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 180:sc= 0.66 USER MOD Set 1.2: B 245 THR OG1 : rot -166:sc= 0.982 USER MOD Set 2.1: A 21 TYR OH : rot 65:sc= 0.376 USER MOD Set 2.2: A 45 THR OG1 : rot 91:sc= 0.348 USER MOD Set 3.1: A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 3.2: B 207 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 12 ASN : amide:sc= -7.38! C(o=-6.4!,f=-8.3!) USER MOD Set 4.2: B 206 TYR OH : rot -118:sc= 1.01 USER MOD Set 5.1: A 7 THR OG1 : rot -170:sc= 0 USER MOD Set 5.2: B 213 ASN : amide:sc= 0.00181 X(o=0.0018,f=0.1) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= -1.11 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= -1.29 USER MOD Single : A 11 THR OG1 : rot 150:sc= -3.14! USER MOD Single : A 14 SER OG : rot 43:sc= -0.0897 USER MOD Single : A 15 ASN : amide:sc= -0.14 X(o=-0.14,f=-0.52) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.461 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.154 USER MOD Single : A 40 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0401) USER MOD Single : A 44 ASN :FLIP amide:sc= -0.714 F(o=-1.5,f=-0.71) USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 205 THR OG1 : rot 180:sc= -3.77! USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 211 THR OG1 : rot 160:sc= -3.28 USER MOD Single : B 212 ASN : amide:sc= -9.65! C(o=-9.7!,f=-27!) USER MOD Single : B 214 SER OG : rot 180:sc= 0 USER MOD Single : B 215 ASN : amide:sc= -0.242 X(o=-0.24,f=-0.58) 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= -0.413 USER MOD Single : B 227 MET CE :methyl -146:sc= -0.057 (180deg=-0.598) USER MOD Single : B 228 THR OG1 : rot 180:sc= 0.0525 USER MOD Single : B 240 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 244 ASN :FLIP amide:sc= -0.734 F(o=-1.4,f=-0.73) USER MOD ----------------------------------------------------------------- ATOM 25 N LYS A 3 -1.117 -20.100 -6.318 1.00 0.00 N ATOM 26 CA LYS A 3 -0.079 -19.761 -5.361 1.00 0.00 C ATOM 27 C LYS A 3 -0.594 -18.669 -4.421 1.00 0.00 C ATOM 28 O LYS A 3 -1.639 -18.071 -4.673 1.00 0.00 O ATOM 29 CB LYS A 3 1.217 -19.389 -6.084 1.00 0.00 C ATOM 30 CG LYS A 3 1.937 -20.639 -6.596 1.00 0.00 C ATOM 31 CD LYS A 3 0.935 -21.706 -7.039 1.00 0.00 C ATOM 32 CE LYS A 3 1.643 -22.868 -7.741 1.00 0.00 C ATOM 33 NZ LYS A 3 1.005 -23.150 -9.046 1.00 0.00 N ATOM 0 HA LYS A 3 0.165 -20.625 -4.743 1.00 0.00 H new ATOM 0 HB2 LYS A 3 0.994 -18.725 -6.919 1.00 0.00 H new ATOM 0 HB3 LYS A 3 1.871 -18.840 -5.407 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.584 -20.373 -7.432 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.578 -21.041 -5.811 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.389 -22.079 -6.172 1.00 0.00 H new ATOM 0 HD3 LYS A 3 0.201 -21.263 -7.712 1.00 0.00 H new ATOM 0 HE2 LYS A 3 2.695 -22.625 -7.889 1.00 0.00 H new ATOM 0 HE3 LYS A 3 1.607 -23.757 -7.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 1.497 -23.941 -9.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 0.007 -23.403 -8.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 1.062 -22.305 -9.650 1.00 0.00 H new ATOM 47 N ALA A 4 0.165 -18.441 -3.359 1.00 0.00 N ATOM 48 CA ALA A 4 -0.201 -17.431 -2.380 1.00 0.00 C ATOM 49 C ALA A 4 0.722 -16.220 -2.534 1.00 0.00 C ATOM 50 O ALA A 4 1.804 -16.183 -1.954 1.00 0.00 O ATOM 51 CB ALA A 4 -0.143 -18.034 -0.976 1.00 0.00 C ATOM 0 H ALA A 4 1.032 -18.938 -3.155 1.00 0.00 H new ATOM 0 HA ALA A 4 -1.223 -17.090 -2.545 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -0.418 -17.276 -0.243 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -0.838 -18.871 -0.910 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.868 -18.386 -0.773 1.00 0.00 H new ATOM 57 N THR A 5 0.257 -15.258 -3.318 1.00 0.00 N ATOM 58 CA THR A 5 1.028 -14.050 -3.556 1.00 0.00 C ATOM 59 C THR A 5 0.108 -12.827 -3.577 1.00 0.00 C ATOM 60 O THR A 5 -1.092 -12.952 -3.813 1.00 0.00 O ATOM 61 CB THR A 5 1.817 -14.238 -4.852 1.00 0.00 C ATOM 62 OG1 THR A 5 0.816 -14.489 -5.835 1.00 0.00 O ATOM 63 CG2 THR A 5 2.660 -15.516 -4.844 1.00 0.00 C ATOM 0 H THR A 5 -0.643 -15.291 -3.796 1.00 0.00 H new ATOM 0 HA THR A 5 1.739 -13.870 -2.750 1.00 0.00 H new ATOM 0 HB THR A 5 2.465 -13.376 -5.010 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.241 -14.621 -6.708 1.00 0.00 H new ATOM 0 HG21 THR A 5 3.200 -15.602 -5.787 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.372 -15.477 -4.020 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.008 -16.381 -4.719 1.00 0.00 H new ATOM 71 N TYR A 6 0.707 -11.672 -3.326 1.00 0.00 N ATOM 72 CA TYR A 6 -0.044 -10.427 -3.313 1.00 0.00 C ATOM 73 C TYR A 6 0.656 -9.357 -4.152 1.00 0.00 C ATOM 74 O TYR A 6 1.880 -9.239 -4.119 1.00 0.00 O ATOM 75 CB TYR A 6 -0.079 -9.972 -1.852 1.00 0.00 C ATOM 76 CG TYR A 6 -1.374 -10.329 -1.121 1.00 0.00 C ATOM 77 CD1 TYR A 6 -1.561 -11.606 -0.631 1.00 0.00 C ATOM 78 CD2 TYR A 6 -2.356 -9.374 -0.950 1.00 0.00 C ATOM 79 CE1 TYR A 6 -2.780 -11.941 0.058 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.575 -9.709 -0.261 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.727 -10.977 0.209 1.00 0.00 C ATOM 82 OH TYR A 6 -4.879 -11.294 0.860 1.00 0.00 O ATOM 0 H TYR A 6 1.703 -11.572 -3.130 1.00 0.00 H new ATOM 0 HA TYR A 6 -1.041 -10.574 -3.729 1.00 0.00 H new ATOM 0 HB2 TYR A 6 0.761 -10.421 -1.322 1.00 0.00 H new ATOM 0 HB3 TYR A 6 0.061 -8.892 -1.815 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -0.793 -12.354 -0.764 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -2.210 -8.375 -1.333 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -2.939 -12.936 0.446 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -4.351 -8.971 -0.120 1.00 0.00 H new ATOM 0 HH TYR A 6 -5.463 -10.507 0.894 1.00 0.00 H new ATOM 92 N THR A 7 -0.151 -8.604 -4.885 1.00 0.00 N ATOM 93 CA THR A 7 0.375 -7.546 -5.731 1.00 0.00 C ATOM 94 C THR A 7 -0.053 -6.177 -5.202 1.00 0.00 C ATOM 95 O THR A 7 -1.221 -5.805 -5.303 1.00 0.00 O ATOM 96 CB THR A 7 -0.087 -7.815 -7.165 1.00 0.00 C ATOM 97 OG1 THR A 7 0.193 -9.198 -7.366 1.00 0.00 O ATOM 98 CG2 THR A 7 0.783 -7.104 -8.203 1.00 0.00 C ATOM 0 H THR A 7 -1.166 -8.706 -4.911 1.00 0.00 H new ATOM 0 HA THR A 7 1.465 -7.536 -5.721 1.00 0.00 H new ATOM 0 HB THR A 7 -1.123 -7.495 -7.279 1.00 0.00 H new ATOM 0 HG1 THR A 7 0.074 -9.422 -8.313 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.412 -7.328 -9.203 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.744 -6.028 -8.034 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.813 -7.449 -8.112 1.00 0.00 H new ATOM 106 N VAL A 8 0.916 -5.462 -4.649 1.00 0.00 N ATOM 107 CA VAL A 8 0.654 -4.141 -4.104 1.00 0.00 C ATOM 108 C VAL A 8 1.174 -3.080 -5.075 1.00 0.00 C ATOM 109 O VAL A 8 2.344 -3.101 -5.456 1.00 0.00 O ATOM 110 CB VAL A 8 1.264 -4.021 -2.705 1.00 0.00 C ATOM 111 CG1 VAL A 8 1.137 -2.593 -2.172 1.00 0.00 C ATOM 112 CG2 VAL A 8 0.629 -5.026 -1.742 1.00 0.00 C ATOM 0 H VAL A 8 1.884 -5.773 -4.567 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.418 -3.981 -3.992 1.00 0.00 H new ATOM 0 HB VAL A 8 2.326 -4.256 -2.781 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.578 -2.535 -1.177 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.658 -1.908 -2.840 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.084 -2.317 -2.119 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.080 -4.920 -0.755 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.442 -4.837 -1.673 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.796 -6.038 -2.110 1.00 0.00 H new ATOM 122 N THR A 9 0.279 -2.177 -5.450 1.00 0.00 N ATOM 123 CA THR A 9 0.634 -1.110 -6.370 1.00 0.00 C ATOM 124 C THR A 9 0.418 0.255 -5.714 1.00 0.00 C ATOM 125 O THR A 9 -0.682 0.560 -5.257 1.00 0.00 O ATOM 126 CB THR A 9 -0.179 -1.303 -7.653 1.00 0.00 C ATOM 127 OG1 THR A 9 0.191 -2.602 -8.106 1.00 0.00 O ATOM 128 CG2 THR A 9 0.275 -0.371 -8.779 1.00 0.00 C ATOM 0 H THR A 9 -0.691 -2.163 -5.133 1.00 0.00 H new ATOM 0 HA THR A 9 1.692 -1.147 -6.629 1.00 0.00 H new ATOM 0 HB THR A 9 -1.235 -1.131 -7.444 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.291 -2.810 -8.934 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.334 -0.548 -9.666 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.161 0.666 -8.462 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.322 -0.565 -9.012 1.00 0.00 H new ATOM 136 N VAL A 10 1.486 1.039 -5.687 1.00 0.00 N ATOM 137 CA VAL A 10 1.427 2.364 -5.093 1.00 0.00 C ATOM 138 C VAL A 10 1.810 3.406 -6.145 1.00 0.00 C ATOM 139 O VAL A 10 2.922 3.384 -6.669 1.00 0.00 O ATOM 140 CB VAL A 10 2.312 2.419 -3.847 1.00 0.00 C ATOM 141 CG1 VAL A 10 2.680 3.862 -3.498 1.00 0.00 C ATOM 142 CG2 VAL A 10 1.636 1.724 -2.662 1.00 0.00 C ATOM 0 H VAL A 10 2.397 0.782 -6.067 1.00 0.00 H new ATOM 0 HA VAL A 10 0.413 2.591 -4.764 1.00 0.00 H new ATOM 0 HB VAL A 10 3.234 1.882 -4.069 1.00 0.00 H new ATOM 0 HG11 VAL A 10 3.309 3.872 -2.608 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.222 4.311 -4.331 1.00 0.00 H new ATOM 0 HG13 VAL A 10 1.772 4.433 -3.306 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.287 1.778 -1.789 1.00 0.00 H new ATOM 0 HG22 VAL A 10 0.691 2.219 -2.441 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.449 0.680 -2.911 1.00 0.00 H new ATOM 152 N THR A 11 0.867 4.295 -6.421 1.00 0.00 N ATOM 153 CA THR A 11 1.092 5.344 -7.401 1.00 0.00 C ATOM 154 C THR A 11 0.835 6.718 -6.780 1.00 0.00 C ATOM 155 O THR A 11 -0.056 6.869 -5.945 1.00 0.00 O ATOM 156 CB THR A 11 0.211 5.052 -8.618 1.00 0.00 C ATOM 157 OG1 THR A 11 0.759 3.856 -9.164 1.00 0.00 O ATOM 158 CG2 THR A 11 0.389 6.086 -9.731 1.00 0.00 C ATOM 0 H THR A 11 -0.054 4.310 -5.983 1.00 0.00 H new ATOM 0 HA THR A 11 2.131 5.361 -7.731 1.00 0.00 H new ATOM 0 HB THR A 11 -0.835 5.026 -8.311 1.00 0.00 H new ATOM 0 HG1 THR A 11 0.049 3.341 -9.602 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.258 5.832 -10.570 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.125 7.074 -9.355 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.428 6.089 -10.062 1.00 0.00 H new ATOM 166 N ASN A 12 1.630 7.686 -7.211 1.00 0.00 N ATOM 167 CA ASN A 12 1.499 9.043 -6.708 1.00 0.00 C ATOM 168 C ASN A 12 0.731 9.888 -7.725 1.00 0.00 C ATOM 169 O ASN A 12 1.228 10.155 -8.818 1.00 0.00 O ATOM 170 CB ASN A 12 2.871 9.688 -6.498 1.00 0.00 C ATOM 171 CG ASN A 12 3.917 8.639 -6.113 1.00 0.00 C ATOM 172 OD1 ASN A 12 4.260 8.461 -4.956 1.00 0.00 O ATOM 173 ND2 ASN A 12 4.402 7.955 -7.145 1.00 0.00 N ATOM 0 H ASN A 12 2.368 7.558 -7.903 1.00 0.00 H new ATOM 0 HA ASN A 12 0.971 8.999 -5.755 1.00 0.00 H new ATOM 0 HB2 ASN A 12 3.181 10.198 -7.410 1.00 0.00 H new ATOM 0 HB3 ASN A 12 2.805 10.445 -5.717 1.00 0.00 H new ATOM 0 HD21 ASN A 12 5.104 7.231 -6.992 1.00 0.00 H new ATOM 0 HD22 ASN A 12 4.072 8.154 -8.089 1.00 0.00 H new ATOM 180 N ASN A 13 -0.470 10.285 -7.331 1.00 0.00 N ATOM 181 CA ASN A 13 -1.312 11.095 -8.195 1.00 0.00 C ATOM 182 C ASN A 13 -0.748 12.515 -8.264 1.00 0.00 C ATOM 183 O ASN A 13 -1.139 13.301 -9.127 1.00 0.00 O ATOM 184 CB ASN A 13 -2.740 11.179 -7.651 1.00 0.00 C ATOM 185 CG ASN A 13 -3.724 10.468 -8.582 1.00 0.00 C ATOM 186 OD1 ASN A 13 -4.148 10.995 -9.598 1.00 0.00 O ATOM 187 ND2 ASN A 13 -4.064 9.248 -8.179 1.00 0.00 N ATOM 0 H ASN A 13 -0.880 10.061 -6.424 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.328 10.631 -9.181 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.782 10.729 -6.659 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -3.030 12.224 -7.539 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.717 8.692 -8.731 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.671 8.867 -7.318 1.00 0.00 H new ATOM 194 N SER A 14 0.162 12.802 -7.345 1.00 0.00 N ATOM 195 CA SER A 14 0.784 14.115 -7.292 1.00 0.00 C ATOM 196 C SER A 14 1.922 14.196 -8.310 1.00 0.00 C ATOM 197 O SER A 14 2.141 15.241 -8.920 1.00 0.00 O ATOM 198 CB SER A 14 1.307 14.418 -5.886 1.00 0.00 C ATOM 199 OG SER A 14 1.192 15.802 -5.562 1.00 0.00 O ATOM 0 H SER A 14 0.484 12.148 -6.631 1.00 0.00 H new ATOM 0 HA SER A 14 0.030 14.862 -7.540 1.00 0.00 H new ATOM 0 HB2 SER A 14 0.752 13.827 -5.157 1.00 0.00 H new ATOM 0 HB3 SER A 14 2.351 14.114 -5.814 1.00 0.00 H new ATOM 0 HG SER A 14 0.318 16.135 -5.855 1.00 0.00 H new ATOM 205 N ASN A 15 2.618 13.079 -8.463 1.00 0.00 N ATOM 206 CA ASN A 15 3.728 13.011 -9.398 1.00 0.00 C ATOM 207 C ASN A 15 3.353 12.094 -10.564 1.00 0.00 C ATOM 208 O ASN A 15 4.140 11.908 -11.491 1.00 0.00 O ATOM 209 CB ASN A 15 4.978 12.436 -8.727 1.00 0.00 C ATOM 210 CG ASN A 15 6.202 13.312 -9.006 1.00 0.00 C ATOM 211 OD1 ASN A 15 6.144 14.530 -8.978 1.00 0.00 O ATOM 212 ND2 ASN A 15 7.308 12.625 -9.276 1.00 0.00 N ATOM 0 H ASN A 15 2.435 12.214 -7.955 1.00 0.00 H new ATOM 0 HA ASN A 15 3.938 14.022 -9.746 1.00 0.00 H new ATOM 0 HB2 ASN A 15 4.817 12.362 -7.652 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.159 11.425 -9.092 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.178 13.118 -9.476 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.286 11.605 -9.283 1.00 0.00 H new ATOM 219 N GLY A 16 2.151 11.544 -10.479 1.00 0.00 N ATOM 220 CA GLY A 16 1.661 10.650 -11.514 1.00 0.00 C ATOM 221 C GLY A 16 2.605 9.461 -11.704 1.00 0.00 C ATOM 222 O GLY A 16 2.568 8.793 -12.737 1.00 0.00 O ATOM 0 H GLY A 16 1.501 11.700 -9.708 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.667 10.291 -11.248 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.563 11.194 -12.453 1.00 0.00 H new ATOM 226 N VAL A 17 3.429 9.233 -10.691 1.00 0.00 N ATOM 227 CA VAL A 17 4.381 8.136 -10.733 1.00 0.00 C ATOM 228 C VAL A 17 3.735 6.883 -10.138 1.00 0.00 C ATOM 229 O VAL A 17 3.160 6.933 -9.051 1.00 0.00 O ATOM 230 CB VAL A 17 5.674 8.538 -10.021 1.00 0.00 C ATOM 231 CG1 VAL A 17 6.514 7.307 -9.675 1.00 0.00 C ATOM 232 CG2 VAL A 17 6.477 9.532 -10.861 1.00 0.00 C ATOM 0 H VAL A 17 3.457 9.789 -9.837 1.00 0.00 H new ATOM 0 HA VAL A 17 4.652 7.904 -11.763 1.00 0.00 H new ATOM 0 HB VAL A 17 5.403 9.032 -9.088 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.428 7.620 -9.170 1.00 0.00 H new ATOM 0 HG12 VAL A 17 5.943 6.650 -9.019 1.00 0.00 H new ATOM 0 HG13 VAL A 17 6.770 6.773 -10.590 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.391 9.801 -10.331 1.00 0.00 H new ATOM 0 HG22 VAL A 17 6.733 9.077 -11.818 1.00 0.00 H new ATOM 0 HG23 VAL A 17 5.881 10.428 -11.033 1.00 0.00 H new ATOM 242 N SER A 18 3.850 5.789 -10.877 1.00 0.00 N ATOM 243 CA SER A 18 3.285 4.525 -10.435 1.00 0.00 C ATOM 244 C SER A 18 4.405 3.536 -10.109 1.00 0.00 C ATOM 245 O SER A 18 5.455 3.547 -10.750 1.00 0.00 O ATOM 246 CB SER A 18 2.351 3.939 -11.496 1.00 0.00 C ATOM 247 OG SER A 18 2.673 4.404 -12.805 1.00 0.00 O ATOM 0 H SER A 18 4.326 5.752 -11.778 1.00 0.00 H new ATOM 0 HA SER A 18 2.699 4.709 -9.535 1.00 0.00 H new ATOM 0 HB2 SER A 18 2.412 2.851 -11.472 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.321 4.205 -11.260 1.00 0.00 H new ATOM 0 HG SER A 18 2.056 4.006 -13.454 1.00 0.00 H new ATOM 253 N VAL A 19 4.144 2.703 -9.111 1.00 0.00 N ATOM 254 CA VAL A 19 5.118 1.710 -8.693 1.00 0.00 C ATOM 255 C VAL A 19 4.389 0.524 -8.057 1.00 0.00 C ATOM 256 O VAL A 19 3.616 0.698 -7.116 1.00 0.00 O ATOM 257 CB VAL A 19 6.148 2.347 -7.759 1.00 0.00 C ATOM 258 CG1 VAL A 19 6.716 1.316 -6.782 1.00 0.00 C ATOM 259 CG2 VAL A 19 7.267 3.022 -8.556 1.00 0.00 C ATOM 0 H VAL A 19 3.273 2.696 -8.581 1.00 0.00 H new ATOM 0 HA VAL A 19 5.670 1.331 -9.553 1.00 0.00 H new ATOM 0 HB VAL A 19 5.641 3.116 -7.176 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.446 1.796 -6.130 1.00 0.00 H new ATOM 0 HG12 VAL A 19 5.908 0.902 -6.179 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.200 0.514 -7.340 1.00 0.00 H new ATOM 0 HG21 VAL A 19 7.986 3.467 -7.868 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.770 2.281 -9.177 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.843 3.800 -9.191 1.00 0.00 H new ATOM 269 N ASP A 20 4.660 -0.655 -8.599 1.00 0.00 N ATOM 270 CA ASP A 20 4.039 -1.869 -8.096 1.00 0.00 C ATOM 271 C ASP A 20 5.128 -2.857 -7.674 1.00 0.00 C ATOM 272 O ASP A 20 6.198 -2.903 -8.279 1.00 0.00 O ATOM 273 CB ASP A 20 3.186 -2.539 -9.175 1.00 0.00 C ATOM 274 CG ASP A 20 2.815 -1.640 -10.356 1.00 0.00 C ATOM 275 OD1 ASP A 20 3.745 -1.004 -10.900 1.00 0.00 O ATOM 276 OD2 ASP A 20 1.610 -1.608 -10.689 1.00 0.00 O ATOM 0 H ASP A 20 5.300 -0.795 -9.380 1.00 0.00 H new ATOM 0 HA ASP A 20 3.405 -1.598 -7.251 1.00 0.00 H new ATOM 0 HB2 ASP A 20 3.723 -3.408 -9.554 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.269 -2.907 -8.715 1.00 0.00 H new ATOM 281 N TYR A 21 4.819 -3.623 -6.638 1.00 0.00 N ATOM 282 CA TYR A 21 5.758 -4.607 -6.128 1.00 0.00 C ATOM 283 C TYR A 21 5.041 -5.905 -5.749 1.00 0.00 C ATOM 284 O TYR A 21 4.056 -5.881 -5.014 1.00 0.00 O ATOM 285 CB TYR A 21 6.372 -3.992 -4.869 1.00 0.00 C ATOM 286 CG TYR A 21 7.819 -3.526 -5.046 1.00 0.00 C ATOM 287 CD1 TYR A 21 8.122 -2.553 -5.977 1.00 0.00 C ATOM 288 CD2 TYR A 21 8.820 -4.078 -4.274 1.00 0.00 C ATOM 289 CE1 TYR A 21 9.483 -2.114 -6.144 1.00 0.00 C ATOM 290 CE2 TYR A 21 10.182 -3.639 -4.440 1.00 0.00 C ATOM 291 CZ TYR A 21 10.447 -2.680 -5.366 1.00 0.00 C ATOM 292 OH TYR A 21 11.733 -2.266 -5.524 1.00 0.00 O ATOM 0 H TYR A 21 3.931 -3.582 -6.138 1.00 0.00 H new ATOM 0 HA TYR A 21 6.506 -4.850 -6.883 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.763 -3.143 -4.558 1.00 0.00 H new ATOM 0 HB3 TYR A 21 6.333 -4.725 -4.063 1.00 0.00 H new ATOM 0 HD1 TYR A 21 7.338 -2.121 -6.581 1.00 0.00 H new ATOM 0 HD2 TYR A 21 8.583 -4.839 -3.545 1.00 0.00 H new ATOM 0 HE1 TYR A 21 9.734 -1.354 -6.869 1.00 0.00 H new ATOM 0 HE2 TYR A 21 10.975 -4.063 -3.842 1.00 0.00 H new ATOM 0 HH TYR A 21 11.808 -1.324 -5.264 1.00 0.00 H new ATOM 302 N GLU A 22 5.565 -7.006 -6.268 1.00 0.00 N ATOM 303 CA GLU A 22 4.987 -8.311 -5.994 1.00 0.00 C ATOM 304 C GLU A 22 5.562 -8.882 -4.696 1.00 0.00 C ATOM 305 O GLU A 22 6.750 -9.190 -4.623 1.00 0.00 O ATOM 306 CB GLU A 22 5.216 -9.268 -7.165 1.00 0.00 C ATOM 307 CG GLU A 22 4.714 -10.674 -6.829 1.00 0.00 C ATOM 308 CD GLU A 22 5.192 -11.690 -7.868 1.00 0.00 C ATOM 309 OE1 GLU A 22 6.424 -11.892 -7.940 1.00 0.00 O ATOM 310 OE2 GLU A 22 4.315 -12.242 -8.567 1.00 0.00 O ATOM 0 H GLU A 22 6.383 -7.021 -6.877 1.00 0.00 H new ATOM 0 HA GLU A 22 3.910 -8.193 -5.871 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.700 -8.896 -8.050 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.278 -9.305 -7.407 1.00 0.00 H new ATOM 0 HG2 GLU A 22 5.070 -10.964 -5.841 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.625 -10.675 -6.788 1.00 0.00 H new ATOM 317 N THR A 23 4.691 -9.008 -3.705 1.00 0.00 N ATOM 318 CA THR A 23 5.098 -9.538 -2.415 1.00 0.00 C ATOM 319 C THR A 23 4.057 -10.533 -1.896 1.00 0.00 C ATOM 320 O THR A 23 2.898 -10.176 -1.694 1.00 0.00 O ATOM 321 CB THR A 23 5.332 -8.357 -1.472 1.00 0.00 C ATOM 322 OG1 THR A 23 5.941 -8.944 -0.325 1.00 0.00 O ATOM 323 CG2 THR A 23 4.026 -7.765 -0.938 1.00 0.00 C ATOM 0 H THR A 23 3.706 -8.752 -3.770 1.00 0.00 H new ATOM 0 HA THR A 23 6.029 -10.100 -2.493 1.00 0.00 H new ATOM 0 HB THR A 23 5.895 -7.583 -1.994 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.129 -8.247 0.338 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.250 -6.930 -0.274 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.418 -7.413 -1.772 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.478 -8.530 -0.388 1.00 0.00 H new ATOM 331 N GLU A 24 4.509 -11.762 -1.695 1.00 0.00 N ATOM 332 CA GLU A 24 3.633 -12.811 -1.203 1.00 0.00 C ATOM 333 C GLU A 24 3.636 -12.833 0.326 1.00 0.00 C ATOM 334 O GLU A 24 4.522 -13.428 0.939 1.00 0.00 O ATOM 335 CB GLU A 24 4.035 -14.173 -1.772 1.00 0.00 C ATOM 336 CG GLU A 24 5.541 -14.403 -1.631 1.00 0.00 C ATOM 337 CD GLU A 24 5.841 -15.857 -1.257 1.00 0.00 C ATOM 338 OE1 GLU A 24 5.342 -16.284 -0.195 1.00 0.00 O ATOM 339 OE2 GLU A 24 6.563 -16.506 -2.043 1.00 0.00 O ATOM 0 H GLU A 24 5.471 -12.055 -1.864 1.00 0.00 H new ATOM 0 HA GLU A 24 2.619 -12.598 -1.541 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.493 -14.963 -1.252 1.00 0.00 H new ATOM 0 HB3 GLU A 24 3.752 -14.230 -2.823 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.040 -14.154 -2.568 1.00 0.00 H new ATOM 0 HG3 GLU A 24 5.944 -13.737 -0.868 1.00 0.00 H new ATOM 346 N THR A 25 2.638 -12.177 0.898 1.00 0.00 N ATOM 347 CA THR A 25 2.515 -12.113 2.345 1.00 0.00 C ATOM 348 C THR A 25 1.078 -12.419 2.772 1.00 0.00 C ATOM 349 O THR A 25 0.159 -11.664 2.458 1.00 0.00 O ATOM 350 CB THR A 25 3.004 -10.738 2.801 1.00 0.00 C ATOM 351 OG1 THR A 25 2.439 -9.836 1.854 1.00 0.00 O ATOM 352 CG2 THR A 25 4.515 -10.566 2.624 1.00 0.00 C ATOM 0 H THR A 25 1.906 -11.685 0.386 1.00 0.00 H new ATOM 0 HA THR A 25 3.133 -12.870 2.828 1.00 0.00 H new ATOM 0 HB THR A 25 2.741 -10.589 3.848 1.00 0.00 H new ATOM 0 HG1 THR A 25 2.705 -8.919 2.076 1.00 0.00 H new ATOM 0 HG21 THR A 25 4.810 -9.573 2.963 1.00 0.00 H new ATOM 0 HG22 THR A 25 5.038 -11.320 3.212 1.00 0.00 H new ATOM 0 HG23 THR A 25 4.774 -10.682 1.572 1.00 0.00 H new ATOM 360 N PRO A 26 0.925 -13.557 3.501 1.00 0.00 N ATOM 361 CA PRO A 26 -0.385 -13.972 3.974 1.00 0.00 C ATOM 362 C PRO A 26 -0.837 -13.112 5.157 1.00 0.00 C ATOM 363 O PRO A 26 -1.464 -12.071 4.967 1.00 0.00 O ATOM 364 CB PRO A 26 -0.226 -15.440 4.335 1.00 0.00 C ATOM 365 CG PRO A 26 1.269 -15.672 4.489 1.00 0.00 C ATOM 366 CD PRO A 26 1.991 -14.475 3.892 1.00 0.00 C ATOM 0 HA PRO A 26 -1.164 -13.842 3.223 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.755 -15.674 5.259 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -0.643 -16.081 3.558 1.00 0.00 H new ATOM 0 HG2 PRO A 26 1.531 -15.790 5.541 1.00 0.00 H new ATOM 0 HG3 PRO A 26 1.567 -16.589 3.982 1.00 0.00 H new ATOM 0 HD2 PRO A 26 2.663 -14.016 4.617 1.00 0.00 H new ATOM 0 HD3 PRO A 26 2.598 -14.766 3.034 1.00 0.00 H new ATOM 374 N MET A 27 -0.504 -13.580 6.350 1.00 0.00 N ATOM 375 CA MET A 27 -0.869 -12.868 7.563 1.00 0.00 C ATOM 376 C MET A 27 0.021 -11.639 7.765 1.00 0.00 C ATOM 377 O MET A 27 -0.396 -10.663 8.385 1.00 0.00 O ATOM 378 CB MET A 27 -0.731 -13.803 8.765 1.00 0.00 C ATOM 379 CG MET A 27 -1.643 -15.023 8.619 1.00 0.00 C ATOM 380 SD MET A 27 -2.792 -15.093 9.983 1.00 0.00 S ATOM 381 CE MET A 27 -4.335 -15.138 9.087 1.00 0.00 C ATOM 0 H MET A 27 0.015 -14.444 6.503 1.00 0.00 H new ATOM 0 HA MET A 27 -1.902 -12.534 7.470 1.00 0.00 H new ATOM 0 HB2 MET A 27 0.305 -14.128 8.860 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.981 -13.265 9.679 1.00 0.00 H new ATOM 0 HG2 MET A 27 -2.188 -14.969 7.676 1.00 0.00 H new ATOM 0 HG3 MET A 27 -1.044 -15.933 8.590 1.00 0.00 H new ATOM 0 HE1 MET A 27 -5.164 -15.184 9.793 1.00 0.00 H new ATOM 0 HE2 MET A 27 -4.427 -14.240 8.476 1.00 0.00 H new ATOM 0 HE3 MET A 27 -4.357 -16.018 8.444 1.00 0.00 H new ATOM 391 N THR A 28 1.230 -11.730 7.231 1.00 0.00 N ATOM 392 CA THR A 28 2.182 -10.638 7.347 1.00 0.00 C ATOM 393 C THR A 28 1.556 -9.332 6.858 1.00 0.00 C ATOM 394 O THR A 28 1.892 -8.256 7.351 1.00 0.00 O ATOM 395 CB THR A 28 3.447 -11.032 6.578 1.00 0.00 C ATOM 396 OG1 THR A 28 3.403 -12.455 6.543 1.00 0.00 O ATOM 397 CG2 THR A 28 4.726 -10.716 7.356 1.00 0.00 C ATOM 0 H THR A 28 1.572 -12.542 6.717 1.00 0.00 H new ATOM 0 HA THR A 28 2.457 -10.460 8.387 1.00 0.00 H new ATOM 0 HB THR A 28 3.467 -10.512 5.620 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.186 -12.795 6.061 1.00 0.00 H new ATOM 0 HG21 THR A 28 5.593 -11.015 6.767 1.00 0.00 H new ATOM 0 HG22 THR A 28 4.775 -9.646 7.557 1.00 0.00 H new ATOM 0 HG23 THR A 28 4.723 -11.262 8.299 1.00 0.00 H new ATOM 405 N LEU A 29 0.657 -9.466 5.893 1.00 0.00 N ATOM 406 CA LEU A 29 -0.018 -8.309 5.333 1.00 0.00 C ATOM 407 C LEU A 29 -0.604 -7.467 6.469 1.00 0.00 C ATOM 408 O LEU A 29 -0.708 -6.247 6.351 1.00 0.00 O ATOM 409 CB LEU A 29 -1.053 -8.745 4.294 1.00 0.00 C ATOM 410 CG LEU A 29 -0.534 -8.922 2.865 1.00 0.00 C ATOM 411 CD1 LEU A 29 -1.555 -9.662 1.999 1.00 0.00 C ATOM 412 CD2 LEU A 29 -0.135 -7.576 2.256 1.00 0.00 C ATOM 0 H LEU A 29 0.381 -10.359 5.485 1.00 0.00 H new ATOM 0 HA LEU A 29 0.690 -7.676 4.798 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.491 -9.688 4.620 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.857 -8.009 4.279 1.00 0.00 H new ATOM 0 HG LEU A 29 0.364 -9.538 2.902 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.162 -9.775 0.989 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.748 -10.647 2.425 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.484 -9.093 1.965 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.230 -7.730 1.241 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.002 -6.916 2.234 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.651 -7.122 2.859 1.00 0.00 H new ATOM 424 N LEU A 30 -0.973 -8.152 7.541 1.00 0.00 N ATOM 425 CA LEU A 30 -1.546 -7.482 8.696 1.00 0.00 C ATOM 426 C LEU A 30 -0.423 -6.863 9.531 1.00 0.00 C ATOM 427 O LEU A 30 -0.629 -5.856 10.207 1.00 0.00 O ATOM 428 CB LEU A 30 -2.440 -8.442 9.483 1.00 0.00 C ATOM 429 CG LEU A 30 -3.390 -9.306 8.654 1.00 0.00 C ATOM 430 CD1 LEU A 30 -4.241 -10.205 9.553 1.00 0.00 C ATOM 431 CD2 LEU A 30 -4.250 -8.444 7.727 1.00 0.00 C ATOM 0 H LEU A 30 -0.886 -9.164 7.634 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.195 -6.666 8.379 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.802 -9.101 10.072 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.033 -7.859 10.188 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.790 -9.959 8.021 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.908 -10.809 8.937 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.591 -10.860 10.133 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.832 -9.588 10.230 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.916 -9.084 7.149 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.841 -7.748 8.322 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.606 -7.885 7.049 1.00 0.00 H new ATOM 443 N VAL A 31 0.742 -7.491 9.455 1.00 0.00 N ATOM 444 CA VAL A 31 1.898 -7.015 10.195 1.00 0.00 C ATOM 445 C VAL A 31 2.214 -5.579 9.771 1.00 0.00 C ATOM 446 O VAL A 31 2.231 -5.269 8.581 1.00 0.00 O ATOM 447 CB VAL A 31 3.076 -7.970 9.996 1.00 0.00 C ATOM 448 CG1 VAL A 31 4.325 -7.456 10.715 1.00 0.00 C ATOM 449 CG2 VAL A 31 2.721 -9.384 10.458 1.00 0.00 C ATOM 0 H VAL A 31 0.910 -8.325 8.892 1.00 0.00 H new ATOM 0 HA VAL A 31 1.687 -6.999 11.264 1.00 0.00 H new ATOM 0 HB VAL A 31 3.296 -8.012 8.929 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.148 -8.153 10.558 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.597 -6.478 10.318 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.121 -7.370 11.782 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.576 -10.042 10.305 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.461 -9.366 11.516 1.00 0.00 H new ATOM 0 HG23 VAL A 31 1.872 -9.753 9.882 1.00 0.00 H new ATOM 459 N PRO A 32 2.463 -4.718 10.795 1.00 0.00 N ATOM 460 CA PRO A 32 2.778 -3.323 10.539 1.00 0.00 C ATOM 461 C PRO A 32 4.207 -3.170 10.017 1.00 0.00 C ATOM 462 O PRO A 32 4.450 -2.420 9.072 1.00 0.00 O ATOM 463 CB PRO A 32 2.552 -2.619 11.868 1.00 0.00 C ATOM 464 CG PRO A 32 2.571 -3.711 12.925 1.00 0.00 C ATOM 465 CD PRO A 32 2.451 -5.050 12.216 1.00 0.00 C ATOM 0 HA PRO A 32 2.153 -2.887 9.760 1.00 0.00 H new ATOM 0 HB2 PRO A 32 3.331 -1.880 12.056 1.00 0.00 H new ATOM 0 HB3 PRO A 32 1.600 -2.088 11.872 1.00 0.00 H new ATOM 0 HG2 PRO A 32 3.494 -3.667 13.503 1.00 0.00 H new ATOM 0 HG3 PRO A 32 1.749 -3.576 13.628 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.278 -5.711 12.475 1.00 0.00 H new ATOM 0 HD3 PRO A 32 1.532 -5.565 12.495 1.00 0.00 H new ATOM 473 N GLU A 33 5.117 -3.892 10.655 1.00 0.00 N ATOM 474 CA GLU A 33 6.516 -3.845 10.266 1.00 0.00 C ATOM 475 C GLU A 33 6.673 -4.250 8.798 1.00 0.00 C ATOM 476 O GLU A 33 7.532 -3.722 8.093 1.00 0.00 O ATOM 477 CB GLU A 33 7.368 -4.734 11.175 1.00 0.00 C ATOM 478 CG GLU A 33 6.910 -4.627 12.630 1.00 0.00 C ATOM 479 CD GLU A 33 8.029 -5.040 13.588 1.00 0.00 C ATOM 480 OE1 GLU A 33 9.011 -4.271 13.679 1.00 0.00 O ATOM 481 OE2 GLU A 33 7.880 -6.115 14.207 1.00 0.00 O ATOM 0 H GLU A 33 4.913 -4.512 11.438 1.00 0.00 H new ATOM 0 HA GLU A 33 6.870 -2.821 10.379 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.300 -5.770 10.844 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.415 -4.442 11.097 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.602 -3.603 12.844 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.038 -5.262 12.788 1.00 0.00 H new ATOM 488 N VAL A 34 5.830 -5.185 8.382 1.00 0.00 N ATOM 489 CA VAL A 34 5.865 -5.666 7.012 1.00 0.00 C ATOM 490 C VAL A 34 5.095 -4.696 6.115 1.00 0.00 C ATOM 491 O VAL A 34 5.566 -4.334 5.037 1.00 0.00 O ATOM 492 CB VAL A 34 5.326 -7.097 6.947 1.00 0.00 C ATOM 493 CG1 VAL A 34 4.971 -7.484 5.510 1.00 0.00 C ATOM 494 CG2 VAL A 34 6.324 -8.087 7.550 1.00 0.00 C ATOM 0 H VAL A 34 5.120 -5.621 8.970 1.00 0.00 H new ATOM 0 HA VAL A 34 6.891 -5.702 6.646 1.00 0.00 H new ATOM 0 HB VAL A 34 4.413 -7.138 7.541 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.590 -8.505 5.492 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.208 -6.806 5.128 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.861 -7.417 4.885 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.916 -9.096 7.491 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.262 -8.042 6.996 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.506 -7.830 8.593 1.00 0.00 H new ATOM 504 N ALA A 35 3.924 -4.301 6.592 1.00 0.00 N ATOM 505 CA ALA A 35 3.084 -3.379 5.848 1.00 0.00 C ATOM 506 C ALA A 35 3.808 -2.039 5.703 1.00 0.00 C ATOM 507 O ALA A 35 3.877 -1.481 4.609 1.00 0.00 O ATOM 508 CB ALA A 35 1.731 -3.239 6.549 1.00 0.00 C ATOM 0 H ALA A 35 3.537 -4.603 7.486 1.00 0.00 H new ATOM 0 HA ALA A 35 2.892 -3.760 4.845 1.00 0.00 H new ATOM 0 HB1 ALA A 35 1.101 -2.547 5.990 1.00 0.00 H new ATOM 0 HB2 ALA A 35 1.244 -4.213 6.599 1.00 0.00 H new ATOM 0 HB3 ALA A 35 1.882 -2.857 7.559 1.00 0.00 H new ATOM 514 N ALA A 36 4.329 -1.561 6.824 1.00 0.00 N ATOM 515 CA ALA A 36 5.044 -0.296 6.837 1.00 0.00 C ATOM 516 C ALA A 36 6.194 -0.357 5.829 1.00 0.00 C ATOM 517 O ALA A 36 6.362 0.554 5.018 1.00 0.00 O ATOM 518 CB ALA A 36 5.530 0.001 8.257 1.00 0.00 C ATOM 0 H ALA A 36 4.270 -2.027 7.729 1.00 0.00 H new ATOM 0 HA ALA A 36 4.386 0.521 6.540 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.066 0.950 8.267 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.674 0.061 8.929 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.196 -0.796 8.588 1.00 0.00 H new ATOM 524 N GLU A 37 6.956 -1.437 5.911 1.00 0.00 N ATOM 525 CA GLU A 37 8.085 -1.627 5.016 1.00 0.00 C ATOM 526 C GLU A 37 7.604 -1.710 3.566 1.00 0.00 C ATOM 527 O GLU A 37 8.289 -1.249 2.653 1.00 0.00 O ATOM 528 CB GLU A 37 8.886 -2.873 5.400 1.00 0.00 C ATOM 529 CG GLU A 37 9.851 -2.571 6.549 1.00 0.00 C ATOM 530 CD GLU A 37 10.969 -3.613 6.613 1.00 0.00 C ATOM 531 OE1 GLU A 37 10.728 -4.666 7.242 1.00 0.00 O ATOM 532 OE2 GLU A 37 12.039 -3.333 6.033 1.00 0.00 O ATOM 0 H GLU A 37 6.814 -2.190 6.584 1.00 0.00 H new ATOM 0 HA GLU A 37 8.747 -0.766 5.110 1.00 0.00 H new ATOM 0 HB2 GLU A 37 8.205 -3.672 5.693 1.00 0.00 H new ATOM 0 HB3 GLU A 37 9.445 -3.231 4.535 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.281 -1.578 6.416 1.00 0.00 H new ATOM 0 HG3 GLU A 37 9.306 -2.559 7.493 1.00 0.00 H new ATOM 539 N VAL A 38 6.430 -2.300 3.398 1.00 0.00 N ATOM 540 CA VAL A 38 5.849 -2.449 2.074 1.00 0.00 C ATOM 541 C VAL A 38 5.419 -1.076 1.553 1.00 0.00 C ATOM 542 O VAL A 38 5.697 -0.729 0.407 1.00 0.00 O ATOM 543 CB VAL A 38 4.700 -3.459 2.118 1.00 0.00 C ATOM 544 CG1 VAL A 38 3.533 -2.998 1.243 1.00 0.00 C ATOM 545 CG2 VAL A 38 5.179 -4.852 1.704 1.00 0.00 C ATOM 0 H VAL A 38 5.865 -2.681 4.157 1.00 0.00 H new ATOM 0 HA VAL A 38 6.586 -2.845 1.375 1.00 0.00 H new ATOM 0 HB VAL A 38 4.345 -3.519 3.147 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.729 -3.733 1.291 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.167 -2.036 1.602 1.00 0.00 H new ATOM 0 HG13 VAL A 38 3.870 -2.896 0.211 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.343 -5.551 1.744 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.573 -4.814 0.688 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.963 -5.184 2.385 1.00 0.00 H new ATOM 555 N ILE A 39 4.748 -0.333 2.421 1.00 0.00 N ATOM 556 CA ILE A 39 4.278 0.994 2.061 1.00 0.00 C ATOM 557 C ILE A 39 5.479 1.922 1.870 1.00 0.00 C ATOM 558 O ILE A 39 5.514 2.709 0.925 1.00 0.00 O ATOM 559 CB ILE A 39 3.268 1.501 3.093 1.00 0.00 C ATOM 560 CG1 ILE A 39 2.033 0.598 3.141 1.00 0.00 C ATOM 561 CG2 ILE A 39 2.899 2.962 2.828 1.00 0.00 C ATOM 562 CD1 ILE A 39 1.482 0.348 1.737 1.00 0.00 C ATOM 0 H ILE A 39 4.519 -0.624 3.371 1.00 0.00 H new ATOM 0 HA ILE A 39 3.744 0.965 1.111 1.00 0.00 H new ATOM 0 HB ILE A 39 3.736 1.460 4.077 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.291 -0.352 3.609 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.264 1.060 3.760 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.180 3.297 3.576 1.00 0.00 H new ATOM 0 HG22 ILE A 39 3.795 3.580 2.884 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.458 3.052 1.835 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.605 -0.296 1.800 1.00 0.00 H new ATOM 0 HD12 ILE A 39 1.203 1.298 1.281 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.245 -0.136 1.128 1.00 0.00 H new ATOM 574 N LYS A 40 6.433 1.799 2.780 1.00 0.00 N ATOM 575 CA LYS A 40 7.632 2.616 2.724 1.00 0.00 C ATOM 576 C LYS A 40 8.497 2.164 1.546 1.00 0.00 C ATOM 577 O LYS A 40 9.065 2.991 0.834 1.00 0.00 O ATOM 578 CB LYS A 40 8.363 2.591 4.068 1.00 0.00 C ATOM 579 CG LYS A 40 9.878 2.668 3.871 1.00 0.00 C ATOM 580 CD LYS A 40 10.504 1.271 3.891 1.00 0.00 C ATOM 581 CE LYS A 40 11.957 1.315 3.415 1.00 0.00 C ATOM 582 NZ LYS A 40 12.787 2.100 4.356 1.00 0.00 N ATOM 0 H LYS A 40 6.400 1.145 3.562 1.00 0.00 H new ATOM 0 HA LYS A 40 7.372 3.660 2.549 1.00 0.00 H new ATOM 0 HB2 LYS A 40 8.030 3.427 4.683 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.109 1.678 4.607 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.101 3.157 2.923 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.320 3.280 4.657 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.461 0.863 4.901 1.00 0.00 H new ATOM 0 HD3 LYS A 40 9.928 0.601 3.252 1.00 0.00 H new ATOM 0 HE2 LYS A 40 12.350 0.302 3.333 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.007 1.758 2.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.786 2.036 4.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.486 3.095 4.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.673 1.722 5.318 1.00 0.00 H new ATOM 596 N ASP A 41 8.571 0.852 1.376 1.00 0.00 N ATOM 597 CA ASP A 41 9.357 0.279 0.297 1.00 0.00 C ATOM 598 C ASP A 41 8.852 0.824 -1.041 1.00 0.00 C ATOM 599 O ASP A 41 9.646 1.215 -1.895 1.00 0.00 O ATOM 600 CB ASP A 41 9.224 -1.244 0.267 1.00 0.00 C ATOM 601 CG ASP A 41 9.728 -1.912 -1.014 1.00 0.00 C ATOM 602 OD1 ASP A 41 10.753 -1.429 -1.540 1.00 0.00 O ATOM 603 OD2 ASP A 41 9.077 -2.892 -1.438 1.00 0.00 O ATOM 0 H ASP A 41 8.099 0.169 1.968 1.00 0.00 H new ATOM 0 HA ASP A 41 10.401 0.546 0.462 1.00 0.00 H new ATOM 0 HB2 ASP A 41 9.771 -1.658 1.114 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.175 -1.505 0.406 1.00 0.00 H new ATOM 608 N LEU A 42 7.535 0.833 -1.181 1.00 0.00 N ATOM 609 CA LEU A 42 6.915 1.324 -2.399 1.00 0.00 C ATOM 610 C LEU A 42 7.296 2.791 -2.606 1.00 0.00 C ATOM 611 O LEU A 42 7.770 3.168 -3.676 1.00 0.00 O ATOM 612 CB LEU A 42 5.404 1.079 -2.368 1.00 0.00 C ATOM 613 CG LEU A 42 4.942 -0.320 -2.779 1.00 0.00 C ATOM 614 CD1 LEU A 42 4.109 -0.969 -1.672 1.00 0.00 C ATOM 615 CD2 LEU A 42 4.194 -0.281 -4.112 1.00 0.00 C ATOM 0 H LEU A 42 6.880 0.508 -0.470 1.00 0.00 H new ATOM 0 HA LEU A 42 7.286 0.774 -3.263 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.045 1.276 -1.358 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.925 1.805 -3.024 1.00 0.00 H new ATOM 0 HG LEU A 42 5.825 -0.943 -2.924 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.793 -1.963 -1.990 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.709 -1.051 -0.766 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.230 -0.356 -1.471 1.00 0.00 H new ATOM 0 HD21 LEU A 42 3.877 -1.289 -4.381 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.319 0.362 -4.020 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.852 0.111 -4.887 1.00 0.00 H new ATOM 627 N VAL A 43 7.076 3.579 -1.564 1.00 0.00 N ATOM 628 CA VAL A 43 7.390 4.997 -1.618 1.00 0.00 C ATOM 629 C VAL A 43 8.894 5.172 -1.837 1.00 0.00 C ATOM 630 O VAL A 43 9.313 5.959 -2.685 1.00 0.00 O ATOM 631 CB VAL A 43 6.886 5.692 -0.352 1.00 0.00 C ATOM 632 CG1 VAL A 43 7.818 6.837 0.053 1.00 0.00 C ATOM 633 CG2 VAL A 43 5.451 6.192 -0.535 1.00 0.00 C ATOM 0 H VAL A 43 6.684 3.263 -0.677 1.00 0.00 H new ATOM 0 HA VAL A 43 6.881 5.470 -2.458 1.00 0.00 H new ATOM 0 HB VAL A 43 6.885 4.959 0.455 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.437 7.314 0.956 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.816 6.443 0.244 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.865 7.570 -0.753 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.117 6.682 0.380 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.416 6.902 -1.361 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.797 5.348 -0.754 1.00 0.00 H new ATOM 643 N ASN A 44 9.665 4.426 -1.059 1.00 0.00 N ATOM 644 CA ASN A 44 11.113 4.490 -1.158 1.00 0.00 C ATOM 645 C ASN A 44 11.534 4.196 -2.600 1.00 0.00 C ATOM 646 O ASN A 44 12.487 4.789 -3.105 1.00 0.00 O ATOM 647 CB ASN A 44 11.774 3.451 -0.251 1.00 0.00 C ATOM 648 CG ASN A 44 12.359 4.108 1.000 1.00 0.00 C ATOM 649 OD1 ASN A 44 11.449 4.655 1.800 1.00 0.00 O flip ATOM 650 ND2 ASN A 44 13.559 4.116 1.225 1.00 0.00 N flip ATOM 0 H ASN A 44 9.314 3.774 -0.357 1.00 0.00 H new ATOM 0 HA ASN A 44 11.428 5.487 -0.852 1.00 0.00 H new ATOM 0 HB2 ASN A 44 11.042 2.697 0.038 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.563 2.935 -0.798 1.00 0.00 H new ATOM 0 HD21 ASN A 44 14.204 3.677 0.568 1.00 0.00 H new ATOM 0 HD22 ASN A 44 13.916 4.562 2.070 1.00 0.00 H new ATOM 657 N THR A 45 10.804 3.282 -3.222 1.00 0.00 N ATOM 658 CA THR A 45 11.091 2.903 -4.595 1.00 0.00 C ATOM 659 C THR A 45 10.682 4.022 -5.553 1.00 0.00 C ATOM 660 O THR A 45 11.398 4.316 -6.510 1.00 0.00 O ATOM 661 CB THR A 45 10.385 1.574 -4.875 1.00 0.00 C ATOM 662 OG1 THR A 45 11.379 0.589 -4.608 1.00 0.00 O ATOM 663 CG2 THR A 45 10.061 1.386 -6.358 1.00 0.00 C ATOM 0 H THR A 45 10.014 2.793 -2.801 1.00 0.00 H new ATOM 0 HA THR A 45 12.160 2.759 -4.751 1.00 0.00 H new ATOM 0 HB THR A 45 9.465 1.522 -4.293 1.00 0.00 H new ATOM 0 HG1 THR A 45 11.325 0.317 -3.668 1.00 0.00 H new ATOM 0 HG21 THR A 45 9.561 0.428 -6.503 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.407 2.191 -6.692 1.00 0.00 H new ATOM 0 HG23 THR A 45 10.984 1.405 -6.937 1.00 0.00 H new ATOM 925 N LYS B 203 -2.943 17.977 -7.364 1.00 0.00 N ATOM 926 CA LYS B 203 -3.351 17.513 -6.050 1.00 0.00 C ATOM 927 C LYS B 203 -2.382 16.429 -5.573 1.00 0.00 C ATOM 928 O LYS B 203 -1.762 15.743 -6.385 1.00 0.00 O ATOM 929 CB LYS B 203 -4.813 17.063 -6.071 1.00 0.00 C ATOM 930 CG LYS B 203 -5.508 17.393 -4.749 1.00 0.00 C ATOM 931 CD LYS B 203 -7.026 17.450 -4.926 1.00 0.00 C ATOM 932 CE LYS B 203 -7.545 18.880 -4.757 1.00 0.00 C ATOM 933 NZ LYS B 203 -8.989 18.948 -5.075 1.00 0.00 N ATOM 0 HA LYS B 203 -3.302 18.327 -5.327 1.00 0.00 H new ATOM 0 HB2 LYS B 203 -5.336 17.552 -6.893 1.00 0.00 H new ATOM 0 HB3 LYS B 203 -4.864 15.990 -6.255 1.00 0.00 H new ATOM 0 HG2 LYS B 203 -5.254 16.640 -4.003 1.00 0.00 H new ATOM 0 HG3 LYS B 203 -5.146 18.350 -4.373 1.00 0.00 H new ATOM 0 HD2 LYS B 203 -7.295 17.076 -5.914 1.00 0.00 H new ATOM 0 HD3 LYS B 203 -7.505 16.797 -4.197 1.00 0.00 H new ATOM 0 HE2 LYS B 203 -7.376 19.216 -3.734 1.00 0.00 H new ATOM 0 HE3 LYS B 203 -6.991 19.554 -5.410 1.00 0.00 H new ATOM 0 HZ1 LYS B 203 -9.325 19.925 -4.955 1.00 0.00 H new ATOM 0 HZ2 LYS B 203 -9.142 18.647 -6.059 1.00 0.00 H new ATOM 0 HZ3 LYS B 203 -9.515 18.320 -4.435 1.00 0.00 H new ATOM 947 N ALA B 204 -2.280 16.309 -4.257 1.00 0.00 N ATOM 948 CA ALA B 204 -1.397 15.322 -3.662 1.00 0.00 C ATOM 949 C ALA B 204 -2.225 14.134 -3.169 1.00 0.00 C ATOM 950 O ALA B 204 -2.944 14.241 -2.177 1.00 0.00 O ATOM 951 CB ALA B 204 -0.586 15.972 -2.539 1.00 0.00 C ATOM 0 H ALA B 204 -2.795 16.880 -3.587 1.00 0.00 H new ATOM 0 HA ALA B 204 -0.689 14.947 -4.401 1.00 0.00 H new ATOM 0 HB1 ALA B 204 0.077 15.231 -2.093 1.00 0.00 H new ATOM 0 HB2 ALA B 204 0.007 16.791 -2.946 1.00 0.00 H new ATOM 0 HB3 ALA B 204 -1.264 16.358 -1.777 1.00 0.00 H new ATOM 957 N THR B 205 -2.097 13.026 -3.886 1.00 0.00 N ATOM 958 CA THR B 205 -2.826 11.819 -3.535 1.00 0.00 C ATOM 959 C THR B 205 -2.018 10.578 -3.919 1.00 0.00 C ATOM 960 O THR B 205 -1.094 10.660 -4.727 1.00 0.00 O ATOM 961 CB THR B 205 -4.199 11.882 -4.207 1.00 0.00 C ATOM 962 OG1 THR B 205 -3.908 12.229 -5.559 1.00 0.00 O ATOM 963 CG2 THR B 205 -5.047 13.049 -3.697 1.00 0.00 C ATOM 0 H THR B 205 -1.499 12.939 -4.708 1.00 0.00 H new ATOM 0 HA THR B 205 -2.979 11.749 -2.458 1.00 0.00 H new ATOM 0 HB THR B 205 -4.730 10.946 -4.037 1.00 0.00 H new ATOM 0 HG1 THR B 205 -4.743 12.290 -6.068 1.00 0.00 H new ATOM 0 HG21 THR B 205 -6.011 13.048 -4.206 1.00 0.00 H new ATOM 0 HG22 THR B 205 -5.203 12.943 -2.623 1.00 0.00 H new ATOM 0 HG23 THR B 205 -4.532 13.988 -3.898 1.00 0.00 H new ATOM 971 N TYR B 206 -2.396 9.458 -3.322 1.00 0.00 N ATOM 972 CA TYR B 206 -1.717 8.201 -3.592 1.00 0.00 C ATOM 973 C TYR B 206 -2.723 7.057 -3.746 1.00 0.00 C ATOM 974 O TYR B 206 -3.717 6.999 -3.025 1.00 0.00 O ATOM 975 CB TYR B 206 -0.836 7.927 -2.371 1.00 0.00 C ATOM 976 CG TYR B 206 0.601 8.434 -2.516 1.00 0.00 C ATOM 977 CD1 TYR B 206 0.857 9.789 -2.517 1.00 0.00 C ATOM 978 CD2 TYR B 206 1.640 7.535 -2.644 1.00 0.00 C ATOM 979 CE1 TYR B 206 2.209 10.266 -2.653 1.00 0.00 C ATOM 980 CE2 TYR B 206 2.992 8.012 -2.780 1.00 0.00 C ATOM 981 CZ TYR B 206 3.210 9.354 -2.777 1.00 0.00 C ATOM 982 OH TYR B 206 4.486 9.805 -2.906 1.00 0.00 O ATOM 0 H TYR B 206 -3.163 9.394 -2.653 1.00 0.00 H new ATOM 0 HA TYR B 206 -1.143 8.266 -4.516 1.00 0.00 H new ATOM 0 HB2 TYR B 206 -1.289 8.394 -1.496 1.00 0.00 H new ATOM 0 HB3 TYR B 206 -0.815 6.853 -2.184 1.00 0.00 H new ATOM 0 HD1 TYR B 206 0.044 10.492 -2.416 1.00 0.00 H new ATOM 0 HD2 TYR B 206 1.439 6.474 -2.642 1.00 0.00 H new ATOM 0 HE1 TYR B 206 2.423 11.325 -2.656 1.00 0.00 H new ATOM 0 HE2 TYR B 206 3.814 7.319 -2.882 1.00 0.00 H new ATOM 0 HH TYR B 206 4.846 9.525 -3.773 1.00 0.00 H new ATOM 992 N THR B 207 -2.427 6.176 -4.690 1.00 0.00 N ATOM 993 CA THR B 207 -3.293 5.038 -4.949 1.00 0.00 C ATOM 994 C THR B 207 -2.574 3.733 -4.602 1.00 0.00 C ATOM 995 O THR B 207 -1.653 3.320 -5.304 1.00 0.00 O ATOM 996 CB THR B 207 -3.748 5.111 -6.408 1.00 0.00 C ATOM 997 OG1 THR B 207 -4.078 6.485 -6.599 1.00 0.00 O ATOM 998 CG2 THR B 207 -5.067 4.374 -6.647 1.00 0.00 C ATOM 0 H THR B 207 -1.600 6.227 -5.285 1.00 0.00 H new ATOM 0 HA THR B 207 -4.180 5.064 -4.316 1.00 0.00 H new ATOM 0 HB THR B 207 -2.976 4.690 -7.052 1.00 0.00 H new ATOM 0 HG1 THR B 207 -4.382 6.623 -7.520 1.00 0.00 H new ATOM 0 HG21 THR B 207 -5.345 4.457 -7.698 1.00 0.00 H new ATOM 0 HG22 THR B 207 -4.949 3.323 -6.384 1.00 0.00 H new ATOM 0 HG23 THR B 207 -5.848 4.817 -6.029 1.00 0.00 H new ATOM 1006 N VAL B 208 -3.024 3.118 -3.517 1.00 0.00 N ATOM 1007 CA VAL B 208 -2.436 1.868 -3.068 1.00 0.00 C ATOM 1008 C VAL B 208 -3.387 0.715 -3.395 1.00 0.00 C ATOM 1009 O VAL B 208 -4.470 0.616 -2.821 1.00 0.00 O ATOM 1010 CB VAL B 208 -2.093 1.955 -1.579 1.00 0.00 C ATOM 1011 CG1 VAL B 208 -1.802 0.569 -1.001 1.00 0.00 C ATOM 1012 CG2 VAL B 208 -0.918 2.906 -1.342 1.00 0.00 C ATOM 0 H VAL B 208 -3.789 3.463 -2.937 1.00 0.00 H new ATOM 0 HA VAL B 208 -1.500 1.677 -3.593 1.00 0.00 H new ATOM 0 HB VAL B 208 -2.961 2.359 -1.058 1.00 0.00 H new ATOM 0 HG11 VAL B 208 -1.561 0.660 0.058 1.00 0.00 H new ATOM 0 HG12 VAL B 208 -2.679 -0.067 -1.121 1.00 0.00 H new ATOM 0 HG13 VAL B 208 -0.958 0.125 -1.528 1.00 0.00 H new ATOM 0 HG21 VAL B 208 -0.695 2.950 -0.276 1.00 0.00 H new ATOM 0 HG22 VAL B 208 -0.043 2.544 -1.882 1.00 0.00 H new ATOM 0 HG23 VAL B 208 -1.178 3.902 -1.699 1.00 0.00 H new ATOM 1022 N THR B 209 -2.947 -0.129 -4.317 1.00 0.00 N ATOM 1023 CA THR B 209 -3.745 -1.271 -4.728 1.00 0.00 C ATOM 1024 C THR B 209 -3.266 -2.541 -4.021 1.00 0.00 C ATOM 1025 O THR B 209 -2.083 -2.674 -3.712 1.00 0.00 O ATOM 1026 CB THR B 209 -3.684 -1.367 -6.254 1.00 0.00 C ATOM 1027 OG1 THR B 209 -3.618 -0.011 -6.685 1.00 0.00 O ATOM 1028 CG2 THR B 209 -4.988 -1.887 -6.861 1.00 0.00 C ATOM 0 H THR B 209 -2.048 -0.044 -4.791 1.00 0.00 H new ATOM 0 HA THR B 209 -4.788 -1.148 -4.436 1.00 0.00 H new ATOM 0 HB THR B 209 -2.862 -2.022 -6.543 1.00 0.00 H new ATOM 0 HG1 THR B 209 -3.574 0.019 -7.664 1.00 0.00 H new ATOM 0 HG21 THR B 209 -4.891 -1.936 -7.946 1.00 0.00 H new ATOM 0 HG22 THR B 209 -5.199 -2.883 -6.471 1.00 0.00 H new ATOM 0 HG23 THR B 209 -5.805 -1.214 -6.600 1.00 0.00 H new ATOM 1036 N VAL B 210 -4.209 -3.440 -3.783 1.00 0.00 N ATOM 1037 CA VAL B 210 -3.898 -4.693 -3.117 1.00 0.00 C ATOM 1038 C VAL B 210 -4.697 -5.823 -3.768 1.00 0.00 C ATOM 1039 O VAL B 210 -5.925 -5.839 -3.702 1.00 0.00 O ATOM 1040 CB VAL B 210 -4.157 -4.566 -1.615 1.00 0.00 C ATOM 1041 CG1 VAL B 210 -4.426 -5.935 -0.987 1.00 0.00 C ATOM 1042 CG2 VAL B 210 -2.994 -3.861 -0.915 1.00 0.00 C ATOM 0 H VAL B 210 -5.190 -3.326 -4.040 1.00 0.00 H new ATOM 0 HA VAL B 210 -2.841 -4.934 -3.231 1.00 0.00 H new ATOM 0 HB VAL B 210 -5.049 -3.954 -1.480 1.00 0.00 H new ATOM 0 HG11 VAL B 210 -4.607 -5.816 0.081 1.00 0.00 H new ATOM 0 HG12 VAL B 210 -5.302 -6.385 -1.455 1.00 0.00 H new ATOM 0 HG13 VAL B 210 -3.561 -6.581 -1.139 1.00 0.00 H new ATOM 0 HG21 VAL B 210 -3.204 -3.784 0.152 1.00 0.00 H new ATOM 0 HG22 VAL B 210 -2.079 -4.434 -1.064 1.00 0.00 H new ATOM 0 HG23 VAL B 210 -2.869 -2.862 -1.333 1.00 0.00 H new ATOM 1052 N THR B 211 -3.968 -6.743 -4.383 1.00 0.00 N ATOM 1053 CA THR B 211 -4.593 -7.875 -5.045 1.00 0.00 C ATOM 1054 C THR B 211 -3.949 -9.185 -4.586 1.00 0.00 C ATOM 1055 O THR B 211 -2.725 -9.311 -4.586 1.00 0.00 O ATOM 1056 CB THR B 211 -4.500 -7.649 -6.556 1.00 0.00 C ATOM 1057 OG1 THR B 211 -5.288 -6.483 -6.782 1.00 0.00 O ATOM 1058 CG2 THR B 211 -5.213 -8.741 -7.356 1.00 0.00 C ATOM 0 H THR B 211 -2.950 -6.727 -4.437 1.00 0.00 H new ATOM 0 HA THR B 211 -5.647 -7.957 -4.778 1.00 0.00 H new ATOM 0 HB THR B 211 -3.452 -7.607 -6.853 1.00 0.00 H new ATOM 0 HG1 THR B 211 -5.037 -6.080 -7.639 1.00 0.00 H new ATOM 0 HG21 THR B 211 -5.117 -8.533 -8.422 1.00 0.00 H new ATOM 0 HG22 THR B 211 -4.763 -9.708 -7.133 1.00 0.00 H new ATOM 0 HG23 THR B 211 -6.268 -8.761 -7.084 1.00 0.00 H new ATOM 1066 N ASN B 212 -4.801 -10.124 -4.207 1.00 0.00 N ATOM 1067 CA ASN B 212 -4.331 -11.420 -3.746 1.00 0.00 C ATOM 1068 C ASN B 212 -4.378 -12.417 -4.905 1.00 0.00 C ATOM 1069 O ASN B 212 -5.441 -12.943 -5.233 1.00 0.00 O ATOM 1070 CB ASN B 212 -5.216 -11.960 -2.621 1.00 0.00 C ATOM 1071 CG ASN B 212 -6.693 -11.922 -3.020 1.00 0.00 C ATOM 1072 OD1 ASN B 212 -7.053 -11.577 -4.132 1.00 0.00 O ATOM 1073 ND2 ASN B 212 -7.524 -12.294 -2.051 1.00 0.00 N ATOM 0 H ASN B 212 -5.815 -10.014 -4.209 1.00 0.00 H new ATOM 0 HA ASN B 212 -3.313 -11.296 -3.376 1.00 0.00 H new ATOM 0 HB2 ASN B 212 -4.926 -12.984 -2.384 1.00 0.00 H new ATOM 0 HB3 ASN B 212 -5.064 -11.369 -1.718 1.00 0.00 H new ATOM 0 HD21 ASN B 212 -8.530 -12.302 -2.217 1.00 0.00 H new ATOM 0 HD22 ASN B 212 -7.155 -12.572 -1.141 1.00 0.00 H new ATOM 1080 N ASN B 213 -3.214 -12.647 -5.494 1.00 0.00 N ATOM 1081 CA ASN B 213 -3.110 -13.572 -6.610 1.00 0.00 C ATOM 1082 C ASN B 213 -3.577 -14.959 -6.164 1.00 0.00 C ATOM 1083 O ASN B 213 -3.833 -15.830 -6.993 1.00 0.00 O ATOM 1084 CB ASN B 213 -1.663 -13.694 -7.092 1.00 0.00 C ATOM 1085 CG ASN B 213 -1.478 -13.014 -8.450 1.00 0.00 C ATOM 1086 OD1 ASN B 213 -1.799 -13.559 -9.495 1.00 0.00 O ATOM 1087 ND2 ASN B 213 -0.946 -11.798 -8.378 1.00 0.00 N ATOM 0 H ASN B 213 -2.335 -12.209 -5.220 1.00 0.00 H new ATOM 0 HA ASN B 213 -3.730 -13.191 -7.421 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -0.993 -13.242 -6.361 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -1.389 -14.746 -7.168 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -0.783 -11.261 -9.230 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -0.701 -11.402 -7.471 1.00 0.00 H new ATOM 1094 N SER B 214 -3.674 -15.121 -4.852 1.00 0.00 N ATOM 1095 CA SER B 214 -4.106 -16.387 -4.284 1.00 0.00 C ATOM 1096 C SER B 214 -5.617 -16.551 -4.458 1.00 0.00 C ATOM 1097 O SER B 214 -6.103 -17.658 -4.687 1.00 0.00 O ATOM 1098 CB SER B 214 -3.729 -16.485 -2.805 1.00 0.00 C ATOM 1099 OG SER B 214 -4.864 -16.347 -1.954 1.00 0.00 O ATOM 0 H SER B 214 -3.461 -14.397 -4.166 1.00 0.00 H new ATOM 0 HA SER B 214 -3.596 -17.191 -4.815 1.00 0.00 H new ATOM 0 HB2 SER B 214 -3.249 -17.445 -2.616 1.00 0.00 H new ATOM 0 HB3 SER B 214 -3.000 -15.711 -2.565 1.00 0.00 H new ATOM 0 HG SER B 214 -4.582 -16.417 -1.018 1.00 0.00 H new ATOM 1105 N ASN B 215 -6.318 -15.432 -4.344 1.00 0.00 N ATOM 1106 CA ASN B 215 -7.763 -15.437 -4.487 1.00 0.00 C ATOM 1107 C ASN B 215 -8.148 -14.701 -5.772 1.00 0.00 C ATOM 1108 O ASN B 215 -9.324 -14.634 -6.126 1.00 0.00 O ATOM 1109 CB ASN B 215 -8.436 -14.723 -3.313 1.00 0.00 C ATOM 1110 CG ASN B 215 -9.566 -15.571 -2.728 1.00 0.00 C ATOM 1111 OD1 ASN B 215 -9.461 -16.778 -2.584 1.00 0.00 O ATOM 1112 ND2 ASN B 215 -10.652 -14.875 -2.401 1.00 0.00 N ATOM 0 H ASN B 215 -5.911 -14.516 -4.154 1.00 0.00 H new ATOM 0 HA ASN B 215 -8.094 -16.475 -4.515 1.00 0.00 H new ATOM 0 HB2 ASN B 215 -7.697 -14.512 -2.540 1.00 0.00 H new ATOM 0 HB3 ASN B 215 -8.832 -13.763 -3.645 1.00 0.00 H new ATOM 0 HD21 ASN B 215 -11.462 -15.351 -2.004 1.00 0.00 H new ATOM 0 HD22 ASN B 215 -10.674 -13.866 -2.548 1.00 0.00 H new ATOM 1119 N GLY B 216 -7.134 -14.165 -6.435 1.00 0.00 N ATOM 1120 CA GLY B 216 -7.351 -13.436 -7.673 1.00 0.00 C ATOM 1121 C GLY B 216 -8.236 -12.209 -7.439 1.00 0.00 C ATOM 1122 O GLY B 216 -8.746 -11.618 -8.388 1.00 0.00 O ATOM 0 H GLY B 216 -6.160 -14.221 -6.138 1.00 0.00 H new ATOM 0 HA2 GLY B 216 -6.393 -13.124 -8.088 1.00 0.00 H new ATOM 0 HA3 GLY B 216 -7.819 -14.091 -8.408 1.00 0.00 H new ATOM 1126 N VAL B 217 -8.390 -11.864 -6.169 1.00 0.00 N ATOM 1127 CA VAL B 217 -9.204 -10.720 -5.798 1.00 0.00 C ATOM 1128 C VAL B 217 -8.327 -9.466 -5.763 1.00 0.00 C ATOM 1129 O VAL B 217 -7.268 -9.462 -5.137 1.00 0.00 O ATOM 1130 CB VAL B 217 -9.914 -10.990 -4.470 1.00 0.00 C ATOM 1131 CG1 VAL B 217 -10.572 -9.719 -3.930 1.00 0.00 C ATOM 1132 CG2 VAL B 217 -10.938 -12.118 -4.616 1.00 0.00 C ATOM 0 H VAL B 217 -7.964 -12.357 -5.384 1.00 0.00 H new ATOM 0 HA VAL B 217 -9.985 -10.551 -6.539 1.00 0.00 H new ATOM 0 HB VAL B 217 -9.163 -11.310 -3.748 1.00 0.00 H new ATOM 0 HG11 VAL B 217 -11.069 -9.940 -2.986 1.00 0.00 H new ATOM 0 HG12 VAL B 217 -9.811 -8.955 -3.770 1.00 0.00 H new ATOM 0 HG13 VAL B 217 -11.305 -9.355 -4.650 1.00 0.00 H new ATOM 0 HG21 VAL B 217 -11.429 -12.290 -3.658 1.00 0.00 H new ATOM 0 HG22 VAL B 217 -11.683 -11.839 -5.360 1.00 0.00 H new ATOM 0 HG23 VAL B 217 -10.432 -13.030 -4.934 1.00 0.00 H new ATOM 1142 N SER B 218 -8.801 -8.433 -6.443 1.00 0.00 N ATOM 1143 CA SER B 218 -8.074 -7.175 -6.497 1.00 0.00 C ATOM 1144 C SER B 218 -8.849 -6.089 -5.749 1.00 0.00 C ATOM 1145 O SER B 218 -10.077 -6.126 -5.692 1.00 0.00 O ATOM 1146 CB SER B 218 -7.822 -6.748 -7.944 1.00 0.00 C ATOM 1147 OG SER B 218 -8.776 -7.309 -8.841 1.00 0.00 O ATOM 0 H SER B 218 -9.679 -8.441 -6.961 1.00 0.00 H new ATOM 0 HA SER B 218 -7.107 -7.317 -6.015 1.00 0.00 H new ATOM 0 HB2 SER B 218 -7.856 -5.661 -8.012 1.00 0.00 H new ATOM 0 HB3 SER B 218 -6.820 -7.055 -8.243 1.00 0.00 H new ATOM 0 HG SER B 218 -8.581 -7.011 -9.754 1.00 0.00 H new ATOM 1153 N VAL B 219 -8.100 -5.149 -5.194 1.00 0.00 N ATOM 1154 CA VAL B 219 -8.702 -4.054 -4.452 1.00 0.00 C ATOM 1155 C VAL B 219 -7.792 -2.826 -4.535 1.00 0.00 C ATOM 1156 O VAL B 219 -6.597 -2.915 -4.259 1.00 0.00 O ATOM 1157 CB VAL B 219 -8.986 -4.491 -3.014 1.00 0.00 C ATOM 1158 CG1 VAL B 219 -9.392 -3.296 -2.148 1.00 0.00 C ATOM 1159 CG2 VAL B 219 -10.054 -5.585 -2.973 1.00 0.00 C ATOM 0 H VAL B 219 -7.082 -5.122 -5.243 1.00 0.00 H new ATOM 0 HA VAL B 219 -9.661 -3.778 -4.890 1.00 0.00 H new ATOM 0 HB VAL B 219 -8.066 -4.906 -2.603 1.00 0.00 H new ATOM 0 HG11 VAL B 219 -9.588 -3.634 -1.131 1.00 0.00 H new ATOM 0 HG12 VAL B 219 -8.585 -2.563 -2.138 1.00 0.00 H new ATOM 0 HG13 VAL B 219 -10.292 -2.838 -2.558 1.00 0.00 H new ATOM 0 HG21 VAL B 219 -10.236 -5.877 -1.939 1.00 0.00 H new ATOM 0 HG22 VAL B 219 -10.978 -5.208 -3.412 1.00 0.00 H new ATOM 0 HG23 VAL B 219 -9.710 -6.451 -3.539 1.00 0.00 H new ATOM 1169 N ASP B 220 -8.393 -1.709 -4.917 1.00 0.00 N ATOM 1170 CA ASP B 220 -7.652 -0.465 -5.041 1.00 0.00 C ATOM 1171 C ASP B 220 -8.195 0.548 -4.032 1.00 0.00 C ATOM 1172 O ASP B 220 -9.393 0.573 -3.754 1.00 0.00 O ATOM 1173 CB ASP B 220 -7.807 0.132 -6.441 1.00 0.00 C ATOM 1174 CG ASP B 220 -8.342 -0.834 -7.500 1.00 0.00 C ATOM 1175 OD1 ASP B 220 -9.399 -1.444 -7.230 1.00 0.00 O ATOM 1176 OD2 ASP B 220 -7.682 -0.940 -8.556 1.00 0.00 O ATOM 0 H ASP B 220 -9.385 -1.639 -5.145 1.00 0.00 H new ATOM 0 HA ASP B 220 -6.599 -0.679 -4.856 1.00 0.00 H new ATOM 0 HB2 ASP B 220 -8.477 0.990 -6.382 1.00 0.00 H new ATOM 0 HB3 ASP B 220 -6.838 0.507 -6.769 1.00 0.00 H new ATOM 1181 N TYR B 221 -7.287 1.362 -3.511 1.00 0.00 N ATOM 1182 CA TYR B 221 -7.660 2.375 -2.539 1.00 0.00 C ATOM 1183 C TYR B 221 -6.894 3.677 -2.783 1.00 0.00 C ATOM 1184 O TYR B 221 -5.668 3.672 -2.878 1.00 0.00 O ATOM 1185 CB TYR B 221 -7.264 1.814 -1.172 1.00 0.00 C ATOM 1186 CG TYR B 221 -8.417 1.155 -0.412 1.00 0.00 C ATOM 1187 CD1 TYR B 221 -8.979 -0.012 -0.886 1.00 0.00 C ATOM 1188 CD2 TYR B 221 -8.896 1.730 0.748 1.00 0.00 C ATOM 1189 CE1 TYR B 221 -10.065 -0.632 -0.171 1.00 0.00 C ATOM 1190 CE2 TYR B 221 -9.982 1.110 1.463 1.00 0.00 C ATOM 1191 CZ TYR B 221 -10.513 -0.040 0.968 1.00 0.00 C ATOM 1192 OH TYR B 221 -11.538 -0.625 1.643 1.00 0.00 O ATOM 0 H TYR B 221 -6.294 1.340 -3.744 1.00 0.00 H new ATOM 0 HA TYR B 221 -8.725 2.598 -2.607 1.00 0.00 H new ATOM 0 HB2 TYR B 221 -6.467 1.083 -1.308 1.00 0.00 H new ATOM 0 HB3 TYR B 221 -6.856 2.621 -0.564 1.00 0.00 H new ATOM 0 HD1 TYR B 221 -8.605 -0.461 -1.794 1.00 0.00 H new ATOM 0 HD2 TYR B 221 -8.457 2.644 1.119 1.00 0.00 H new ATOM 0 HE1 TYR B 221 -10.513 -1.546 -0.531 1.00 0.00 H new ATOM 0 HE2 TYR B 221 -10.366 1.549 2.372 1.00 0.00 H new ATOM 0 HH TYR B 221 -11.752 -0.093 2.438 1.00 0.00 H new ATOM 1202 N GLU B 222 -7.650 4.761 -2.878 1.00 0.00 N ATOM 1203 CA GLU B 222 -7.057 6.068 -3.109 1.00 0.00 C ATOM 1204 C GLU B 222 -6.986 6.858 -1.801 1.00 0.00 C ATOM 1205 O GLU B 222 -8.014 7.218 -1.231 1.00 0.00 O ATOM 1206 CB GLU B 222 -7.836 6.842 -4.175 1.00 0.00 C ATOM 1207 CG GLU B 222 -7.227 8.228 -4.400 1.00 0.00 C ATOM 1208 CD GLU B 222 -7.751 8.852 -5.695 1.00 0.00 C ATOM 1209 OE1 GLU B 222 -8.893 8.507 -6.071 1.00 0.00 O ATOM 1210 OE2 GLU B 222 -6.998 9.660 -6.280 1.00 0.00 O ATOM 0 H GLU B 222 -8.667 4.761 -2.799 1.00 0.00 H new ATOM 0 HA GLU B 222 -6.042 5.924 -3.479 1.00 0.00 H new ATOM 0 HB2 GLU B 222 -7.833 6.283 -5.111 1.00 0.00 H new ATOM 0 HB3 GLU B 222 -8.877 6.944 -3.868 1.00 0.00 H new ATOM 0 HG2 GLU B 222 -7.466 8.876 -3.557 1.00 0.00 H new ATOM 0 HG3 GLU B 222 -6.141 8.149 -4.443 1.00 0.00 H new ATOM 1217 N THR B 223 -5.760 7.102 -1.362 1.00 0.00 N ATOM 1218 CA THR B 223 -5.540 7.843 -0.131 1.00 0.00 C ATOM 1219 C THR B 223 -4.384 8.830 -0.301 1.00 0.00 C ATOM 1220 O THR B 223 -3.426 8.553 -1.022 1.00 0.00 O ATOM 1221 CB THR B 223 -5.314 6.832 0.996 1.00 0.00 C ATOM 1222 OG1 THR B 223 -5.691 7.536 2.175 1.00 0.00 O ATOM 1223 CG2 THR B 223 -3.832 6.514 1.209 1.00 0.00 C ATOM 0 H THR B 223 -4.909 6.800 -1.836 1.00 0.00 H new ATOM 0 HA THR B 223 -6.409 8.449 0.125 1.00 0.00 H new ATOM 0 HB THR B 223 -5.854 5.912 0.772 1.00 0.00 H new ATOM 0 HG1 THR B 223 -5.577 6.953 2.955 1.00 0.00 H new ATOM 0 HG21 THR B 223 -3.728 5.792 2.019 1.00 0.00 H new ATOM 0 HG22 THR B 223 -3.415 6.095 0.294 1.00 0.00 H new ATOM 0 HG23 THR B 223 -3.297 7.428 1.466 1.00 0.00 H new ATOM 1231 N GLU B 224 -4.510 9.962 0.376 1.00 0.00 N ATOM 1232 CA GLU B 224 -3.487 10.992 0.308 1.00 0.00 C ATOM 1233 C GLU B 224 -2.642 10.986 1.583 1.00 0.00 C ATOM 1234 O GLU B 224 -3.008 11.611 2.577 1.00 0.00 O ATOM 1235 CB GLU B 224 -4.111 12.369 0.070 1.00 0.00 C ATOM 1236 CG GLU B 224 -5.604 12.361 0.407 1.00 0.00 C ATOM 1237 CD GLU B 224 -6.232 13.732 0.151 1.00 0.00 C ATOM 1238 OE1 GLU B 224 -5.831 14.681 0.860 1.00 0.00 O ATOM 1239 OE2 GLU B 224 -7.097 13.801 -0.748 1.00 0.00 O ATOM 0 H GLU B 224 -5.305 10.189 0.974 1.00 0.00 H new ATOM 0 HA GLU B 224 -2.835 10.774 -0.538 1.00 0.00 H new ATOM 0 HB2 GLU B 224 -3.601 13.114 0.681 1.00 0.00 H new ATOM 0 HB3 GLU B 224 -3.971 12.660 -0.971 1.00 0.00 H new ATOM 0 HG2 GLU B 224 -6.112 11.607 -0.194 1.00 0.00 H new ATOM 0 HG3 GLU B 224 -5.743 12.083 1.452 1.00 0.00 H new ATOM 1246 N THR B 225 -1.528 10.272 1.513 1.00 0.00 N ATOM 1247 CA THR B 225 -0.628 10.177 2.649 1.00 0.00 C ATOM 1248 C THR B 225 0.820 10.396 2.204 1.00 0.00 C ATOM 1249 O THR B 225 1.404 9.541 1.540 1.00 0.00 O ATOM 1250 CB THR B 225 -0.859 8.822 3.322 1.00 0.00 C ATOM 1251 OG1 THR B 225 -0.854 7.893 2.242 1.00 0.00 O ATOM 1252 CG2 THR B 225 -2.263 8.695 3.916 1.00 0.00 C ATOM 0 H THR B 225 -1.229 9.754 0.687 1.00 0.00 H new ATOM 0 HA THR B 225 -0.831 10.959 3.381 1.00 0.00 H new ATOM 0 HB THR B 225 -0.118 8.676 4.108 1.00 0.00 H new ATOM 0 HG1 THR B 225 -0.996 6.987 2.589 1.00 0.00 H new ATOM 0 HG21 THR B 225 -2.374 7.715 4.381 1.00 0.00 H new ATOM 0 HG22 THR B 225 -2.412 9.472 4.666 1.00 0.00 H new ATOM 0 HG23 THR B 225 -3.004 8.807 3.125 1.00 0.00 H new ATOM 1260 N PRO B 226 1.370 11.575 2.597 1.00 0.00 N ATOM 1261 CA PRO B 226 2.737 11.917 2.246 1.00 0.00 C ATOM 1262 C PRO B 226 3.735 11.128 3.096 1.00 0.00 C ATOM 1263 O PRO B 226 4.225 10.082 2.673 1.00 0.00 O ATOM 1264 CB PRO B 226 2.835 13.419 2.457 1.00 0.00 C ATOM 1265 CG PRO B 226 1.666 13.789 3.357 1.00 0.00 C ATOM 1266 CD PRO B 226 0.708 12.611 3.384 1.00 0.00 C ATOM 0 HA PRO B 226 2.984 11.656 1.217 1.00 0.00 H new ATOM 0 HB2 PRO B 226 3.785 13.688 2.920 1.00 0.00 H new ATOM 0 HB3 PRO B 226 2.781 13.951 1.507 1.00 0.00 H new ATOM 0 HG2 PRO B 226 2.017 14.019 4.363 1.00 0.00 H new ATOM 0 HG3 PRO B 226 1.164 14.681 2.983 1.00 0.00 H new ATOM 0 HD2 PRO B 226 0.523 12.275 4.404 1.00 0.00 H new ATOM 0 HD3 PRO B 226 -0.258 12.877 2.955 1.00 0.00 H new ATOM 1274 N MET B 227 4.007 11.660 4.278 1.00 0.00 N ATOM 1275 CA MET B 227 4.938 11.019 5.191 1.00 0.00 C ATOM 1276 C MET B 227 4.305 9.790 5.847 1.00 0.00 C ATOM 1277 O MET B 227 5.004 8.843 6.203 1.00 0.00 O ATOM 1278 CB MET B 227 5.360 12.015 6.273 1.00 0.00 C ATOM 1279 CG MET B 227 6.089 13.213 5.661 1.00 0.00 C ATOM 1280 SD MET B 227 7.717 12.724 5.115 1.00 0.00 S ATOM 1281 CE MET B 227 7.436 12.621 3.355 1.00 0.00 C ATOM 0 H MET B 227 3.599 12.528 4.625 1.00 0.00 H new ATOM 0 HA MET B 227 5.810 10.695 4.623 1.00 0.00 H new ATOM 0 HB2 MET B 227 4.481 12.359 6.818 1.00 0.00 H new ATOM 0 HB3 MET B 227 6.009 11.520 6.995 1.00 0.00 H new ATOM 0 HG2 MET B 227 5.517 13.606 4.820 1.00 0.00 H new ATOM 0 HG3 MET B 227 6.168 14.015 6.395 1.00 0.00 H new ATOM 0 HE1 MET B 227 8.044 11.819 2.936 1.00 0.00 H new ATOM 0 HE2 MET B 227 6.383 12.414 3.166 1.00 0.00 H new ATOM 0 HE3 MET B 227 7.710 13.566 2.887 1.00 0.00 H new ATOM 1291 N THR B 228 2.989 9.846 5.985 1.00 0.00 N ATOM 1292 CA THR B 228 2.253 8.750 6.592 1.00 0.00 C ATOM 1293 C THR B 228 2.596 7.429 5.899 1.00 0.00 C ATOM 1294 O THR B 228 2.647 6.382 6.541 1.00 0.00 O ATOM 1295 CB THR B 228 0.763 9.093 6.540 1.00 0.00 C ATOM 1296 OG1 THR B 228 0.726 10.388 5.946 1.00 0.00 O ATOM 1297 CG2 THR B 228 0.162 9.303 7.931 1.00 0.00 C ATOM 0 H THR B 228 2.413 10.633 5.687 1.00 0.00 H new ATOM 0 HA THR B 228 2.534 8.617 7.637 1.00 0.00 H new ATOM 0 HB THR B 228 0.224 8.295 6.029 1.00 0.00 H new ATOM 0 HG1 THR B 228 -0.204 10.688 5.872 1.00 0.00 H new ATOM 0 HG21 THR B 228 -0.897 9.544 7.837 1.00 0.00 H new ATOM 0 HG22 THR B 228 0.276 8.392 8.518 1.00 0.00 H new ATOM 0 HG23 THR B 228 0.678 10.123 8.430 1.00 0.00 H new ATOM 1305 N LEU B 229 2.823 7.522 4.596 1.00 0.00 N ATOM 1306 CA LEU B 229 3.160 6.348 3.809 1.00 0.00 C ATOM 1307 C LEU B 229 4.322 5.610 4.475 1.00 0.00 C ATOM 1308 O LEU B 229 4.405 4.385 4.407 1.00 0.00 O ATOM 1309 CB LEU B 229 3.431 6.738 2.355 1.00 0.00 C ATOM 1310 CG LEU B 229 2.203 6.851 1.450 1.00 0.00 C ATOM 1311 CD1 LEU B 229 2.527 7.640 0.181 1.00 0.00 C ATOM 1312 CD2 LEU B 229 1.627 5.468 1.134 1.00 0.00 C ATOM 0 H LEU B 229 2.780 8.393 4.066 1.00 0.00 H new ATOM 0 HA LEU B 229 2.319 5.656 3.777 1.00 0.00 H new ATOM 0 HB2 LEU B 229 3.952 7.695 2.348 1.00 0.00 H new ATOM 0 HB3 LEU B 229 4.109 6.002 1.923 1.00 0.00 H new ATOM 0 HG LEU B 229 1.434 7.407 1.986 1.00 0.00 H new ATOM 0 HD11 LEU B 229 1.637 7.705 -0.444 1.00 0.00 H new ATOM 0 HD12 LEU B 229 2.855 8.644 0.451 1.00 0.00 H new ATOM 0 HD13 LEU B 229 3.320 7.134 -0.369 1.00 0.00 H new ATOM 0 HD21 LEU B 229 0.755 5.576 0.489 1.00 0.00 H new ATOM 0 HD22 LEU B 229 2.381 4.867 0.626 1.00 0.00 H new ATOM 0 HD23 LEU B 229 1.334 4.975 2.061 1.00 0.00 H new ATOM 1324 N LEU B 230 5.193 6.386 5.104 1.00 0.00 N ATOM 1325 CA LEU B 230 6.347 5.821 5.782 1.00 0.00 C ATOM 1326 C LEU B 230 5.925 5.314 7.162 1.00 0.00 C ATOM 1327 O LEU B 230 6.548 4.408 7.712 1.00 0.00 O ATOM 1328 CB LEU B 230 7.493 6.834 5.822 1.00 0.00 C ATOM 1329 CG LEU B 230 7.797 7.556 4.508 1.00 0.00 C ATOM 1330 CD1 LEU B 230 8.964 8.531 4.675 1.00 0.00 C ATOM 1331 CD2 LEU B 230 8.043 6.555 3.377 1.00 0.00 C ATOM 0 H LEU B 230 5.122 7.402 5.158 1.00 0.00 H new ATOM 0 HA LEU B 230 6.730 4.962 5.231 1.00 0.00 H new ATOM 0 HB2 LEU B 230 7.263 7.583 6.580 1.00 0.00 H new ATOM 0 HB3 LEU B 230 8.396 6.318 6.147 1.00 0.00 H new ATOM 0 HG LEU B 230 6.923 8.145 4.232 1.00 0.00 H new ATOM 0 HD11 LEU B 230 9.159 9.031 3.726 1.00 0.00 H new ATOM 0 HD12 LEU B 230 8.712 9.274 5.431 1.00 0.00 H new ATOM 0 HD13 LEU B 230 9.854 7.984 4.987 1.00 0.00 H new ATOM 0 HD21 LEU B 230 8.257 7.094 2.454 1.00 0.00 H new ATOM 0 HD22 LEU B 230 8.892 5.920 3.631 1.00 0.00 H new ATOM 0 HD23 LEU B 230 7.156 5.937 3.239 1.00 0.00 H new ATOM 1343 N VAL B 231 4.869 5.921 7.682 1.00 0.00 N ATOM 1344 CA VAL B 231 4.356 5.543 8.989 1.00 0.00 C ATOM 1345 C VAL B 231 3.851 4.100 8.935 1.00 0.00 C ATOM 1346 O VAL B 231 3.141 3.721 8.003 1.00 0.00 O ATOM 1347 CB VAL B 231 3.282 6.536 9.437 1.00 0.00 C ATOM 1348 CG1 VAL B 231 2.670 6.116 10.775 1.00 0.00 C ATOM 1349 CG2 VAL B 231 3.846 7.956 9.514 1.00 0.00 C ATOM 0 H VAL B 231 4.354 6.672 7.223 1.00 0.00 H new ATOM 0 HA VAL B 231 5.148 5.583 9.737 1.00 0.00 H new ATOM 0 HB VAL B 231 2.489 6.531 8.690 1.00 0.00 H new ATOM 0 HG11 VAL B 231 1.910 6.839 11.070 1.00 0.00 H new ATOM 0 HG12 VAL B 231 2.214 5.131 10.673 1.00 0.00 H new ATOM 0 HG13 VAL B 231 3.450 6.078 11.536 1.00 0.00 H new ATOM 0 HG21 VAL B 231 3.062 8.642 9.835 1.00 0.00 H new ATOM 0 HG22 VAL B 231 4.667 7.983 10.230 1.00 0.00 H new ATOM 0 HG23 VAL B 231 4.211 8.256 8.532 1.00 0.00 H new ATOM 1359 N PRO B 232 4.246 3.314 9.972 1.00 0.00 N ATOM 1360 CA PRO B 232 3.840 1.920 10.051 1.00 0.00 C ATOM 1361 C PRO B 232 2.375 1.798 10.472 1.00 0.00 C ATOM 1362 O PRO B 232 1.630 0.993 9.916 1.00 0.00 O ATOM 1363 CB PRO B 232 4.799 1.288 11.047 1.00 0.00 C ATOM 1364 CG PRO B 232 5.402 2.441 11.834 1.00 0.00 C ATOM 1365 CD PRO B 232 5.085 3.728 11.091 1.00 0.00 C ATOM 0 HA PRO B 232 3.893 1.411 9.089 1.00 0.00 H new ATOM 0 HB2 PRO B 232 4.276 0.596 11.707 1.00 0.00 H new ATOM 0 HB3 PRO B 232 5.574 0.717 10.535 1.00 0.00 H new ATOM 0 HG2 PRO B 232 4.990 2.471 12.843 1.00 0.00 H new ATOM 0 HG3 PRO B 232 6.480 2.313 11.933 1.00 0.00 H new ATOM 0 HD2 PRO B 232 4.565 4.438 11.734 1.00 0.00 H new ATOM 0 HD3 PRO B 232 5.994 4.219 10.744 1.00 0.00 H new ATOM 1373 N GLU B 233 2.004 2.611 11.451 1.00 0.00 N ATOM 1374 CA GLU B 233 0.640 2.604 11.952 1.00 0.00 C ATOM 1375 C GLU B 233 -0.340 2.958 10.832 1.00 0.00 C ATOM 1376 O GLU B 233 -1.452 2.434 10.787 1.00 0.00 O ATOM 1377 CB GLU B 233 0.487 3.562 13.136 1.00 0.00 C ATOM 1378 CG GLU B 233 1.711 3.502 14.051 1.00 0.00 C ATOM 1379 CD GLU B 233 1.367 3.991 15.460 1.00 0.00 C ATOM 1380 OE1 GLU B 233 0.274 3.621 15.938 1.00 0.00 O ATOM 1381 OE2 GLU B 233 2.205 4.726 16.027 1.00 0.00 O ATOM 0 H GLU B 233 2.624 3.278 11.910 1.00 0.00 H new ATOM 0 HA GLU B 233 0.409 1.599 12.306 1.00 0.00 H new ATOM 0 HB2 GLU B 233 0.352 4.580 12.770 1.00 0.00 H new ATOM 0 HB3 GLU B 233 -0.408 3.306 13.703 1.00 0.00 H new ATOM 0 HG2 GLU B 233 2.084 2.479 14.098 1.00 0.00 H new ATOM 0 HG3 GLU B 233 2.511 4.114 13.635 1.00 0.00 H new ATOM 1388 N VAL B 234 0.109 3.843 9.954 1.00 0.00 N ATOM 1389 CA VAL B 234 -0.714 4.271 8.836 1.00 0.00 C ATOM 1390 C VAL B 234 -0.614 3.242 7.710 1.00 0.00 C ATOM 1391 O VAL B 234 -1.625 2.850 7.129 1.00 0.00 O ATOM 1392 CB VAL B 234 -0.308 5.679 8.397 1.00 0.00 C ATOM 1393 CG1 VAL B 234 -1.056 6.095 7.128 1.00 0.00 C ATOM 1394 CG2 VAL B 234 -0.532 6.691 9.522 1.00 0.00 C ATOM 0 H VAL B 234 1.032 4.275 9.994 1.00 0.00 H new ATOM 0 HA VAL B 234 -1.761 4.326 9.132 1.00 0.00 H new ATOM 0 HB VAL B 234 0.758 5.664 8.168 1.00 0.00 H new ATOM 0 HG11 VAL B 234 -0.749 7.100 6.838 1.00 0.00 H new ATOM 0 HG12 VAL B 234 -0.823 5.398 6.323 1.00 0.00 H new ATOM 0 HG13 VAL B 234 -2.129 6.084 7.318 1.00 0.00 H new ATOM 0 HG21 VAL B 234 -0.235 7.684 9.183 1.00 0.00 H new ATOM 0 HG22 VAL B 234 -1.587 6.702 9.797 1.00 0.00 H new ATOM 0 HG23 VAL B 234 0.066 6.410 10.389 1.00 0.00 H new ATOM 1404 N ALA B 235 0.616 2.831 7.435 1.00 0.00 N ATOM 1405 CA ALA B 235 0.862 1.853 6.388 1.00 0.00 C ATOM 1406 C ALA B 235 0.247 0.512 6.792 1.00 0.00 C ATOM 1407 O ALA B 235 -0.418 -0.138 5.988 1.00 0.00 O ATOM 1408 CB ALA B 235 2.366 1.750 6.128 1.00 0.00 C ATOM 0 H ALA B 235 1.452 3.157 7.919 1.00 0.00 H new ATOM 0 HA ALA B 235 0.390 2.164 5.456 1.00 0.00 H new ATOM 0 HB1 ALA B 235 2.550 1.017 5.343 1.00 0.00 H new ATOM 0 HB2 ALA B 235 2.748 2.721 5.814 1.00 0.00 H new ATOM 0 HB3 ALA B 235 2.873 1.439 7.041 1.00 0.00 H new ATOM 1414 N ALA B 236 0.492 0.139 8.040 1.00 0.00 N ATOM 1415 CA ALA B 236 -0.031 -1.113 8.562 1.00 0.00 C ATOM 1416 C ALA B 236 -1.548 -1.148 8.369 1.00 0.00 C ATOM 1417 O ALA B 236 -2.091 -2.134 7.872 1.00 0.00 O ATOM 1418 CB ALA B 236 0.374 -1.263 10.030 1.00 0.00 C ATOM 0 H ALA B 236 1.045 0.681 8.704 1.00 0.00 H new ATOM 0 HA ALA B 236 0.389 -1.960 8.020 1.00 0.00 H new ATOM 0 HB1 ALA B 236 -0.018 -2.202 10.422 1.00 0.00 H new ATOM 0 HB2 ALA B 236 1.461 -1.263 10.109 1.00 0.00 H new ATOM 0 HB3 ALA B 236 -0.032 -0.432 10.606 1.00 0.00 H new ATOM 1424 N GLU B 237 -2.189 -0.061 8.772 1.00 0.00 N ATOM 1425 CA GLU B 237 -3.633 0.044 8.650 1.00 0.00 C ATOM 1426 C GLU B 237 -4.038 0.103 7.175 1.00 0.00 C ATOM 1427 O GLU B 237 -5.080 -0.427 6.793 1.00 0.00 O ATOM 1428 CB GLU B 237 -4.160 1.263 9.412 1.00 0.00 C ATOM 1429 CG GLU B 237 -5.672 1.411 9.228 1.00 0.00 C ATOM 1430 CD GLU B 237 -6.377 1.549 10.579 1.00 0.00 C ATOM 1431 OE1 GLU B 237 -6.240 0.607 11.389 1.00 0.00 O ATOM 1432 OE2 GLU B 237 -7.036 2.593 10.771 1.00 0.00 O ATOM 0 H GLU B 237 -1.735 0.755 9.183 1.00 0.00 H new ATOM 0 HA GLU B 237 -4.082 -0.844 9.095 1.00 0.00 H new ATOM 0 HB2 GLU B 237 -3.927 1.163 10.472 1.00 0.00 H new ATOM 0 HB3 GLU B 237 -3.657 2.163 9.059 1.00 0.00 H new ATOM 0 HG2 GLU B 237 -5.883 2.285 8.612 1.00 0.00 H new ATOM 0 HG3 GLU B 237 -6.064 0.544 8.696 1.00 0.00 H new ATOM 1439 N VAL B 238 -3.192 0.752 6.388 1.00 0.00 N ATOM 1440 CA VAL B 238 -3.450 0.886 4.964 1.00 0.00 C ATOM 1441 C VAL B 238 -3.350 -0.489 4.299 1.00 0.00 C ATOM 1442 O VAL B 238 -4.171 -0.834 3.453 1.00 0.00 O ATOM 1443 CB VAL B 238 -2.495 1.915 4.354 1.00 0.00 C ATOM 1444 CG1 VAL B 238 -2.124 1.536 2.920 1.00 0.00 C ATOM 1445 CG2 VAL B 238 -3.094 3.322 4.414 1.00 0.00 C ATOM 0 H VAL B 238 -2.329 1.190 6.709 1.00 0.00 H new ATOM 0 HA VAL B 238 -4.461 1.257 4.793 1.00 0.00 H new ATOM 0 HB VAL B 238 -1.580 1.916 4.946 1.00 0.00 H new ATOM 0 HG11 VAL B 238 -1.445 2.284 2.510 1.00 0.00 H new ATOM 0 HG12 VAL B 238 -1.636 0.561 2.916 1.00 0.00 H new ATOM 0 HG13 VAL B 238 -3.026 1.493 2.310 1.00 0.00 H new ATOM 0 HG21 VAL B 238 -2.395 4.034 3.974 1.00 0.00 H new ATOM 0 HG22 VAL B 238 -4.031 3.342 3.858 1.00 0.00 H new ATOM 0 HG23 VAL B 238 -3.283 3.593 5.453 1.00 0.00 H new ATOM 1455 N ILE B 239 -2.336 -1.237 4.711 1.00 0.00 N ATOM 1456 CA ILE B 239 -2.118 -2.566 4.167 1.00 0.00 C ATOM 1457 C ILE B 239 -3.189 -3.516 4.707 1.00 0.00 C ATOM 1458 O ILE B 239 -3.801 -4.265 3.948 1.00 0.00 O ATOM 1459 CB ILE B 239 -0.687 -3.030 4.444 1.00 0.00 C ATOM 1460 CG1 ILE B 239 0.323 -2.197 3.652 1.00 0.00 C ATOM 1461 CG2 ILE B 239 -0.533 -4.528 4.170 1.00 0.00 C ATOM 1462 CD1 ILE B 239 0.511 -2.757 2.241 1.00 0.00 C ATOM 0 H ILE B 239 -1.657 -0.947 5.415 1.00 0.00 H new ATOM 0 HA ILE B 239 -2.220 -2.555 3.082 1.00 0.00 H new ATOM 0 HB ILE B 239 -0.476 -2.872 5.502 1.00 0.00 H new ATOM 0 HG12 ILE B 239 -0.019 -1.164 3.594 1.00 0.00 H new ATOM 0 HG13 ILE B 239 1.280 -2.187 4.174 1.00 0.00 H new ATOM 0 HG21 ILE B 239 0.494 -4.832 4.375 1.00 0.00 H new ATOM 0 HG22 ILE B 239 -1.212 -5.087 4.814 1.00 0.00 H new ATOM 0 HG23 ILE B 239 -0.771 -4.733 3.126 1.00 0.00 H new ATOM 0 HD11 ILE B 239 1.234 -2.146 1.700 1.00 0.00 H new ATOM 0 HD12 ILE B 239 0.876 -3.782 2.302 1.00 0.00 H new ATOM 0 HD13 ILE B 239 -0.443 -2.742 1.714 1.00 0.00 H new ATOM 1474 N LYS B 240 -3.382 -3.454 6.016 1.00 0.00 N ATOM 1475 CA LYS B 240 -4.368 -4.299 6.668 1.00 0.00 C ATOM 1476 C LYS B 240 -5.764 -3.927 6.165 1.00 0.00 C ATOM 1477 O LYS B 240 -6.585 -4.803 5.895 1.00 0.00 O ATOM 1478 CB LYS B 240 -4.221 -4.220 8.189 1.00 0.00 C ATOM 1479 CG LYS B 240 -5.578 -4.364 8.880 1.00 0.00 C ATOM 1480 CD LYS B 240 -6.180 -2.994 9.198 1.00 0.00 C ATOM 1481 CE LYS B 240 -7.658 -3.118 9.571 1.00 0.00 C ATOM 1482 NZ LYS B 240 -7.819 -3.173 11.042 1.00 0.00 N ATOM 0 H LYS B 240 -2.872 -2.832 6.643 1.00 0.00 H new ATOM 0 HA LYS B 240 -4.203 -5.345 6.410 1.00 0.00 H new ATOM 0 HB2 LYS B 240 -3.548 -5.005 8.534 1.00 0.00 H new ATOM 0 HB3 LYS B 240 -3.768 -3.268 8.465 1.00 0.00 H new ATOM 0 HG2 LYS B 240 -6.259 -4.924 8.239 1.00 0.00 H new ATOM 0 HG3 LYS B 240 -5.462 -4.937 9.800 1.00 0.00 H new ATOM 0 HD2 LYS B 240 -5.631 -2.534 10.020 1.00 0.00 H new ATOM 0 HD3 LYS B 240 -6.073 -2.337 8.335 1.00 0.00 H new ATOM 0 HE2 LYS B 240 -8.213 -2.270 9.170 1.00 0.00 H new ATOM 0 HE3 LYS B 240 -8.079 -4.016 9.119 1.00 0.00 H new ATOM 0 HZ1 LYS B 240 -8.828 -3.257 11.278 1.00 0.00 H new ATOM 0 HZ2 LYS B 240 -7.306 -3.996 11.417 1.00 0.00 H new ATOM 0 HZ3 LYS B 240 -7.436 -2.304 11.466 1.00 0.00 H new ATOM 1496 N ASP B 241 -5.991 -2.626 6.056 1.00 0.00 N ATOM 1497 CA ASP B 241 -7.274 -2.128 5.590 1.00 0.00 C ATOM 1498 C ASP B 241 -7.537 -2.649 4.176 1.00 0.00 C ATOM 1499 O ASP B 241 -8.640 -3.098 3.871 1.00 0.00 O ATOM 1500 CB ASP B 241 -7.285 -0.598 5.540 1.00 0.00 C ATOM 1501 CG ASP B 241 -8.499 0.017 4.841 1.00 0.00 C ATOM 1502 OD1 ASP B 241 -9.606 -0.527 5.041 1.00 0.00 O ATOM 1503 OD2 ASP B 241 -8.293 1.018 4.122 1.00 0.00 O ATOM 0 H ASP B 241 -5.309 -1.902 6.282 1.00 0.00 H new ATOM 0 HA ASP B 241 -8.041 -2.473 6.283 1.00 0.00 H new ATOM 0 HB2 ASP B 241 -7.239 -0.216 6.560 1.00 0.00 H new ATOM 0 HB3 ASP B 241 -6.382 -0.259 5.032 1.00 0.00 H new ATOM 1508 N LEU B 242 -6.504 -2.571 3.349 1.00 0.00 N ATOM 1509 CA LEU B 242 -6.609 -3.029 1.975 1.00 0.00 C ATOM 1510 C LEU B 242 -6.887 -4.533 1.964 1.00 0.00 C ATOM 1511 O LEU B 242 -7.771 -4.999 1.245 1.00 0.00 O ATOM 1512 CB LEU B 242 -5.366 -2.628 1.179 1.00 0.00 C ATOM 1513 CG LEU B 242 -5.491 -1.360 0.333 1.00 0.00 C ATOM 1514 CD1 LEU B 242 -4.252 -0.475 0.482 1.00 0.00 C ATOM 1515 CD2 LEU B 242 -5.777 -1.703 -1.130 1.00 0.00 C ATOM 0 H LEU B 242 -5.590 -2.197 3.605 1.00 0.00 H new ATOM 0 HA LEU B 242 -7.448 -2.545 1.475 1.00 0.00 H new ATOM 0 HB2 LEU B 242 -4.539 -2.495 1.877 1.00 0.00 H new ATOM 0 HB3 LEU B 242 -5.098 -3.455 0.521 1.00 0.00 H new ATOM 0 HG LEU B 242 -6.341 -0.787 0.702 1.00 0.00 H new ATOM 0 HD11 LEU B 242 -4.368 0.419 -0.130 1.00 0.00 H new ATOM 0 HD12 LEU B 242 -4.134 -0.187 1.527 1.00 0.00 H new ATOM 0 HD13 LEU B 242 -3.370 -1.026 0.156 1.00 0.00 H new ATOM 0 HD21 LEU B 242 -5.861 -0.784 -1.709 1.00 0.00 H new ATOM 0 HD22 LEU B 242 -4.963 -2.309 -1.527 1.00 0.00 H new ATOM 0 HD23 LEU B 242 -6.711 -2.261 -1.197 1.00 0.00 H new ATOM 1527 N VAL B 243 -6.116 -5.251 2.767 1.00 0.00 N ATOM 1528 CA VAL B 243 -6.269 -6.693 2.858 1.00 0.00 C ATOM 1529 C VAL B 243 -7.630 -7.020 3.475 1.00 0.00 C ATOM 1530 O VAL B 243 -8.349 -7.887 2.980 1.00 0.00 O ATOM 1531 CB VAL B 243 -5.099 -7.295 3.639 1.00 0.00 C ATOM 1532 CG1 VAL B 243 -5.545 -8.523 4.435 1.00 0.00 C ATOM 1533 CG2 VAL B 243 -3.936 -7.640 2.705 1.00 0.00 C ATOM 0 H VAL B 243 -5.384 -4.861 3.360 1.00 0.00 H new ATOM 0 HA VAL B 243 -6.246 -7.142 1.865 1.00 0.00 H new ATOM 0 HB VAL B 243 -4.749 -6.545 4.348 1.00 0.00 H new ATOM 0 HG11 VAL B 243 -4.694 -8.931 4.981 1.00 0.00 H new ATOM 0 HG12 VAL B 243 -6.325 -8.236 5.140 1.00 0.00 H new ATOM 0 HG13 VAL B 243 -5.934 -9.278 3.752 1.00 0.00 H new ATOM 0 HG21 VAL B 243 -3.118 -8.066 3.285 1.00 0.00 H new ATOM 0 HG22 VAL B 243 -4.269 -8.364 1.961 1.00 0.00 H new ATOM 0 HG23 VAL B 243 -3.592 -6.736 2.203 1.00 0.00 H new ATOM 1543 N ASN B 244 -7.944 -6.308 4.548 1.00 0.00 N ATOM 1544 CA ASN B 244 -9.207 -6.512 5.238 1.00 0.00 C ATOM 1545 C ASN B 244 -10.359 -6.331 4.248 1.00 0.00 C ATOM 1546 O ASN B 244 -11.367 -7.031 4.328 1.00 0.00 O ATOM 1547 CB ASN B 244 -9.387 -5.495 6.366 1.00 0.00 C ATOM 1548 CG ASN B 244 -9.129 -6.137 7.731 1.00 0.00 C ATOM 1549 OD1 ASN B 244 -7.875 -6.548 7.905 1.00 0.00 O flip ATOM 1550 ND2 ASN B 244 -10.007 -6.250 8.569 1.00 0.00 N flip ATOM 0 H ASN B 244 -7.346 -5.590 4.956 1.00 0.00 H new ATOM 0 HA ASN B 244 -9.205 -7.518 5.657 1.00 0.00 H new ATOM 0 HB2 ASN B 244 -8.704 -4.659 6.219 1.00 0.00 H new ATOM 0 HB3 ASN B 244 -10.398 -5.089 6.336 1.00 0.00 H new ATOM 0 HD21 ASN B 244 -10.949 -5.913 8.370 1.00 0.00 H new ATOM 0 HD22 ASN B 244 -9.800 -6.682 9.470 1.00 0.00 H new ATOM 1557 N THR B 245 -10.171 -5.386 3.337 1.00 0.00 N ATOM 1558 CA THR B 245 -11.183 -5.104 2.333 1.00 0.00 C ATOM 1559 C THR B 245 -11.200 -6.204 1.269 1.00 0.00 C ATOM 1560 O THR B 245 -12.266 -6.623 0.822 1.00 0.00 O ATOM 1561 CB THR B 245 -10.907 -3.712 1.763 1.00 0.00 C ATOM 1562 OG1 THR B 245 -11.440 -2.825 2.743 1.00 0.00 O ATOM 1563 CG2 THR B 245 -11.732 -3.419 0.508 1.00 0.00 C ATOM 0 H THR B 245 -9.334 -4.807 3.274 1.00 0.00 H new ATOM 0 HA THR B 245 -12.182 -5.101 2.768 1.00 0.00 H new ATOM 0 HB THR B 245 -9.846 -3.619 1.530 1.00 0.00 H new ATOM 0 HG1 THR B 245 -11.505 -1.922 2.367 1.00 0.00 H new ATOM 0 HG21 THR B 245 -11.498 -2.419 0.144 1.00 0.00 H new ATOM 0 HG22 THR B 245 -11.493 -4.151 -0.264 1.00 0.00 H new ATOM 0 HG23 THR B 245 -12.794 -3.479 0.748 1.00 0.00 H new