USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=27 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 -137:sc= 0.766 USER MOD Set 1.2: B 245 THR OG1 : rot 82:sc= 2.1 USER MOD Set 2.1: B 211 THR OG1 : rot 141:sc= -1.15 USER MOD Set 2.2: B 218 SER OG : rot 52:sc= 0.691 USER MOD Set 3.1: A 6 TYR OH : rot 165:sc= -0.831 USER MOD Set 3.2: B 212 ASN : amide:sc= -9.53! C(o=-10!,f=-15!) USER MOD Set 4.1: A 21 TYR OH : rot 78:sc= 0.957 USER MOD Set 4.2: A 45 THR OG1 : rot 89:sc= 2.07 USER MOD Set 5.1: A 11 THR OG1 : rot 170:sc= -1.96! USER MOD Set 5.2: A 18 SER OG : rot 43:sc= 0.988 USER MOD Set 6.1: A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 6.2: B 207 THR OG1 : 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= -2.9! USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot -37:sc= 0.533 USER MOD Single : A 12 ASN : amide:sc= -8.49! C(o=-8.5!,f=-25!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.194 X(o=-0.19,f=-0.6) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 35:sc= 0.187 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot -100:sc= -0.73 USER MOD Single : A 40 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0569) USER MOD Single : A 44 ASN : amide:sc= -0.638 X(o=-0.64,f=-0.22) USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 205 THR OG1 : rot 180:sc= -3.54! USER MOD Single : B 206 TYR OH : rot 180:sc= 0 USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 213 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 214 SER OG : rot 38:sc= 0.0309 USER MOD Single : B 215 ASN : amide:sc= -0.579 X(o=-0.58,f=-0.47) USER MOD Single : B 223 THR OG1 : rot 180:sc= 0 USER MOD Single : B 225 THR OG1 : rot 180:sc= -0.319 USER MOD Single : B 227 MET CE :methyl 154:sc= -0.958! (180deg=-3.84!) USER MOD Single : B 228 THR OG1 : rot 180:sc= 0.0829 USER MOD Single : B 240 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 244 ASN :FLIP amide:sc= -0.611 F(o=-1.4!,f=-0.61) USER MOD ----------------------------------------------------------------- ATOM 25 N LYS A 3 -1.166 -20.049 -6.820 1.00 0.00 N ATOM 26 CA LYS A 3 -0.130 -19.775 -5.840 1.00 0.00 C ATOM 27 C LYS A 3 -0.616 -18.688 -4.880 1.00 0.00 C ATOM 28 O LYS A 3 -1.636 -18.048 -5.127 1.00 0.00 O ATOM 29 CB LYS A 3 1.190 -19.437 -6.536 1.00 0.00 C ATOM 30 CG LYS A 3 1.887 -20.704 -7.038 1.00 0.00 C ATOM 31 CD LYS A 3 0.865 -21.752 -7.481 1.00 0.00 C ATOM 32 CE LYS A 3 1.560 -22.980 -8.073 1.00 0.00 C ATOM 33 NZ LYS A 3 2.064 -23.860 -6.995 1.00 0.00 N ATOM 0 HA LYS A 3 0.071 -20.663 -5.240 1.00 0.00 H new ATOM 0 HB2 LYS A 3 1.002 -18.765 -7.374 1.00 0.00 H new ATOM 0 HB3 LYS A 3 1.845 -18.908 -5.844 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.544 -20.456 -7.872 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.516 -21.115 -6.248 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.253 -22.051 -6.630 1.00 0.00 H new ATOM 0 HD3 LYS A 3 0.192 -21.319 -8.221 1.00 0.00 H new ATOM 0 HE2 LYS A 3 0.863 -23.531 -8.704 1.00 0.00 H new ATOM 0 HE3 LYS A 3 2.387 -22.666 -8.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 2.533 -24.688 -7.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 2.745 -23.336 -6.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 1.269 -24.175 -6.403 1.00 0.00 H new ATOM 47 N ALA A 4 0.139 -18.511 -3.805 1.00 0.00 N ATOM 48 CA ALA A 4 -0.201 -17.511 -2.809 1.00 0.00 C ATOM 49 C ALA A 4 0.769 -16.334 -2.919 1.00 0.00 C ATOM 50 O ALA A 4 1.848 -16.356 -2.329 1.00 0.00 O ATOM 51 CB ALA A 4 -0.186 -18.151 -1.418 1.00 0.00 C ATOM 0 H ALA A 4 0.985 -19.044 -3.603 1.00 0.00 H new ATOM 0 HA ALA A 4 -1.206 -17.125 -2.981 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -0.441 -17.401 -0.670 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -0.914 -18.961 -1.382 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.808 -18.547 -1.210 1.00 0.00 H new ATOM 57 N THR A 5 0.352 -15.334 -3.681 1.00 0.00 N ATOM 58 CA THR A 5 1.172 -14.149 -3.877 1.00 0.00 C ATOM 59 C THR A 5 0.301 -12.891 -3.869 1.00 0.00 C ATOM 60 O THR A 5 -0.903 -12.964 -4.110 1.00 0.00 O ATOM 61 CB THR A 5 1.963 -14.332 -5.173 1.00 0.00 C ATOM 62 OG1 THR A 5 0.962 -14.506 -6.170 1.00 0.00 O ATOM 63 CG2 THR A 5 2.748 -15.646 -5.199 1.00 0.00 C ATOM 0 H THR A 5 -0.543 -15.319 -4.170 1.00 0.00 H new ATOM 0 HA THR A 5 1.883 -14.019 -3.061 1.00 0.00 H new ATOM 0 HB THR A 5 2.650 -13.496 -5.299 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.388 -14.630 -7.044 1.00 0.00 H new ATOM 0 HG21 THR A 5 3.292 -15.726 -6.140 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.454 -15.664 -4.369 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.057 -16.484 -5.106 1.00 0.00 H new ATOM 71 N TYR A 6 0.944 -11.768 -3.589 1.00 0.00 N ATOM 72 CA TYR A 6 0.244 -10.495 -3.546 1.00 0.00 C ATOM 73 C TYR A 6 1.065 -9.394 -4.221 1.00 0.00 C ATOM 74 O TYR A 6 2.284 -9.340 -4.064 1.00 0.00 O ATOM 75 CB TYR A 6 0.077 -10.155 -2.064 1.00 0.00 C ATOM 76 CG TYR A 6 -1.246 -10.633 -1.462 1.00 0.00 C ATOM 77 CD1 TYR A 6 -1.502 -11.984 -1.344 1.00 0.00 C ATOM 78 CD2 TYR A 6 -2.182 -9.712 -1.035 1.00 0.00 C ATOM 79 CE1 TYR A 6 -2.748 -12.432 -0.777 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.426 -10.161 -0.468 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.648 -11.500 -0.367 1.00 0.00 C ATOM 82 OH TYR A 6 -4.824 -11.924 0.169 1.00 0.00 O ATOM 0 H TYR A 6 1.943 -11.712 -3.389 1.00 0.00 H new ATOM 0 HA TYR A 6 -0.710 -10.564 -4.069 1.00 0.00 H new ATOM 0 HB2 TYR A 6 0.900 -10.599 -1.505 1.00 0.00 H new ATOM 0 HB3 TYR A 6 0.152 -9.075 -1.939 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -0.769 -12.704 -1.676 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -1.980 -8.655 -1.127 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -2.962 -13.486 -0.680 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -4.167 -9.451 -0.130 1.00 0.00 H new ATOM 0 HH TYR A 6 -5.261 -11.178 0.631 1.00 0.00 H new ATOM 92 N THR A 7 0.365 -8.544 -4.957 1.00 0.00 N ATOM 93 CA THR A 7 1.014 -7.448 -5.655 1.00 0.00 C ATOM 94 C THR A 7 0.471 -6.106 -5.163 1.00 0.00 C ATOM 95 O THR A 7 -0.702 -5.795 -5.364 1.00 0.00 O ATOM 96 CB THR A 7 0.824 -7.666 -7.158 1.00 0.00 C ATOM 97 OG1 THR A 7 1.673 -8.771 -7.459 1.00 0.00 O ATOM 98 CG2 THR A 7 1.395 -6.518 -7.993 1.00 0.00 C ATOM 0 H THR A 7 -0.646 -8.592 -5.085 1.00 0.00 H new ATOM 0 HA THR A 7 2.084 -7.426 -5.447 1.00 0.00 H new ATOM 0 HB THR A 7 -0.238 -7.780 -7.377 1.00 0.00 H new ATOM 0 HG1 THR A 7 1.610 -8.981 -8.414 1.00 0.00 H new ATOM 0 HG21 THR A 7 1.234 -6.723 -9.051 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.895 -5.588 -7.723 1.00 0.00 H new ATOM 0 HG23 THR A 7 2.464 -6.424 -7.800 1.00 0.00 H new ATOM 106 N VAL A 8 1.350 -5.345 -4.527 1.00 0.00 N ATOM 107 CA VAL A 8 0.973 -4.043 -4.003 1.00 0.00 C ATOM 108 C VAL A 8 1.428 -2.955 -4.978 1.00 0.00 C ATOM 109 O VAL A 8 2.616 -2.847 -5.283 1.00 0.00 O ATOM 110 CB VAL A 8 1.543 -3.860 -2.595 1.00 0.00 C ATOM 111 CG1 VAL A 8 1.475 -2.394 -2.162 1.00 0.00 C ATOM 112 CG2 VAL A 8 0.823 -4.763 -1.591 1.00 0.00 C ATOM 0 H VAL A 8 2.322 -5.605 -4.363 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.111 -3.967 -3.913 1.00 0.00 H new ATOM 0 HB VAL A 8 2.592 -4.154 -2.617 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.886 -2.292 -1.158 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.053 -1.783 -2.855 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.437 -2.062 -2.164 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.247 -4.614 -0.598 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.238 -4.514 -1.574 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.946 -5.805 -1.885 1.00 0.00 H new ATOM 122 N THR A 9 0.461 -2.177 -5.440 1.00 0.00 N ATOM 123 CA THR A 9 0.748 -1.101 -6.375 1.00 0.00 C ATOM 124 C THR A 9 0.626 0.256 -5.679 1.00 0.00 C ATOM 125 O THR A 9 -0.400 0.555 -5.071 1.00 0.00 O ATOM 126 CB THR A 9 -0.188 -1.256 -7.575 1.00 0.00 C ATOM 127 OG1 THR A 9 -0.390 -2.663 -7.679 1.00 0.00 O ATOM 128 CG2 THR A 9 0.486 -0.877 -8.895 1.00 0.00 C ATOM 0 H THR A 9 -0.522 -2.270 -5.185 1.00 0.00 H new ATOM 0 HA THR A 9 1.775 -1.154 -6.737 1.00 0.00 H new ATOM 0 HB THR A 9 -1.073 -0.636 -7.428 1.00 0.00 H new ATOM 0 HG1 THR A 9 0.442 -3.130 -7.455 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.221 -1.005 -9.714 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.809 0.163 -8.853 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.351 -1.519 -9.059 1.00 0.00 H new ATOM 136 N VAL A 10 1.687 1.040 -5.792 1.00 0.00 N ATOM 137 CA VAL A 10 1.712 2.359 -5.181 1.00 0.00 C ATOM 138 C VAL A 10 2.052 3.403 -6.247 1.00 0.00 C ATOM 139 O VAL A 10 3.114 3.343 -6.863 1.00 0.00 O ATOM 140 CB VAL A 10 2.684 2.371 -4.001 1.00 0.00 C ATOM 141 CG1 VAL A 10 3.158 3.793 -3.694 1.00 0.00 C ATOM 142 CG2 VAL A 10 2.054 1.726 -2.765 1.00 0.00 C ATOM 0 H VAL A 10 2.536 0.788 -6.298 1.00 0.00 H new ATOM 0 HA VAL A 10 0.731 2.612 -4.779 1.00 0.00 H new ATOM 0 HB VAL A 10 3.556 1.780 -4.281 1.00 0.00 H new ATOM 0 HG11 VAL A 10 3.848 3.772 -2.851 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.664 4.204 -4.567 1.00 0.00 H new ATOM 0 HG13 VAL A 10 2.300 4.417 -3.445 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.766 1.748 -1.940 1.00 0.00 H new ATOM 0 HG22 VAL A 10 1.157 2.278 -2.484 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.789 0.693 -2.989 1.00 0.00 H new ATOM 152 N THR A 11 1.129 4.337 -6.431 1.00 0.00 N ATOM 153 CA THR A 11 1.318 5.393 -7.410 1.00 0.00 C ATOM 154 C THR A 11 1.128 6.765 -6.759 1.00 0.00 C ATOM 155 O THR A 11 0.239 6.943 -5.929 1.00 0.00 O ATOM 156 CB THR A 11 0.360 5.134 -8.574 1.00 0.00 C ATOM 157 OG1 THR A 11 0.786 3.882 -9.104 1.00 0.00 O ATOM 158 CG2 THR A 11 0.565 6.116 -9.731 1.00 0.00 C ATOM 0 H THR A 11 0.249 4.383 -5.918 1.00 0.00 H new ATOM 0 HA THR A 11 2.335 5.393 -7.801 1.00 0.00 H new ATOM 0 HB THR A 11 -0.668 5.200 -8.218 1.00 0.00 H new ATOM 0 HG1 THR A 11 0.127 3.561 -9.754 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.140 5.888 -10.531 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.397 7.134 -9.379 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.584 6.026 -10.108 1.00 0.00 H new ATOM 166 N ASN A 12 1.979 7.697 -7.163 1.00 0.00 N ATOM 167 CA ASN A 12 1.915 9.047 -6.630 1.00 0.00 C ATOM 168 C ASN A 12 1.199 9.954 -7.632 1.00 0.00 C ATOM 169 O ASN A 12 1.804 10.415 -8.600 1.00 0.00 O ATOM 170 CB ASN A 12 3.317 9.614 -6.396 1.00 0.00 C ATOM 171 CG ASN A 12 4.203 9.407 -7.627 1.00 0.00 C ATOM 172 OD1 ASN A 12 3.754 9.002 -8.686 1.00 0.00 O ATOM 173 ND2 ASN A 12 5.483 9.709 -7.427 1.00 0.00 N ATOM 0 H ASN A 12 2.715 7.544 -7.852 1.00 0.00 H new ATOM 0 HA ASN A 12 1.378 9.010 -5.682 1.00 0.00 H new ATOM 0 HB2 ASN A 12 3.250 10.677 -6.166 1.00 0.00 H new ATOM 0 HB3 ASN A 12 3.770 9.129 -5.531 1.00 0.00 H new ATOM 0 HD21 ASN A 12 6.156 9.606 -8.187 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.791 10.043 -6.514 1.00 0.00 H new ATOM 180 N ASN A 13 -0.078 10.184 -7.368 1.00 0.00 N ATOM 181 CA ASN A 13 -0.883 11.028 -8.235 1.00 0.00 C ATOM 182 C ASN A 13 -0.238 12.411 -8.333 1.00 0.00 C ATOM 183 O ASN A 13 -0.567 13.192 -9.226 1.00 0.00 O ATOM 184 CB ASN A 13 -2.295 11.204 -7.675 1.00 0.00 C ATOM 185 CG ASN A 13 -3.327 10.501 -8.560 1.00 0.00 C ATOM 186 OD1 ASN A 13 -3.745 11.003 -9.589 1.00 0.00 O ATOM 187 ND2 ASN A 13 -3.712 9.313 -8.102 1.00 0.00 N ATOM 0 H ASN A 13 -0.576 9.800 -6.565 1.00 0.00 H new ATOM 0 HA ASN A 13 -0.940 10.550 -9.213 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.342 10.800 -6.664 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -2.533 12.265 -7.605 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.398 8.764 -8.621 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.322 8.951 -7.232 1.00 0.00 H new ATOM 194 N SER A 14 0.669 12.674 -7.404 1.00 0.00 N ATOM 195 CA SER A 14 1.363 13.951 -7.376 1.00 0.00 C ATOM 196 C SER A 14 2.423 13.995 -8.479 1.00 0.00 C ATOM 197 O SER A 14 2.668 15.048 -9.067 1.00 0.00 O ATOM 198 CB SER A 14 2.008 14.197 -6.011 1.00 0.00 C ATOM 199 OG SER A 14 3.425 14.051 -6.056 1.00 0.00 O ATOM 0 H SER A 14 0.940 12.025 -6.665 1.00 0.00 H new ATOM 0 HA SER A 14 0.633 14.741 -7.551 1.00 0.00 H new ATOM 0 HB2 SER A 14 1.758 15.201 -5.667 1.00 0.00 H new ATOM 0 HB3 SER A 14 1.594 13.499 -5.283 1.00 0.00 H new ATOM 0 HG SER A 14 3.799 14.218 -5.166 1.00 0.00 H new ATOM 205 N ASN A 15 3.021 12.839 -8.727 1.00 0.00 N ATOM 206 CA ASN A 15 4.049 12.734 -9.749 1.00 0.00 C ATOM 207 C ASN A 15 3.518 11.896 -10.914 1.00 0.00 C ATOM 208 O ASN A 15 4.187 11.754 -11.937 1.00 0.00 O ATOM 209 CB ASN A 15 5.301 12.043 -9.202 1.00 0.00 C ATOM 210 CG ASN A 15 6.555 12.867 -9.499 1.00 0.00 C ATOM 211 OD1 ASN A 15 6.563 14.084 -9.416 1.00 0.00 O ATOM 212 ND2 ASN A 15 7.610 12.138 -9.848 1.00 0.00 N ATOM 0 H ASN A 15 2.814 11.968 -8.239 1.00 0.00 H new ATOM 0 HA ASN A 15 4.306 13.742 -10.074 1.00 0.00 H new ATOM 0 HB2 ASN A 15 5.201 11.900 -8.126 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.398 11.053 -9.647 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.496 12.594 -10.066 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.534 11.122 -9.898 1.00 0.00 H new ATOM 219 N GLY A 16 2.320 11.363 -10.721 1.00 0.00 N ATOM 220 CA GLY A 16 1.691 10.544 -11.743 1.00 0.00 C ATOM 221 C GLY A 16 2.508 9.277 -12.009 1.00 0.00 C ATOM 222 O GLY A 16 2.275 8.579 -12.995 1.00 0.00 O ATOM 0 H GLY A 16 1.768 11.483 -9.871 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.684 10.272 -11.427 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.592 11.118 -12.664 1.00 0.00 H new ATOM 226 N VAL A 17 3.450 9.020 -11.114 1.00 0.00 N ATOM 227 CA VAL A 17 4.302 7.850 -11.239 1.00 0.00 C ATOM 228 C VAL A 17 3.662 6.675 -10.496 1.00 0.00 C ATOM 229 O VAL A 17 3.037 6.862 -9.453 1.00 0.00 O ATOM 230 CB VAL A 17 5.712 8.173 -10.742 1.00 0.00 C ATOM 231 CG1 VAL A 17 6.583 6.916 -10.707 1.00 0.00 C ATOM 232 CG2 VAL A 17 6.358 9.264 -11.599 1.00 0.00 C ATOM 0 H VAL A 17 3.642 9.602 -10.299 1.00 0.00 H new ATOM 0 HA VAL A 17 4.399 7.560 -12.285 1.00 0.00 H new ATOM 0 HB VAL A 17 5.630 8.551 -9.723 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.580 7.174 -10.350 1.00 0.00 H new ATOM 0 HG12 VAL A 17 6.136 6.182 -10.036 1.00 0.00 H new ATOM 0 HG13 VAL A 17 6.654 6.495 -11.710 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.360 9.475 -11.225 1.00 0.00 H new ATOM 0 HG22 VAL A 17 6.421 8.925 -12.633 1.00 0.00 H new ATOM 0 HG23 VAL A 17 5.754 10.170 -11.550 1.00 0.00 H new ATOM 242 N SER A 18 3.839 5.491 -11.062 1.00 0.00 N ATOM 243 CA SER A 18 3.286 4.286 -10.466 1.00 0.00 C ATOM 244 C SER A 18 4.411 3.309 -10.122 1.00 0.00 C ATOM 245 O SER A 18 5.499 3.381 -10.694 1.00 0.00 O ATOM 246 CB SER A 18 2.275 3.623 -11.403 1.00 0.00 C ATOM 247 OG SER A 18 1.737 2.427 -10.846 1.00 0.00 O ATOM 0 H SER A 18 4.358 5.340 -11.927 1.00 0.00 H new ATOM 0 HA SER A 18 2.764 4.565 -9.551 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.465 4.321 -11.615 1.00 0.00 H new ATOM 0 HB3 SER A 18 2.757 3.396 -12.354 1.00 0.00 H new ATOM 0 HG SER A 18 1.531 2.571 -9.899 1.00 0.00 H new ATOM 253 N VAL A 19 4.112 2.416 -9.189 1.00 0.00 N ATOM 254 CA VAL A 19 5.085 1.426 -8.762 1.00 0.00 C ATOM 255 C VAL A 19 4.352 0.204 -8.204 1.00 0.00 C ATOM 256 O VAL A 19 3.542 0.327 -7.286 1.00 0.00 O ATOM 257 CB VAL A 19 6.060 2.047 -7.759 1.00 0.00 C ATOM 258 CG1 VAL A 19 6.599 0.991 -6.791 1.00 0.00 C ATOM 259 CG2 VAL A 19 7.202 2.767 -8.478 1.00 0.00 C ATOM 0 H VAL A 19 3.209 2.358 -8.717 1.00 0.00 H new ATOM 0 HA VAL A 19 5.682 1.089 -9.609 1.00 0.00 H new ATOM 0 HB VAL A 19 5.513 2.787 -7.175 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.289 1.459 -6.089 1.00 0.00 H new ATOM 0 HG12 VAL A 19 5.770 0.544 -6.241 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.122 0.216 -7.352 1.00 0.00 H new ATOM 0 HG21 VAL A 19 7.880 3.199 -7.742 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.746 2.056 -9.100 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.795 3.560 -9.105 1.00 0.00 H new ATOM 269 N ASP A 20 4.662 -0.947 -8.782 1.00 0.00 N ATOM 270 CA ASP A 20 4.043 -2.190 -8.353 1.00 0.00 C ATOM 271 C ASP A 20 5.114 -3.114 -7.770 1.00 0.00 C ATOM 272 O ASP A 20 6.252 -3.124 -8.237 1.00 0.00 O ATOM 273 CB ASP A 20 3.386 -2.912 -9.532 1.00 0.00 C ATOM 274 CG ASP A 20 1.987 -3.465 -9.252 1.00 0.00 C ATOM 275 OD1 ASP A 20 1.723 -3.767 -8.068 1.00 0.00 O ATOM 276 OD2 ASP A 20 1.214 -3.573 -10.229 1.00 0.00 O ATOM 0 H ASP A 20 5.333 -1.045 -9.544 1.00 0.00 H new ATOM 0 HA ASP A 20 3.284 -1.950 -7.608 1.00 0.00 H new ATOM 0 HB2 ASP A 20 3.326 -2.222 -10.374 1.00 0.00 H new ATOM 0 HB3 ASP A 20 4.031 -3.735 -9.840 1.00 0.00 H new ATOM 281 N TYR A 21 4.711 -3.869 -6.758 1.00 0.00 N ATOM 282 CA TYR A 21 5.623 -4.795 -6.107 1.00 0.00 C ATOM 283 C TYR A 21 4.920 -6.113 -5.775 1.00 0.00 C ATOM 284 O TYR A 21 3.865 -6.116 -5.142 1.00 0.00 O ATOM 285 CB TYR A 21 6.051 -4.117 -4.804 1.00 0.00 C ATOM 286 CG TYR A 21 7.404 -3.406 -4.888 1.00 0.00 C ATOM 287 CD1 TYR A 21 7.506 -2.194 -5.541 1.00 0.00 C ATOM 288 CD2 TYR A 21 8.521 -3.976 -4.312 1.00 0.00 C ATOM 289 CE1 TYR A 21 8.779 -1.525 -5.621 1.00 0.00 C ATOM 290 CE2 TYR A 21 9.793 -3.306 -4.392 1.00 0.00 C ATOM 291 CZ TYR A 21 9.859 -2.114 -5.042 1.00 0.00 C ATOM 292 OH TYR A 21 11.061 -1.482 -5.117 1.00 0.00 O ATOM 0 H TYR A 21 3.766 -3.859 -6.373 1.00 0.00 H new ATOM 0 HA TYR A 21 6.468 -5.024 -6.757 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.289 -3.393 -4.516 1.00 0.00 H new ATOM 0 HB3 TYR A 21 6.094 -4.866 -4.014 1.00 0.00 H new ATOM 0 HD1 TYR A 21 6.632 -1.748 -5.992 1.00 0.00 H new ATOM 0 HD2 TYR A 21 8.441 -4.924 -3.801 1.00 0.00 H new ATOM 0 HE1 TYR A 21 8.874 -0.577 -6.129 1.00 0.00 H new ATOM 0 HE2 TYR A 21 10.675 -3.741 -3.946 1.00 0.00 H new ATOM 0 HH TYR A 21 11.090 -0.756 -4.460 1.00 0.00 H new ATOM 302 N GLU A 22 5.533 -7.201 -6.217 1.00 0.00 N ATOM 303 CA GLU A 22 4.980 -8.523 -5.975 1.00 0.00 C ATOM 304 C GLU A 22 5.683 -9.183 -4.787 1.00 0.00 C ATOM 305 O GLU A 22 6.863 -9.522 -4.871 1.00 0.00 O ATOM 306 CB GLU A 22 5.080 -9.396 -7.227 1.00 0.00 C ATOM 307 CG GLU A 22 4.559 -10.809 -6.953 1.00 0.00 C ATOM 308 CD GLU A 22 5.330 -11.846 -7.770 1.00 0.00 C ATOM 309 OE1 GLU A 22 5.051 -11.933 -8.986 1.00 0.00 O ATOM 310 OE2 GLU A 22 6.182 -12.530 -7.161 1.00 0.00 O ATOM 0 H GLU A 22 6.408 -7.194 -6.742 1.00 0.00 H new ATOM 0 HA GLU A 22 3.923 -8.415 -5.731 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.507 -8.944 -8.037 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.117 -9.445 -7.559 1.00 0.00 H new ATOM 0 HG2 GLU A 22 4.653 -11.035 -5.891 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.498 -10.863 -7.198 1.00 0.00 H new ATOM 317 N THR A 23 4.929 -9.345 -3.710 1.00 0.00 N ATOM 318 CA THR A 23 5.465 -9.958 -2.507 1.00 0.00 C ATOM 319 C THR A 23 4.454 -10.941 -1.913 1.00 0.00 C ATOM 320 O THR A 23 3.281 -10.607 -1.753 1.00 0.00 O ATOM 321 CB THR A 23 5.864 -8.840 -1.543 1.00 0.00 C ATOM 322 OG1 THR A 23 6.895 -9.418 -0.747 1.00 0.00 O ATOM 323 CG2 THR A 23 4.758 -8.510 -0.539 1.00 0.00 C ATOM 0 H THR A 23 3.951 -9.062 -3.645 1.00 0.00 H new ATOM 0 HA THR A 23 6.354 -10.549 -2.727 1.00 0.00 H new ATOM 0 HB THR A 23 6.117 -7.945 -2.111 1.00 0.00 H new ATOM 0 HG1 THR A 23 7.213 -8.759 -0.095 1.00 0.00 H new ATOM 0 HG21 THR A 23 5.093 -7.710 0.122 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.865 -8.188 -1.074 1.00 0.00 H new ATOM 0 HG23 THR A 23 4.527 -9.396 0.052 1.00 0.00 H new ATOM 331 N GLU A 24 4.946 -12.131 -1.603 1.00 0.00 N ATOM 332 CA GLU A 24 4.099 -13.164 -1.030 1.00 0.00 C ATOM 333 C GLU A 24 4.090 -13.057 0.497 1.00 0.00 C ATOM 334 O GLU A 24 4.972 -13.594 1.165 1.00 0.00 O ATOM 335 CB GLU A 24 4.551 -14.555 -1.479 1.00 0.00 C ATOM 336 CG GLU A 24 3.937 -15.643 -0.595 1.00 0.00 C ATOM 337 CD GLU A 24 4.291 -17.037 -1.117 1.00 0.00 C ATOM 338 OE1 GLU A 24 5.491 -17.252 -1.392 1.00 0.00 O ATOM 339 OE2 GLU A 24 3.353 -17.856 -1.229 1.00 0.00 O ATOM 0 H GLU A 24 5.920 -12.403 -1.737 1.00 0.00 H new ATOM 0 HA GLU A 24 3.082 -13.014 -1.391 1.00 0.00 H new ATOM 0 HB2 GLU A 24 4.261 -14.718 -2.517 1.00 0.00 H new ATOM 0 HB3 GLU A 24 5.638 -14.619 -1.438 1.00 0.00 H new ATOM 0 HG2 GLU A 24 4.297 -15.532 0.428 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.854 -15.525 -0.567 1.00 0.00 H new ATOM 346 N THR A 25 3.084 -12.361 1.004 1.00 0.00 N ATOM 347 CA THR A 25 2.949 -12.176 2.439 1.00 0.00 C ATOM 348 C THR A 25 1.503 -12.420 2.873 1.00 0.00 C ATOM 349 O THR A 25 0.605 -11.658 2.515 1.00 0.00 O ATOM 350 CB THR A 25 3.460 -10.777 2.786 1.00 0.00 C ATOM 351 OG1 THR A 25 2.838 -9.931 1.822 1.00 0.00 O ATOM 352 CG2 THR A 25 4.957 -10.615 2.512 1.00 0.00 C ATOM 0 H THR A 25 2.354 -11.918 0.447 1.00 0.00 H new ATOM 0 HA THR A 25 3.548 -12.901 2.990 1.00 0.00 H new ATOM 0 HB THR A 25 3.258 -10.568 3.837 1.00 0.00 H new ATOM 0 HG1 THR A 25 1.943 -10.273 1.615 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.268 -9.604 2.776 1.00 0.00 H new ATOM 0 HG22 THR A 25 5.516 -11.334 3.110 1.00 0.00 H new ATOM 0 HG23 THR A 25 5.155 -10.791 1.455 1.00 0.00 H new ATOM 360 N PRO A 26 1.316 -13.514 3.661 1.00 0.00 N ATOM 361 CA PRO A 26 -0.006 -13.867 4.149 1.00 0.00 C ATOM 362 C PRO A 26 -0.441 -12.935 5.282 1.00 0.00 C ATOM 363 O PRO A 26 -1.093 -11.920 5.039 1.00 0.00 O ATOM 364 CB PRO A 26 0.112 -15.318 4.586 1.00 0.00 C ATOM 365 CG PRO A 26 1.598 -15.582 4.761 1.00 0.00 C ATOM 366 CD PRO A 26 2.354 -14.438 4.106 1.00 0.00 C ATOM 0 HA PRO A 26 -0.779 -13.754 3.389 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.427 -15.490 5.517 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -0.318 -15.987 3.840 1.00 0.00 H new ATOM 0 HG2 PRO A 26 1.852 -15.651 5.819 1.00 0.00 H new ATOM 0 HG3 PRO A 26 1.873 -16.533 4.304 1.00 0.00 H new ATOM 0 HD2 PRO A 26 3.035 -13.959 4.810 1.00 0.00 H new ATOM 0 HD3 PRO A 26 2.956 -14.790 3.269 1.00 0.00 H new ATOM 374 N MET A 27 -0.061 -13.312 6.493 1.00 0.00 N ATOM 375 CA MET A 27 -0.402 -12.522 7.665 1.00 0.00 C ATOM 376 C MET A 27 0.442 -11.247 7.731 1.00 0.00 C ATOM 377 O MET A 27 0.010 -10.242 8.293 1.00 0.00 O ATOM 378 CB MET A 27 -0.171 -13.354 8.927 1.00 0.00 C ATOM 379 CG MET A 27 -1.095 -14.573 8.957 1.00 0.00 C ATOM 380 SD MET A 27 -2.236 -14.442 10.323 1.00 0.00 S ATOM 381 CE MET A 27 -3.785 -14.460 9.436 1.00 0.00 C ATOM 0 H MET A 27 0.480 -14.154 6.689 1.00 0.00 H new ATOM 0 HA MET A 27 -1.452 -12.237 7.595 1.00 0.00 H new ATOM 0 HB2 MET A 27 0.868 -13.680 8.967 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.346 -12.739 9.810 1.00 0.00 H new ATOM 0 HG2 MET A 27 -1.645 -14.646 8.019 1.00 0.00 H new ATOM 0 HG3 MET A 27 -0.505 -15.485 9.052 1.00 0.00 H new ATOM 0 HE1 MET A 27 -4.611 -14.385 10.144 1.00 0.00 H new ATOM 0 HE2 MET A 27 -3.820 -13.616 8.747 1.00 0.00 H new ATOM 0 HE3 MET A 27 -3.872 -15.390 8.874 1.00 0.00 H new ATOM 391 N THR A 28 1.629 -11.331 7.149 1.00 0.00 N ATOM 392 CA THR A 28 2.537 -10.196 7.136 1.00 0.00 C ATOM 393 C THR A 28 1.825 -8.949 6.606 1.00 0.00 C ATOM 394 O THR A 28 2.217 -7.826 6.920 1.00 0.00 O ATOM 395 CB THR A 28 3.769 -10.586 6.318 1.00 0.00 C ATOM 396 OG1 THR A 28 3.415 -11.836 5.732 1.00 0.00 O ATOM 397 CG2 THR A 28 4.976 -10.917 7.199 1.00 0.00 C ATOM 0 H THR A 28 1.983 -12.166 6.683 1.00 0.00 H new ATOM 0 HA THR A 28 2.865 -9.941 8.143 1.00 0.00 H new ATOM 0 HB THR A 28 4.026 -9.773 5.640 1.00 0.00 H new ATOM 0 HG1 THR A 28 3.820 -12.565 6.247 1.00 0.00 H new ATOM 0 HG21 THR A 28 5.823 -11.187 6.569 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.235 -10.047 7.802 1.00 0.00 H new ATOM 0 HG23 THR A 28 4.730 -11.753 7.854 1.00 0.00 H new ATOM 405 N LEU A 29 0.793 -9.190 5.811 1.00 0.00 N ATOM 406 CA LEU A 29 0.022 -8.101 5.235 1.00 0.00 C ATOM 407 C LEU A 29 -0.585 -7.260 6.360 1.00 0.00 C ATOM 408 O LEU A 29 -0.644 -6.036 6.261 1.00 0.00 O ATOM 409 CB LEU A 29 -1.010 -8.641 4.243 1.00 0.00 C ATOM 410 CG LEU A 29 -0.473 -9.048 2.870 1.00 0.00 C ATOM 411 CD1 LEU A 29 -1.399 -10.063 2.197 1.00 0.00 C ATOM 412 CD2 LEU A 29 -0.232 -7.819 1.990 1.00 0.00 C ATOM 0 H LEU A 29 0.473 -10.123 5.552 1.00 0.00 H new ATOM 0 HA LEU A 29 0.668 -7.440 4.657 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.497 -9.507 4.692 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.779 -7.882 4.100 1.00 0.00 H new ATOM 0 HG LEU A 29 0.491 -9.537 3.011 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.994 -10.335 1.223 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.476 -10.954 2.820 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.388 -9.624 2.069 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.150 -8.136 1.019 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.170 -7.280 1.853 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.496 -7.165 2.470 1.00 0.00 H new ATOM 424 N LEU A 30 -1.022 -7.951 7.401 1.00 0.00 N ATOM 425 CA LEU A 30 -1.624 -7.284 8.542 1.00 0.00 C ATOM 426 C LEU A 30 -0.520 -6.716 9.436 1.00 0.00 C ATOM 427 O LEU A 30 -0.751 -5.773 10.191 1.00 0.00 O ATOM 428 CB LEU A 30 -2.580 -8.229 9.273 1.00 0.00 C ATOM 429 CG LEU A 30 -3.451 -9.121 8.385 1.00 0.00 C ATOM 430 CD1 LEU A 30 -4.511 -9.851 9.212 1.00 0.00 C ATOM 431 CD2 LEU A 30 -4.072 -8.316 7.240 1.00 0.00 C ATOM 0 H LEU A 30 -0.971 -8.967 7.479 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.234 -6.443 8.212 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.993 -8.869 9.932 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.235 -7.632 9.908 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.813 -9.882 7.935 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -5.116 -10.478 8.557 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -4.023 -10.474 9.961 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -5.151 -9.122 9.709 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.686 -8.973 6.624 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.692 -7.519 7.650 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.280 -7.882 6.629 1.00 0.00 H new ATOM 443 N VAL A 31 0.656 -7.315 9.322 1.00 0.00 N ATOM 444 CA VAL A 31 1.797 -6.881 10.109 1.00 0.00 C ATOM 445 C VAL A 31 2.163 -5.446 9.722 1.00 0.00 C ATOM 446 O VAL A 31 2.187 -5.106 8.540 1.00 0.00 O ATOM 447 CB VAL A 31 2.959 -7.862 9.934 1.00 0.00 C ATOM 448 CG1 VAL A 31 4.217 -7.354 10.641 1.00 0.00 C ATOM 449 CG2 VAL A 31 2.576 -9.258 10.431 1.00 0.00 C ATOM 0 H VAL A 31 0.843 -8.098 8.696 1.00 0.00 H new ATOM 0 HA VAL A 31 1.549 -6.878 11.170 1.00 0.00 H new ATOM 0 HB VAL A 31 3.180 -7.934 8.869 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.027 -8.070 10.501 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.507 -6.391 10.221 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.015 -7.239 11.706 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.418 -9.936 10.296 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.316 -9.209 11.488 1.00 0.00 H new ATOM 0 HG23 VAL A 31 1.721 -9.624 9.863 1.00 0.00 H new ATOM 459 N PRO A 32 2.448 -4.623 10.766 1.00 0.00 N ATOM 460 CA PRO A 32 2.811 -3.234 10.547 1.00 0.00 C ATOM 461 C PRO A 32 4.243 -3.118 10.022 1.00 0.00 C ATOM 462 O PRO A 32 4.509 -2.351 9.098 1.00 0.00 O ATOM 463 CB PRO A 32 2.616 -2.558 11.895 1.00 0.00 C ATOM 464 CG PRO A 32 2.599 -3.678 12.923 1.00 0.00 C ATOM 465 CD PRO A 32 2.429 -4.993 12.178 1.00 0.00 C ATOM 0 HA PRO A 32 2.198 -2.755 9.784 1.00 0.00 H new ATOM 0 HB2 PRO A 32 3.422 -1.853 12.099 1.00 0.00 H new ATOM 0 HB3 PRO A 32 1.684 -1.993 11.918 1.00 0.00 H new ATOM 0 HG2 PRO A 32 3.525 -3.682 13.498 1.00 0.00 H new ATOM 0 HG3 PRO A 32 1.784 -3.533 13.632 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.233 -5.690 12.416 1.00 0.00 H new ATOM 0 HD3 PRO A 32 1.493 -5.482 12.447 1.00 0.00 H new ATOM 473 N GLU A 33 5.128 -3.892 10.633 1.00 0.00 N ATOM 474 CA GLU A 33 6.527 -3.886 10.239 1.00 0.00 C ATOM 475 C GLU A 33 6.664 -4.273 8.766 1.00 0.00 C ATOM 476 O GLU A 33 7.525 -3.750 8.060 1.00 0.00 O ATOM 477 CB GLU A 33 7.351 -4.817 11.131 1.00 0.00 C ATOM 478 CG GLU A 33 6.898 -4.724 12.589 1.00 0.00 C ATOM 479 CD GLU A 33 8.016 -5.158 13.539 1.00 0.00 C ATOM 480 OE1 GLU A 33 9.191 -4.989 13.147 1.00 0.00 O ATOM 481 OE2 GLU A 33 7.671 -5.649 14.635 1.00 0.00 O ATOM 0 H GLU A 33 4.903 -4.528 11.398 1.00 0.00 H new ATOM 0 HA GLU A 33 6.917 -2.876 10.366 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.251 -5.844 10.781 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.407 -4.556 11.057 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.600 -3.701 12.816 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.021 -5.353 12.742 1.00 0.00 H new ATOM 488 N VAL A 34 5.803 -5.187 8.344 1.00 0.00 N ATOM 489 CA VAL A 34 5.818 -5.651 6.967 1.00 0.00 C ATOM 490 C VAL A 34 5.054 -4.656 6.090 1.00 0.00 C ATOM 491 O VAL A 34 5.514 -4.299 5.006 1.00 0.00 O ATOM 492 CB VAL A 34 5.255 -7.072 6.887 1.00 0.00 C ATOM 493 CG1 VAL A 34 4.876 -7.432 5.449 1.00 0.00 C ATOM 494 CG2 VAL A 34 6.245 -8.086 7.463 1.00 0.00 C ATOM 0 H VAL A 34 5.090 -5.619 8.932 1.00 0.00 H new ATOM 0 HA VAL A 34 6.840 -5.699 6.591 1.00 0.00 H new ATOM 0 HB VAL A 34 4.348 -7.108 7.491 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.479 -8.447 5.421 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.119 -6.736 5.087 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.759 -7.370 4.814 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.821 -9.088 7.394 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.176 -8.047 6.898 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.444 -7.847 8.508 1.00 0.00 H new ATOM 504 N ALA A 35 3.903 -4.236 6.592 1.00 0.00 N ATOM 505 CA ALA A 35 3.072 -3.289 5.868 1.00 0.00 C ATOM 506 C ALA A 35 3.826 -1.965 5.721 1.00 0.00 C ATOM 507 O ALA A 35 3.857 -1.382 4.638 1.00 0.00 O ATOM 508 CB ALA A 35 1.737 -3.122 6.595 1.00 0.00 C ATOM 0 H ALA A 35 3.526 -4.534 7.492 1.00 0.00 H new ATOM 0 HA ALA A 35 2.853 -3.657 4.866 1.00 0.00 H new ATOM 0 HB1 ALA A 35 1.113 -2.412 6.052 1.00 0.00 H new ATOM 0 HB2 ALA A 35 1.229 -4.085 6.648 1.00 0.00 H new ATOM 0 HB3 ALA A 35 1.916 -2.750 7.604 1.00 0.00 H new ATOM 514 N ALA A 36 4.413 -1.530 6.825 1.00 0.00 N ATOM 515 CA ALA A 36 5.163 -0.285 6.833 1.00 0.00 C ATOM 516 C ALA A 36 6.308 -0.378 5.821 1.00 0.00 C ATOM 517 O ALA A 36 6.485 0.515 4.996 1.00 0.00 O ATOM 518 CB ALA A 36 5.662 0.003 8.251 1.00 0.00 C ATOM 0 H ALA A 36 4.385 -2.017 7.721 1.00 0.00 H new ATOM 0 HA ALA A 36 4.526 0.548 6.536 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.224 0.937 8.256 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.810 0.088 8.926 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.307 -0.811 8.582 1.00 0.00 H new ATOM 524 N GLU A 37 7.054 -1.469 5.919 1.00 0.00 N ATOM 525 CA GLU A 37 8.176 -1.691 5.023 1.00 0.00 C ATOM 526 C GLU A 37 7.688 -1.785 3.576 1.00 0.00 C ATOM 527 O GLU A 37 8.380 -1.351 2.655 1.00 0.00 O ATOM 528 CB GLU A 37 8.956 -2.946 5.420 1.00 0.00 C ATOM 529 CG GLU A 37 9.965 -2.635 6.527 1.00 0.00 C ATOM 530 CD GLU A 37 11.299 -2.171 5.938 1.00 0.00 C ATOM 531 OE1 GLU A 37 11.907 -2.978 5.202 1.00 0.00 O ATOM 532 OE2 GLU A 37 11.681 -1.018 6.235 1.00 0.00 O ATOM 0 H GLU A 37 6.903 -2.208 6.605 1.00 0.00 H new ATOM 0 HA GLU A 37 8.854 -0.841 5.104 1.00 0.00 H new ATOM 0 HB2 GLU A 37 8.264 -3.717 5.759 1.00 0.00 H new ATOM 0 HB3 GLU A 37 9.477 -3.346 4.550 1.00 0.00 H new ATOM 0 HG2 GLU A 37 9.564 -1.862 7.183 1.00 0.00 H new ATOM 0 HG3 GLU A 37 10.123 -3.522 7.140 1.00 0.00 H new ATOM 539 N VAL A 38 6.502 -2.353 3.420 1.00 0.00 N ATOM 540 CA VAL A 38 5.914 -2.509 2.100 1.00 0.00 C ATOM 541 C VAL A 38 5.527 -1.134 1.554 1.00 0.00 C ATOM 542 O VAL A 38 5.840 -0.805 0.411 1.00 0.00 O ATOM 543 CB VAL A 38 4.734 -3.481 2.164 1.00 0.00 C ATOM 544 CG1 VAL A 38 3.601 -3.029 1.241 1.00 0.00 C ATOM 545 CG2 VAL A 38 5.179 -4.906 1.830 1.00 0.00 C ATOM 0 H VAL A 38 5.932 -2.711 4.186 1.00 0.00 H new ATOM 0 HA VAL A 38 6.637 -2.942 1.408 1.00 0.00 H new ATOM 0 HB VAL A 38 4.354 -3.480 3.186 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.775 -3.737 1.305 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.256 -2.041 1.545 1.00 0.00 H new ATOM 0 HG13 VAL A 38 3.963 -2.987 0.214 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.321 -5.577 1.883 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.597 -4.930 0.824 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.936 -5.228 2.545 1.00 0.00 H new ATOM 555 N ILE A 39 4.850 -0.367 2.396 1.00 0.00 N ATOM 556 CA ILE A 39 4.415 0.966 2.012 1.00 0.00 C ATOM 557 C ILE A 39 5.641 1.857 1.804 1.00 0.00 C ATOM 558 O ILE A 39 5.721 2.592 0.822 1.00 0.00 O ATOM 559 CB ILE A 39 3.419 1.519 3.032 1.00 0.00 C ATOM 560 CG1 ILE A 39 2.114 0.720 3.013 1.00 0.00 C ATOM 561 CG2 ILE A 39 3.177 3.013 2.807 1.00 0.00 C ATOM 562 CD1 ILE A 39 1.270 1.075 1.788 1.00 0.00 C ATOM 0 H ILE A 39 4.592 -0.643 3.343 1.00 0.00 H new ATOM 0 HA ILE A 39 3.879 0.934 1.063 1.00 0.00 H new ATOM 0 HB ILE A 39 3.852 1.408 4.026 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.337 -0.347 3.008 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.546 0.923 3.921 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.465 3.382 3.545 1.00 0.00 H new ATOM 0 HG22 ILE A 39 4.118 3.553 2.909 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.775 3.170 1.806 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.349 0.493 1.800 1.00 0.00 H new ATOM 0 HD12 ILE A 39 1.028 2.138 1.808 1.00 0.00 H new ATOM 0 HD13 ILE A 39 1.831 0.848 0.881 1.00 0.00 H new ATOM 574 N LYS A 40 6.569 1.762 2.747 1.00 0.00 N ATOM 575 CA LYS A 40 7.787 2.551 2.680 1.00 0.00 C ATOM 576 C LYS A 40 8.634 2.074 1.499 1.00 0.00 C ATOM 577 O LYS A 40 9.163 2.886 0.742 1.00 0.00 O ATOM 578 CB LYS A 40 8.524 2.513 4.021 1.00 0.00 C ATOM 579 CG LYS A 40 10.039 2.559 3.814 1.00 0.00 C ATOM 580 CD LYS A 40 10.643 1.154 3.859 1.00 0.00 C ATOM 581 CE LYS A 40 12.089 1.162 3.360 1.00 0.00 C ATOM 582 NZ LYS A 40 12.940 1.981 4.252 1.00 0.00 N ATOM 0 H LYS A 40 6.501 1.151 3.561 1.00 0.00 H new ATOM 0 HA LYS A 40 7.552 3.600 2.501 1.00 0.00 H new ATOM 0 HB2 LYS A 40 8.211 3.357 4.636 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.255 1.606 4.563 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.264 3.025 2.855 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.496 3.180 4.585 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.609 0.772 4.879 1.00 0.00 H new ATOM 0 HD3 LYS A 40 10.047 0.478 3.246 1.00 0.00 H new ATOM 0 HE2 LYS A 40 12.471 0.142 3.318 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.128 1.559 2.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.934 1.894 3.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.647 2.977 4.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.837 1.648 5.232 1.00 0.00 H new ATOM 596 N ASP A 41 8.735 0.758 1.377 1.00 0.00 N ATOM 597 CA ASP A 41 9.508 0.164 0.300 1.00 0.00 C ATOM 598 C ASP A 41 8.948 0.634 -1.044 1.00 0.00 C ATOM 599 O ASP A 41 9.706 0.997 -1.943 1.00 0.00 O ATOM 600 CB ASP A 41 9.423 -1.364 0.339 1.00 0.00 C ATOM 601 CG ASP A 41 9.957 -2.073 -0.906 1.00 0.00 C ATOM 602 OD1 ASP A 41 9.308 -1.927 -1.965 1.00 0.00 O ATOM 603 OD2 ASP A 41 11.002 -2.746 -0.772 1.00 0.00 O ATOM 0 H ASP A 41 8.294 0.087 2.006 1.00 0.00 H new ATOM 0 HA ASP A 41 10.547 0.471 0.422 1.00 0.00 H new ATOM 0 HB2 ASP A 41 9.976 -1.722 1.208 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.382 -1.651 0.484 1.00 0.00 H new ATOM 608 N LEU A 42 7.628 0.614 -1.139 1.00 0.00 N ATOM 609 CA LEU A 42 6.958 1.034 -2.358 1.00 0.00 C ATOM 610 C LEU A 42 7.188 2.532 -2.571 1.00 0.00 C ATOM 611 O LEU A 42 7.602 2.953 -3.650 1.00 0.00 O ATOM 612 CB LEU A 42 5.481 0.638 -2.322 1.00 0.00 C ATOM 613 CG LEU A 42 5.146 -0.756 -2.858 1.00 0.00 C ATOM 614 CD1 LEU A 42 4.534 -1.631 -1.764 1.00 0.00 C ATOM 615 CD2 LEU A 42 4.246 -0.667 -4.092 1.00 0.00 C ATOM 0 H LEU A 42 7.003 0.313 -0.391 1.00 0.00 H new ATOM 0 HA LEU A 42 7.381 0.520 -3.221 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.133 0.702 -1.291 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.915 1.372 -2.896 1.00 0.00 H new ATOM 0 HG LEU A 42 6.074 -1.234 -3.171 1.00 0.00 H new ATOM 0 HD11 LEU A 42 4.305 -2.616 -2.171 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.242 -1.734 -0.942 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.618 -1.168 -1.398 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.023 -1.671 -4.453 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.317 -0.161 -3.829 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.756 -0.105 -4.875 1.00 0.00 H new ATOM 627 N VAL A 43 6.910 3.295 -1.525 1.00 0.00 N ATOM 628 CA VAL A 43 7.082 4.737 -1.584 1.00 0.00 C ATOM 629 C VAL A 43 8.544 5.059 -1.903 1.00 0.00 C ATOM 630 O VAL A 43 8.825 5.904 -2.752 1.00 0.00 O ATOM 631 CB VAL A 43 6.600 5.375 -0.279 1.00 0.00 C ATOM 632 CG1 VAL A 43 7.473 6.574 0.100 1.00 0.00 C ATOM 633 CG2 VAL A 43 5.128 5.777 -0.378 1.00 0.00 C ATOM 0 H VAL A 43 6.567 2.942 -0.632 1.00 0.00 H new ATOM 0 HA VAL A 43 6.474 5.162 -2.382 1.00 0.00 H new ATOM 0 HB VAL A 43 6.692 4.631 0.513 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.109 7.009 1.031 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.504 6.246 0.231 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.428 7.322 -0.692 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.810 6.228 0.562 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.001 6.497 -1.187 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.522 4.894 -0.580 1.00 0.00 H new ATOM 643 N ASN A 44 9.434 4.370 -1.206 1.00 0.00 N ATOM 644 CA ASN A 44 10.860 4.572 -1.404 1.00 0.00 C ATOM 645 C ASN A 44 11.199 4.360 -2.881 1.00 0.00 C ATOM 646 O ASN A 44 12.044 5.062 -3.434 1.00 0.00 O ATOM 647 CB ASN A 44 11.677 3.574 -0.583 1.00 0.00 C ATOM 648 CG ASN A 44 12.243 4.234 0.677 1.00 0.00 C ATOM 649 OD1 ASN A 44 13.442 4.295 0.891 1.00 0.00 O ATOM 650 ND2 ASN A 44 11.315 4.722 1.494 1.00 0.00 N ATOM 0 H ASN A 44 9.196 3.671 -0.503 1.00 0.00 H new ATOM 0 HA ASN A 44 11.105 5.585 -1.086 1.00 0.00 H new ATOM 0 HB2 ASN A 44 11.050 2.727 -0.304 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.493 3.180 -1.189 1.00 0.00 H new ATOM 0 HD21 ASN A 44 11.590 5.182 2.362 1.00 0.00 H new ATOM 0 HD22 ASN A 44 10.328 4.637 1.253 1.00 0.00 H new ATOM 657 N THR A 45 10.523 3.389 -3.478 1.00 0.00 N ATOM 658 CA THR A 45 10.743 3.076 -4.879 1.00 0.00 C ATOM 659 C THR A 45 10.118 4.151 -5.771 1.00 0.00 C ATOM 660 O THR A 45 10.712 4.557 -6.768 1.00 0.00 O ATOM 661 CB THR A 45 10.193 1.672 -5.142 1.00 0.00 C ATOM 662 OG1 THR A 45 11.001 0.825 -4.331 1.00 0.00 O ATOM 663 CG2 THR A 45 10.465 1.194 -6.569 1.00 0.00 C ATOM 0 H THR A 45 9.823 2.809 -3.016 1.00 0.00 H new ATOM 0 HA THR A 45 11.806 3.075 -5.122 1.00 0.00 H new ATOM 0 HB THR A 45 9.119 1.662 -4.956 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.602 0.748 -3.439 1.00 0.00 H new ATOM 0 HG21 THR A 45 10.054 0.193 -6.702 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.995 1.876 -7.277 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.540 1.171 -6.746 1.00 0.00 H new ATOM 925 N LYS B 203 -2.037 18.105 -7.391 1.00 0.00 N ATOM 926 CA LYS B 203 -2.442 17.693 -6.058 1.00 0.00 C ATOM 927 C LYS B 203 -1.539 16.553 -5.584 1.00 0.00 C ATOM 928 O LYS B 203 -0.977 15.821 -6.398 1.00 0.00 O ATOM 929 CB LYS B 203 -3.933 17.346 -6.035 1.00 0.00 C ATOM 930 CG LYS B 203 -4.567 17.739 -4.699 1.00 0.00 C ATOM 931 CD LYS B 203 -6.084 17.884 -4.833 1.00 0.00 C ATOM 932 CE LYS B 203 -6.471 19.331 -5.143 1.00 0.00 C ATOM 933 NZ LYS B 203 -7.788 19.384 -5.815 1.00 0.00 N ATOM 0 HA LYS B 203 -2.317 18.514 -5.352 1.00 0.00 H new ATOM 0 HB2 LYS B 203 -4.443 17.862 -6.849 1.00 0.00 H new ATOM 0 HB3 LYS B 203 -4.064 16.277 -6.203 1.00 0.00 H new ATOM 0 HG2 LYS B 203 -4.335 16.985 -3.947 1.00 0.00 H new ATOM 0 HG3 LYS B 203 -4.138 18.679 -4.351 1.00 0.00 H new ATOM 0 HD2 LYS B 203 -6.447 17.229 -5.625 1.00 0.00 H new ATOM 0 HD3 LYS B 203 -6.566 17.565 -3.909 1.00 0.00 H new ATOM 0 HE2 LYS B 203 -6.504 19.910 -4.220 1.00 0.00 H new ATOM 0 HE3 LYS B 203 -5.713 19.788 -5.779 1.00 0.00 H new ATOM 0 HZ1 LYS B 203 -8.035 20.374 -6.018 1.00 0.00 H new ATOM 0 HZ2 LYS B 203 -7.745 18.848 -6.705 1.00 0.00 H new ATOM 0 HZ3 LYS B 203 -8.511 18.967 -5.195 1.00 0.00 H new ATOM 947 N ALA B 204 -1.426 16.437 -4.269 1.00 0.00 N ATOM 948 CA ALA B 204 -0.600 15.399 -3.677 1.00 0.00 C ATOM 949 C ALA B 204 -1.495 14.262 -3.180 1.00 0.00 C ATOM 950 O ALA B 204 -2.195 14.411 -2.180 1.00 0.00 O ATOM 951 CB ALA B 204 0.253 16.000 -2.559 1.00 0.00 C ATOM 0 H ALA B 204 -1.893 17.045 -3.597 1.00 0.00 H new ATOM 0 HA ALA B 204 0.081 14.982 -4.419 1.00 0.00 H new ATOM 0 HB1 ALA B 204 0.873 15.221 -2.115 1.00 0.00 H new ATOM 0 HB2 ALA B 204 0.892 16.782 -2.969 1.00 0.00 H new ATOM 0 HB3 ALA B 204 -0.397 16.426 -1.795 1.00 0.00 H new ATOM 957 N THR B 205 -1.444 13.152 -3.902 1.00 0.00 N ATOM 958 CA THR B 205 -2.241 11.991 -3.547 1.00 0.00 C ATOM 959 C THR B 205 -1.504 10.703 -3.920 1.00 0.00 C ATOM 960 O THR B 205 -0.590 10.722 -4.744 1.00 0.00 O ATOM 961 CB THR B 205 -3.605 12.127 -4.227 1.00 0.00 C ATOM 962 OG1 THR B 205 -3.288 12.453 -5.578 1.00 0.00 O ATOM 963 CG2 THR B 205 -4.389 13.342 -3.725 1.00 0.00 C ATOM 0 H THR B 205 -0.863 13.033 -4.732 1.00 0.00 H new ATOM 0 HA THR B 205 -2.402 11.937 -2.470 1.00 0.00 H new ATOM 0 HB THR B 205 -4.188 11.222 -4.057 1.00 0.00 H new ATOM 0 HG1 THR B 205 -4.116 12.558 -6.092 1.00 0.00 H new ATOM 0 HG21 THR B 205 -5.349 13.393 -4.239 1.00 0.00 H new ATOM 0 HG22 THR B 205 -4.556 13.249 -2.652 1.00 0.00 H new ATOM 0 HG23 THR B 205 -3.821 14.250 -3.926 1.00 0.00 H new ATOM 971 N TYR B 206 -1.927 9.614 -3.294 1.00 0.00 N ATOM 972 CA TYR B 206 -1.318 8.320 -3.550 1.00 0.00 C ATOM 973 C TYR B 206 -2.381 7.225 -3.657 1.00 0.00 C ATOM 974 O TYR B 206 -3.367 7.238 -2.922 1.00 0.00 O ATOM 975 CB TYR B 206 -0.424 8.028 -2.343 1.00 0.00 C ATOM 976 CG TYR B 206 1.030 8.471 -2.523 1.00 0.00 C ATOM 977 CD1 TYR B 206 1.899 7.698 -3.268 1.00 0.00 C ATOM 978 CD2 TYR B 206 1.473 9.642 -1.943 1.00 0.00 C ATOM 979 CE1 TYR B 206 3.266 8.114 -3.438 1.00 0.00 C ATOM 980 CE2 TYR B 206 2.841 10.056 -2.113 1.00 0.00 C ATOM 981 CZ TYR B 206 3.670 9.272 -2.852 1.00 0.00 C ATOM 982 OH TYR B 206 4.962 9.665 -3.014 1.00 0.00 O ATOM 0 H TYR B 206 -2.684 9.602 -2.610 1.00 0.00 H new ATOM 0 HA TYR B 206 -0.763 8.337 -4.488 1.00 0.00 H new ATOM 0 HB2 TYR B 206 -0.839 8.527 -1.467 1.00 0.00 H new ATOM 0 HB3 TYR B 206 -0.444 6.957 -2.139 1.00 0.00 H new ATOM 0 HD1 TYR B 206 1.553 6.782 -3.723 1.00 0.00 H new ATOM 0 HD2 TYR B 206 0.794 10.248 -1.362 1.00 0.00 H new ATOM 0 HE1 TYR B 206 3.956 7.519 -4.018 1.00 0.00 H new ATOM 0 HE2 TYR B 206 3.201 10.970 -1.663 1.00 0.00 H new ATOM 0 HH TYR B 206 5.108 10.511 -2.541 1.00 0.00 H new ATOM 992 N THR B 207 -2.144 6.303 -4.579 1.00 0.00 N ATOM 993 CA THR B 207 -3.069 5.203 -4.793 1.00 0.00 C ATOM 994 C THR B 207 -2.382 3.865 -4.512 1.00 0.00 C ATOM 995 O THR B 207 -1.521 3.434 -5.277 1.00 0.00 O ATOM 996 CB THR B 207 -3.619 5.318 -6.215 1.00 0.00 C ATOM 997 OG1 THR B 207 -4.286 6.577 -6.230 1.00 0.00 O ATOM 998 CG2 THR B 207 -4.730 4.304 -6.497 1.00 0.00 C ATOM 0 H THR B 207 -1.325 6.295 -5.186 1.00 0.00 H new ATOM 0 HA THR B 207 -3.909 5.252 -4.100 1.00 0.00 H new ATOM 0 HB THR B 207 -2.808 5.176 -6.930 1.00 0.00 H new ATOM 0 HG1 THR B 207 -4.671 6.733 -7.118 1.00 0.00 H new ATOM 0 HG21 THR B 207 -5.085 4.429 -7.520 1.00 0.00 H new ATOM 0 HG22 THR B 207 -4.342 3.294 -6.368 1.00 0.00 H new ATOM 0 HG23 THR B 207 -5.555 4.467 -5.804 1.00 0.00 H new ATOM 1006 N VAL B 208 -2.788 3.247 -3.413 1.00 0.00 N ATOM 1007 CA VAL B 208 -2.221 1.967 -3.023 1.00 0.00 C ATOM 1008 C VAL B 208 -3.181 0.846 -3.424 1.00 0.00 C ATOM 1009 O VAL B 208 -4.337 0.833 -3.004 1.00 0.00 O ATOM 1010 CB VAL B 208 -1.900 1.972 -1.527 1.00 0.00 C ATOM 1011 CG1 VAL B 208 -1.567 0.563 -1.033 1.00 0.00 C ATOM 1012 CG2 VAL B 208 -0.761 2.946 -1.214 1.00 0.00 C ATOM 0 H VAL B 208 -3.502 3.608 -2.781 1.00 0.00 H new ATOM 0 HA VAL B 208 -1.280 1.791 -3.544 1.00 0.00 H new ATOM 0 HB VAL B 208 -2.788 2.312 -0.995 1.00 0.00 H new ATOM 0 HG11 VAL B 208 -1.343 0.595 0.033 1.00 0.00 H new ATOM 0 HG12 VAL B 208 -2.420 -0.094 -1.205 1.00 0.00 H new ATOM 0 HG13 VAL B 208 -0.701 0.183 -1.575 1.00 0.00 H new ATOM 0 HG21 VAL B 208 -0.553 2.930 -0.144 1.00 0.00 H new ATOM 0 HG22 VAL B 208 0.133 2.649 -1.762 1.00 0.00 H new ATOM 0 HG23 VAL B 208 -1.051 3.953 -1.512 1.00 0.00 H new ATOM 1022 N THR B 209 -2.666 -0.070 -4.233 1.00 0.00 N ATOM 1023 CA THR B 209 -3.464 -1.192 -4.695 1.00 0.00 C ATOM 1024 C THR B 209 -2.985 -2.491 -4.043 1.00 0.00 C ATOM 1025 O THR B 209 -1.801 -2.642 -3.747 1.00 0.00 O ATOM 1026 CB THR B 209 -3.398 -1.221 -6.223 1.00 0.00 C ATOM 1027 OG1 THR B 209 -3.399 0.154 -6.597 1.00 0.00 O ATOM 1028 CG2 THR B 209 -4.675 -1.779 -6.855 1.00 0.00 C ATOM 0 H THR B 209 -1.707 -0.057 -4.579 1.00 0.00 H new ATOM 0 HA THR B 209 -4.508 -1.082 -4.401 1.00 0.00 H new ATOM 0 HB THR B 209 -2.545 -1.822 -6.537 1.00 0.00 H new ATOM 0 HG1 THR B 209 -3.356 0.227 -7.573 1.00 0.00 H new ATOM 0 HG21 THR B 209 -4.575 -1.777 -7.940 1.00 0.00 H new ATOM 0 HG22 THR B 209 -4.837 -2.799 -6.507 1.00 0.00 H new ATOM 0 HG23 THR B 209 -5.524 -1.159 -6.568 1.00 0.00 H new ATOM 1036 N VAL B 210 -3.931 -3.396 -3.836 1.00 0.00 N ATOM 1037 CA VAL B 210 -3.622 -4.676 -3.224 1.00 0.00 C ATOM 1038 C VAL B 210 -4.408 -5.780 -3.934 1.00 0.00 C ATOM 1039 O VAL B 210 -5.637 -5.807 -3.875 1.00 0.00 O ATOM 1040 CB VAL B 210 -3.897 -4.618 -1.719 1.00 0.00 C ATOM 1041 CG1 VAL B 210 -4.265 -5.999 -1.176 1.00 0.00 C ATOM 1042 CG2 VAL B 210 -2.703 -4.030 -0.966 1.00 0.00 C ATOM 0 H VAL B 210 -4.913 -3.267 -4.082 1.00 0.00 H new ATOM 0 HA VAL B 210 -2.563 -4.907 -3.338 1.00 0.00 H new ATOM 0 HB VAL B 210 -4.750 -3.958 -1.559 1.00 0.00 H new ATOM 0 HG11 VAL B 210 -4.455 -5.930 -0.105 1.00 0.00 H new ATOM 0 HG12 VAL B 210 -5.160 -6.362 -1.681 1.00 0.00 H new ATOM 0 HG13 VAL B 210 -3.442 -6.691 -1.354 1.00 0.00 H new ATOM 0 HG21 VAL B 210 -2.925 -4.000 0.101 1.00 0.00 H new ATOM 0 HG22 VAL B 210 -1.824 -4.651 -1.137 1.00 0.00 H new ATOM 0 HG23 VAL B 210 -2.509 -3.019 -1.325 1.00 0.00 H new ATOM 1052 N THR B 211 -3.668 -6.663 -4.587 1.00 0.00 N ATOM 1053 CA THR B 211 -4.282 -7.766 -5.307 1.00 0.00 C ATOM 1054 C THR B 211 -3.693 -9.099 -4.842 1.00 0.00 C ATOM 1055 O THR B 211 -2.474 -9.247 -4.753 1.00 0.00 O ATOM 1056 CB THR B 211 -4.101 -7.511 -6.805 1.00 0.00 C ATOM 1057 OG1 THR B 211 -4.881 -6.346 -7.055 1.00 0.00 O ATOM 1058 CG2 THR B 211 -4.758 -8.592 -7.667 1.00 0.00 C ATOM 0 H THR B 211 -2.649 -6.638 -4.633 1.00 0.00 H new ATOM 0 HA THR B 211 -5.350 -7.829 -5.100 1.00 0.00 H new ATOM 0 HB THR B 211 -3.038 -7.458 -7.038 1.00 0.00 H new ATOM 0 HG1 THR B 211 -4.411 -5.768 -7.692 1.00 0.00 H new ATOM 0 HG21 THR B 211 -4.600 -8.363 -8.721 1.00 0.00 H new ATOM 0 HG22 THR B 211 -4.315 -9.561 -7.436 1.00 0.00 H new ATOM 0 HG23 THR B 211 -5.828 -8.623 -7.459 1.00 0.00 H new ATOM 1066 N ASN B 212 -4.585 -10.038 -4.559 1.00 0.00 N ATOM 1067 CA ASN B 212 -4.168 -11.353 -4.106 1.00 0.00 C ATOM 1068 C ASN B 212 -4.159 -12.318 -5.293 1.00 0.00 C ATOM 1069 O ASN B 212 -5.214 -12.760 -5.747 1.00 0.00 O ATOM 1070 CB ASN B 212 -5.135 -11.906 -3.055 1.00 0.00 C ATOM 1071 CG ASN B 212 -5.734 -10.776 -2.214 1.00 0.00 C ATOM 1072 OD1 ASN B 212 -5.235 -9.664 -2.177 1.00 0.00 O ATOM 1073 ND2 ASN B 212 -6.828 -11.125 -1.543 1.00 0.00 N ATOM 0 H ASN B 212 -5.594 -9.913 -4.635 1.00 0.00 H new ATOM 0 HA ASN B 212 -3.174 -11.259 -3.669 1.00 0.00 H new ATOM 0 HB2 ASN B 212 -5.934 -12.461 -3.547 1.00 0.00 H new ATOM 0 HB3 ASN B 212 -4.611 -12.608 -2.407 1.00 0.00 H new ATOM 0 HD21 ASN B 212 -7.303 -10.443 -0.952 1.00 0.00 H new ATOM 0 HD22 ASN B 212 -7.192 -12.075 -1.620 1.00 0.00 H new ATOM 1080 N ASN B 213 -2.957 -12.615 -5.764 1.00 0.00 N ATOM 1081 CA ASN B 213 -2.796 -13.519 -6.891 1.00 0.00 C ATOM 1082 C ASN B 213 -3.318 -14.905 -6.505 1.00 0.00 C ATOM 1083 O ASN B 213 -3.497 -15.766 -7.365 1.00 0.00 O ATOM 1084 CB ASN B 213 -1.324 -13.660 -7.279 1.00 0.00 C ATOM 1085 CG ASN B 213 -1.067 -13.090 -8.676 1.00 0.00 C ATOM 1086 OD1 ASN B 213 -1.317 -13.724 -9.687 1.00 0.00 O ATOM 1087 ND2 ASN B 213 -0.558 -11.862 -8.673 1.00 0.00 N ATOM 0 H ASN B 213 -2.085 -12.246 -5.386 1.00 0.00 H new ATOM 0 HA ASN B 213 -3.353 -13.109 -7.734 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -0.701 -13.141 -6.551 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -1.037 -14.711 -7.253 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -0.352 -11.393 -9.555 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -0.373 -11.389 -7.789 1.00 0.00 H new ATOM 1094 N SER B 214 -3.549 -15.076 -5.212 1.00 0.00 N ATOM 1095 CA SER B 214 -4.048 -16.342 -4.702 1.00 0.00 C ATOM 1096 C SER B 214 -5.561 -16.430 -4.905 1.00 0.00 C ATOM 1097 O SER B 214 -6.095 -17.506 -5.169 1.00 0.00 O ATOM 1098 CB SER B 214 -3.699 -16.516 -3.222 1.00 0.00 C ATOM 1099 OG SER B 214 -3.340 -17.860 -2.912 1.00 0.00 O ATOM 0 H SER B 214 -3.400 -14.359 -4.502 1.00 0.00 H new ATOM 0 HA SER B 214 -3.567 -17.147 -5.258 1.00 0.00 H new ATOM 0 HB2 SER B 214 -2.874 -15.852 -2.964 1.00 0.00 H new ATOM 0 HB3 SER B 214 -4.551 -16.218 -2.611 1.00 0.00 H new ATOM 0 HG SER B 214 -2.824 -18.240 -3.653 1.00 0.00 H new ATOM 1105 N ASN B 215 -6.210 -15.282 -4.773 1.00 0.00 N ATOM 1106 CA ASN B 215 -7.653 -15.215 -4.938 1.00 0.00 C ATOM 1107 C ASN B 215 -7.980 -14.441 -6.217 1.00 0.00 C ATOM 1108 O ASN B 215 -9.147 -14.273 -6.563 1.00 0.00 O ATOM 1109 CB ASN B 215 -8.308 -14.486 -3.764 1.00 0.00 C ATOM 1110 CG ASN B 215 -9.501 -15.277 -3.224 1.00 0.00 C ATOM 1111 OD1 ASN B 215 -9.463 -16.488 -3.084 1.00 0.00 O ATOM 1112 ND2 ASN B 215 -10.559 -14.527 -2.930 1.00 0.00 N ATOM 0 H ASN B 215 -5.764 -14.391 -4.554 1.00 0.00 H new ATOM 0 HA ASN B 215 -8.035 -16.235 -4.987 1.00 0.00 H new ATOM 0 HB2 ASN B 215 -7.576 -14.337 -2.970 1.00 0.00 H new ATOM 0 HB3 ASN B 215 -8.637 -13.497 -4.083 1.00 0.00 H new ATOM 0 HD21 ASN B 215 -11.406 -14.961 -2.563 1.00 0.00 H new ATOM 0 HD22 ASN B 215 -10.524 -13.517 -3.071 1.00 0.00 H new ATOM 1119 N GLY B 216 -6.927 -13.991 -6.884 1.00 0.00 N ATOM 1120 CA GLY B 216 -7.087 -13.239 -8.117 1.00 0.00 C ATOM 1121 C GLY B 216 -7.934 -11.986 -7.889 1.00 0.00 C ATOM 1122 O GLY B 216 -8.410 -11.372 -8.842 1.00 0.00 O ATOM 0 H GLY B 216 -5.960 -14.133 -6.594 1.00 0.00 H new ATOM 0 HA2 GLY B 216 -6.108 -12.955 -8.504 1.00 0.00 H new ATOM 0 HA3 GLY B 216 -7.558 -13.868 -8.872 1.00 0.00 H new ATOM 1126 N VAL B 217 -8.095 -11.643 -6.619 1.00 0.00 N ATOM 1127 CA VAL B 217 -8.876 -10.473 -6.253 1.00 0.00 C ATOM 1128 C VAL B 217 -7.958 -9.252 -6.189 1.00 0.00 C ATOM 1129 O VAL B 217 -6.796 -9.364 -5.799 1.00 0.00 O ATOM 1130 CB VAL B 217 -9.621 -10.731 -4.942 1.00 0.00 C ATOM 1131 CG1 VAL B 217 -10.301 -9.456 -4.437 1.00 0.00 C ATOM 1132 CG2 VAL B 217 -10.634 -11.867 -5.099 1.00 0.00 C ATOM 0 H VAL B 217 -7.698 -12.155 -5.831 1.00 0.00 H new ATOM 0 HA VAL B 217 -9.635 -10.269 -7.008 1.00 0.00 H new ATOM 0 HB VAL B 217 -8.888 -11.038 -4.196 1.00 0.00 H new ATOM 0 HG11 VAL B 217 -10.823 -9.667 -3.504 1.00 0.00 H new ATOM 0 HG12 VAL B 217 -9.549 -8.686 -4.265 1.00 0.00 H new ATOM 0 HG13 VAL B 217 -11.016 -9.105 -5.182 1.00 0.00 H new ATOM 0 HG21 VAL B 217 -11.149 -12.029 -4.152 1.00 0.00 H new ATOM 0 HG22 VAL B 217 -11.361 -11.603 -5.867 1.00 0.00 H new ATOM 0 HG23 VAL B 217 -10.115 -12.780 -5.390 1.00 0.00 H new ATOM 1142 N SER B 218 -8.513 -8.113 -6.577 1.00 0.00 N ATOM 1143 CA SER B 218 -7.758 -6.872 -6.569 1.00 0.00 C ATOM 1144 C SER B 218 -8.513 -5.805 -5.774 1.00 0.00 C ATOM 1145 O SER B 218 -9.734 -5.875 -5.640 1.00 0.00 O ATOM 1146 CB SER B 218 -7.489 -6.381 -7.993 1.00 0.00 C ATOM 1147 OG SER B 218 -6.782 -5.144 -8.007 1.00 0.00 O ATOM 0 H SER B 218 -9.477 -8.024 -6.899 1.00 0.00 H new ATOM 0 HA SER B 218 -6.797 -7.060 -6.091 1.00 0.00 H new ATOM 0 HB2 SER B 218 -6.914 -7.133 -8.533 1.00 0.00 H new ATOM 0 HB3 SER B 218 -8.435 -6.264 -8.521 1.00 0.00 H new ATOM 0 HG SER B 218 -5.985 -5.216 -7.441 1.00 0.00 H new ATOM 1153 N VAL B 219 -7.757 -4.842 -5.268 1.00 0.00 N ATOM 1154 CA VAL B 219 -8.340 -3.763 -4.490 1.00 0.00 C ATOM 1155 C VAL B 219 -7.440 -2.529 -4.585 1.00 0.00 C ATOM 1156 O VAL B 219 -6.253 -2.595 -4.271 1.00 0.00 O ATOM 1157 CB VAL B 219 -8.573 -4.223 -3.049 1.00 0.00 C ATOM 1158 CG1 VAL B 219 -8.857 -3.031 -2.133 1.00 0.00 C ATOM 1159 CG2 VAL B 219 -9.704 -5.251 -2.979 1.00 0.00 C ATOM 0 H VAL B 219 -6.745 -4.787 -5.382 1.00 0.00 H new ATOM 0 HA VAL B 219 -9.315 -3.487 -4.890 1.00 0.00 H new ATOM 0 HB VAL B 219 -7.660 -4.705 -2.698 1.00 0.00 H new ATOM 0 HG11 VAL B 219 -9.019 -3.385 -1.115 1.00 0.00 H new ATOM 0 HG12 VAL B 219 -8.007 -2.349 -2.149 1.00 0.00 H new ATOM 0 HG13 VAL B 219 -9.748 -2.508 -2.481 1.00 0.00 H new ATOM 0 HG21 VAL B 219 -9.850 -5.562 -1.944 1.00 0.00 H new ATOM 0 HG22 VAL B 219 -10.624 -4.806 -3.357 1.00 0.00 H new ATOM 0 HG23 VAL B 219 -9.445 -6.119 -3.586 1.00 0.00 H new ATOM 1169 N ASP B 220 -8.041 -1.430 -5.019 1.00 0.00 N ATOM 1170 CA ASP B 220 -7.309 -0.183 -5.160 1.00 0.00 C ATOM 1171 C ASP B 220 -7.844 0.834 -4.149 1.00 0.00 C ATOM 1172 O ASP B 220 -9.043 0.871 -3.878 1.00 0.00 O ATOM 1173 CB ASP B 220 -7.487 0.405 -6.562 1.00 0.00 C ATOM 1174 CG ASP B 220 -8.057 -0.562 -7.602 1.00 0.00 C ATOM 1175 OD1 ASP B 220 -9.192 -1.033 -7.376 1.00 0.00 O ATOM 1176 OD2 ASP B 220 -7.343 -0.809 -8.597 1.00 0.00 O ATOM 0 H ASP B 220 -9.026 -1.378 -5.277 1.00 0.00 H new ATOM 0 HA ASP B 220 -6.253 -0.390 -4.988 1.00 0.00 H new ATOM 0 HB2 ASP B 220 -8.145 1.272 -6.495 1.00 0.00 H new ATOM 0 HB3 ASP B 220 -6.520 0.765 -6.914 1.00 0.00 H new ATOM 1181 N TYR B 221 -6.929 1.631 -3.620 1.00 0.00 N ATOM 1182 CA TYR B 221 -7.293 2.646 -2.645 1.00 0.00 C ATOM 1183 C TYR B 221 -6.516 3.942 -2.885 1.00 0.00 C ATOM 1184 O TYR B 221 -5.290 3.925 -2.980 1.00 0.00 O ATOM 1185 CB TYR B 221 -6.905 2.076 -1.279 1.00 0.00 C ATOM 1186 CG TYR B 221 -8.076 1.479 -0.497 1.00 0.00 C ATOM 1187 CD1 TYR B 221 -8.952 2.308 0.174 1.00 0.00 C ATOM 1188 CD2 TYR B 221 -8.257 0.111 -0.465 1.00 0.00 C ATOM 1189 CE1 TYR B 221 -10.055 1.745 0.910 1.00 0.00 C ATOM 1190 CE2 TYR B 221 -9.360 -0.451 0.271 1.00 0.00 C ATOM 1191 CZ TYR B 221 -10.204 0.393 0.922 1.00 0.00 C ATOM 1192 OH TYR B 221 -11.246 -0.138 1.617 1.00 0.00 O ATOM 0 H TYR B 221 -5.935 1.595 -3.848 1.00 0.00 H new ATOM 0 HA TYR B 221 -8.355 2.881 -2.713 1.00 0.00 H new ATOM 0 HB2 TYR B 221 -6.146 1.306 -1.420 1.00 0.00 H new ATOM 0 HB3 TYR B 221 -6.449 2.867 -0.683 1.00 0.00 H new ATOM 0 HD1 TYR B 221 -8.811 3.378 0.147 1.00 0.00 H new ATOM 0 HD2 TYR B 221 -7.572 -0.537 -0.991 1.00 0.00 H new ATOM 0 HE1 TYR B 221 -10.748 2.382 1.440 1.00 0.00 H new ATOM 0 HE2 TYR B 221 -9.513 -1.520 0.305 1.00 0.00 H new ATOM 0 HH TYR B 221 -10.940 -0.925 2.114 1.00 0.00 H new ATOM 1202 N GLU B 222 -7.261 5.033 -2.976 1.00 0.00 N ATOM 1203 CA GLU B 222 -6.657 6.335 -3.202 1.00 0.00 C ATOM 1204 C GLU B 222 -6.579 7.119 -1.891 1.00 0.00 C ATOM 1205 O GLU B 222 -7.606 7.491 -1.323 1.00 0.00 O ATOM 1206 CB GLU B 222 -7.429 7.120 -4.264 1.00 0.00 C ATOM 1207 CG GLU B 222 -6.890 8.546 -4.391 1.00 0.00 C ATOM 1208 CD GLU B 222 -7.811 9.404 -5.262 1.00 0.00 C ATOM 1209 OE1 GLU B 222 -8.213 8.900 -6.333 1.00 0.00 O ATOM 1210 OE2 GLU B 222 -8.091 10.546 -4.837 1.00 0.00 O ATOM 0 H GLU B 222 -8.278 5.042 -2.897 1.00 0.00 H new ATOM 0 HA GLU B 222 -5.643 6.184 -3.573 1.00 0.00 H new ATOM 0 HB2 GLU B 222 -7.352 6.611 -5.225 1.00 0.00 H new ATOM 0 HB3 GLU B 222 -8.487 7.149 -4.003 1.00 0.00 H new ATOM 0 HG2 GLU B 222 -6.798 8.994 -3.401 1.00 0.00 H new ATOM 0 HG3 GLU B 222 -5.890 8.524 -4.825 1.00 0.00 H new ATOM 1217 N THR B 223 -5.352 7.348 -1.447 1.00 0.00 N ATOM 1218 CA THR B 223 -5.126 8.081 -0.213 1.00 0.00 C ATOM 1219 C THR B 223 -3.961 9.058 -0.379 1.00 0.00 C ATOM 1220 O THR B 223 -3.004 8.772 -1.096 1.00 0.00 O ATOM 1221 CB THR B 223 -4.911 7.064 0.909 1.00 0.00 C ATOM 1222 OG1 THR B 223 -5.252 7.776 2.094 1.00 0.00 O ATOM 1223 CG2 THR B 223 -3.436 6.706 1.100 1.00 0.00 C ATOM 0 H THR B 223 -4.503 7.038 -1.920 1.00 0.00 H new ATOM 0 HA THR B 223 -5.989 8.694 0.046 1.00 0.00 H new ATOM 0 HB THR B 223 -5.479 6.159 0.692 1.00 0.00 H new ATOM 0 HG1 THR B 223 -5.142 7.189 2.871 1.00 0.00 H new ATOM 0 HG21 THR B 223 -3.339 5.981 1.908 1.00 0.00 H new ATOM 0 HG22 THR B 223 -3.044 6.277 0.178 1.00 0.00 H new ATOM 0 HG23 THR B 223 -2.873 7.605 1.350 1.00 0.00 H new ATOM 1231 N GLU B 224 -4.081 10.192 0.296 1.00 0.00 N ATOM 1232 CA GLU B 224 -3.049 11.213 0.232 1.00 0.00 C ATOM 1233 C GLU B 224 -2.229 11.221 1.524 1.00 0.00 C ATOM 1234 O GLU B 224 -2.605 11.871 2.498 1.00 0.00 O ATOM 1235 CB GLU B 224 -3.658 12.591 -0.039 1.00 0.00 C ATOM 1236 CG GLU B 224 -5.130 12.631 0.376 1.00 0.00 C ATOM 1237 CD GLU B 224 -5.279 12.460 1.888 1.00 0.00 C ATOM 1238 OE1 GLU B 224 -5.179 13.491 2.589 1.00 0.00 O ATOM 1239 OE2 GLU B 224 -5.488 11.303 2.311 1.00 0.00 O ATOM 0 H GLU B 224 -4.877 10.426 0.890 1.00 0.00 H new ATOM 0 HA GLU B 224 -2.382 10.977 -0.597 1.00 0.00 H new ATOM 0 HB2 GLU B 224 -3.102 13.352 0.508 1.00 0.00 H new ATOM 0 HB3 GLU B 224 -3.569 12.830 -1.099 1.00 0.00 H new ATOM 0 HG2 GLU B 224 -5.572 13.579 0.068 1.00 0.00 H new ATOM 0 HG3 GLU B 224 -5.678 11.842 -0.138 1.00 0.00 H new ATOM 1246 N THR B 225 -1.125 10.490 1.491 1.00 0.00 N ATOM 1247 CA THR B 225 -0.249 10.405 2.646 1.00 0.00 C ATOM 1248 C THR B 225 1.213 10.558 2.220 1.00 0.00 C ATOM 1249 O THR B 225 1.770 9.672 1.574 1.00 0.00 O ATOM 1250 CB THR B 225 -0.537 9.084 3.363 1.00 0.00 C ATOM 1251 OG1 THR B 225 -0.761 8.157 2.304 1.00 0.00 O ATOM 1252 CG2 THR B 225 -1.866 9.109 4.122 1.00 0.00 C ATOM 0 H THR B 225 -0.817 9.951 0.682 1.00 0.00 H new ATOM 0 HA THR B 225 -0.438 11.219 3.345 1.00 0.00 H new ATOM 0 HB THR B 225 0.274 8.862 4.056 1.00 0.00 H new ATOM 0 HG1 THR B 225 -0.954 7.272 2.679 1.00 0.00 H new ATOM 0 HG21 THR B 225 -2.023 8.148 4.613 1.00 0.00 H new ATOM 0 HG22 THR B 225 -1.842 9.900 4.872 1.00 0.00 H new ATOM 0 HG23 THR B 225 -2.681 9.296 3.423 1.00 0.00 H new ATOM 1260 N PRO B 226 1.808 11.717 2.610 1.00 0.00 N ATOM 1261 CA PRO B 226 3.194 11.996 2.274 1.00 0.00 C ATOM 1262 C PRO B 226 4.145 11.175 3.147 1.00 0.00 C ATOM 1263 O PRO B 226 4.614 10.116 2.734 1.00 0.00 O ATOM 1264 CB PRO B 226 3.351 13.495 2.472 1.00 0.00 C ATOM 1265 CG PRO B 226 2.188 13.925 3.350 1.00 0.00 C ATOM 1266 CD PRO B 226 1.178 12.788 3.376 1.00 0.00 C ATOM 0 HA PRO B 226 3.445 11.714 1.252 1.00 0.00 H new ATOM 0 HB2 PRO B 226 4.305 13.728 2.946 1.00 0.00 H new ATOM 0 HB3 PRO B 226 3.333 14.019 1.516 1.00 0.00 H new ATOM 0 HG2 PRO B 226 2.534 14.151 4.358 1.00 0.00 H new ATOM 0 HG3 PRO B 226 1.730 14.834 2.959 1.00 0.00 H new ATOM 0 HD2 PRO B 226 0.964 12.472 4.397 1.00 0.00 H new ATOM 0 HD3 PRO B 226 0.230 13.090 2.930 1.00 0.00 H new ATOM 1274 N MET B 227 4.400 11.695 4.339 1.00 0.00 N ATOM 1275 CA MET B 227 5.288 11.023 5.274 1.00 0.00 C ATOM 1276 C MET B 227 4.603 9.808 5.904 1.00 0.00 C ATOM 1277 O MET B 227 5.263 8.835 6.261 1.00 0.00 O ATOM 1278 CB MET B 227 5.706 12.001 6.374 1.00 0.00 C ATOM 1279 CG MET B 227 5.924 13.405 5.806 1.00 0.00 C ATOM 1280 SD MET B 227 4.506 14.432 6.154 1.00 0.00 S ATOM 1281 CE MET B 227 4.258 14.045 7.878 1.00 0.00 C ATOM 0 H MET B 227 4.008 12.573 4.679 1.00 0.00 H new ATOM 0 HA MET B 227 6.167 10.679 4.728 1.00 0.00 H new ATOM 0 HB2 MET B 227 4.939 12.033 7.148 1.00 0.00 H new ATOM 0 HB3 MET B 227 6.623 11.650 6.848 1.00 0.00 H new ATOM 0 HG2 MET B 227 6.820 13.848 6.242 1.00 0.00 H new ATOM 0 HG3 MET B 227 6.088 13.349 4.730 1.00 0.00 H new ATOM 0 HE1 MET B 227 3.759 14.880 8.370 1.00 0.00 H new ATOM 0 HE2 MET B 227 3.641 13.151 7.965 1.00 0.00 H new ATOM 0 HE3 MET B 227 5.223 13.868 8.354 1.00 0.00 H new ATOM 1291 N THR B 228 3.286 9.906 6.019 1.00 0.00 N ATOM 1292 CA THR B 228 2.505 8.827 6.599 1.00 0.00 C ATOM 1293 C THR B 228 2.838 7.499 5.916 1.00 0.00 C ATOM 1294 O THR B 228 2.866 6.454 6.564 1.00 0.00 O ATOM 1295 CB THR B 228 1.026 9.208 6.498 1.00 0.00 C ATOM 1296 OG1 THR B 228 1.036 10.465 5.828 1.00 0.00 O ATOM 1297 CG2 THR B 228 0.407 9.518 7.863 1.00 0.00 C ATOM 0 H THR B 228 2.741 10.715 5.721 1.00 0.00 H new ATOM 0 HA THR B 228 2.749 8.684 7.652 1.00 0.00 H new ATOM 0 HB THR B 228 0.474 8.396 6.025 1.00 0.00 H new ATOM 0 HG1 THR B 228 0.116 10.785 5.719 1.00 0.00 H new ATOM 0 HG21 THR B 228 -0.643 9.782 7.735 1.00 0.00 H new ATOM 0 HG22 THR B 228 0.484 8.641 8.505 1.00 0.00 H new ATOM 0 HG23 THR B 228 0.938 10.352 8.322 1.00 0.00 H new ATOM 1305 N LEU B 229 3.082 7.584 4.617 1.00 0.00 N ATOM 1306 CA LEU B 229 3.413 6.403 3.838 1.00 0.00 C ATOM 1307 C LEU B 229 4.575 5.667 4.507 1.00 0.00 C ATOM 1308 O LEU B 229 4.634 4.438 4.480 1.00 0.00 O ATOM 1309 CB LEU B 229 3.680 6.779 2.380 1.00 0.00 C ATOM 1310 CG LEU B 229 2.447 6.908 1.484 1.00 0.00 C ATOM 1311 CD1 LEU B 229 2.788 7.638 0.183 1.00 0.00 C ATOM 1312 CD2 LEU B 229 1.812 5.541 1.224 1.00 0.00 C ATOM 0 H LEU B 229 3.057 8.453 4.084 1.00 0.00 H new ATOM 0 HA LEU B 229 2.569 5.713 3.814 1.00 0.00 H new ATOM 0 HB2 LEU B 229 4.218 7.727 2.363 1.00 0.00 H new ATOM 0 HB3 LEU B 229 4.342 6.029 1.947 1.00 0.00 H new ATOM 0 HG LEU B 229 1.707 7.512 2.008 1.00 0.00 H new ATOM 0 HD11 LEU B 229 1.894 7.716 -0.436 1.00 0.00 H new ATOM 0 HD12 LEU B 229 3.159 8.637 0.413 1.00 0.00 H new ATOM 0 HD13 LEU B 229 3.555 7.082 -0.356 1.00 0.00 H new ATOM 0 HD21 LEU B 229 0.938 5.662 0.585 1.00 0.00 H new ATOM 0 HD22 LEU B 229 2.535 4.892 0.731 1.00 0.00 H new ATOM 0 HD23 LEU B 229 1.510 5.094 2.171 1.00 0.00 H new ATOM 1324 N LEU B 230 5.473 6.448 5.090 1.00 0.00 N ATOM 1325 CA LEU B 230 6.631 5.886 5.763 1.00 0.00 C ATOM 1326 C LEU B 230 6.217 5.390 7.151 1.00 0.00 C ATOM 1327 O LEU B 230 6.857 4.503 7.712 1.00 0.00 O ATOM 1328 CB LEU B 230 7.779 6.897 5.789 1.00 0.00 C ATOM 1329 CG LEU B 230 8.080 7.603 4.465 1.00 0.00 C ATOM 1330 CD1 LEU B 230 9.293 8.524 4.600 1.00 0.00 C ATOM 1331 CD2 LEU B 230 8.251 6.592 3.330 1.00 0.00 C ATOM 0 H LEU B 230 5.421 7.466 5.110 1.00 0.00 H new ATOM 0 HA LEU B 230 7.009 5.023 5.214 1.00 0.00 H new ATOM 0 HB2 LEU B 230 7.553 7.655 6.539 1.00 0.00 H new ATOM 0 HB3 LEU B 230 8.682 6.383 6.118 1.00 0.00 H new ATOM 0 HG LEU B 230 7.226 8.230 4.210 1.00 0.00 H new ATOM 0 HD11 LEU B 230 9.486 9.014 3.646 1.00 0.00 H new ATOM 0 HD12 LEU B 230 9.094 9.278 5.361 1.00 0.00 H new ATOM 0 HD13 LEU B 230 10.165 7.937 4.890 1.00 0.00 H new ATOM 0 HD21 LEU B 230 8.464 7.121 2.401 1.00 0.00 H new ATOM 0 HD22 LEU B 230 9.077 5.920 3.563 1.00 0.00 H new ATOM 0 HD23 LEU B 230 7.334 6.014 3.216 1.00 0.00 H new ATOM 1343 N VAL B 231 5.150 5.985 7.662 1.00 0.00 N ATOM 1344 CA VAL B 231 4.644 5.615 8.974 1.00 0.00 C ATOM 1345 C VAL B 231 4.104 4.184 8.922 1.00 0.00 C ATOM 1346 O VAL B 231 3.377 3.824 7.998 1.00 0.00 O ATOM 1347 CB VAL B 231 3.598 6.631 9.436 1.00 0.00 C ATOM 1348 CG1 VAL B 231 3.038 6.255 10.810 1.00 0.00 C ATOM 1349 CG2 VAL B 231 4.178 8.047 9.450 1.00 0.00 C ATOM 0 H VAL B 231 4.622 6.720 7.192 1.00 0.00 H new ATOM 0 HA VAL B 231 5.446 5.634 9.712 1.00 0.00 H new ATOM 0 HB VAL B 231 2.775 6.613 8.722 1.00 0.00 H new ATOM 0 HG11 VAL B 231 2.297 6.993 11.115 1.00 0.00 H new ATOM 0 HG12 VAL B 231 2.570 5.272 10.756 1.00 0.00 H new ATOM 0 HG13 VAL B 231 3.848 6.231 11.539 1.00 0.00 H new ATOM 0 HG21 VAL B 231 3.414 8.750 9.782 1.00 0.00 H new ATOM 0 HG22 VAL B 231 5.027 8.086 10.132 1.00 0.00 H new ATOM 0 HG23 VAL B 231 4.506 8.316 8.446 1.00 0.00 H new ATOM 1359 N PRO B 232 4.492 3.387 9.952 1.00 0.00 N ATOM 1360 CA PRO B 232 4.056 2.002 10.033 1.00 0.00 C ATOM 1361 C PRO B 232 2.592 1.914 10.470 1.00 0.00 C ATOM 1362 O PRO B 232 1.824 1.124 9.923 1.00 0.00 O ATOM 1363 CB PRO B 232 5.011 1.346 11.018 1.00 0.00 C ATOM 1364 CG PRO B 232 5.649 2.482 11.800 1.00 0.00 C ATOM 1365 CD PRO B 232 5.354 3.779 11.064 1.00 0.00 C ATOM 0 HA PRO B 232 4.088 1.493 9.070 1.00 0.00 H new ATOM 0 HB2 PRO B 232 4.479 0.665 11.682 1.00 0.00 H new ATOM 0 HB3 PRO B 232 5.767 0.758 10.497 1.00 0.00 H new ATOM 0 HG2 PRO B 232 5.250 2.519 12.813 1.00 0.00 H new ATOM 0 HG3 PRO B 232 6.725 2.329 11.887 1.00 0.00 H new ATOM 0 HD2 PRO B 232 4.858 4.499 11.715 1.00 0.00 H new ATOM 0 HD3 PRO B 232 6.270 4.249 10.708 1.00 0.00 H new ATOM 1373 N GLU B 233 2.250 2.735 11.453 1.00 0.00 N ATOM 1374 CA GLU B 233 0.892 2.758 11.969 1.00 0.00 C ATOM 1375 C GLU B 233 -0.093 3.119 10.855 1.00 0.00 C ATOM 1376 O GLU B 233 -1.219 2.627 10.834 1.00 0.00 O ATOM 1377 CB GLU B 233 0.770 3.730 13.145 1.00 0.00 C ATOM 1378 CG GLU B 233 2.009 3.665 14.040 1.00 0.00 C ATOM 1379 CD GLU B 233 1.684 4.131 15.460 1.00 0.00 C ATOM 1380 OE1 GLU B 233 0.680 3.627 16.007 1.00 0.00 O ATOM 1381 OE2 GLU B 233 2.449 4.980 15.968 1.00 0.00 O ATOM 0 H GLU B 233 2.890 3.388 11.905 1.00 0.00 H new ATOM 0 HA GLU B 233 0.646 1.762 12.336 1.00 0.00 H new ATOM 0 HB2 GLU B 233 0.640 4.745 12.770 1.00 0.00 H new ATOM 0 HB3 GLU B 233 -0.118 3.490 13.729 1.00 0.00 H new ATOM 0 HG2 GLU B 233 2.390 2.644 14.067 1.00 0.00 H new ATOM 0 HG3 GLU B 233 2.798 4.289 13.620 1.00 0.00 H new ATOM 1388 N VAL B 234 0.368 3.977 9.956 1.00 0.00 N ATOM 1389 CA VAL B 234 -0.459 4.410 8.842 1.00 0.00 C ATOM 1390 C VAL B 234 -0.390 3.366 7.726 1.00 0.00 C ATOM 1391 O VAL B 234 -1.416 2.981 7.166 1.00 0.00 O ATOM 1392 CB VAL B 234 -0.030 5.805 8.383 1.00 0.00 C ATOM 1393 CG1 VAL B 234 -0.741 6.198 7.087 1.00 0.00 C ATOM 1394 CG2 VAL B 234 -0.275 6.842 9.480 1.00 0.00 C ATOM 0 H VAL B 234 1.303 4.384 9.976 1.00 0.00 H new ATOM 0 HA VAL B 234 -1.502 4.490 9.149 1.00 0.00 H new ATOM 0 HB VAL B 234 1.041 5.778 8.182 1.00 0.00 H new ATOM 0 HG11 VAL B 234 -0.418 7.194 6.783 1.00 0.00 H new ATOM 0 HG12 VAL B 234 -0.493 5.481 6.304 1.00 0.00 H new ATOM 0 HG13 VAL B 234 -1.819 6.200 7.249 1.00 0.00 H new ATOM 0 HG21 VAL B 234 0.038 7.825 9.128 1.00 0.00 H new ATOM 0 HG22 VAL B 234 -1.336 6.866 9.727 1.00 0.00 H new ATOM 0 HG23 VAL B 234 0.298 6.575 10.368 1.00 0.00 H new ATOM 1404 N ALA B 235 0.830 2.937 7.435 1.00 0.00 N ATOM 1405 CA ALA B 235 1.046 1.946 6.396 1.00 0.00 C ATOM 1406 C ALA B 235 0.405 0.622 6.818 1.00 0.00 C ATOM 1407 O ALA B 235 -0.239 -0.046 6.010 1.00 0.00 O ATOM 1408 CB ALA B 235 2.546 1.806 6.127 1.00 0.00 C ATOM 0 H ALA B 235 1.678 3.258 7.901 1.00 0.00 H new ATOM 0 HA ALA B 235 0.575 2.259 5.464 1.00 0.00 H new ATOM 0 HB1 ALA B 235 2.708 1.062 5.347 1.00 0.00 H new ATOM 0 HB2 ALA B 235 2.949 2.766 5.802 1.00 0.00 H new ATOM 0 HB3 ALA B 235 3.051 1.491 7.040 1.00 0.00 H new ATOM 1414 N ALA B 236 0.602 0.283 8.083 1.00 0.00 N ATOM 1415 CA ALA B 236 0.051 -0.949 8.622 1.00 0.00 C ATOM 1416 C ALA B 236 -1.465 -0.959 8.413 1.00 0.00 C ATOM 1417 O ALA B 236 -2.024 -1.950 7.945 1.00 0.00 O ATOM 1418 CB ALA B 236 0.437 -1.079 10.097 1.00 0.00 C ATOM 0 H ALA B 236 1.135 0.840 8.751 1.00 0.00 H new ATOM 0 HA ALA B 236 0.462 -1.813 8.100 1.00 0.00 H new ATOM 0 HB1 ALA B 236 0.024 -2.003 10.501 1.00 0.00 H new ATOM 0 HB2 ALA B 236 1.523 -1.097 10.189 1.00 0.00 H new ATOM 0 HB3 ALA B 236 0.040 -0.230 10.653 1.00 0.00 H new ATOM 1424 N GLU B 237 -2.087 0.156 8.769 1.00 0.00 N ATOM 1425 CA GLU B 237 -3.527 0.288 8.626 1.00 0.00 C ATOM 1426 C GLU B 237 -3.914 0.294 7.146 1.00 0.00 C ATOM 1427 O GLU B 237 -4.960 -0.236 6.772 1.00 0.00 O ATOM 1428 CB GLU B 237 -4.034 1.547 9.331 1.00 0.00 C ATOM 1429 CG GLU B 237 -4.085 1.344 10.847 1.00 0.00 C ATOM 1430 CD GLU B 237 -4.350 2.666 11.569 1.00 0.00 C ATOM 1431 OE1 GLU B 237 -5.323 3.345 11.173 1.00 0.00 O ATOM 1432 OE2 GLU B 237 -3.573 2.970 12.500 1.00 0.00 O ATOM 0 H GLU B 237 -1.620 0.976 9.156 1.00 0.00 H new ATOM 0 HA GLU B 237 -4.001 -0.570 9.102 1.00 0.00 H new ATOM 0 HB2 GLU B 237 -3.382 2.388 9.095 1.00 0.00 H new ATOM 0 HB3 GLU B 237 -5.027 1.800 8.961 1.00 0.00 H new ATOM 0 HG2 GLU B 237 -4.867 0.627 11.095 1.00 0.00 H new ATOM 0 HG3 GLU B 237 -3.142 0.920 11.192 1.00 0.00 H new ATOM 1439 N VAL B 238 -3.051 0.899 6.343 1.00 0.00 N ATOM 1440 CA VAL B 238 -3.290 0.980 4.912 1.00 0.00 C ATOM 1441 C VAL B 238 -3.230 -0.424 4.308 1.00 0.00 C ATOM 1442 O VAL B 238 -4.148 -0.840 3.602 1.00 0.00 O ATOM 1443 CB VAL B 238 -2.296 1.951 4.270 1.00 0.00 C ATOM 1444 CG1 VAL B 238 -1.927 1.501 2.856 1.00 0.00 C ATOM 1445 CG2 VAL B 238 -2.849 3.378 4.265 1.00 0.00 C ATOM 0 H VAL B 238 -2.185 1.338 6.656 1.00 0.00 H new ATOM 0 HA VAL B 238 -4.286 1.376 4.713 1.00 0.00 H new ATOM 0 HB VAL B 238 -1.387 1.947 4.871 1.00 0.00 H new ATOM 0 HG11 VAL B 238 -1.220 2.208 2.422 1.00 0.00 H new ATOM 0 HG12 VAL B 238 -1.472 0.511 2.896 1.00 0.00 H new ATOM 0 HG13 VAL B 238 -2.826 1.463 2.240 1.00 0.00 H new ATOM 0 HG21 VAL B 238 -2.123 4.048 3.804 1.00 0.00 H new ATOM 0 HG22 VAL B 238 -3.780 3.406 3.698 1.00 0.00 H new ATOM 0 HG23 VAL B 238 -3.038 3.698 5.289 1.00 0.00 H new ATOM 1455 N ILE B 239 -2.141 -1.115 4.608 1.00 0.00 N ATOM 1456 CA ILE B 239 -1.948 -2.464 4.102 1.00 0.00 C ATOM 1457 C ILE B 239 -3.084 -3.359 4.606 1.00 0.00 C ATOM 1458 O ILE B 239 -3.726 -4.053 3.820 1.00 0.00 O ATOM 1459 CB ILE B 239 -0.554 -2.979 4.465 1.00 0.00 C ATOM 1460 CG1 ILE B 239 0.532 -2.144 3.781 1.00 0.00 C ATOM 1461 CG2 ILE B 239 -0.419 -4.468 4.145 1.00 0.00 C ATOM 1462 CD1 ILE B 239 0.230 -1.965 2.293 1.00 0.00 C ATOM 0 H ILE B 239 -1.383 -0.767 5.195 1.00 0.00 H new ATOM 0 HA ILE B 239 -1.992 -2.472 3.013 1.00 0.00 H new ATOM 0 HB ILE B 239 -0.417 -2.868 5.541 1.00 0.00 H new ATOM 0 HG12 ILE B 239 0.602 -1.168 4.261 1.00 0.00 H new ATOM 0 HG13 ILE B 239 1.500 -2.630 3.903 1.00 0.00 H new ATOM 0 HG21 ILE B 239 0.581 -4.808 4.413 1.00 0.00 H new ATOM 0 HG22 ILE B 239 -1.158 -5.031 4.715 1.00 0.00 H new ATOM 0 HG23 ILE B 239 -0.583 -4.628 3.079 1.00 0.00 H new ATOM 0 HD11 ILE B 239 1.017 -1.368 1.831 1.00 0.00 H new ATOM 0 HD12 ILE B 239 0.185 -2.942 1.811 1.00 0.00 H new ATOM 0 HD13 ILE B 239 -0.727 -1.457 2.175 1.00 0.00 H new ATOM 1474 N LYS B 240 -3.295 -3.313 5.913 1.00 0.00 N ATOM 1475 CA LYS B 240 -4.340 -4.111 6.530 1.00 0.00 C ATOM 1476 C LYS B 240 -5.700 -3.674 5.981 1.00 0.00 C ATOM 1477 O LYS B 240 -6.543 -4.512 5.662 1.00 0.00 O ATOM 1478 CB LYS B 240 -4.241 -4.038 8.055 1.00 0.00 C ATOM 1479 CG LYS B 240 -5.630 -4.050 8.697 1.00 0.00 C ATOM 1480 CD LYS B 240 -6.101 -2.629 9.011 1.00 0.00 C ATOM 1481 CE LYS B 240 -7.583 -2.614 9.392 1.00 0.00 C ATOM 1482 NZ LYS B 240 -8.017 -1.240 9.731 1.00 0.00 N ATOM 0 H LYS B 240 -2.760 -2.735 6.562 1.00 0.00 H new ATOM 0 HA LYS B 240 -4.215 -5.164 6.276 1.00 0.00 H new ATOM 0 HB2 LYS B 240 -3.658 -4.881 8.426 1.00 0.00 H new ATOM 0 HB3 LYS B 240 -3.710 -3.131 8.345 1.00 0.00 H new ATOM 0 HG2 LYS B 240 -6.341 -4.533 8.026 1.00 0.00 H new ATOM 0 HG3 LYS B 240 -5.606 -4.640 9.613 1.00 0.00 H new ATOM 0 HD2 LYS B 240 -5.508 -2.218 9.828 1.00 0.00 H new ATOM 0 HD3 LYS B 240 -5.938 -1.988 8.144 1.00 0.00 H new ATOM 0 HE2 LYS B 240 -8.181 -2.997 8.565 1.00 0.00 H new ATOM 0 HE3 LYS B 240 -7.753 -3.275 10.242 1.00 0.00 H new ATOM 0 HZ1 LYS B 240 -9.025 -1.248 9.987 1.00 0.00 H new ATOM 0 HZ2 LYS B 240 -7.458 -0.888 10.534 1.00 0.00 H new ATOM 0 HZ3 LYS B 240 -7.873 -0.618 8.910 1.00 0.00 H new ATOM 1496 N ASP B 241 -5.871 -2.364 5.888 1.00 0.00 N ATOM 1497 CA ASP B 241 -7.115 -1.806 5.382 1.00 0.00 C ATOM 1498 C ASP B 241 -7.382 -2.354 3.979 1.00 0.00 C ATOM 1499 O ASP B 241 -8.501 -2.761 3.672 1.00 0.00 O ATOM 1500 CB ASP B 241 -7.034 -0.281 5.287 1.00 0.00 C ATOM 1501 CG ASP B 241 -8.141 0.374 4.457 1.00 0.00 C ATOM 1502 OD1 ASP B 241 -9.295 -0.090 4.582 1.00 0.00 O ATOM 1503 OD2 ASP B 241 -7.807 1.323 3.715 1.00 0.00 O ATOM 0 H ASP B 241 -5.170 -1.672 6.154 1.00 0.00 H new ATOM 0 HA ASP B 241 -7.914 -2.083 6.069 1.00 0.00 H new ATOM 0 HB2 ASP B 241 -7.063 0.133 6.295 1.00 0.00 H new ATOM 0 HB3 ASP B 241 -6.070 -0.009 4.858 1.00 0.00 H new ATOM 1508 N LEU B 242 -6.336 -2.348 3.167 1.00 0.00 N ATOM 1509 CA LEU B 242 -6.444 -2.840 1.804 1.00 0.00 C ATOM 1510 C LEU B 242 -6.817 -4.324 1.830 1.00 0.00 C ATOM 1511 O LEU B 242 -7.757 -4.743 1.159 1.00 0.00 O ATOM 1512 CB LEU B 242 -5.162 -2.541 1.024 1.00 0.00 C ATOM 1513 CG LEU B 242 -5.133 -1.211 0.268 1.00 0.00 C ATOM 1514 CD1 LEU B 242 -3.926 -0.370 0.686 1.00 0.00 C ATOM 1515 CD2 LEU B 242 -5.175 -1.438 -1.245 1.00 0.00 C ATOM 0 H LEU B 242 -5.409 -2.010 3.426 1.00 0.00 H new ATOM 0 HA LEU B 242 -7.241 -2.320 1.273 1.00 0.00 H new ATOM 0 HB2 LEU B 242 -4.324 -2.559 1.720 1.00 0.00 H new ATOM 0 HB3 LEU B 242 -4.999 -3.347 0.308 1.00 0.00 H new ATOM 0 HG LEU B 242 -6.027 -0.648 0.534 1.00 0.00 H new ATOM 0 HD11 LEU B 242 -3.929 0.570 0.134 1.00 0.00 H new ATOM 0 HD12 LEU B 242 -3.979 -0.163 1.755 1.00 0.00 H new ATOM 0 HD13 LEU B 242 -3.009 -0.916 0.467 1.00 0.00 H new ATOM 0 HD21 LEU B 242 -5.153 -0.476 -1.758 1.00 0.00 H new ATOM 0 HD22 LEU B 242 -4.312 -2.031 -1.548 1.00 0.00 H new ATOM 0 HD23 LEU B 242 -6.090 -1.969 -1.508 1.00 0.00 H new ATOM 1527 N VAL B 243 -6.058 -5.078 2.612 1.00 0.00 N ATOM 1528 CA VAL B 243 -6.296 -6.505 2.735 1.00 0.00 C ATOM 1529 C VAL B 243 -7.686 -6.737 3.332 1.00 0.00 C ATOM 1530 O VAL B 243 -8.443 -7.574 2.844 1.00 0.00 O ATOM 1531 CB VAL B 243 -5.178 -7.154 3.554 1.00 0.00 C ATOM 1532 CG1 VAL B 243 -5.708 -8.341 4.361 1.00 0.00 C ATOM 1533 CG2 VAL B 243 -4.015 -7.578 2.655 1.00 0.00 C ATOM 0 H VAL B 243 -5.278 -4.727 3.167 1.00 0.00 H new ATOM 0 HA VAL B 243 -6.280 -6.980 1.754 1.00 0.00 H new ATOM 0 HB VAL B 243 -4.804 -6.411 4.258 1.00 0.00 H new ATOM 0 HG11 VAL B 243 -4.893 -8.784 4.934 1.00 0.00 H new ATOM 0 HG12 VAL B 243 -6.487 -7.999 5.043 1.00 0.00 H new ATOM 0 HG13 VAL B 243 -6.122 -9.087 3.682 1.00 0.00 H new ATOM 0 HG21 VAL B 243 -3.234 -8.036 3.262 1.00 0.00 H new ATOM 0 HG22 VAL B 243 -4.369 -8.297 1.916 1.00 0.00 H new ATOM 0 HG23 VAL B 243 -3.612 -6.703 2.145 1.00 0.00 H new ATOM 1543 N ASN B 244 -7.978 -5.981 4.380 1.00 0.00 N ATOM 1544 CA ASN B 244 -9.263 -6.093 5.049 1.00 0.00 C ATOM 1545 C ASN B 244 -10.384 -5.864 4.033 1.00 0.00 C ATOM 1546 O ASN B 244 -11.432 -6.504 4.104 1.00 0.00 O ATOM 1547 CB ASN B 244 -9.404 -5.043 6.152 1.00 0.00 C ATOM 1548 CG ASN B 244 -9.207 -5.670 7.533 1.00 0.00 C ATOM 1549 OD1 ASN B 244 -7.978 -6.131 7.749 1.00 0.00 O flip ATOM 1550 ND2 ASN B 244 -10.111 -5.731 8.351 1.00 0.00 N flip ATOM 0 H ASN B 244 -7.347 -5.288 4.782 1.00 0.00 H new ATOM 0 HA ASN B 244 -9.328 -7.088 5.488 1.00 0.00 H new ATOM 0 HB2 ASN B 244 -8.671 -4.250 6.001 1.00 0.00 H new ATOM 0 HB3 ASN B 244 -10.390 -4.581 6.096 1.00 0.00 H new ATOM 0 HD21 ASN B 244 -11.032 -5.358 8.122 1.00 0.00 H new ATOM 0 HD22 ASN B 244 -9.945 -6.155 9.264 1.00 0.00 H new ATOM 1557 N THR B 245 -10.125 -4.947 3.111 1.00 0.00 N ATOM 1558 CA THR B 245 -11.099 -4.625 2.081 1.00 0.00 C ATOM 1559 C THR B 245 -11.211 -5.773 1.075 1.00 0.00 C ATOM 1560 O THR B 245 -12.312 -6.152 0.680 1.00 0.00 O ATOM 1561 CB THR B 245 -10.691 -3.296 1.443 1.00 0.00 C ATOM 1562 OG1 THR B 245 -10.886 -2.339 2.482 1.00 0.00 O ATOM 1563 CG2 THR B 245 -11.657 -2.854 0.342 1.00 0.00 C ATOM 0 H THR B 245 -9.255 -4.417 3.056 1.00 0.00 H new ATOM 0 HA THR B 245 -12.097 -4.506 2.504 1.00 0.00 H new ATOM 0 HB THR B 245 -9.686 -3.385 1.029 1.00 0.00 H new ATOM 0 HG1 THR B 245 -10.113 -2.348 3.084 1.00 0.00 H new ATOM 0 HG21 THR B 245 -11.321 -1.906 -0.077 1.00 0.00 H new ATOM 0 HG22 THR B 245 -11.683 -3.609 -0.444 1.00 0.00 H new ATOM 0 HG23 THR B 245 -12.656 -2.732 0.762 1.00 0.00 H new