0.373 -1.878 1.973 1.00 0.00 H new ATOM 1474 N LYS B 240 -3.131 -3.230 6.087 1.00 0.00 N ATOM 1475 CA LYS B 240 -4.142 -4.073 6.702 1.00 0.00 C ATOM 1476 C LYS B 240 -5.527 -3.634 6.219 1.00 0.00 C ATOM 1477 O LYS B 240 -6.369 -4.471 5.897 1.00 0.00 O ATOM 1478 CB LYS B 240 -3.991 -4.068 8.224 1.00 0.00 C ATOM 1479 CG LYS B 240 -5.358 -4.107 8.910 1.00 0.00 C ATOM 1480 CD LYS B 240 -5.789 -2.706 9.351 1.00 0.00 C ATOM 1481 CE LYS B 240 -7.226 -2.715 9.877 1.00 0.00 C ATOM 1482 NZ LYS B 240 -8.179 -2.410 8.786 1.00 0.00 N ATOM 0 H LYS B 240 -2.593 -2.662 6.742 1.00 0.00 H new ATOM 0 HA LYS B 240 -4.011 -5.111 6.396 1.00 0.00 H new ATOM 0 HB2 LYS B 240 -3.398 -4.927 8.537 1.00 0.00 H new ATOM 0 HB3 LYS B 240 -3.449 -3.176 8.536 1.00 0.00 H new ATOM 0 HG2 LYS B 240 -6.100 -4.522 8.228 1.00 0.00 H new ATOM 0 HG3 LYS B 240 -5.316 -4.768 9.776 1.00 0.00 H new ATOM 0 HD2 LYS B 240 -5.116 -2.342 10.127 1.00 0.00 H new ATOM 0 HD3 LYS B 240 -5.710 -2.016 8.511 1.00 0.00 H new ATOM 0 HE2 LYS B 240 -7.456 -3.690 10.307 1.00 0.00 H new ATOM 0 HE3 LYS B 240 -7.332 -1.981 10.676 1.00 0.00 H new ATOM 0 HZ1 LYS B 240 -9.148 -2.403 9.163 1.00 0.00 H new ATOM 0 HZ2 LYS B 240 -7.958 -1.477 8.383 1.00 0.00 H new ATOM 0 HZ3 LYS B 240 -8.101 -3.135 8.044 1.00 0.00 H new ATOM 1496 N ASP B 241 -5.719 -2.324 6.186 1.00 0.00 N ATOM 1497 CA ASP B 241 -6.987 -1.765 5.749 1.00 0.00 C ATOM 1498 C ASP B 241 -7.296 -2.257 4.334 1.00 0.00 C ATOM 1499 O ASP B 241 -8.423 -2.654 4.043 1.00 0.00 O ATOM 1500 CB ASP B 241 -6.931 -0.235 5.716 1.00 0.00 C ATOM 1501 CG ASP B 241 -8.074 0.436 4.951 1.00 0.00 C ATOM 1502 OD1 ASP B 241 -8.016 0.406 3.703 1.00 0.00 O ATOM 1503 OD2 ASP B 241 -8.980 0.964 5.632 1.00 0.00 O ATOM 0 H ASP B 241 -5.018 -1.633 6.455 1.00 0.00 H new ATOM 0 HA ASP B 241 -7.757 -2.084 6.452 1.00 0.00 H new ATOM 0 HB2 ASP B 241 -6.932 0.136 6.741 1.00 0.00 H new ATOM 0 HB3 ASP B 241 -5.985 0.070 5.268 1.00 0.00 H new ATOM 1508 N LEU B 242 -6.275 -2.214 3.491 1.00 0.00 N ATOM 1509 CA LEU B 242 -6.423 -2.652 2.113 1.00 0.00 C ATOM 1510 C LEU B 242 -6.703 -4.156 2.087 1.00 0.00 C ATOM 1511 O LEU B 242 -7.690 -4.598 1.500 1.00 0.00 O ATOM 1512 CB LEU B 242 -5.205 -2.238 1.285 1.00 0.00 C ATOM 1513 CG LEU B 242 -5.223 -0.813 0.730 1.00 0.00 C ATOM 1514 CD1 LEU B 242 -4.206 0.070 1.454 1.00 0.00 C ATOM 1515 CD2 LEU B 242 -5.008 -0.812 -0.785 1.00 0.00 C ATOM 0 H LEU B 242 -5.342 -1.883 3.735 1.00 0.00 H new ATOM 0 HA LEU B 242 -7.277 -2.161 1.647 1.00 0.00 H new ATOM 0 HB2 LEU B 242 -4.314 -2.355 1.902 1.00 0.00 H new ATOM 0 HB3 LEU B 242 -5.106 -2.931 0.449 1.00 0.00 H new ATOM 0 HG LEU B 242 -6.209 -0.386 0.915 1.00 0.00 H new ATOM 0 HD11 LEU B 242 -4.239 1.078 1.040 1.00 0.00 H new ATOM 0 HD12 LEU B 242 -4.447 0.106 2.517 1.00 0.00 H new ATOM 0 HD13 LEU B 242 -3.206 -0.343 1.322 1.00 0.00 H new ATOM 0 HD21 LEU B 242 -5.025 0.213 -1.154 1.00 0.00 H new ATOM 0 HD22 LEU B 242 -4.044 -1.265 -1.016 1.00 0.00 H new ATOM 0 HD23 LEU B 242 -5.802 -1.384 -1.266 1.00 0.00 H new ATOM 1527 N VAL B 243 -5.817 -4.901 2.731 1.00 0.00 N ATOM 1528 CA VAL B 243 -5.956 -6.347 2.790 1.00 0.00 C ATOM 1529 C VAL B 243 -7.312 -6.700 3.403 1.00 0.00 C ATOM 1530 O VAL B 243 -8.009 -7.587 2.911 1.00 0.00 O ATOM 1531 CB VAL B 243 -4.778 -6.956 3.553 1.00 0.00 C ATOM 1532 CG1 VAL B 243 -5.217 -8.187 4.347 1.00 0.00 C ATOM 1533 CG2 VAL B 243 -3.627 -7.297 2.603 1.00 0.00 C ATOM 0 H VAL B 243 -5.000 -4.531 3.217 1.00 0.00 H new ATOM 0 HA VAL B 243 -5.931 -6.774 1.787 1.00 0.00 H new ATOM 0 HB VAL B 243 -4.417 -6.211 4.263 1.00 0.00 H new ATOM 0 HG11 VAL B 243 -4.361 -8.601 4.880 1.00 0.00 H new ATOM 0 HG12 VAL B 243 -5.987 -7.902 5.063 1.00 0.00 H new ATOM 0 HG13 VAL B 243 -5.616 -8.937 3.664 1.00 0.00 H new ATOM 0 HG21 VAL B 243 -2.802 -7.728 3.171 1.00 0.00 H new ATOM 0 HG22 VAL B 243 -3.970 -8.016 1.859 1.00 0.00 H new ATOM 0 HG23 VAL B 243 -3.288 -6.390 2.102 1.00 0.00 H new ATOM 1543 N ASN B 244 -7.648 -5.988 4.469 1.00 0.00 N ATOM 1544 CA ASN B 244 -8.908 -6.214 5.155 1.00 0.00 C ATOM 1545 C ASN B 244 -10.060 -6.079 4.156 1.00 0.00 C ATOM 1546 O ASN B 244 -11.033 -6.827 4.220 1.00 0.00 O ATOM 1547 CB ASN B 244 -9.124 -5.186 6.267 1.00 0.00 C ATOM 1548 CG ASN B 244 -8.809 -5.787 7.638 1.00 0.00 C ATOM 1549 OD1 ASN B 244 -9.643 -5.846 8.525 1.00 0.00 O ATOM 1550 ND2 ASN B 244 -7.560 -6.229 7.761 1.00 0.00 N ATOM 0 H ASN B 244 -7.068 -5.253 4.874 1.00 0.00 H new ATOM 0 HA ASN B 244 -8.879 -7.213 5.589 1.00 0.00 H new ATOM 0 HB2 ASN B 244 -8.489 -4.317 6.092 1.00 0.00 H new ATOM 0 HB3 ASN B 244 -10.156 -4.836 6.248 1.00 0.00 H new ATOM 0 HD21 ASN B 244 -7.251 -6.648 8.638 1.00 0.00 H new ATOM 0 HD22 ASN B 244 -6.911 -6.149 6.978 1.00 0.00 H new ATOM 1557 N THR B 245 -9.909 -5.118 3.255 1.00 0.00 N ATOM 1558 CA THR B 245 -10.923 -4.874 2.245 1.00 0.00 C ATOM 1559 C THR B 245 -10.920 -5.996 1.204 1.00 0.00 C ATOM 1560 O THR B 245 -11.976 -6.497 0.821 1.00 0.00 O ATOM 1561 CB THR B 245 -10.670 -3.489 1.646 1.00 0.00 C ATOM 1562 OG1 THR B 245 -11.019 -2.589 2.694 1.00 0.00 O ATOM 1563 CG2 THR B 245 -11.652 -3.150 0.521 1.00 0.00 C ATOM 0 H THR B 245 -9.099 -4.500 3.204 1.00 0.00 H new ATOM 0 HA THR B 245 -11.923 -4.879 2.679 1.00 0.00 H new ATOM 0 HB THR B 245 -9.650 -3.438 1.265 1.00 0.00 H new ATOM 0 HG1 THR B 245 -10.251 -2.467 3.290 1.00 0.00 H new ATOM 0 HG21 THR B 245 -11.429 -2.157 0.130 1.00 0.00 H new ATOM 0 HG22 THR B 245 -11.557 -3.884 -0.279 1.00 0.00 H new ATOM 0 HG23 THR B 245 -12.670 -3.167 0.909 1.00 0.00 H new