USER MOD reduce.3.24.130724 H: found=0, std=0, add=513, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 514 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 953 GLN : amide:sc= -0.0794 X(o=-0.38,f=-0.1) USER MOD Set 1.2: A 954 CYS SG : rot 180:sc= -0.296 USER MOD Set 2.1: A 950 GLN : amide:sc= 0.574 K(o=1.8,f=-8!) USER MOD Set 2.2: A 951 LYS NZ :NH3+ 140:sc= 1.21 (180deg=0) USER MOD Set 3.1: A 928 TYR OH : rot 180:sc= 0.603 USER MOD Set 3.2: A 947 TYR OH : rot -171:sc= 0.95 USER MOD Set 4.1: A 929 THR OG1 : rot -46:sc= 0.0232 USER MOD Set 4.2: A 935 THR OG1 : rot 24:sc= 0.092 USER MOD Single : A 889 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 890 SER OG : rot 180:sc= 0 USER MOD Single : A 894 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0441) USER MOD Single : A 895 ASN : amide:sc=-0.00547 X(o=-0.0055,f=0) USER MOD Single : A 900 THR OG1 : rot 180:sc= 0 USER MOD Single : A 901 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 903 THR OG1 : rot 180:sc= 0.0109 USER MOD Single : A 904 SER OG : rot -28:sc= 0.361 USER MOD Single : A 910 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 912 ASN :FLIP amide:sc=-0.00158 F(o=-0.73,f=-0.0016) USER MOD Single : A 915 SER OG : rot 71:sc= 1.24 USER MOD Single : A 916 GLN : amide:sc= 0.919 K(o=0.92,f=-3.8!) USER MOD Single : A 920 GLN : amide:sc= -0.026 K(o=-0.026,f=-0.72) USER MOD Single : A 924 SER OG : rot -150:sc= -0.387 USER MOD Single : A 925 SER OG : rot 180:sc= 0 USER MOD Single : A 927 SER OG : rot 180:sc= 0 USER MOD Single : A 930 SER OG : rot 9:sc= 0.984 USER MOD Single : A 932 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 934 GLN : amide:sc= -0.0774 K(o=-0.077,f=-1.3) USER MOD Single : A 936 THR OG1 : rot -119:sc= 0.00125 USER MOD Single : A 938 TYR OH : rot 180:sc= 0 USER MOD Single : A 941 ASN :FLIP amide:sc= -0.202 F(o=-0.81,f=-0.2) USER MOD Single : A 943 LYS NZ :NH3+ 171:sc= -0.0187 (180deg=-0.156) USER MOD Single : A 949 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 83 N LYS A 889 6.424 8.184 6.357 1.00 0.00 N ATOM 84 CA LYS A 889 6.349 8.787 7.682 1.00 0.00 C ATOM 85 C LYS A 889 4.898 9.112 8.031 1.00 0.00 C ATOM 86 O LYS A 889 4.614 9.810 9.002 1.00 0.00 O ATOM 87 CB LYS A 889 7.219 10.044 7.754 1.00 0.00 C ATOM 88 CG LYS A 889 8.706 9.764 7.578 1.00 0.00 C ATOM 89 CD LYS A 889 9.547 11.022 7.741 1.00 0.00 C ATOM 90 CE LYS A 889 9.427 11.604 9.141 1.00 0.00 C ATOM 91 NZ LYS A 889 10.301 12.793 9.326 1.00 0.00 N ATOM 0 HA LYS A 889 6.729 8.072 8.412 1.00 0.00 H new ATOM 0 HB2 LYS A 889 6.896 10.745 6.984 1.00 0.00 H new ATOM 0 HB3 LYS A 889 7.060 10.532 8.716 1.00 0.00 H new ATOM 0 HG2 LYS A 889 9.023 9.019 8.308 1.00 0.00 H new ATOM 0 HG3 LYS A 889 8.880 9.337 6.590 1.00 0.00 H new ATOM 0 HD2 LYS A 889 10.591 10.791 7.532 1.00 0.00 H new ATOM 0 HD3 LYS A 889 9.233 11.767 7.010 1.00 0.00 H new ATOM 0 HE2 LYS A 889 8.390 11.883 9.330 1.00 0.00 H new ATOM 0 HE3 LYS A 889 9.691 10.842 9.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 889 10.189 13.159 10.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 889 11.293 12.522 9.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 889 10.033 13.531 8.644 1.00 0.00 H new ATOM 105 N SER A 890 3.988 8.603 7.217 1.00 0.00 N ATOM 106 CA SER A 890 2.570 8.718 7.480 1.00 0.00 C ATOM 107 C SER A 890 2.019 7.368 7.921 1.00 0.00 C ATOM 108 O SER A 890 2.475 6.320 7.461 1.00 0.00 O ATOM 109 CB SER A 890 1.840 9.211 6.232 1.00 0.00 C ATOM 110 OG SER A 890 2.369 10.455 5.799 1.00 0.00 O ATOM 0 H SER A 890 4.214 8.101 6.359 1.00 0.00 H new ATOM 0 HA SER A 890 2.412 9.442 8.279 1.00 0.00 H new ATOM 0 HB2 SER A 890 1.933 8.473 5.435 1.00 0.00 H new ATOM 0 HB3 SER A 890 0.776 9.317 6.445 1.00 0.00 H new ATOM 0 HG SER A 890 1.890 10.753 4.998 1.00 0.00 H new ATOM 116 N VAL A 891 1.061 7.394 8.825 1.00 0.00 N ATOM 117 CA VAL A 891 0.452 6.177 9.340 1.00 0.00 C ATOM 118 C VAL A 891 -1.011 6.114 8.923 1.00 0.00 C ATOM 119 O VAL A 891 -1.694 7.128 8.931 1.00 0.00 O ATOM 120 CB VAL A 891 0.543 6.129 10.885 1.00 0.00 C ATOM 121 CG1 VAL A 891 -0.115 4.875 11.438 1.00 0.00 C ATOM 122 CG2 VAL A 891 1.992 6.217 11.339 1.00 0.00 C ATOM 0 H VAL A 891 0.682 8.253 9.224 1.00 0.00 H new ATOM 0 HA VAL A 891 0.992 5.325 8.927 1.00 0.00 H new ATOM 0 HB VAL A 891 0.003 6.991 11.278 1.00 0.00 H new ATOM 0 HG11 VAL A 891 -0.034 4.871 12.525 1.00 0.00 H new ATOM 0 HG12 VAL A 891 -1.167 4.860 11.152 1.00 0.00 H new ATOM 0 HG13 VAL A 891 0.384 3.994 11.034 1.00 0.00 H new ATOM 0 HG21 VAL A 891 2.035 6.182 12.428 1.00 0.00 H new ATOM 0 HG22 VAL A 891 2.554 5.379 10.926 1.00 0.00 H new ATOM 0 HG23 VAL A 891 2.427 7.153 10.989 1.00 0.00 H new ATOM 132 N PHE A 892 -1.493 4.943 8.543 1.00 0.00 N ATOM 133 CA PHE A 892 -2.907 4.787 8.237 1.00 0.00 C ATOM 134 C PHE A 892 -3.602 4.011 9.351 1.00 0.00 C ATOM 135 O PHE A 892 -3.230 2.882 9.660 1.00 0.00 O ATOM 136 CB PHE A 892 -3.120 4.117 6.864 1.00 0.00 C ATOM 137 CG PHE A 892 -2.489 2.758 6.705 1.00 0.00 C ATOM 138 CD1 PHE A 892 -1.165 2.634 6.318 1.00 0.00 C ATOM 139 CD2 PHE A 892 -3.227 1.605 6.928 1.00 0.00 C ATOM 140 CE1 PHE A 892 -0.589 1.387 6.158 1.00 0.00 C ATOM 141 CE2 PHE A 892 -2.656 0.358 6.772 1.00 0.00 C ATOM 142 CZ PHE A 892 -1.336 0.249 6.387 1.00 0.00 C ATOM 0 H PHE A 892 -0.935 4.095 8.439 1.00 0.00 H new ATOM 0 HA PHE A 892 -3.355 5.779 8.177 1.00 0.00 H new ATOM 0 HB2 PHE A 892 -4.191 4.025 6.686 1.00 0.00 H new ATOM 0 HB3 PHE A 892 -2.724 4.776 6.091 1.00 0.00 H new ATOM 0 HD1 PHE A 892 -0.576 3.521 6.139 1.00 0.00 H new ATOM 0 HD2 PHE A 892 -4.262 1.684 7.228 1.00 0.00 H new ATOM 0 HE1 PHE A 892 0.444 1.304 5.854 1.00 0.00 H new ATOM 0 HE2 PHE A 892 -3.242 -0.531 6.951 1.00 0.00 H new ATOM 0 HZ PHE A 892 -0.887 -0.726 6.265 1.00 0.00 H new ATOM 152 N VAL A 893 -4.590 4.634 9.981 1.00 0.00 N ATOM 153 CA VAL A 893 -5.332 3.985 11.051 1.00 0.00 C ATOM 154 C VAL A 893 -6.687 3.526 10.533 1.00 0.00 C ATOM 155 O VAL A 893 -7.489 4.350 10.059 1.00 0.00 O ATOM 156 CB VAL A 893 -5.539 4.929 12.259 1.00 0.00 C ATOM 157 CG1 VAL A 893 -6.259 4.208 13.389 1.00 0.00 C ATOM 158 CG2 VAL A 893 -4.208 5.483 12.743 1.00 0.00 C ATOM 0 H VAL A 893 -4.894 5.584 9.770 1.00 0.00 H new ATOM 0 HA VAL A 893 -4.748 3.128 11.386 1.00 0.00 H new ATOM 0 HB VAL A 893 -6.160 5.764 11.934 1.00 0.00 H new ATOM 0 HG11 VAL A 893 -6.394 4.890 14.228 1.00 0.00 H new ATOM 0 HG12 VAL A 893 -7.233 3.865 13.040 1.00 0.00 H new ATOM 0 HG13 VAL A 893 -5.666 3.351 13.710 1.00 0.00 H new ATOM 0 HG21 VAL A 893 -4.377 6.144 13.593 1.00 0.00 H new ATOM 0 HG22 VAL A 893 -3.560 4.660 13.046 1.00 0.00 H new ATOM 0 HG23 VAL A 893 -3.732 6.042 11.937 1.00 0.00 H new ATOM 168 N LYS A 894 -6.918 2.206 10.618 1.00 0.00 N ATOM 169 CA LYS A 894 -8.146 1.554 10.134 1.00 0.00 C ATOM 170 C LYS A 894 -8.381 1.840 8.641 1.00 0.00 C ATOM 171 O LYS A 894 -9.386 1.431 8.061 1.00 0.00 O ATOM 172 CB LYS A 894 -9.347 2.011 10.974 1.00 0.00 C ATOM 173 CG LYS A 894 -10.550 1.082 10.893 1.00 0.00 C ATOM 174 CD LYS A 894 -11.682 1.550 11.795 1.00 0.00 C ATOM 175 CE LYS A 894 -12.798 0.520 11.870 1.00 0.00 C ATOM 176 NZ LYS A 894 -13.413 0.258 10.543 1.00 0.00 N ATOM 0 H LYS A 894 -6.250 1.554 11.029 1.00 0.00 H new ATOM 0 HA LYS A 894 -8.029 0.476 10.244 1.00 0.00 H new ATOM 0 HB2 LYS A 894 -9.037 2.097 12.015 1.00 0.00 H new ATOM 0 HB3 LYS A 894 -9.647 3.007 10.648 1.00 0.00 H new ATOM 0 HG2 LYS A 894 -10.902 1.031 9.863 1.00 0.00 H new ATOM 0 HG3 LYS A 894 -10.251 0.073 11.177 1.00 0.00 H new ATOM 0 HD2 LYS A 894 -11.295 1.742 12.796 1.00 0.00 H new ATOM 0 HD3 LYS A 894 -12.081 2.493 11.421 1.00 0.00 H new ATOM 0 HE2 LYS A 894 -12.403 -0.412 12.275 1.00 0.00 H new ATOM 0 HE3 LYS A 894 -13.565 0.868 12.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 894 -14.233 -0.372 10.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 894 -13.723 1.156 10.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 894 -12.714 -0.194 9.920 1.00 0.00 H new ATOM 190 N ASN A 895 -7.423 2.540 8.041 1.00 0.00 N ATOM 191 CA ASN A 895 -7.526 3.068 6.684 1.00 0.00 C ATOM 192 C ASN A 895 -8.713 4.030 6.591 1.00 0.00 C ATOM 193 O ASN A 895 -9.260 4.280 5.513 1.00 0.00 O ATOM 194 CB ASN A 895 -7.656 1.935 5.659 1.00 0.00 C ATOM 195 CG ASN A 895 -7.069 2.313 4.311 1.00 0.00 C ATOM 196 OD1 ASN A 895 -5.879 2.119 4.073 1.00 0.00 O ATOM 197 ND2 ASN A 895 -7.891 2.848 3.419 1.00 0.00 N ATOM 0 H ASN A 895 -6.536 2.761 8.493 1.00 0.00 H new ATOM 0 HA ASN A 895 -6.612 3.615 6.452 1.00 0.00 H new ATOM 0 HB2 ASN A 895 -7.152 1.046 6.037 1.00 0.00 H new ATOM 0 HB3 ASN A 895 -8.708 1.677 5.536 1.00 0.00 H new ATOM 0 HD21 ASN A 895 -7.541 3.114 2.498 1.00 0.00 H new ATOM 0 HD22 ASN A 895 -8.873 2.994 3.653 1.00 0.00 H new ATOM 204 N VAL A 896 -9.096 4.584 7.737 1.00 0.00 N ATOM 205 CA VAL A 896 -10.118 5.614 7.781 1.00 0.00 C ATOM 206 C VAL A 896 -9.459 6.963 8.013 1.00 0.00 C ATOM 207 O VAL A 896 -9.956 8.002 7.570 1.00 0.00 O ATOM 208 CB VAL A 896 -11.181 5.335 8.875 1.00 0.00 C ATOM 209 CG1 VAL A 896 -10.577 5.398 10.270 1.00 0.00 C ATOM 210 CG2 VAL A 896 -12.349 6.301 8.753 1.00 0.00 C ATOM 0 H VAL A 896 -8.711 4.333 8.648 1.00 0.00 H new ATOM 0 HA VAL A 896 -10.641 5.616 6.824 1.00 0.00 H new ATOM 0 HB VAL A 896 -11.553 4.322 8.720 1.00 0.00 H new ATOM 0 HG11 VAL A 896 -11.351 5.198 11.011 1.00 0.00 H new ATOM 0 HG12 VAL A 896 -9.788 4.652 10.359 1.00 0.00 H new ATOM 0 HG13 VAL A 896 -10.159 6.390 10.441 1.00 0.00 H new ATOM 0 HG21 VAL A 896 -13.082 6.086 9.531 1.00 0.00 H new ATOM 0 HG22 VAL A 896 -11.989 7.324 8.866 1.00 0.00 H new ATOM 0 HG23 VAL A 896 -12.815 6.187 7.774 1.00 0.00 H new ATOM 220 N GLY A 897 -8.313 6.932 8.689 1.00 0.00 N ATOM 221 CA GLY A 897 -7.583 8.151 8.941 1.00 0.00 C ATOM 222 C GLY A 897 -6.095 7.980 8.740 1.00 0.00 C ATOM 223 O GLY A 897 -5.577 6.862 8.784 1.00 0.00 O ATOM 0 H GLY A 897 -7.883 6.086 9.063 1.00 0.00 H new ATOM 0 HA2 GLY A 897 -7.949 8.935 8.278 1.00 0.00 H new ATOM 0 HA3 GLY A 897 -7.774 8.482 9.962 1.00 0.00 H new ATOM 227 N TRP A 898 -5.411 9.089 8.525 1.00 0.00 N ATOM 228 CA TRP A 898 -3.977 9.081 8.307 1.00 0.00 C ATOM 229 C TRP A 898 -3.293 9.953 9.352 1.00 0.00 C ATOM 230 O TRP A 898 -3.744 11.057 9.632 1.00 0.00 O ATOM 231 CB TRP A 898 -3.648 9.602 6.900 1.00 0.00 C ATOM 232 CG TRP A 898 -4.823 9.593 5.963 1.00 0.00 C ATOM 233 CD1 TRP A 898 -5.622 10.655 5.653 1.00 0.00 C ATOM 234 CD2 TRP A 898 -5.338 8.477 5.227 1.00 0.00 C ATOM 235 NE1 TRP A 898 -6.607 10.270 4.782 1.00 0.00 N ATOM 236 CE2 TRP A 898 -6.453 8.939 4.500 1.00 0.00 C ATOM 237 CE3 TRP A 898 -4.968 7.135 5.113 1.00 0.00 C ATOM 238 CZ2 TRP A 898 -7.196 8.106 3.669 1.00 0.00 C ATOM 239 CZ3 TRP A 898 -5.707 6.309 4.288 1.00 0.00 C ATOM 240 CH2 TRP A 898 -6.810 6.797 3.575 1.00 0.00 C ATOM 0 H TRP A 898 -5.833 10.017 8.497 1.00 0.00 H new ATOM 0 HA TRP A 898 -3.614 8.057 8.396 1.00 0.00 H new ATOM 0 HB2 TRP A 898 -3.265 10.620 6.979 1.00 0.00 H new ATOM 0 HB3 TRP A 898 -2.850 8.994 6.474 1.00 0.00 H new ATOM 0 HD1 TRP A 898 -5.496 11.656 6.039 1.00 0.00 H new ATOM 0 HE1 TRP A 898 -7.336 10.876 4.405 1.00 0.00 H new ATOM 0 HE3 TRP A 898 -4.120 6.750 5.660 1.00 0.00 H new ATOM 0 HZ2 TRP A 898 -8.047 8.479 3.118 1.00 0.00 H new ATOM 0 HZ3 TRP A 898 -5.430 5.270 4.191 1.00 0.00 H new ATOM 0 HH2 TRP A 898 -7.367 6.126 2.938 1.00 0.00 H new ATOM 251 N ALA A 899 -2.201 9.464 9.908 1.00 0.00 N ATOM 252 CA ALA A 899 -1.442 10.212 10.891 1.00 0.00 C ATOM 253 C ALA A 899 -0.142 10.704 10.274 1.00 0.00 C ATOM 254 O ALA A 899 0.576 9.942 9.627 1.00 0.00 O ATOM 255 CB ALA A 899 -1.166 9.357 12.119 1.00 0.00 C ATOM 0 H ALA A 899 -1.817 8.544 9.693 1.00 0.00 H new ATOM 0 HA ALA A 899 -2.028 11.075 11.207 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -0.595 9.936 12.845 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -2.110 9.045 12.565 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -0.594 8.476 11.828 1.00 0.00 H new ATOM 261 N THR A 900 0.148 11.975 10.465 1.00 0.00 N ATOM 262 CA THR A 900 1.323 12.586 9.878 1.00 0.00 C ATOM 263 C THR A 900 2.300 13.029 10.961 1.00 0.00 C ATOM 264 O THR A 900 1.902 13.641 11.951 1.00 0.00 O ATOM 265 CB THR A 900 0.917 13.795 9.017 1.00 0.00 C ATOM 266 OG1 THR A 900 -0.252 13.461 8.258 1.00 0.00 O ATOM 267 CG2 THR A 900 2.041 14.201 8.073 1.00 0.00 C ATOM 0 H THR A 900 -0.419 12.609 11.027 1.00 0.00 H new ATOM 0 HA THR A 900 1.815 11.845 9.248 1.00 0.00 H new ATOM 0 HB THR A 900 0.709 14.637 9.677 1.00 0.00 H new ATOM 0 HG1 THR A 900 -0.516 14.229 7.709 1.00 0.00 H new ATOM 0 HG21 THR A 900 1.725 15.058 7.478 1.00 0.00 H new ATOM 0 HG22 THR A 900 2.924 14.468 8.653 1.00 0.00 H new ATOM 0 HG23 THR A 900 2.280 13.368 7.412 1.00 0.00 H new ATOM 275 N GLN A 901 3.569 12.695 10.775 1.00 0.00 N ATOM 276 CA GLN A 901 4.611 13.077 11.715 1.00 0.00 C ATOM 277 C GLN A 901 5.165 14.456 11.362 1.00 0.00 C ATOM 278 O GLN A 901 5.740 14.645 10.289 1.00 0.00 O ATOM 279 CB GLN A 901 5.735 12.036 11.689 1.00 0.00 C ATOM 280 CG GLN A 901 6.897 12.348 12.620 1.00 0.00 C ATOM 281 CD GLN A 901 8.048 11.372 12.460 1.00 0.00 C ATOM 282 OE1 GLN A 901 7.849 10.201 12.128 1.00 0.00 O ATOM 283 NE2 GLN A 901 9.263 11.852 12.677 1.00 0.00 N ATOM 0 H GLN A 901 3.903 12.156 9.976 1.00 0.00 H new ATOM 0 HA GLN A 901 4.185 13.121 12.717 1.00 0.00 H new ATOM 0 HB2 GLN A 901 5.321 11.064 11.957 1.00 0.00 H new ATOM 0 HB3 GLN A 901 6.113 11.952 10.670 1.00 0.00 H new ATOM 0 HG2 GLN A 901 7.253 13.360 12.425 1.00 0.00 H new ATOM 0 HG3 GLN A 901 6.547 12.326 13.652 1.00 0.00 H new ATOM 0 HE21 GLN A 901 9.385 12.827 12.950 1.00 0.00 H new ATOM 0 HE22 GLN A 901 10.077 11.247 12.571 1.00 0.00 H new ATOM 292 N LEU A 902 4.978 15.421 12.253 1.00 0.00 N ATOM 293 CA LEU A 902 5.512 16.764 12.046 1.00 0.00 C ATOM 294 C LEU A 902 6.661 17.032 13.008 1.00 0.00 C ATOM 295 O LEU A 902 6.620 16.616 14.166 1.00 0.00 O ATOM 296 CB LEU A 902 4.426 17.837 12.230 1.00 0.00 C ATOM 297 CG LEU A 902 3.374 17.938 11.115 1.00 0.00 C ATOM 298 CD1 LEU A 902 4.040 17.994 9.749 1.00 0.00 C ATOM 299 CD2 LEU A 902 2.383 16.788 11.188 1.00 0.00 C ATOM 0 H LEU A 902 4.462 15.301 13.125 1.00 0.00 H new ATOM 0 HA LEU A 902 5.876 16.817 11.020 1.00 0.00 H new ATOM 0 HB2 LEU A 902 3.910 17.644 13.171 1.00 0.00 H new ATOM 0 HB3 LEU A 902 4.915 18.806 12.328 1.00 0.00 H new ATOM 0 HG LEU A 902 2.819 18.865 11.262 1.00 0.00 H new ATOM 0 HD11 LEU A 902 3.276 18.065 8.975 1.00 0.00 H new ATOM 0 HD12 LEU A 902 4.692 18.866 9.697 1.00 0.00 H new ATOM 0 HD13 LEU A 902 4.630 17.091 9.595 1.00 0.00 H new ATOM 0 HD21 LEU A 902 1.651 16.887 10.386 1.00 0.00 H new ATOM 0 HD22 LEU A 902 2.914 15.842 11.080 1.00 0.00 H new ATOM 0 HD23 LEU A 902 1.872 16.809 12.151 1.00 0.00 H new ATOM 311 N THR A 903 7.681 17.735 12.527 1.00 0.00 N ATOM 312 CA THR A 903 8.850 18.062 13.338 1.00 0.00 C ATOM 313 C THR A 903 8.505 19.049 14.456 1.00 0.00 C ATOM 314 O THR A 903 9.326 19.323 15.333 1.00 0.00 O ATOM 315 CB THR A 903 9.992 18.630 12.472 1.00 0.00 C ATOM 316 OG1 THR A 903 9.482 19.608 11.554 1.00 0.00 O ATOM 317 CG2 THR A 903 10.686 17.520 11.701 1.00 0.00 C ATOM 0 H THR A 903 7.722 18.092 11.572 1.00 0.00 H new ATOM 0 HA THR A 903 9.187 17.131 13.794 1.00 0.00 H new ATOM 0 HB THR A 903 10.716 19.103 13.135 1.00 0.00 H new ATOM 0 HG1 THR A 903 10.217 19.962 11.011 1.00 0.00 H new ATOM 0 HG21 THR A 903 11.488 17.943 11.097 1.00 0.00 H new ATOM 0 HG22 THR A 903 11.103 16.796 12.401 1.00 0.00 H new ATOM 0 HG23 THR A 903 9.966 17.023 11.051 1.00 0.00 H new ATOM 325 N SER A 904 7.286 19.583 14.413 1.00 0.00 N ATOM 326 CA SER A 904 6.796 20.471 15.460 1.00 0.00 C ATOM 327 C SER A 904 6.300 19.653 16.657 1.00 0.00 C ATOM 328 O SER A 904 5.879 20.203 17.676 1.00 0.00 O ATOM 329 CB SER A 904 5.667 21.354 14.898 1.00 0.00 C ATOM 330 OG SER A 904 5.159 22.256 15.868 1.00 0.00 O ATOM 0 H SER A 904 6.619 19.414 13.660 1.00 0.00 H new ATOM 0 HA SER A 904 7.609 21.113 15.801 1.00 0.00 H new ATOM 0 HB2 SER A 904 6.040 21.916 14.042 1.00 0.00 H new ATOM 0 HB3 SER A 904 4.858 20.720 14.535 1.00 0.00 H new ATOM 0 HG SER A 904 5.268 21.870 16.762 1.00 0.00 H new ATOM 336 N GLY A 905 6.381 18.332 16.536 1.00 0.00 N ATOM 337 CA GLY A 905 5.952 17.456 17.609 1.00 0.00 C ATOM 338 C GLY A 905 4.466 17.191 17.546 1.00 0.00 C ATOM 339 O GLY A 905 3.893 16.552 18.429 1.00 0.00 O ATOM 0 H GLY A 905 6.738 17.852 15.710 1.00 0.00 H new ATOM 0 HA2 GLY A 905 6.494 16.512 17.548 1.00 0.00 H new ATOM 0 HA3 GLY A 905 6.202 17.906 18.570 1.00 0.00 H new ATOM 343 N ALA A 906 3.844 17.710 16.502 1.00 0.00 N ATOM 344 CA ALA A 906 2.427 17.522 16.281 1.00 0.00 C ATOM 345 C ALA A 906 2.173 16.298 15.417 1.00 0.00 C ATOM 346 O ALA A 906 2.905 16.040 14.458 1.00 0.00 O ATOM 347 CB ALA A 906 1.825 18.760 15.634 1.00 0.00 C ATOM 0 H ALA A 906 4.308 18.271 15.788 1.00 0.00 H new ATOM 0 HA ALA A 906 1.948 17.363 17.247 1.00 0.00 H new ATOM 0 HB1 ALA A 906 0.758 18.604 15.473 1.00 0.00 H new ATOM 0 HB2 ALA A 906 1.972 19.620 16.287 1.00 0.00 H new ATOM 0 HB3 ALA A 906 2.313 18.944 14.677 1.00 0.00 H new ATOM 353 N VAL A 907 1.152 15.542 15.767 1.00 0.00 N ATOM 354 CA VAL A 907 0.687 14.462 14.924 1.00 0.00 C ATOM 355 C VAL A 907 -0.584 14.913 14.225 1.00 0.00 C ATOM 356 O VAL A 907 -1.556 15.300 14.877 1.00 0.00 O ATOM 357 CB VAL A 907 0.411 13.172 15.729 1.00 0.00 C ATOM 358 CG1 VAL A 907 -0.002 12.036 14.806 1.00 0.00 C ATOM 359 CG2 VAL A 907 1.631 12.777 16.545 1.00 0.00 C ATOM 0 H VAL A 907 0.627 15.658 16.634 1.00 0.00 H new ATOM 0 HA VAL A 907 1.468 14.227 14.200 1.00 0.00 H new ATOM 0 HB VAL A 907 -0.412 13.372 16.415 1.00 0.00 H new ATOM 0 HG11 VAL A 907 -0.191 11.139 15.395 1.00 0.00 H new ATOM 0 HG12 VAL A 907 -0.909 12.315 14.269 1.00 0.00 H new ATOM 0 HG13 VAL A 907 0.797 11.839 14.091 1.00 0.00 H new ATOM 0 HG21 VAL A 907 1.416 11.867 17.104 1.00 0.00 H new ATOM 0 HG22 VAL A 907 2.474 12.602 15.877 1.00 0.00 H new ATOM 0 HG23 VAL A 907 1.879 13.579 17.240 1.00 0.00 H new ATOM 369 N TRP A 908 -0.568 14.879 12.907 1.00 0.00 N ATOM 370 CA TRP A 908 -1.691 15.365 12.128 1.00 0.00 C ATOM 371 C TRP A 908 -2.540 14.194 11.651 1.00 0.00 C ATOM 372 O TRP A 908 -2.085 13.382 10.851 1.00 0.00 O ATOM 373 CB TRP A 908 -1.167 16.167 10.932 1.00 0.00 C ATOM 374 CG TRP A 908 -2.156 17.139 10.362 1.00 0.00 C ATOM 375 CD1 TRP A 908 -3.241 16.855 9.583 1.00 0.00 C ATOM 376 CD2 TRP A 908 -2.135 18.563 10.519 1.00 0.00 C ATOM 377 NE1 TRP A 908 -3.897 18.016 9.252 1.00 0.00 N ATOM 378 CE2 TRP A 908 -3.237 19.076 9.813 1.00 0.00 C ATOM 379 CE3 TRP A 908 -1.290 19.456 11.189 1.00 0.00 C ATOM 380 CZ2 TRP A 908 -3.517 20.438 9.755 1.00 0.00 C ATOM 381 CZ3 TRP A 908 -1.571 20.808 11.132 1.00 0.00 C ATOM 382 CH2 TRP A 908 -2.676 21.288 10.420 1.00 0.00 C ATOM 0 H TRP A 908 0.210 14.520 12.353 1.00 0.00 H new ATOM 0 HA TRP A 908 -2.313 16.011 12.748 1.00 0.00 H new ATOM 0 HB2 TRP A 908 -0.274 16.712 11.238 1.00 0.00 H new ATOM 0 HB3 TRP A 908 -0.864 15.473 10.148 1.00 0.00 H new ATOM 0 HD1 TRP A 908 -3.539 15.864 9.273 1.00 0.00 H new ATOM 0 HE1 TRP A 908 -4.740 18.078 8.681 1.00 0.00 H new ATOM 0 HE3 TRP A 908 -0.434 19.095 11.740 1.00 0.00 H new ATOM 0 HZ2 TRP A 908 -4.368 20.811 9.205 1.00 0.00 H new ATOM 0 HZ3 TRP A 908 -0.927 21.506 11.646 1.00 0.00 H new ATOM 0 HH2 TRP A 908 -2.869 22.350 10.395 1.00 0.00 H new ATOM 393 N VAL A 909 -3.765 14.105 12.138 1.00 0.00 N ATOM 394 CA VAL A 909 -4.644 13.016 11.747 1.00 0.00 C ATOM 395 C VAL A 909 -5.682 13.515 10.757 1.00 0.00 C ATOM 396 O VAL A 909 -6.495 14.374 11.074 1.00 0.00 O ATOM 397 CB VAL A 909 -5.356 12.384 12.963 1.00 0.00 C ATOM 398 CG1 VAL A 909 -6.217 11.204 12.529 1.00 0.00 C ATOM 399 CG2 VAL A 909 -4.345 11.951 14.014 1.00 0.00 C ATOM 0 H VAL A 909 -4.172 14.767 12.799 1.00 0.00 H new ATOM 0 HA VAL A 909 -4.025 12.249 11.283 1.00 0.00 H new ATOM 0 HB VAL A 909 -6.007 13.138 13.406 1.00 0.00 H new ATOM 0 HG11 VAL A 909 -6.710 10.773 13.401 1.00 0.00 H new ATOM 0 HG12 VAL A 909 -6.970 11.545 11.818 1.00 0.00 H new ATOM 0 HG13 VAL A 909 -5.588 10.449 12.057 1.00 0.00 H new ATOM 0 HG21 VAL A 909 -4.868 11.509 14.862 1.00 0.00 H new ATOM 0 HG22 VAL A 909 -3.665 11.216 13.584 1.00 0.00 H new ATOM 0 HG23 VAL A 909 -3.776 12.818 14.351 1.00 0.00 H new ATOM 409 N GLN A 910 -5.627 12.991 9.553 1.00 0.00 N ATOM 410 CA GLN A 910 -6.574 13.353 8.515 1.00 0.00 C ATOM 411 C GLN A 910 -7.559 12.215 8.300 1.00 0.00 C ATOM 412 O GLN A 910 -7.185 11.054 8.381 1.00 0.00 O ATOM 413 CB GLN A 910 -5.835 13.648 7.210 1.00 0.00 C ATOM 414 CG GLN A 910 -4.692 14.637 7.364 1.00 0.00 C ATOM 415 CD GLN A 910 -3.907 14.824 6.082 1.00 0.00 C ATOM 416 OE1 GLN A 910 -4.209 15.704 5.277 1.00 0.00 O ATOM 417 NE2 GLN A 910 -2.896 13.996 5.881 1.00 0.00 N ATOM 0 H GLN A 910 -4.930 12.305 9.264 1.00 0.00 H new ATOM 0 HA GLN A 910 -7.116 14.246 8.826 1.00 0.00 H new ATOM 0 HB2 GLN A 910 -5.444 12.714 6.806 1.00 0.00 H new ATOM 0 HB3 GLN A 910 -6.545 14.038 6.481 1.00 0.00 H new ATOM 0 HG2 GLN A 910 -5.090 15.599 7.686 1.00 0.00 H new ATOM 0 HG3 GLN A 910 -4.020 14.291 8.150 1.00 0.00 H new ATOM 0 HE21 GLN A 910 -2.678 13.279 6.574 1.00 0.00 H new ATOM 0 HE22 GLN A 910 -2.334 14.074 5.033 1.00 0.00 H new ATOM 426 N PHE A 911 -8.808 12.533 8.039 1.00 0.00 N ATOM 427 CA PHE A 911 -9.776 11.514 7.673 1.00 0.00 C ATOM 428 C PHE A 911 -9.917 11.455 6.161 1.00 0.00 C ATOM 429 O PHE A 911 -9.567 12.410 5.464 1.00 0.00 O ATOM 430 CB PHE A 911 -11.137 11.787 8.313 1.00 0.00 C ATOM 431 CG PHE A 911 -11.181 11.518 9.790 1.00 0.00 C ATOM 432 CD1 PHE A 911 -10.944 10.244 10.281 1.00 0.00 C ATOM 433 CD2 PHE A 911 -11.466 12.534 10.684 1.00 0.00 C ATOM 434 CE1 PHE A 911 -10.992 9.990 11.638 1.00 0.00 C ATOM 435 CE2 PHE A 911 -11.519 12.286 12.041 1.00 0.00 C ATOM 436 CZ PHE A 911 -11.280 11.013 12.519 1.00 0.00 C ATOM 0 H PHE A 911 -9.179 13.483 8.072 1.00 0.00 H new ATOM 0 HA PHE A 911 -9.415 10.554 8.043 1.00 0.00 H new ATOM 0 HB2 PHE A 911 -11.409 12.827 8.135 1.00 0.00 H new ATOM 0 HB3 PHE A 911 -11.889 11.172 7.819 1.00 0.00 H new ATOM 0 HD1 PHE A 911 -10.719 9.441 9.595 1.00 0.00 H new ATOM 0 HD2 PHE A 911 -11.649 13.533 10.316 1.00 0.00 H new ATOM 0 HE1 PHE A 911 -10.805 8.993 12.009 1.00 0.00 H new ATOM 0 HE2 PHE A 911 -11.747 13.087 12.728 1.00 0.00 H new ATOM 0 HZ PHE A 911 -11.318 10.818 13.581 1.00 0.00 H new ATOM 446 N ASN A 912 -10.430 10.340 5.655 1.00 0.00 N ATOM 447 CA ASN A 912 -10.649 10.181 4.220 1.00 0.00 C ATOM 448 C ASN A 912 -11.665 11.205 3.718 1.00 0.00 C ATOM 449 O ASN A 912 -11.650 11.589 2.548 1.00 0.00 O ATOM 450 CB ASN A 912 -11.136 8.764 3.907 1.00 0.00 C ATOM 451 CG ASN A 912 -11.276 8.495 2.413 1.00 0.00 C ATOM 452 OD1 ASN A 912 -10.376 9.052 1.616 1.00 0.00 O flip ATOM 453 ND2 ASN A 912 -12.175 7.772 1.985 1.00 0.00 N flip ATOM 0 H ASN A 912 -10.702 9.532 6.215 1.00 0.00 H new ATOM 0 HA ASN A 912 -9.701 10.348 3.709 1.00 0.00 H new ATOM 0 HB2 ASN A 912 -10.439 8.044 4.336 1.00 0.00 H new ATOM 0 HB3 ASN A 912 -12.099 8.602 4.391 1.00 0.00 H new ATOM 0 HD21 ASN A 912 -12.850 7.361 2.630 1.00 0.00 H new ATOM 0 HD22 ASN A 912 -12.246 7.584 0.985 1.00 0.00 H new ATOM 460 N ASP A 913 -12.536 11.659 4.614 1.00 0.00 N ATOM 461 CA ASP A 913 -13.560 12.638 4.258 1.00 0.00 C ATOM 462 C ASP A 913 -13.027 14.068 4.371 1.00 0.00 C ATOM 463 O ASP A 913 -13.757 15.033 4.144 1.00 0.00 O ATOM 464 CB ASP A 913 -14.798 12.468 5.143 1.00 0.00 C ATOM 465 CG ASP A 913 -14.510 12.725 6.606 1.00 0.00 C ATOM 466 OD1 ASP A 913 -14.631 13.885 7.046 1.00 0.00 O ATOM 467 OD2 ASP A 913 -14.172 11.763 7.325 1.00 0.00 O ATOM 0 H ASP A 913 -12.554 11.366 5.591 1.00 0.00 H new ATOM 0 HA ASP A 913 -13.839 12.460 3.219 1.00 0.00 H new ATOM 0 HB2 ASP A 913 -15.578 13.151 4.805 1.00 0.00 H new ATOM 0 HB3 ASP A 913 -15.187 11.457 5.026 1.00 0.00 H new ATOM 472 N GLY A 914 -11.754 14.200 4.716 1.00 0.00 N ATOM 473 CA GLY A 914 -11.107 15.500 4.696 1.00 0.00 C ATOM 474 C GLY A 914 -11.127 16.230 6.027 1.00 0.00 C ATOM 475 O GLY A 914 -10.674 17.371 6.112 1.00 0.00 O ATOM 0 H GLY A 914 -11.155 13.429 5.010 1.00 0.00 H new ATOM 0 HA2 GLY A 914 -10.071 15.372 4.381 1.00 0.00 H new ATOM 0 HA3 GLY A 914 -11.594 16.123 3.946 1.00 0.00 H new ATOM 479 N SER A 915 -11.624 15.587 7.073 1.00 0.00 N ATOM 480 CA SER A 915 -11.622 16.208 8.393 1.00 0.00 C ATOM 481 C SER A 915 -10.271 15.972 9.058 1.00 0.00 C ATOM 482 O SER A 915 -9.603 14.987 8.752 1.00 0.00 O ATOM 483 CB SER A 915 -12.759 15.649 9.245 1.00 0.00 C ATOM 484 OG SER A 915 -14.011 15.853 8.607 1.00 0.00 O ATOM 0 H SER A 915 -12.028 14.651 7.038 1.00 0.00 H new ATOM 0 HA SER A 915 -11.781 17.282 8.292 1.00 0.00 H new ATOM 0 HB2 SER A 915 -12.602 14.584 9.417 1.00 0.00 H new ATOM 0 HB3 SER A 915 -12.760 16.133 10.222 1.00 0.00 H new ATOM 0 HG SER A 915 -14.082 15.261 7.829 1.00 0.00 H new ATOM 490 N GLN A 916 -9.846 16.866 9.949 1.00 0.00 N ATOM 491 CA GLN A 916 -8.491 16.774 10.487 1.00 0.00 C ATOM 492 C GLN A 916 -8.448 16.905 12.008 1.00 0.00 C ATOM 493 O GLN A 916 -9.317 17.527 12.620 1.00 0.00 O ATOM 494 CB GLN A 916 -7.621 17.859 9.851 1.00 0.00 C ATOM 495 CG GLN A 916 -7.619 17.816 8.331 1.00 0.00 C ATOM 496 CD GLN A 916 -6.941 19.017 7.712 1.00 0.00 C ATOM 497 OE1 GLN A 916 -5.739 19.004 7.461 1.00 0.00 O ATOM 498 NE2 GLN A 916 -7.708 20.063 7.461 1.00 0.00 N ATOM 0 H GLN A 916 -10.403 17.642 10.306 1.00 0.00 H new ATOM 0 HA GLN A 916 -8.109 15.783 10.242 1.00 0.00 H new ATOM 0 HB2 GLN A 916 -7.974 18.837 10.179 1.00 0.00 H new ATOM 0 HB3 GLN A 916 -6.598 17.752 10.212 1.00 0.00 H new ATOM 0 HG2 GLN A 916 -7.115 16.908 7.998 1.00 0.00 H new ATOM 0 HG3 GLN A 916 -8.647 17.760 7.972 1.00 0.00 H new ATOM 0 HE21 GLN A 916 -8.703 20.032 7.685 1.00 0.00 H new ATOM 0 HE22 GLN A 916 -7.306 20.902 7.043 1.00 0.00 H new ATOM 507 N LEU A 917 -7.418 16.307 12.596 1.00 0.00 N ATOM 508 CA LEU A 917 -7.125 16.428 14.019 1.00 0.00 C ATOM 509 C LEU A 917 -5.658 16.787 14.197 1.00 0.00 C ATOM 510 O LEU A 917 -4.794 16.222 13.527 1.00 0.00 O ATOM 511 CB LEU A 917 -7.383 15.107 14.771 1.00 0.00 C ATOM 512 CG LEU A 917 -8.840 14.753 15.091 1.00 0.00 C ATOM 513 CD1 LEU A 917 -9.622 14.433 13.830 1.00 0.00 C ATOM 514 CD2 LEU A 917 -8.886 13.577 16.058 1.00 0.00 C ATOM 0 H LEU A 917 -6.755 15.718 12.092 1.00 0.00 H new ATOM 0 HA LEU A 917 -7.779 17.199 14.426 1.00 0.00 H new ATOM 0 HB2 LEU A 917 -6.960 14.294 14.180 1.00 0.00 H new ATOM 0 HB3 LEU A 917 -6.830 15.140 15.710 1.00 0.00 H new ATOM 0 HG LEU A 917 -9.307 15.620 15.558 1.00 0.00 H new ATOM 0 HD11 LEU A 917 -10.651 14.186 14.093 1.00 0.00 H new ATOM 0 HD12 LEU A 917 -9.614 15.299 13.168 1.00 0.00 H new ATOM 0 HD13 LEU A 917 -9.163 13.584 13.323 1.00 0.00 H new ATOM 0 HD21 LEU A 917 -9.924 13.330 16.282 1.00 0.00 H new ATOM 0 HD22 LEU A 917 -8.397 12.714 15.605 1.00 0.00 H new ATOM 0 HD23 LEU A 917 -8.370 13.844 16.980 1.00 0.00 H new ATOM 526 N VAL A 918 -5.371 17.721 15.079 1.00 0.00 N ATOM 527 CA VAL A 918 -3.998 18.008 15.443 1.00 0.00 C ATOM 528 C VAL A 918 -3.768 17.614 16.894 1.00 0.00 C ATOM 529 O VAL A 918 -4.442 18.118 17.794 1.00 0.00 O ATOM 530 CB VAL A 918 -3.658 19.502 15.257 1.00 0.00 C ATOM 531 CG1 VAL A 918 -2.185 19.759 15.539 1.00 0.00 C ATOM 532 CG2 VAL A 918 -4.029 19.967 13.856 1.00 0.00 C ATOM 0 H VAL A 918 -6.067 18.293 15.556 1.00 0.00 H new ATOM 0 HA VAL A 918 -3.348 17.431 14.786 1.00 0.00 H new ATOM 0 HB VAL A 918 -4.245 20.077 15.973 1.00 0.00 H new ATOM 0 HG11 VAL A 918 -1.968 20.818 15.402 1.00 0.00 H new ATOM 0 HG12 VAL A 918 -1.955 19.471 16.565 1.00 0.00 H new ATOM 0 HG13 VAL A 918 -1.575 19.172 14.852 1.00 0.00 H new ATOM 0 HG21 VAL A 918 -3.781 21.023 13.746 1.00 0.00 H new ATOM 0 HG22 VAL A 918 -3.474 19.385 13.120 1.00 0.00 H new ATOM 0 HG23 VAL A 918 -5.098 19.827 13.697 1.00 0.00 H new ATOM 542 N VAL A 919 -2.835 16.706 17.117 1.00 0.00 N ATOM 543 CA VAL A 919 -2.478 16.296 18.466 1.00 0.00 C ATOM 544 C VAL A 919 -1.014 16.606 18.723 1.00 0.00 C ATOM 545 O VAL A 919 -0.166 16.285 17.900 1.00 0.00 O ATOM 546 CB VAL A 919 -2.720 14.785 18.683 1.00 0.00 C ATOM 547 CG1 VAL A 919 -2.440 14.390 20.128 1.00 0.00 C ATOM 548 CG2 VAL A 919 -4.138 14.405 18.288 1.00 0.00 C ATOM 0 H VAL A 919 -2.309 16.237 16.380 1.00 0.00 H new ATOM 0 HA VAL A 919 -3.110 16.849 19.161 1.00 0.00 H new ATOM 0 HB VAL A 919 -2.028 14.238 18.043 1.00 0.00 H new ATOM 0 HG11 VAL A 919 -2.618 13.322 20.254 1.00 0.00 H new ATOM 0 HG12 VAL A 919 -1.402 14.617 20.373 1.00 0.00 H new ATOM 0 HG13 VAL A 919 -3.099 14.949 20.792 1.00 0.00 H new ATOM 0 HG21 VAL A 919 -4.287 13.337 18.449 1.00 0.00 H new ATOM 0 HG22 VAL A 919 -4.848 14.966 18.896 1.00 0.00 H new ATOM 0 HG23 VAL A 919 -4.298 14.639 17.235 1.00 0.00 H new ATOM 558 N GLN A 920 -0.705 17.226 19.846 1.00 0.00 N ATOM 559 CA GLN A 920 0.688 17.437 20.199 1.00 0.00 C ATOM 560 C GLN A 920 1.178 16.252 21.017 1.00 0.00 C ATOM 561 O GLN A 920 0.455 15.753 21.883 1.00 0.00 O ATOM 562 CB GLN A 920 0.856 18.728 21.002 1.00 0.00 C ATOM 563 CG GLN A 920 0.342 19.974 20.297 1.00 0.00 C ATOM 564 CD GLN A 920 1.113 20.309 19.034 1.00 0.00 C ATOM 565 OE1 GLN A 920 2.303 20.011 18.918 1.00 0.00 O ATOM 566 NE2 GLN A 920 0.442 20.946 18.085 1.00 0.00 N ATOM 0 H GLN A 920 -1.383 17.586 20.518 1.00 0.00 H new ATOM 0 HA GLN A 920 1.276 17.527 19.285 1.00 0.00 H new ATOM 0 HB2 GLN A 920 0.334 18.621 21.953 1.00 0.00 H new ATOM 0 HB3 GLN A 920 1.913 18.864 21.232 1.00 0.00 H new ATOM 0 HG2 GLN A 920 -0.709 19.834 20.046 1.00 0.00 H new ATOM 0 HG3 GLN A 920 0.396 20.820 20.983 1.00 0.00 H new ATOM 0 HE21 GLN A 920 -0.543 21.174 18.222 1.00 0.00 H new ATOM 0 HE22 GLN A 920 0.910 21.209 17.218 1.00 0.00 H new ATOM 575 N ALA A 921 2.388 15.788 20.738 1.00 0.00 N ATOM 576 CA ALA A 921 2.963 14.689 21.501 1.00 0.00 C ATOM 577 C ALA A 921 3.112 15.077 22.967 1.00 0.00 C ATOM 578 O ALA A 921 3.696 16.113 23.284 1.00 0.00 O ATOM 579 CB ALA A 921 4.309 14.277 20.920 1.00 0.00 C ATOM 0 H ALA A 921 2.986 16.151 19.996 1.00 0.00 H new ATOM 0 HA ALA A 921 2.286 13.837 21.436 1.00 0.00 H new ATOM 0 HB1 ALA A 921 4.721 13.455 21.505 1.00 0.00 H new ATOM 0 HB2 ALA A 921 4.177 13.957 19.887 1.00 0.00 H new ATOM 0 HB3 ALA A 921 4.994 15.124 20.952 1.00 0.00 H new ATOM 585 N GLY A 922 2.572 14.256 23.857 1.00 0.00 N ATOM 586 CA GLY A 922 2.704 14.516 25.277 1.00 0.00 C ATOM 587 C GLY A 922 1.591 15.402 25.805 1.00 0.00 C ATOM 588 O GLY A 922 1.550 15.721 26.993 1.00 0.00 O ATOM 0 H GLY A 922 2.045 13.415 23.622 1.00 0.00 H new ATOM 0 HA2 GLY A 922 2.701 13.570 25.819 1.00 0.00 H new ATOM 0 HA3 GLY A 922 3.666 14.991 25.469 1.00 0.00 H new ATOM 592 N VAL A 923 0.691 15.806 24.919 1.00 0.00 N ATOM 593 CA VAL A 923 -0.405 16.689 25.287 1.00 0.00 C ATOM 594 C VAL A 923 -1.740 15.968 25.127 1.00 0.00 C ATOM 595 O VAL A 923 -1.947 15.236 24.159 1.00 0.00 O ATOM 596 CB VAL A 923 -0.397 17.979 24.432 1.00 0.00 C ATOM 597 CG1 VAL A 923 -1.512 18.924 24.852 1.00 0.00 C ATOM 598 CG2 VAL A 923 0.953 18.674 24.531 1.00 0.00 C ATOM 0 H VAL A 923 0.700 15.534 23.936 1.00 0.00 H new ATOM 0 HA VAL A 923 -0.271 16.971 26.331 1.00 0.00 H new ATOM 0 HB VAL A 923 -0.570 17.695 23.394 1.00 0.00 H new ATOM 0 HG11 VAL A 923 -1.481 19.821 24.234 1.00 0.00 H new ATOM 0 HG12 VAL A 923 -2.475 18.429 24.726 1.00 0.00 H new ATOM 0 HG13 VAL A 923 -1.380 19.200 25.898 1.00 0.00 H new ATOM 0 HG21 VAL A 923 0.942 19.579 23.924 1.00 0.00 H new ATOM 0 HG22 VAL A 923 1.152 18.936 25.570 1.00 0.00 H new ATOM 0 HG23 VAL A 923 1.734 18.005 24.170 1.00 0.00 H new ATOM 608 N SER A 924 -2.628 16.164 26.090 1.00 0.00 N ATOM 609 CA SER A 924 -3.925 15.502 26.091 1.00 0.00 C ATOM 610 C SER A 924 -4.993 16.340 25.387 1.00 0.00 C ATOM 611 O SER A 924 -6.123 15.890 25.207 1.00 0.00 O ATOM 612 CB SER A 924 -4.339 15.199 27.529 1.00 0.00 C ATOM 613 OG SER A 924 -3.997 16.275 28.393 1.00 0.00 O ATOM 0 H SER A 924 -2.473 16.781 26.887 1.00 0.00 H new ATOM 0 HA SER A 924 -3.834 14.570 25.534 1.00 0.00 H new ATOM 0 HB2 SER A 924 -5.413 15.020 27.572 1.00 0.00 H new ATOM 0 HB3 SER A 924 -3.850 14.286 27.868 1.00 0.00 H new ATOM 0 HG SER A 924 -3.814 15.928 29.291 1.00 0.00 H new ATOM 619 N SER A 925 -4.634 17.559 25.005 1.00 0.00 N ATOM 620 CA SER A 925 -5.561 18.455 24.324 1.00 0.00 C ATOM 621 C SER A 925 -5.471 18.273 22.806 1.00 0.00 C ATOM 622 O SER A 925 -4.379 18.129 22.252 1.00 0.00 O ATOM 623 CB SER A 925 -5.263 19.905 24.714 1.00 0.00 C ATOM 624 OG SER A 925 -5.330 20.075 26.123 1.00 0.00 O ATOM 0 H SER A 925 -3.705 17.951 25.156 1.00 0.00 H new ATOM 0 HA SER A 925 -6.578 18.211 24.632 1.00 0.00 H new ATOM 0 HB2 SER A 925 -4.272 20.186 24.357 1.00 0.00 H new ATOM 0 HB3 SER A 925 -5.977 20.570 24.229 1.00 0.00 H new ATOM 0 HG SER A 925 -5.135 21.008 26.350 1.00 0.00 H new ATOM 630 N ILE A 926 -6.620 18.279 22.143 1.00 0.00 N ATOM 631 CA ILE A 926 -6.680 18.011 20.711 1.00 0.00 C ATOM 632 C ILE A 926 -7.225 19.222 19.964 1.00 0.00 C ATOM 633 O ILE A 926 -8.074 19.947 20.480 1.00 0.00 O ATOM 634 CB ILE A 926 -7.593 16.800 20.381 1.00 0.00 C ATOM 635 CG1 ILE A 926 -7.350 15.630 21.335 1.00 0.00 C ATOM 636 CG2 ILE A 926 -7.375 16.343 18.947 1.00 0.00 C ATOM 637 CD1 ILE A 926 -8.172 15.699 22.605 1.00 0.00 C ATOM 0 H ILE A 926 -7.525 18.467 22.574 1.00 0.00 H new ATOM 0 HA ILE A 926 -5.661 17.788 20.396 1.00 0.00 H new ATOM 0 HB ILE A 926 -8.624 17.131 20.504 1.00 0.00 H new ATOM 0 HG12 ILE A 926 -7.575 14.698 20.817 1.00 0.00 H new ATOM 0 HG13 ILE A 926 -6.293 15.601 21.598 1.00 0.00 H new ATOM 0 HG21 ILE A 926 -8.023 15.493 18.733 1.00 0.00 H new ATOM 0 HG22 ILE A 926 -7.611 17.160 18.265 1.00 0.00 H new ATOM 0 HG23 ILE A 926 -6.334 16.048 18.813 1.00 0.00 H new ATOM 0 HD11 ILE A 926 -7.946 14.836 23.232 1.00 0.00 H new ATOM 0 HD12 ILE A 926 -7.930 16.614 23.146 1.00 0.00 H new ATOM 0 HD13 ILE A 926 -9.232 15.697 22.353 1.00 0.00 H new ATOM 649 N SER A 927 -6.744 19.436 18.754 1.00 0.00 N ATOM 650 CA SER A 927 -7.284 20.474 17.900 1.00 0.00 C ATOM 651 C SER A 927 -8.025 19.834 16.732 1.00 0.00 C ATOM 652 O SER A 927 -7.423 19.142 15.917 1.00 0.00 O ATOM 653 CB SER A 927 -6.156 21.367 17.385 1.00 0.00 C ATOM 654 OG SER A 927 -5.354 21.838 18.457 1.00 0.00 O ATOM 0 H SER A 927 -5.979 18.903 18.341 1.00 0.00 H new ATOM 0 HA SER A 927 -7.979 21.088 18.472 1.00 0.00 H new ATOM 0 HB2 SER A 927 -5.538 20.810 16.681 1.00 0.00 H new ATOM 0 HB3 SER A 927 -6.576 22.213 16.841 1.00 0.00 H new ATOM 0 HG SER A 927 -4.637 22.406 18.104 1.00 0.00 H new ATOM 660 N TYR A 928 -9.324 20.054 16.649 1.00 0.00 N ATOM 661 CA TYR A 928 -10.120 19.467 15.586 1.00 0.00 C ATOM 662 C TYR A 928 -10.273 20.486 14.471 1.00 0.00 C ATOM 663 O TYR A 928 -10.712 21.608 14.703 1.00 0.00 O ATOM 664 CB TYR A 928 -11.492 19.069 16.138 1.00 0.00 C ATOM 665 CG TYR A 928 -12.261 18.073 15.293 1.00 0.00 C ATOM 666 CD1 TYR A 928 -12.121 16.709 15.509 1.00 0.00 C ATOM 667 CD2 TYR A 928 -13.139 18.493 14.299 1.00 0.00 C ATOM 668 CE1 TYR A 928 -12.833 15.791 14.762 1.00 0.00 C ATOM 669 CE2 TYR A 928 -13.860 17.579 13.551 1.00 0.00 C ATOM 670 CZ TYR A 928 -13.700 16.229 13.785 1.00 0.00 C ATOM 671 OH TYR A 928 -14.424 15.312 13.055 1.00 0.00 O ATOM 0 H TYR A 928 -9.850 20.634 17.303 1.00 0.00 H new ATOM 0 HA TYR A 928 -9.630 18.576 15.195 1.00 0.00 H new ATOM 0 HB2 TYR A 928 -11.357 18.649 17.135 1.00 0.00 H new ATOM 0 HB3 TYR A 928 -12.096 19.969 16.251 1.00 0.00 H new ATOM 0 HD1 TYR A 928 -11.444 16.360 16.274 1.00 0.00 H new ATOM 0 HD2 TYR A 928 -13.260 19.549 14.108 1.00 0.00 H new ATOM 0 HE1 TYR A 928 -12.710 14.733 14.943 1.00 0.00 H new ATOM 0 HE2 TYR A 928 -14.544 17.921 12.788 1.00 0.00 H new ATOM 0 HH TYR A 928 -14.989 15.782 12.407 1.00 0.00 H new ATOM 681 N THR A 929 -9.922 20.099 13.264 1.00 0.00 N ATOM 682 CA THR A 929 -9.940 21.026 12.154 1.00 0.00 C ATOM 683 C THR A 929 -10.995 20.641 11.129 1.00 0.00 C ATOM 684 O THR A 929 -10.990 19.526 10.596 1.00 0.00 O ATOM 685 CB THR A 929 -8.556 21.107 11.484 1.00 0.00 C ATOM 686 OG1 THR A 929 -7.568 21.437 12.470 1.00 0.00 O ATOM 687 CG2 THR A 929 -8.540 22.154 10.379 1.00 0.00 C ATOM 0 H THR A 929 -9.622 19.153 13.027 1.00 0.00 H new ATOM 0 HA THR A 929 -10.194 22.008 12.553 1.00 0.00 H new ATOM 0 HB THR A 929 -8.332 20.137 11.039 1.00 0.00 H new ATOM 0 HG1 THR A 929 -7.897 22.171 13.029 1.00 0.00 H new ATOM 0 HG21 THR A 929 -7.550 22.188 9.925 1.00 0.00 H new ATOM 0 HG22 THR A 929 -9.279 21.894 9.621 1.00 0.00 H new ATOM 0 HG23 THR A 929 -8.780 23.131 10.800 1.00 0.00 H new ATOM 695 N SER A 930 -11.900 21.569 10.863 1.00 0.00 N ATOM 696 CA SER A 930 -12.905 21.376 9.841 1.00 0.00 C ATOM 697 C SER A 930 -12.829 22.495 8.807 1.00 0.00 C ATOM 698 O SER A 930 -12.988 23.682 9.138 1.00 0.00 O ATOM 699 CB SER A 930 -14.301 21.295 10.469 1.00 0.00 C ATOM 700 OG SER A 930 -14.505 22.325 11.425 1.00 0.00 O ATOM 0 H SER A 930 -11.956 22.466 11.345 1.00 0.00 H new ATOM 0 HA SER A 930 -12.712 20.431 9.332 1.00 0.00 H new ATOM 0 HB2 SER A 930 -15.057 21.369 9.687 1.00 0.00 H new ATOM 0 HB3 SER A 930 -14.430 20.324 10.947 1.00 0.00 H new ATOM 0 HG SER A 930 -13.762 22.963 11.382 1.00 0.00 H new ATOM 706 N PRO A 931 -12.586 22.124 7.533 1.00 0.00 N ATOM 707 CA PRO A 931 -12.459 23.079 6.422 1.00 0.00 C ATOM 708 C PRO A 931 -13.763 23.820 6.148 1.00 0.00 C ATOM 709 O PRO A 931 -13.831 24.685 5.277 1.00 0.00 O ATOM 710 CB PRO A 931 -12.072 22.201 5.227 1.00 0.00 C ATOM 711 CG PRO A 931 -12.539 20.834 5.585 1.00 0.00 C ATOM 712 CD PRO A 931 -12.412 20.731 7.078 1.00 0.00 C ATOM 0 HA PRO A 931 -11.729 23.859 6.638 1.00 0.00 H new ATOM 0 HB2 PRO A 931 -12.545 22.552 4.310 1.00 0.00 H new ATOM 0 HB3 PRO A 931 -10.995 22.218 5.057 1.00 0.00 H new ATOM 0 HG2 PRO A 931 -13.571 20.679 5.270 1.00 0.00 H new ATOM 0 HG3 PRO A 931 -11.936 20.073 5.089 1.00 0.00 H new ATOM 0 HD2 PRO A 931 -13.170 20.072 7.501 1.00 0.00 H new ATOM 0 HD3 PRO A 931 -11.442 20.330 7.372 1.00 0.00 H new ATOM 720 N ASN A 932 -14.792 23.460 6.909 1.00 0.00 N ATOM 721 CA ASN A 932 -16.063 24.170 6.898 1.00 0.00 C ATOM 722 C ASN A 932 -15.833 25.630 7.291 1.00 0.00 C ATOM 723 O ASN A 932 -16.624 26.516 6.966 1.00 0.00 O ATOM 724 CB ASN A 932 -17.035 23.493 7.872 1.00 0.00 C ATOM 725 CG ASN A 932 -18.444 24.055 7.811 1.00 0.00 C ATOM 726 OD1 ASN A 932 -18.894 24.533 6.772 1.00 0.00 O ATOM 727 ND2 ASN A 932 -19.150 23.991 8.928 1.00 0.00 N ATOM 0 H ASN A 932 -14.766 22.667 7.550 1.00 0.00 H new ATOM 0 HA ASN A 932 -16.496 24.142 5.898 1.00 0.00 H new ATOM 0 HB2 ASN A 932 -17.069 22.425 7.656 1.00 0.00 H new ATOM 0 HB3 ASN A 932 -16.653 23.601 8.887 1.00 0.00 H new ATOM 0 HD21 ASN A 932 -20.106 24.346 8.948 1.00 0.00 H new ATOM 0 HD22 ASN A 932 -18.738 23.586 9.769 1.00 0.00 H new ATOM 734 N GLY A 933 -14.731 25.867 7.995 1.00 0.00 N ATOM 735 CA GLY A 933 -14.323 27.218 8.307 1.00 0.00 C ATOM 736 C GLY A 933 -13.979 27.412 9.767 1.00 0.00 C ATOM 737 O GLY A 933 -14.029 28.535 10.269 1.00 0.00 O ATOM 0 H GLY A 933 -14.112 25.141 8.355 1.00 0.00 H new ATOM 0 HA2 GLY A 933 -13.458 27.479 7.698 1.00 0.00 H new ATOM 0 HA3 GLY A 933 -15.124 27.905 8.034 1.00 0.00 H new ATOM 741 N GLN A 934 -13.608 26.339 10.460 1.00 0.00 N ATOM 742 CA GLN A 934 -13.332 26.457 11.887 1.00 0.00 C ATOM 743 C GLN A 934 -12.434 25.337 12.394 1.00 0.00 C ATOM 744 O GLN A 934 -12.629 24.163 12.062 1.00 0.00 O ATOM 745 CB GLN A 934 -14.645 26.458 12.679 1.00 0.00 C ATOM 746 CG GLN A 934 -14.467 26.756 14.161 1.00 0.00 C ATOM 747 CD GLN A 934 -13.878 28.131 14.406 1.00 0.00 C ATOM 748 OE1 GLN A 934 -12.662 28.298 14.488 1.00 0.00 O ATOM 749 NE2 GLN A 934 -14.740 29.126 14.523 1.00 0.00 N ATOM 0 H GLN A 934 -13.494 25.403 10.070 1.00 0.00 H new ATOM 0 HA GLN A 934 -12.805 27.400 12.036 1.00 0.00 H new ATOM 0 HB2 GLN A 934 -15.319 27.198 12.247 1.00 0.00 H new ATOM 0 HB3 GLN A 934 -15.126 25.486 12.568 1.00 0.00 H new ATOM 0 HG2 GLN A 934 -15.432 26.682 14.662 1.00 0.00 H new ATOM 0 HG3 GLN A 934 -13.818 26.001 14.606 1.00 0.00 H new ATOM 0 HE21 GLN A 934 -15.741 28.945 14.449 1.00 0.00 H new ATOM 0 HE22 GLN A 934 -14.404 30.075 14.688 1.00 0.00 H new ATOM 758 N THR A 935 -11.423 25.711 13.164 1.00 0.00 N ATOM 759 CA THR A 935 -10.680 24.748 13.947 1.00 0.00 C ATOM 760 C THR A 935 -11.077 24.898 15.422 1.00 0.00 C ATOM 761 O THR A 935 -11.065 26.002 15.976 1.00 0.00 O ATOM 762 CB THR A 935 -9.147 24.901 13.754 1.00 0.00 C ATOM 763 OG1 THR A 935 -8.443 23.886 14.486 1.00 0.00 O ATOM 764 CG2 THR A 935 -8.658 26.277 14.185 1.00 0.00 C ATOM 0 H THR A 935 -11.102 26.674 13.260 1.00 0.00 H new ATOM 0 HA THR A 935 -10.930 23.744 13.603 1.00 0.00 H new ATOM 0 HB THR A 935 -8.943 24.787 12.689 1.00 0.00 H new ATOM 0 HG1 THR A 935 -9.033 23.116 14.627 1.00 0.00 H new ATOM 0 HG21 THR A 935 -7.581 26.344 14.034 1.00 0.00 H new ATOM 0 HG22 THR A 935 -9.156 27.043 13.590 1.00 0.00 H new ATOM 0 HG23 THR A 935 -8.887 26.431 15.240 1.00 0.00 H new ATOM 772 N THR A 936 -11.473 23.801 16.037 1.00 0.00 N ATOM 773 CA THR A 936 -11.930 23.822 17.414 1.00 0.00 C ATOM 774 C THR A 936 -11.026 22.955 18.288 1.00 0.00 C ATOM 775 O THR A 936 -10.764 21.799 17.967 1.00 0.00 O ATOM 776 CB THR A 936 -13.405 23.355 17.507 1.00 0.00 C ATOM 777 OG1 THR A 936 -13.832 23.252 18.872 1.00 0.00 O ATOM 778 CG2 THR A 936 -13.606 22.019 16.803 1.00 0.00 C ATOM 0 H THR A 936 -11.488 22.878 15.602 1.00 0.00 H new ATOM 0 HA THR A 936 -11.878 24.847 17.781 1.00 0.00 H new ATOM 0 HB THR A 936 -14.013 24.109 17.007 1.00 0.00 H new ATOM 0 HG1 THR A 936 -14.092 22.327 19.064 1.00 0.00 H new ATOM 0 HG21 THR A 936 -14.650 21.718 16.885 1.00 0.00 H new ATOM 0 HG22 THR A 936 -13.339 22.118 15.751 1.00 0.00 H new ATOM 0 HG23 THR A 936 -12.973 21.264 17.268 1.00 0.00 H new ATOM 786 N ARG A 937 -10.543 23.505 19.388 1.00 0.00 N ATOM 787 CA ARG A 937 -9.650 22.752 20.254 1.00 0.00 C ATOM 788 C ARG A 937 -10.396 22.261 21.488 1.00 0.00 C ATOM 789 O ARG A 937 -11.123 23.017 22.134 1.00 0.00 O ATOM 790 CB ARG A 937 -8.401 23.571 20.647 1.00 0.00 C ATOM 791 CG ARG A 937 -8.618 24.627 21.728 1.00 0.00 C ATOM 792 CD ARG A 937 -9.541 25.740 21.268 1.00 0.00 C ATOM 793 NE ARG A 937 -9.787 26.718 22.325 1.00 0.00 N ATOM 794 CZ ARG A 937 -10.824 26.666 23.163 1.00 0.00 C ATOM 795 NH1 ARG A 937 -11.699 25.671 23.080 1.00 0.00 N ATOM 796 NH2 ARG A 937 -10.977 27.601 24.092 1.00 0.00 N ATOM 0 H ARG A 937 -10.749 24.454 19.700 1.00 0.00 H new ATOM 0 HA ARG A 937 -9.298 21.886 19.694 1.00 0.00 H new ATOM 0 HB2 ARG A 937 -7.629 22.881 20.988 1.00 0.00 H new ATOM 0 HB3 ARG A 937 -8.016 24.064 19.754 1.00 0.00 H new ATOM 0 HG2 ARG A 937 -9.037 24.154 22.616 1.00 0.00 H new ATOM 0 HG3 ARG A 937 -7.656 25.051 22.017 1.00 0.00 H new ATOM 0 HD2 ARG A 937 -9.103 26.241 20.405 1.00 0.00 H new ATOM 0 HD3 ARG A 937 -10.489 25.313 20.941 1.00 0.00 H new ATOM 0 HE ARG A 937 -9.126 27.488 22.429 1.00 0.00 H new ATOM 0 HH11 ARG A 937 -11.579 24.944 22.375 1.00 0.00 H new ATOM 0 HH12 ARG A 937 -12.491 25.633 23.722 1.00 0.00 H new ATOM 0 HH21 ARG A 937 -10.301 28.361 24.166 1.00 0.00 H new ATOM 0 HH22 ARG A 937 -11.770 27.559 24.732 1.00 0.00 H new ATOM 810 N TYR A 938 -10.245 20.981 21.779 1.00 0.00 N ATOM 811 CA TYR A 938 -10.887 20.372 22.930 1.00 0.00 C ATOM 812 C TYR A 938 -9.845 20.049 23.987 1.00 0.00 C ATOM 813 O TYR A 938 -8.748 19.585 23.667 1.00 0.00 O ATOM 814 CB TYR A 938 -11.639 19.102 22.524 1.00 0.00 C ATOM 815 CG TYR A 938 -12.768 19.342 21.542 1.00 0.00 C ATOM 816 CD1 TYR A 938 -14.025 19.734 21.986 1.00 0.00 C ATOM 817 CD2 TYR A 938 -12.580 19.173 20.176 1.00 0.00 C ATOM 818 CE1 TYR A 938 -15.059 19.957 21.096 1.00 0.00 C ATOM 819 CE2 TYR A 938 -13.610 19.394 19.280 1.00 0.00 C ATOM 820 CZ TYR A 938 -14.847 19.784 19.745 1.00 0.00 C ATOM 821 OH TYR A 938 -15.875 20.007 18.855 1.00 0.00 O ATOM 0 H TYR A 938 -9.677 20.338 21.227 1.00 0.00 H new ATOM 0 HA TYR A 938 -11.609 21.078 23.341 1.00 0.00 H new ATOM 0 HB2 TYR A 938 -10.932 18.398 22.084 1.00 0.00 H new ATOM 0 HB3 TYR A 938 -12.044 18.630 23.419 1.00 0.00 H new ATOM 0 HD1 TYR A 938 -14.197 19.867 23.044 1.00 0.00 H new ATOM 0 HD2 TYR A 938 -11.613 18.864 19.807 1.00 0.00 H new ATOM 0 HE1 TYR A 938 -16.029 20.265 21.458 1.00 0.00 H new ATOM 0 HE2 TYR A 938 -13.446 19.262 18.221 1.00 0.00 H new ATOM 0 HH TYR A 938 -15.559 19.842 17.942 1.00 0.00 H new ATOM 831 N GLY A 939 -10.184 20.302 25.236 1.00 0.00 N ATOM 832 CA GLY A 939 -9.246 20.071 26.311 1.00 0.00 C ATOM 833 C GLY A 939 -9.720 18.994 27.259 1.00 0.00 C ATOM 834 O GLY A 939 -10.914 18.726 27.353 1.00 0.00 O ATOM 0 H GLY A 939 -11.092 20.664 25.527 1.00 0.00 H new ATOM 0 HA2 GLY A 939 -8.280 19.786 25.894 1.00 0.00 H new ATOM 0 HA3 GLY A 939 -9.094 20.998 26.864 1.00 0.00 H new ATOM 838 N GLU A 940 -8.787 18.368 27.965 1.00 0.00 N ATOM 839 CA GLU A 940 -9.125 17.334 28.940 1.00 0.00 C ATOM 840 C GLU A 940 -9.872 17.911 30.148 1.00 0.00 C ATOM 841 O GLU A 940 -10.357 17.168 31.003 1.00 0.00 O ATOM 842 CB GLU A 940 -7.867 16.567 29.376 1.00 0.00 C ATOM 843 CG GLU A 940 -6.665 17.439 29.708 1.00 0.00 C ATOM 844 CD GLU A 940 -6.841 18.258 30.968 1.00 0.00 C ATOM 845 OE1 GLU A 940 -6.931 17.661 32.061 1.00 0.00 O ATOM 846 OE2 GLU A 940 -6.893 19.500 30.871 1.00 0.00 O ATOM 0 H GLU A 940 -7.788 18.557 27.882 1.00 0.00 H new ATOM 0 HA GLU A 940 -9.801 16.631 28.454 1.00 0.00 H new ATOM 0 HB2 GLU A 940 -8.112 15.964 30.250 1.00 0.00 H new ATOM 0 HB3 GLU A 940 -7.587 15.876 28.581 1.00 0.00 H new ATOM 0 HG2 GLU A 940 -5.785 16.805 29.817 1.00 0.00 H new ATOM 0 HG3 GLU A 940 -6.472 18.111 28.872 1.00 0.00 H new ATOM 853 N ASN A 941 -9.967 19.239 30.208 1.00 0.00 N ATOM 854 CA ASN A 941 -10.684 19.916 31.288 1.00 0.00 C ATOM 855 C ASN A 941 -12.186 19.940 30.992 1.00 0.00 C ATOM 856 O ASN A 941 -12.987 20.448 31.777 1.00 0.00 O ATOM 857 CB ASN A 941 -10.154 21.351 31.450 1.00 0.00 C ATOM 858 CG ASN A 941 -10.754 22.098 32.636 1.00 0.00 C ATOM 859 OD1 ASN A 941 -10.957 21.407 33.746 1.00 0.00 O flip ATOM 860 ND2 ASN A 941 -11.002 23.303 32.560 1.00 0.00 N flip ATOM 0 H ASN A 941 -9.555 19.869 29.519 1.00 0.00 H new ATOM 0 HA ASN A 941 -10.520 19.370 32.217 1.00 0.00 H new ATOM 0 HB2 ASN A 941 -9.070 21.318 31.564 1.00 0.00 H new ATOM 0 HB3 ASN A 941 -10.361 21.910 30.538 1.00 0.00 H new ATOM 0 HD21 ASN A 941 -10.833 23.804 31.688 1.00 0.00 H new ATOM 0 HD22 ASN A 941 -11.376 23.799 33.369 1.00 0.00 H new ATOM 867 N GLU A 942 -12.568 19.358 29.867 1.00 0.00 N ATOM 868 CA GLU A 942 -13.969 19.267 29.493 1.00 0.00 C ATOM 869 C GLU A 942 -14.287 17.845 29.048 1.00 0.00 C ATOM 870 O GLU A 942 -13.457 16.947 29.193 1.00 0.00 O ATOM 871 CB GLU A 942 -14.293 20.270 28.381 1.00 0.00 C ATOM 872 CG GLU A 942 -13.620 19.956 27.057 1.00 0.00 C ATOM 873 CD GLU A 942 -13.835 21.033 26.018 1.00 0.00 C ATOM 874 OE1 GLU A 942 -15.001 21.407 25.778 1.00 0.00 O ATOM 875 OE2 GLU A 942 -12.837 21.502 25.428 1.00 0.00 O ATOM 0 H GLU A 942 -11.924 18.940 29.195 1.00 0.00 H new ATOM 0 HA GLU A 942 -14.587 19.512 30.357 1.00 0.00 H new ATOM 0 HB2 GLU A 942 -15.372 20.297 28.232 1.00 0.00 H new ATOM 0 HB3 GLU A 942 -13.991 21.266 28.704 1.00 0.00 H new ATOM 0 HG2 GLU A 942 -12.550 19.825 27.221 1.00 0.00 H new ATOM 0 HG3 GLU A 942 -14.003 19.009 26.676 1.00 0.00 H new ATOM 882 N LYS A 943 -15.482 17.637 28.520 1.00 0.00 N ATOM 883 CA LYS A 943 -15.878 16.321 28.057 1.00 0.00 C ATOM 884 C LYS A 943 -15.621 16.198 26.562 1.00 0.00 C ATOM 885 O LYS A 943 -16.137 16.982 25.763 1.00 0.00 O ATOM 886 CB LYS A 943 -17.353 16.066 28.377 1.00 0.00 C ATOM 887 CG LYS A 943 -17.868 14.705 27.920 1.00 0.00 C ATOM 888 CD LYS A 943 -17.068 13.555 28.520 1.00 0.00 C ATOM 889 CE LYS A 943 -17.126 13.541 30.044 1.00 0.00 C ATOM 890 NZ LYS A 943 -18.521 13.469 30.555 1.00 0.00 N ATOM 0 H LYS A 943 -16.191 18.361 28.402 1.00 0.00 H new ATOM 0 HA LYS A 943 -15.283 15.568 28.575 1.00 0.00 H new ATOM 0 HB2 LYS A 943 -17.500 16.154 29.453 1.00 0.00 H new ATOM 0 HB3 LYS A 943 -17.954 16.845 27.908 1.00 0.00 H new ATOM 0 HG2 LYS A 943 -18.916 14.602 28.201 1.00 0.00 H new ATOM 0 HG3 LYS A 943 -17.823 14.648 26.832 1.00 0.00 H new ATOM 0 HD2 LYS A 943 -17.451 12.610 28.136 1.00 0.00 H new ATOM 0 HD3 LYS A 943 -16.029 13.632 28.199 1.00 0.00 H new ATOM 0 HE2 LYS A 943 -16.560 12.689 30.419 1.00 0.00 H new ATOM 0 HE3 LYS A 943 -16.645 14.439 30.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 943 -18.507 13.309 31.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 943 -19.012 14.363 30.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 943 -19.021 12.685 30.089 1.00 0.00 H new ATOM 904 N LEU A 944 -14.822 15.208 26.203 1.00 0.00 N ATOM 905 CA LEU A 944 -14.455 14.974 24.817 1.00 0.00 C ATOM 906 C LEU A 944 -15.541 14.193 24.096 1.00 0.00 C ATOM 907 O LEU A 944 -16.119 13.264 24.659 1.00 0.00 O ATOM 908 CB LEU A 944 -13.137 14.201 24.751 1.00 0.00 C ATOM 909 CG LEU A 944 -11.909 14.966 25.238 1.00 0.00 C ATOM 910 CD1 LEU A 944 -10.737 14.022 25.440 1.00 0.00 C ATOM 911 CD2 LEU A 944 -11.545 16.051 24.243 1.00 0.00 C ATOM 0 H LEU A 944 -14.411 14.546 26.861 1.00 0.00 H new ATOM 0 HA LEU A 944 -14.336 15.940 24.326 1.00 0.00 H new ATOM 0 HB2 LEU A 944 -13.238 13.292 25.344 1.00 0.00 H new ATOM 0 HB3 LEU A 944 -12.967 13.892 23.720 1.00 0.00 H new ATOM 0 HG LEU A 944 -12.145 15.429 26.196 1.00 0.00 H new ATOM 0 HD11 LEU A 944 -9.871 14.586 25.787 1.00 0.00 H new ATOM 0 HD12 LEU A 944 -11.001 13.268 26.182 1.00 0.00 H new ATOM 0 HD13 LEU A 944 -10.497 13.533 24.496 1.00 0.00 H new ATOM 0 HD21 LEU A 944 -10.668 16.592 24.599 1.00 0.00 H new ATOM 0 HD22 LEU A 944 -11.325 15.599 23.276 1.00 0.00 H new ATOM 0 HD23 LEU A 944 -12.380 16.744 24.138 1.00 0.00 H new ATOM 923 N PRO A 945 -15.848 14.576 22.847 1.00 0.00 N ATOM 924 CA PRO A 945 -16.773 13.825 21.999 1.00 0.00 C ATOM 925 C PRO A 945 -16.307 12.384 21.814 1.00 0.00 C ATOM 926 O PRO A 945 -15.107 12.130 21.687 1.00 0.00 O ATOM 927 CB PRO A 945 -16.744 14.584 20.668 1.00 0.00 C ATOM 928 CG PRO A 945 -16.291 15.956 21.027 1.00 0.00 C ATOM 929 CD PRO A 945 -15.338 15.782 22.175 1.00 0.00 C ATOM 0 HA PRO A 945 -17.773 13.758 22.427 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -16.062 14.114 19.959 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -17.728 14.601 20.200 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -15.802 16.440 20.182 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -17.135 16.585 21.310 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -14.312 15.650 21.832 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -15.343 16.647 22.839 1.00 0.00 H new ATOM 937 N ASP A 946 -17.270 11.464 21.794 1.00 0.00 N ATOM 938 CA ASP A 946 -17.006 10.018 21.785 1.00 0.00 C ATOM 939 C ASP A 946 -15.880 9.625 20.833 1.00 0.00 C ATOM 940 O ASP A 946 -14.837 9.131 21.264 1.00 0.00 O ATOM 941 CB ASP A 946 -18.278 9.253 21.401 1.00 0.00 C ATOM 942 CG ASP A 946 -19.433 9.529 22.340 1.00 0.00 C ATOM 943 OD1 ASP A 946 -20.152 10.524 22.123 1.00 0.00 O ATOM 944 OD2 ASP A 946 -19.635 8.748 23.295 1.00 0.00 O ATOM 0 H ASP A 946 -18.263 11.698 21.783 1.00 0.00 H new ATOM 0 HA ASP A 946 -16.691 9.754 22.794 1.00 0.00 H new ATOM 0 HB2 ASP A 946 -18.568 9.525 20.386 1.00 0.00 H new ATOM 0 HB3 ASP A 946 -18.066 8.184 21.397 1.00 0.00 H new ATOM 949 N TYR A 947 -16.082 9.859 19.542 1.00 0.00 N ATOM 950 CA TYR A 947 -15.139 9.380 18.536 1.00 0.00 C ATOM 951 C TYR A 947 -13.792 10.098 18.621 1.00 0.00 C ATOM 952 O TYR A 947 -12.763 9.528 18.260 1.00 0.00 O ATOM 953 CB TYR A 947 -15.728 9.496 17.121 1.00 0.00 C ATOM 954 CG TYR A 947 -15.900 10.912 16.603 1.00 0.00 C ATOM 955 CD1 TYR A 947 -17.046 11.649 16.884 1.00 0.00 C ATOM 956 CD2 TYR A 947 -14.919 11.503 15.815 1.00 0.00 C ATOM 957 CE1 TYR A 947 -17.208 12.932 16.392 1.00 0.00 C ATOM 958 CE2 TYR A 947 -15.072 12.785 15.325 1.00 0.00 C ATOM 959 CZ TYR A 947 -16.216 13.495 15.615 1.00 0.00 C ATOM 960 OH TYR A 947 -16.371 14.770 15.125 1.00 0.00 O ATOM 0 H TYR A 947 -16.881 10.372 19.169 1.00 0.00 H new ATOM 0 HA TYR A 947 -14.960 8.326 18.748 1.00 0.00 H new ATOM 0 HB2 TYR A 947 -15.084 8.950 16.432 1.00 0.00 H new ATOM 0 HB3 TYR A 947 -16.699 9.002 17.108 1.00 0.00 H new ATOM 0 HD1 TYR A 947 -17.822 11.213 17.496 1.00 0.00 H new ATOM 0 HD2 TYR A 947 -14.021 10.950 15.582 1.00 0.00 H new ATOM 0 HE1 TYR A 947 -18.106 13.490 16.615 1.00 0.00 H new ATOM 0 HE2 TYR A 947 -14.298 13.229 14.717 1.00 0.00 H new ATOM 0 HH TYR A 947 -15.656 14.963 14.483 1.00 0.00 H new ATOM 970 N ILE A 948 -13.792 11.342 19.096 1.00 0.00 N ATOM 971 CA ILE A 948 -12.552 12.097 19.211 1.00 0.00 C ATOM 972 C ILE A 948 -11.673 11.515 20.311 1.00 0.00 C ATOM 973 O ILE A 948 -10.474 11.317 20.119 1.00 0.00 O ATOM 974 CB ILE A 948 -12.815 13.593 19.494 1.00 0.00 C ATOM 975 CG1 ILE A 948 -13.594 14.220 18.334 1.00 0.00 C ATOM 976 CG2 ILE A 948 -11.505 14.336 19.729 1.00 0.00 C ATOM 977 CD1 ILE A 948 -13.871 15.698 18.508 1.00 0.00 C ATOM 0 H ILE A 948 -14.627 11.841 19.403 1.00 0.00 H new ATOM 0 HA ILE A 948 -12.037 12.018 18.254 1.00 0.00 H new ATOM 0 HB ILE A 948 -13.415 13.675 20.400 1.00 0.00 H new ATOM 0 HG12 ILE A 948 -13.034 14.072 17.411 1.00 0.00 H new ATOM 0 HG13 ILE A 948 -14.542 13.694 18.219 1.00 0.00 H new ATOM 0 HG21 ILE A 948 -11.713 15.388 19.926 1.00 0.00 H new ATOM 0 HG22 ILE A 948 -10.989 13.902 20.585 1.00 0.00 H new ATOM 0 HG23 ILE A 948 -10.875 14.251 18.844 1.00 0.00 H new ATOM 0 HD11 ILE A 948 -14.426 16.068 17.646 1.00 0.00 H new ATOM 0 HD12 ILE A 948 -14.459 15.854 19.412 1.00 0.00 H new ATOM 0 HD13 ILE A 948 -12.928 16.238 18.591 1.00 0.00 H new ATOM 989 N LYS A 949 -12.280 11.215 21.453 1.00 0.00 N ATOM 990 CA LYS A 949 -11.551 10.595 22.552 1.00 0.00 C ATOM 991 C LYS A 949 -11.096 9.197 22.152 1.00 0.00 C ATOM 992 O LYS A 949 -9.997 8.762 22.500 1.00 0.00 O ATOM 993 CB LYS A 949 -12.401 10.540 23.825 1.00 0.00 C ATOM 994 CG LYS A 949 -11.607 10.106 25.049 1.00 0.00 C ATOM 995 CD LYS A 949 -12.432 10.180 26.320 1.00 0.00 C ATOM 996 CE LYS A 949 -11.579 9.879 27.543 1.00 0.00 C ATOM 997 NZ LYS A 949 -12.353 9.969 28.808 1.00 0.00 N ATOM 0 H LYS A 949 -13.267 11.389 21.641 1.00 0.00 H new ATOM 0 HA LYS A 949 -10.675 11.207 22.767 1.00 0.00 H new ATOM 0 HB2 LYS A 949 -12.834 11.523 24.009 1.00 0.00 H new ATOM 0 HB3 LYS A 949 -13.230 9.849 23.673 1.00 0.00 H new ATOM 0 HG2 LYS A 949 -11.252 9.085 24.907 1.00 0.00 H new ATOM 0 HG3 LYS A 949 -10.726 10.739 25.152 1.00 0.00 H new ATOM 0 HD2 LYS A 949 -12.872 11.173 26.415 1.00 0.00 H new ATOM 0 HD3 LYS A 949 -13.257 9.470 26.264 1.00 0.00 H new ATOM 0 HE2 LYS A 949 -11.155 8.879 27.450 1.00 0.00 H new ATOM 0 HE3 LYS A 949 -10.743 10.578 27.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 949 -11.729 9.756 29.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 949 -12.737 10.930 28.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 949 -13.135 9.284 28.786 1.00 0.00 H new ATOM 1011 N GLN A 950 -11.959 8.502 21.415 1.00 0.00 N ATOM 1012 CA GLN A 950 -11.643 7.171 20.909 1.00 0.00 C ATOM 1013 C GLN A 950 -10.412 7.232 20.005 1.00 0.00 C ATOM 1014 O GLN A 950 -9.539 6.374 20.076 1.00 0.00 O ATOM 1015 CB GLN A 950 -12.848 6.589 20.146 1.00 0.00 C ATOM 1016 CG GLN A 950 -12.841 5.067 20.014 1.00 0.00 C ATOM 1017 CD GLN A 950 -11.827 4.543 19.011 1.00 0.00 C ATOM 1018 OE1 GLN A 950 -11.527 5.190 18.006 1.00 0.00 O ATOM 1019 NE2 GLN A 950 -11.291 3.362 19.281 1.00 0.00 N ATOM 0 H GLN A 950 -12.885 8.841 21.155 1.00 0.00 H new ATOM 0 HA GLN A 950 -11.422 6.516 21.752 1.00 0.00 H new ATOM 0 HB2 GLN A 950 -13.764 6.893 20.653 1.00 0.00 H new ATOM 0 HB3 GLN A 950 -12.876 7.027 19.148 1.00 0.00 H new ATOM 0 HG2 GLN A 950 -12.633 4.628 20.990 1.00 0.00 H new ATOM 0 HG3 GLN A 950 -13.836 4.733 19.719 1.00 0.00 H new ATOM 0 HE21 GLN A 950 -11.566 2.858 20.124 1.00 0.00 H new ATOM 0 HE22 GLN A 950 -10.603 2.957 18.646 1.00 0.00 H new ATOM 1028 N LYS A 951 -10.351 8.245 19.151 1.00 0.00 N ATOM 1029 CA LYS A 951 -9.217 8.411 18.256 1.00 0.00 C ATOM 1030 C LYS A 951 -7.981 8.809 19.050 1.00 0.00 C ATOM 1031 O LYS A 951 -6.869 8.372 18.766 1.00 0.00 O ATOM 1032 CB LYS A 951 -9.523 9.455 17.180 1.00 0.00 C ATOM 1033 CG LYS A 951 -8.971 9.106 15.802 1.00 0.00 C ATOM 1034 CD LYS A 951 -9.711 7.926 15.177 1.00 0.00 C ATOM 1035 CE LYS A 951 -9.270 6.588 15.760 1.00 0.00 C ATOM 1036 NZ LYS A 951 -10.268 5.516 15.511 1.00 0.00 N ATOM 0 H LYS A 951 -11.072 8.961 19.060 1.00 0.00 H new ATOM 0 HA LYS A 951 -9.025 7.460 17.759 1.00 0.00 H new ATOM 0 HB2 LYS A 951 -10.603 9.580 17.106 1.00 0.00 H new ATOM 0 HB3 LYS A 951 -9.112 10.415 17.492 1.00 0.00 H new ATOM 0 HG2 LYS A 951 -9.052 9.974 15.147 1.00 0.00 H new ATOM 0 HG3 LYS A 951 -7.911 8.867 15.885 1.00 0.00 H new ATOM 0 HD2 LYS A 951 -10.783 8.050 15.331 1.00 0.00 H new ATOM 0 HD3 LYS A 951 -9.541 7.924 14.100 1.00 0.00 H new ATOM 0 HE2 LYS A 951 -8.313 6.301 15.324 1.00 0.00 H new ATOM 0 HE3 LYS A 951 -9.113 6.694 16.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 951 -9.775 4.632 15.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 951 -10.842 5.371 16.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 951 -10.886 5.793 14.722 1.00 0.00 H new ATOM 1050 N LEU A 952 -8.210 9.643 20.054 1.00 0.00 N ATOM 1051 CA LEU A 952 -7.155 10.185 20.898 1.00 0.00 C ATOM 1052 C LEU A 952 -6.333 9.092 21.581 1.00 0.00 C ATOM 1053 O LEU A 952 -5.116 9.223 21.733 1.00 0.00 O ATOM 1054 CB LEU A 952 -7.788 11.089 21.952 1.00 0.00 C ATOM 1055 CG LEU A 952 -6.832 11.677 22.983 1.00 0.00 C ATOM 1056 CD1 LEU A 952 -5.836 12.606 22.313 1.00 0.00 C ATOM 1057 CD2 LEU A 952 -7.622 12.401 24.058 1.00 0.00 C ATOM 0 H LEU A 952 -9.144 9.966 20.308 1.00 0.00 H new ATOM 0 HA LEU A 952 -6.470 10.748 20.264 1.00 0.00 H new ATOM 0 HB2 LEU A 952 -8.293 11.910 21.443 1.00 0.00 H new ATOM 0 HB3 LEU A 952 -8.555 10.520 22.478 1.00 0.00 H new ATOM 0 HG LEU A 952 -6.268 10.871 23.453 1.00 0.00 H new ATOM 0 HD11 LEU A 952 -5.161 13.017 23.063 1.00 0.00 H new ATOM 0 HD12 LEU A 952 -5.261 12.050 21.573 1.00 0.00 H new ATOM 0 HD13 LEU A 952 -6.370 13.419 21.821 1.00 0.00 H new ATOM 0 HD21 LEU A 952 -6.936 12.820 24.794 1.00 0.00 H new ATOM 0 HD22 LEU A 952 -8.203 13.204 23.604 1.00 0.00 H new ATOM 0 HD23 LEU A 952 -8.296 11.699 24.549 1.00 0.00 H new ATOM 1069 N GLN A 953 -6.984 8.008 21.985 1.00 0.00 N ATOM 1070 CA GLN A 953 -6.281 6.939 22.682 1.00 0.00 C ATOM 1071 C GLN A 953 -5.332 6.200 21.740 1.00 0.00 C ATOM 1072 O GLN A 953 -4.372 5.572 22.187 1.00 0.00 O ATOM 1073 CB GLN A 953 -7.250 5.981 23.403 1.00 0.00 C ATOM 1074 CG GLN A 953 -8.300 5.323 22.522 1.00 0.00 C ATOM 1075 CD GLN A 953 -7.787 4.107 21.774 1.00 0.00 C ATOM 1076 OE1 GLN A 953 -6.896 3.397 22.243 1.00 0.00 O ATOM 1077 NE2 GLN A 953 -8.348 3.861 20.603 1.00 0.00 N ATOM 0 H GLN A 953 -7.981 7.847 21.845 1.00 0.00 H new ATOM 0 HA GLN A 953 -5.673 7.400 23.460 1.00 0.00 H new ATOM 0 HB2 GLN A 953 -6.666 5.199 23.887 1.00 0.00 H new ATOM 0 HB3 GLN A 953 -7.759 6.534 24.193 1.00 0.00 H new ATOM 0 HG2 GLN A 953 -9.148 5.028 23.140 1.00 0.00 H new ATOM 0 HG3 GLN A 953 -8.668 6.054 21.802 1.00 0.00 H new ATOM 0 HE21 GLN A 953 -9.083 4.474 20.251 1.00 0.00 H new ATOM 0 HE22 GLN A 953 -8.046 3.058 20.051 1.00 0.00 H new ATOM 1086 N CYS A 954 -5.578 6.299 20.434 1.00 0.00 N ATOM 1087 CA CYS A 954 -4.675 5.699 19.460 1.00 0.00 C ATOM 1088 C CYS A 954 -3.348 6.458 19.441 1.00 0.00 C ATOM 1089 O CYS A 954 -2.293 5.886 19.160 1.00 0.00 O ATOM 1090 CB CYS A 954 -5.303 5.715 18.061 1.00 0.00 C ATOM 1091 SG CYS A 954 -6.882 4.842 17.946 1.00 0.00 S ATOM 0 H CYS A 954 -6.382 6.781 20.033 1.00 0.00 H new ATOM 0 HA CYS A 954 -4.493 4.664 19.749 1.00 0.00 H new ATOM 0 HB2 CYS A 954 -5.450 6.750 17.753 1.00 0.00 H new ATOM 0 HB3 CYS A 954 -4.602 5.269 17.355 1.00 0.00 H new ATOM 0 HG CYS A 954 -7.330 4.915 16.728 1.00 0.00 H new ATOM 1097 N LEU A 955 -3.402 7.742 19.781 1.00 0.00 N ATOM 1098 CA LEU A 955 -2.197 8.552 19.893 1.00 0.00 C ATOM 1099 C LEU A 955 -1.420 8.171 21.143 1.00 0.00 C ATOM 1100 O LEU A 955 -0.193 8.241 21.169 1.00 0.00 O ATOM 1101 CB LEU A 955 -2.529 10.053 19.915 1.00 0.00 C ATOM 1102 CG LEU A 955 -2.926 10.676 18.569 1.00 0.00 C ATOM 1103 CD1 LEU A 955 -1.895 10.351 17.500 1.00 0.00 C ATOM 1104 CD2 LEU A 955 -4.314 10.224 18.140 1.00 0.00 C ATOM 0 H LEU A 955 -4.267 8.242 19.983 1.00 0.00 H new ATOM 0 HA LEU A 955 -1.582 8.356 19.015 1.00 0.00 H new ATOM 0 HB2 LEU A 955 -3.343 10.214 20.621 1.00 0.00 H new ATOM 0 HB3 LEU A 955 -1.662 10.591 20.300 1.00 0.00 H new ATOM 0 HG LEU A 955 -2.955 11.758 18.697 1.00 0.00 H new ATOM 0 HD11 LEU A 955 -2.196 10.802 16.555 1.00 0.00 H new ATOM 0 HD12 LEU A 955 -0.924 10.747 17.798 1.00 0.00 H new ATOM 0 HD13 LEU A 955 -1.824 9.270 17.380 1.00 0.00 H new ATOM 0 HD21 LEU A 955 -4.566 10.682 17.184 1.00 0.00 H new ATOM 0 HD22 LEU A 955 -4.328 9.139 18.038 1.00 0.00 H new ATOM 0 HD23 LEU A 955 -5.044 10.527 18.891 1.00 0.00 H new