USER MOD reduce.3.24.130724 H: found=0, std=0, add=495, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 498 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 Single : A 89 MET CE :methyl 161:sc= -0.13 (180deg=-0.532) USER MOD Single : A 90 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 TYR OH : rot 30:sc= -0.619 USER MOD Single : A 102 LYS NZ :NH3+ 168:sc= 0.383 (180deg=0.146) USER MOD Single : A 105 ASN :FLIP amide:sc=-0.00073 F(o=-1.5,f=-0.00073) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0129 USER MOD Single : A 113 MET CE :methyl -170:sc= -2 (180deg=-2.31!) USER MOD Single : A 123 THR OG1 : rot -56:sc= 0.531 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 132 MET CE :methyl -175:sc= -0.625 (180deg=-0.746) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0.00647 USER MOD Single : A 150 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 153 MET CE :methyl 162:sc= -0.366 (180deg=-0.919) USER MOD Single : A 154 THR OG1 : rot -76:sc= 0.849 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 89 16.494 8.607 -7.767 1.00 0.00 N ATOM 2 CA MET A 89 15.154 8.451 -7.157 1.00 0.00 C ATOM 3 C MET A 89 14.999 7.065 -6.549 1.00 0.00 C ATOM 4 O MET A 89 14.380 6.184 -7.140 1.00 0.00 O ATOM 5 CB MET A 89 14.054 8.668 -8.200 1.00 0.00 C ATOM 6 CG MET A 89 14.011 10.076 -8.773 1.00 0.00 C ATOM 7 SD MET A 89 12.737 10.271 -10.037 1.00 0.00 S ATOM 8 CE MET A 89 11.254 9.976 -9.074 1.00 0.00 C ATOM 0 HA MET A 89 15.058 9.202 -6.373 1.00 0.00 H new ATOM 0 HB2 MET A 89 14.197 7.959 -9.016 1.00 0.00 H new ATOM 0 HB3 MET A 89 13.089 8.442 -7.747 1.00 0.00 H new ATOM 0 HG2 MET A 89 13.830 10.787 -7.967 1.00 0.00 H new ATOM 0 HG3 MET A 89 14.983 10.320 -9.201 1.00 0.00 H new ATOM 0 HE1 MET A 89 10.391 10.380 -9.602 1.00 0.00 H new ATOM 0 HE2 MET A 89 11.121 8.904 -8.929 1.00 0.00 H new ATOM 0 HE3 MET A 89 11.347 10.464 -8.104 1.00 0.00 H new ATOM 20 N GLN A 90 15.567 6.871 -5.370 1.00 0.00 N ATOM 21 CA GLN A 90 15.481 5.586 -4.690 1.00 0.00 C ATOM 22 C GLN A 90 14.241 5.525 -3.810 1.00 0.00 C ATOM 23 O GLN A 90 13.738 4.444 -3.506 1.00 0.00 O ATOM 24 CB GLN A 90 16.731 5.330 -3.849 1.00 0.00 C ATOM 25 CG GLN A 90 18.015 5.287 -4.660 1.00 0.00 C ATOM 26 CD GLN A 90 19.226 4.945 -3.816 1.00 0.00 C ATOM 27 OE1 GLN A 90 19.280 5.254 -2.627 1.00 0.00 O ATOM 28 NE2 GLN A 90 20.206 4.296 -4.423 1.00 0.00 N ATOM 0 H GLN A 90 16.092 7.584 -4.864 1.00 0.00 H new ATOM 0 HA GLN A 90 15.409 4.809 -5.452 1.00 0.00 H new ATOM 0 HB2 GLN A 90 16.815 6.111 -3.093 1.00 0.00 H new ATOM 0 HB3 GLN A 90 16.614 4.384 -3.319 1.00 0.00 H new ATOM 0 HG2 GLN A 90 17.912 4.551 -5.457 1.00 0.00 H new ATOM 0 HG3 GLN A 90 18.171 6.254 -5.138 1.00 0.00 H new ATOM 0 HE21 GLN A 90 20.124 4.057 -5.411 1.00 0.00 H new ATOM 0 HE22 GLN A 90 21.043 4.034 -3.903 1.00 0.00 H new ATOM 37 N GLN A 91 13.739 6.687 -3.417 1.00 0.00 N ATOM 38 CA GLN A 91 12.582 6.751 -2.536 1.00 0.00 C ATOM 39 C GLN A 91 11.296 6.964 -3.336 1.00 0.00 C ATOM 40 O GLN A 91 10.416 7.734 -2.948 1.00 0.00 O ATOM 41 CB GLN A 91 12.766 7.842 -1.476 1.00 0.00 C ATOM 42 CG GLN A 91 13.007 9.232 -2.038 1.00 0.00 C ATOM 43 CD GLN A 91 13.281 10.253 -0.955 1.00 0.00 C ATOM 44 OE1 GLN A 91 14.430 10.480 -0.577 1.00 0.00 O ATOM 45 NE2 GLN A 91 12.231 10.868 -0.443 1.00 0.00 N ATOM 0 H GLN A 91 14.113 7.595 -3.693 1.00 0.00 H new ATOM 0 HA GLN A 91 12.494 5.795 -2.019 1.00 0.00 H new ATOM 0 HB2 GLN A 91 11.879 7.869 -0.843 1.00 0.00 H new ATOM 0 HB3 GLN A 91 13.606 7.572 -0.837 1.00 0.00 H new ATOM 0 HG2 GLN A 91 13.852 9.201 -2.726 1.00 0.00 H new ATOM 0 HG3 GLN A 91 12.136 9.543 -2.615 1.00 0.00 H new ATOM 0 HE21 GLN A 91 11.295 10.650 -0.785 1.00 0.00 H new ATOM 0 HE22 GLN A 91 12.356 11.561 0.295 1.00 0.00 H new ATOM 54 N GLU A 92 11.209 6.282 -4.468 1.00 0.00 N ATOM 55 CA GLU A 92 9.983 6.244 -5.251 1.00 0.00 C ATOM 56 C GLU A 92 8.968 5.367 -4.520 1.00 0.00 C ATOM 57 O GLU A 92 9.372 4.520 -3.734 1.00 0.00 O ATOM 58 CB GLU A 92 10.288 5.692 -6.651 1.00 0.00 C ATOM 59 CG GLU A 92 9.086 5.590 -7.576 1.00 0.00 C ATOM 60 CD GLU A 92 9.446 4.982 -8.914 1.00 0.00 C ATOM 61 OE1 GLU A 92 9.660 3.756 -8.973 1.00 0.00 O ATOM 62 OE2 GLU A 92 9.547 5.725 -9.910 1.00 0.00 O ATOM 0 H GLU A 92 11.978 5.744 -4.867 1.00 0.00 H new ATOM 0 HA GLU A 92 9.567 7.245 -5.367 1.00 0.00 H new ATOM 0 HB2 GLU A 92 11.037 6.329 -7.121 1.00 0.00 H new ATOM 0 HB3 GLU A 92 10.732 4.702 -6.546 1.00 0.00 H new ATOM 0 HG2 GLU A 92 8.313 4.986 -7.100 1.00 0.00 H new ATOM 0 HG3 GLU A 92 8.664 6.583 -7.731 1.00 0.00 H new ATOM 69 N LEU A 93 7.675 5.572 -4.769 1.00 0.00 N ATOM 70 CA LEU A 93 6.594 4.884 -4.035 1.00 0.00 C ATOM 71 C LEU A 93 6.876 3.394 -3.782 1.00 0.00 C ATOM 72 O LEU A 93 6.551 2.867 -2.715 1.00 0.00 O ATOM 73 CB LEU A 93 5.270 5.036 -4.786 1.00 0.00 C ATOM 74 CG LEU A 93 4.721 6.463 -4.850 1.00 0.00 C ATOM 75 CD1 LEU A 93 3.432 6.508 -5.651 1.00 0.00 C ATOM 76 CD2 LEU A 93 4.497 7.013 -3.448 1.00 0.00 C ATOM 0 H LEU A 93 7.339 6.218 -5.483 1.00 0.00 H new ATOM 0 HA LEU A 93 6.535 5.363 -3.058 1.00 0.00 H new ATOM 0 HB2 LEU A 93 5.403 4.668 -5.803 1.00 0.00 H new ATOM 0 HB3 LEU A 93 4.525 4.398 -4.311 1.00 0.00 H new ATOM 0 HG LEU A 93 5.458 7.089 -5.353 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.059 7.532 -5.684 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.622 6.159 -6.666 1.00 0.00 H new ATOM 0 HD13 LEU A 93 2.688 5.866 -5.179 1.00 0.00 H new ATOM 0 HD21 LEU A 93 4.107 8.029 -3.514 1.00 0.00 H new ATOM 0 HD22 LEU A 93 3.782 6.383 -2.920 1.00 0.00 H new ATOM 0 HD23 LEU A 93 5.442 7.022 -2.905 1.00 0.00 H new ATOM 88 N ARG A 94 7.497 2.727 -4.749 1.00 0.00 N ATOM 89 CA ARG A 94 7.795 1.296 -4.635 1.00 0.00 C ATOM 90 C ARG A 94 8.808 0.978 -3.527 1.00 0.00 C ATOM 91 O ARG A 94 8.999 -0.188 -3.190 1.00 0.00 O ATOM 92 CB ARG A 94 8.240 0.696 -5.979 1.00 0.00 C ATOM 93 CG ARG A 94 9.107 1.600 -6.843 1.00 0.00 C ATOM 94 CD ARG A 94 10.529 1.744 -6.322 1.00 0.00 C ATOM 95 NE ARG A 94 11.311 2.624 -7.190 1.00 0.00 N ATOM 96 CZ ARG A 94 12.622 2.840 -7.076 1.00 0.00 C ATOM 97 NH1 ARG A 94 13.328 2.232 -6.128 1.00 0.00 N ATOM 98 NH2 ARG A 94 13.227 3.675 -7.916 1.00 0.00 N ATOM 0 H ARG A 94 7.806 3.152 -5.624 1.00 0.00 H new ATOM 0 HA ARG A 94 6.858 0.820 -4.346 1.00 0.00 H new ATOM 0 HB2 ARG A 94 8.789 -0.225 -5.782 1.00 0.00 H new ATOM 0 HB3 ARG A 94 7.351 0.422 -6.547 1.00 0.00 H new ATOM 0 HG2 ARG A 94 9.137 1.202 -7.857 1.00 0.00 H new ATOM 0 HG3 ARG A 94 8.647 2.586 -6.901 1.00 0.00 H new ATOM 0 HD2 ARG A 94 10.511 2.146 -5.309 1.00 0.00 H new ATOM 0 HD3 ARG A 94 11.003 0.764 -6.268 1.00 0.00 H new ATOM 0 HE ARG A 94 10.816 3.109 -7.939 1.00 0.00 H new ATOM 0 HH11 ARG A 94 12.867 1.594 -5.479 1.00 0.00 H new ATOM 0 HH12 ARG A 94 14.330 2.404 -6.049 1.00 0.00 H new ATOM 0 HH21 ARG A 94 12.688 4.146 -8.643 1.00 0.00 H new ATOM 0 HH22 ARG A 94 14.230 3.844 -7.833 1.00 0.00 H new ATOM 112 N GLU A 95 9.480 2.000 -2.990 1.00 0.00 N ATOM 113 CA GLU A 95 10.435 1.802 -1.898 1.00 0.00 C ATOM 114 C GLU A 95 9.818 0.966 -0.773 1.00 0.00 C ATOM 115 O GLU A 95 10.395 -0.032 -0.345 1.00 0.00 O ATOM 116 CB GLU A 95 10.928 3.148 -1.331 1.00 0.00 C ATOM 117 CG GLU A 95 9.828 4.011 -0.712 1.00 0.00 C ATOM 118 CD GLU A 95 10.360 5.066 0.237 1.00 0.00 C ATOM 119 OE1 GLU A 95 10.801 4.706 1.348 1.00 0.00 O ATOM 120 OE2 GLU A 95 10.325 6.264 -0.108 1.00 0.00 O ATOM 0 H GLU A 95 9.381 2.969 -3.293 1.00 0.00 H new ATOM 0 HA GLU A 95 11.289 1.265 -2.312 1.00 0.00 H new ATOM 0 HB2 GLU A 95 11.689 2.954 -0.576 1.00 0.00 H new ATOM 0 HB3 GLU A 95 11.409 3.711 -2.131 1.00 0.00 H new ATOM 0 HG2 GLU A 95 9.266 4.498 -1.509 1.00 0.00 H new ATOM 0 HG3 GLU A 95 9.129 3.368 -0.176 1.00 0.00 H new ATOM 127 N ALA A 96 8.624 1.355 -0.335 1.00 0.00 N ATOM 128 CA ALA A 96 7.956 0.693 0.778 1.00 0.00 C ATOM 129 C ALA A 96 7.593 -0.743 0.425 1.00 0.00 C ATOM 130 O ALA A 96 7.532 -1.609 1.295 1.00 0.00 O ATOM 131 CB ALA A 96 6.716 1.472 1.185 1.00 0.00 C ATOM 0 H ALA A 96 8.098 2.130 -0.738 1.00 0.00 H new ATOM 0 HA ALA A 96 8.646 0.665 1.621 1.00 0.00 H new ATOM 0 HB1 ALA A 96 6.226 0.967 2.017 1.00 0.00 H new ATOM 0 HB2 ALA A 96 7.002 2.479 1.489 1.00 0.00 H new ATOM 0 HB3 ALA A 96 6.029 1.530 0.341 1.00 0.00 H new ATOM 137 N PHE A 97 7.378 -0.986 -0.860 1.00 0.00 N ATOM 138 CA PHE A 97 7.001 -2.306 -1.342 1.00 0.00 C ATOM 139 C PHE A 97 8.095 -3.319 -1.013 1.00 0.00 C ATOM 140 O PHE A 97 7.830 -4.351 -0.407 1.00 0.00 O ATOM 141 CB PHE A 97 6.751 -2.262 -2.853 1.00 0.00 C ATOM 142 CG PHE A 97 6.005 -3.448 -3.393 1.00 0.00 C ATOM 143 CD1 PHE A 97 6.675 -4.603 -3.763 1.00 0.00 C ATOM 144 CD2 PHE A 97 4.628 -3.400 -3.540 1.00 0.00 C ATOM 145 CE1 PHE A 97 5.983 -5.688 -4.264 1.00 0.00 C ATOM 146 CE2 PHE A 97 3.932 -4.480 -4.042 1.00 0.00 C ATOM 147 CZ PHE A 97 4.611 -5.627 -4.404 1.00 0.00 C ATOM 0 H PHE A 97 7.459 -0.280 -1.592 1.00 0.00 H new ATOM 0 HA PHE A 97 6.081 -2.614 -0.845 1.00 0.00 H new ATOM 0 HB2 PHE A 97 6.191 -1.357 -3.090 1.00 0.00 H new ATOM 0 HB3 PHE A 97 7.710 -2.187 -3.366 1.00 0.00 H new ATOM 0 HD1 PHE A 97 7.749 -4.655 -3.659 1.00 0.00 H new ATOM 0 HD2 PHE A 97 4.093 -2.505 -3.258 1.00 0.00 H new ATOM 0 HE1 PHE A 97 6.515 -6.584 -4.546 1.00 0.00 H new ATOM 0 HE2 PHE A 97 2.859 -4.429 -4.152 1.00 0.00 H new ATOM 0 HZ PHE A 97 4.069 -6.475 -4.796 1.00 0.00 H new ATOM 157 N ARG A 98 9.333 -2.992 -1.377 1.00 0.00 N ATOM 158 CA ARG A 98 10.454 -3.901 -1.149 1.00 0.00 C ATOM 159 C ARG A 98 10.984 -3.803 0.278 1.00 0.00 C ATOM 160 O ARG A 98 11.663 -4.712 0.753 1.00 0.00 O ATOM 161 CB ARG A 98 11.591 -3.643 -2.147 1.00 0.00 C ATOM 162 CG ARG A 98 12.038 -2.194 -2.216 1.00 0.00 C ATOM 163 CD ARG A 98 13.358 -2.054 -2.960 1.00 0.00 C ATOM 164 NE ARG A 98 13.363 -2.778 -4.232 1.00 0.00 N ATOM 165 CZ ARG A 98 13.871 -2.300 -5.367 1.00 0.00 C ATOM 166 NH1 ARG A 98 14.369 -1.069 -5.417 1.00 0.00 N ATOM 167 NH2 ARG A 98 13.883 -3.061 -6.453 1.00 0.00 N ATOM 0 H ARG A 98 9.584 -2.112 -1.827 1.00 0.00 H new ATOM 0 HA ARG A 98 10.074 -4.911 -1.302 1.00 0.00 H new ATOM 0 HB2 ARG A 98 12.445 -4.263 -1.876 1.00 0.00 H new ATOM 0 HB3 ARG A 98 11.269 -3.960 -3.139 1.00 0.00 H new ATOM 0 HG2 ARG A 98 11.273 -1.599 -2.715 1.00 0.00 H new ATOM 0 HG3 ARG A 98 12.144 -1.796 -1.207 1.00 0.00 H new ATOM 0 HD2 ARG A 98 13.557 -0.998 -3.145 1.00 0.00 H new ATOM 0 HD3 ARG A 98 14.167 -2.425 -2.331 1.00 0.00 H new ATOM 0 HE ARG A 98 12.950 -3.711 -4.251 1.00 0.00 H new ATOM 0 HH11 ARG A 98 14.364 -0.483 -4.582 1.00 0.00 H new ATOM 0 HH12 ARG A 98 14.756 -0.711 -6.290 1.00 0.00 H new ATOM 0 HH21 ARG A 98 13.504 -4.007 -6.417 1.00 0.00 H new ATOM 0 HH22 ARG A 98 14.271 -2.700 -7.325 1.00 0.00 H new ATOM 181 N LEU A 99 10.683 -2.704 0.965 1.00 0.00 N ATOM 182 CA LEU A 99 11.118 -2.547 2.348 1.00 0.00 C ATOM 183 C LEU A 99 10.315 -3.458 3.268 1.00 0.00 C ATOM 184 O LEU A 99 10.875 -4.141 4.125 1.00 0.00 O ATOM 185 CB LEU A 99 10.988 -1.090 2.812 1.00 0.00 C ATOM 186 CG LEU A 99 11.929 -0.092 2.133 1.00 0.00 C ATOM 187 CD1 LEU A 99 11.705 1.305 2.686 1.00 0.00 C ATOM 188 CD2 LEU A 99 13.380 -0.516 2.314 1.00 0.00 C ATOM 0 H LEU A 99 10.147 -1.920 0.593 1.00 0.00 H new ATOM 0 HA LEU A 99 12.170 -2.829 2.397 1.00 0.00 H new ATOM 0 HB2 LEU A 99 9.961 -0.765 2.645 1.00 0.00 H new ATOM 0 HB3 LEU A 99 11.163 -1.053 3.887 1.00 0.00 H new ATOM 0 HG LEU A 99 11.709 -0.079 1.065 1.00 0.00 H new ATOM 0 HD11 LEU A 99 12.381 2.004 2.194 1.00 0.00 H new ATOM 0 HD12 LEU A 99 10.674 1.608 2.503 1.00 0.00 H new ATOM 0 HD13 LEU A 99 11.899 1.307 3.759 1.00 0.00 H new ATOM 0 HD21 LEU A 99 14.034 0.206 1.824 1.00 0.00 H new ATOM 0 HD22 LEU A 99 13.617 -0.558 3.377 1.00 0.00 H new ATOM 0 HD23 LEU A 99 13.530 -1.500 1.870 1.00 0.00 H new ATOM 200 N TYR A 100 9.006 -3.480 3.071 1.00 0.00 N ATOM 201 CA TYR A 100 8.121 -4.269 3.918 1.00 0.00 C ATOM 202 C TYR A 100 8.031 -5.717 3.444 1.00 0.00 C ATOM 203 O TYR A 100 8.168 -6.643 4.246 1.00 0.00 O ATOM 204 CB TYR A 100 6.722 -3.648 3.968 1.00 0.00 C ATOM 205 CG TYR A 100 6.641 -2.377 4.788 1.00 0.00 C ATOM 206 CD1 TYR A 100 7.087 -1.165 4.279 1.00 0.00 C ATOM 207 CD2 TYR A 100 6.119 -2.395 6.078 1.00 0.00 C ATOM 208 CE1 TYR A 100 7.016 -0.008 5.026 1.00 0.00 C ATOM 209 CE2 TYR A 100 6.047 -1.240 6.833 1.00 0.00 C ATOM 210 CZ TYR A 100 6.495 -0.049 6.302 1.00 0.00 C ATOM 211 OH TYR A 100 6.427 1.103 7.048 1.00 0.00 O ATOM 0 H TYR A 100 8.532 -2.961 2.332 1.00 0.00 H new ATOM 0 HA TYR A 100 8.547 -4.267 4.921 1.00 0.00 H new ATOM 0 HB2 TYR A 100 6.394 -3.433 2.951 1.00 0.00 H new ATOM 0 HB3 TYR A 100 6.026 -4.379 4.380 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.497 -1.128 3.280 1.00 0.00 H new ATOM 0 HD2 TYR A 100 5.765 -3.326 6.495 1.00 0.00 H new ATOM 0 HE1 TYR A 100 7.367 0.926 4.613 1.00 0.00 H new ATOM 0 HE2 TYR A 100 5.642 -1.270 7.834 1.00 0.00 H new ATOM 0 HH TYR A 100 6.316 1.873 6.452 1.00 0.00 H new ATOM 221 N ASP A 101 7.813 -5.912 2.145 1.00 0.00 N ATOM 222 CA ASP A 101 7.607 -7.254 1.601 1.00 0.00 C ATOM 223 C ASP A 101 8.895 -8.063 1.585 1.00 0.00 C ATOM 224 O ASP A 101 9.798 -7.822 0.785 1.00 0.00 O ATOM 225 CB ASP A 101 7.023 -7.203 0.199 1.00 0.00 C ATOM 226 CG ASP A 101 7.042 -8.565 -0.453 1.00 0.00 C ATOM 227 OD1 ASP A 101 6.438 -9.504 0.107 1.00 0.00 O ATOM 228 OD2 ASP A 101 7.679 -8.707 -1.513 1.00 0.00 O ATOM 0 H ASP A 101 7.774 -5.164 1.453 1.00 0.00 H new ATOM 0 HA ASP A 101 6.896 -7.748 2.263 1.00 0.00 H new ATOM 0 HB2 ASP A 101 5.999 -6.833 0.243 1.00 0.00 H new ATOM 0 HB3 ASP A 101 7.591 -6.499 -0.409 1.00 0.00 H new ATOM 233 N LYS A 102 8.971 -9.001 2.504 1.00 0.00 N ATOM 234 CA LYS A 102 10.142 -9.842 2.666 1.00 0.00 C ATOM 235 C LYS A 102 10.172 -11.026 1.688 1.00 0.00 C ATOM 236 O LYS A 102 11.211 -11.669 1.536 1.00 0.00 O ATOM 237 CB LYS A 102 10.188 -10.322 4.117 1.00 0.00 C ATOM 238 CG LYS A 102 10.120 -9.165 5.104 1.00 0.00 C ATOM 239 CD LYS A 102 9.782 -9.617 6.515 1.00 0.00 C ATOM 240 CE LYS A 102 9.527 -8.425 7.425 1.00 0.00 C ATOM 241 NZ LYS A 102 8.440 -7.552 6.900 1.00 0.00 N ATOM 0 H LYS A 102 8.220 -9.204 3.164 1.00 0.00 H new ATOM 0 HA LYS A 102 11.028 -9.251 2.431 1.00 0.00 H new ATOM 0 HB2 LYS A 102 9.357 -11.003 4.300 1.00 0.00 H new ATOM 0 HB3 LYS A 102 11.106 -10.886 4.283 1.00 0.00 H new ATOM 0 HG2 LYS A 102 11.077 -8.644 5.113 1.00 0.00 H new ATOM 0 HG3 LYS A 102 9.371 -8.449 4.767 1.00 0.00 H new ATOM 0 HD2 LYS A 102 8.900 -10.258 6.494 1.00 0.00 H new ATOM 0 HD3 LYS A 102 10.601 -10.215 6.915 1.00 0.00 H new ATOM 0 HE2 LYS A 102 9.260 -8.778 8.421 1.00 0.00 H new ATOM 0 HE3 LYS A 102 10.443 -7.843 7.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 8.155 -6.873 7.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 8.782 -7.036 6.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 7.622 -8.137 6.634 1.00 0.00 H new ATOM 255 N GLU A 103 9.050 -11.319 1.021 1.00 0.00 N ATOM 256 CA GLU A 103 8.940 -12.569 0.259 1.00 0.00 C ATOM 257 C GLU A 103 8.291 -12.408 -1.121 1.00 0.00 C ATOM 258 O GLU A 103 8.853 -12.857 -2.123 1.00 0.00 O ATOM 259 CB GLU A 103 8.143 -13.603 1.063 1.00 0.00 C ATOM 260 CG GLU A 103 8.876 -14.139 2.283 1.00 0.00 C ATOM 261 CD GLU A 103 8.035 -15.103 3.091 1.00 0.00 C ATOM 262 OE1 GLU A 103 7.565 -16.110 2.521 1.00 0.00 O ATOM 263 OE2 GLU A 103 7.838 -14.855 4.299 1.00 0.00 O ATOM 0 H GLU A 103 8.222 -10.723 0.992 1.00 0.00 H new ATOM 0 HA GLU A 103 9.964 -12.902 0.090 1.00 0.00 H new ATOM 0 HB2 GLU A 103 7.204 -13.152 1.385 1.00 0.00 H new ATOM 0 HB3 GLU A 103 7.888 -14.437 0.410 1.00 0.00 H new ATOM 0 HG2 GLU A 103 9.789 -14.640 1.962 1.00 0.00 H new ATOM 0 HG3 GLU A 103 9.176 -13.305 2.917 1.00 0.00 H new ATOM 270 N GLY A 104 7.127 -11.765 -1.166 1.00 0.00 N ATOM 271 CA GLY A 104 6.277 -11.803 -2.350 1.00 0.00 C ATOM 272 C GLY A 104 6.966 -11.344 -3.626 1.00 0.00 C ATOM 273 O GLY A 104 6.991 -12.078 -4.617 1.00 0.00 O ATOM 0 H GLY A 104 6.752 -11.212 -0.396 1.00 0.00 H new ATOM 0 HA2 GLY A 104 5.915 -12.821 -2.492 1.00 0.00 H new ATOM 0 HA3 GLY A 104 5.403 -11.176 -2.176 1.00 0.00 H new ATOM 277 N ASN A 105 7.512 -10.132 -3.598 1.00 0.00 N ATOM 278 CA ASN A 105 8.188 -9.542 -4.752 1.00 0.00 C ATOM 279 C ASN A 105 7.238 -9.442 -5.935 1.00 0.00 C ATOM 280 O ASN A 105 7.472 -10.023 -6.996 1.00 0.00 O ATOM 281 CB ASN A 105 9.438 -10.344 -5.130 1.00 0.00 C ATOM 282 CG ASN A 105 10.613 -10.089 -4.202 1.00 0.00 C ATOM 283 OD1 ASN A 105 10.338 -9.739 -2.952 1.00 0.00 O flip ATOM 284 ND2 ASN A 105 11.768 -10.189 -4.616 1.00 0.00 N flip ATOM 0 H ASN A 105 7.499 -9.530 -2.775 1.00 0.00 H new ATOM 0 HA ASN A 105 8.505 -8.536 -4.477 1.00 0.00 H new ATOM 0 HB2 ASN A 105 9.198 -11.407 -5.118 1.00 0.00 H new ATOM 0 HB3 ASN A 105 9.728 -10.094 -6.151 1.00 0.00 H new ATOM 0 HD21 ASN A 105 11.941 -10.461 -5.584 1.00 0.00 H new ATOM 0 HD22 ASN A 105 12.552 -10.000 -3.991 1.00 0.00 H new ATOM 291 N GLY A 106 6.162 -8.699 -5.736 1.00 0.00 N ATOM 292 CA GLY A 106 5.150 -8.552 -6.759 1.00 0.00 C ATOM 293 C GLY A 106 3.767 -8.532 -6.157 1.00 0.00 C ATOM 294 O GLY A 106 2.811 -8.069 -6.779 1.00 0.00 O ATOM 0 H GLY A 106 5.970 -8.189 -4.873 1.00 0.00 H new ATOM 0 HA2 GLY A 106 5.321 -7.630 -7.314 1.00 0.00 H new ATOM 0 HA3 GLY A 106 5.228 -9.373 -7.472 1.00 0.00 H new ATOM 298 N TYR A 107 3.667 -9.035 -4.935 1.00 0.00 N ATOM 299 CA TYR A 107 2.410 -9.061 -4.202 1.00 0.00 C ATOM 300 C TYR A 107 2.679 -9.019 -2.702 1.00 0.00 C ATOM 301 O TYR A 107 3.563 -9.716 -2.207 1.00 0.00 O ATOM 302 CB TYR A 107 1.585 -10.303 -4.576 1.00 0.00 C ATOM 303 CG TYR A 107 2.402 -11.574 -4.686 1.00 0.00 C ATOM 304 CD1 TYR A 107 2.616 -12.394 -3.585 1.00 0.00 C ATOM 305 CD2 TYR A 107 2.965 -11.948 -5.902 1.00 0.00 C ATOM 306 CE1 TYR A 107 3.370 -13.546 -3.691 1.00 0.00 C ATOM 307 CE2 TYR A 107 3.716 -13.097 -6.014 1.00 0.00 C ATOM 308 CZ TYR A 107 3.915 -13.893 -4.908 1.00 0.00 C ATOM 309 OH TYR A 107 4.670 -15.033 -5.018 1.00 0.00 O ATOM 0 H TYR A 107 4.454 -9.436 -4.425 1.00 0.00 H new ATOM 0 HA TYR A 107 1.829 -8.181 -4.476 1.00 0.00 H new ATOM 0 HB2 TYR A 107 0.805 -10.448 -3.828 1.00 0.00 H new ATOM 0 HB3 TYR A 107 1.084 -10.121 -5.527 1.00 0.00 H new ATOM 0 HD1 TYR A 107 2.186 -12.126 -2.631 1.00 0.00 H new ATOM 0 HD2 TYR A 107 2.811 -11.327 -6.772 1.00 0.00 H new ATOM 0 HE1 TYR A 107 3.532 -14.171 -2.825 1.00 0.00 H new ATOM 0 HE2 TYR A 107 4.147 -13.373 -6.965 1.00 0.00 H new ATOM 0 HH TYR A 107 4.979 -15.133 -5.943 1.00 0.00 H new ATOM 319 N ILE A 108 1.936 -8.179 -1.994 1.00 0.00 N ATOM 320 CA ILE A 108 2.125 -8.009 -0.558 1.00 0.00 C ATOM 321 C ILE A 108 0.904 -8.482 0.216 1.00 0.00 C ATOM 322 O ILE A 108 -0.204 -8.515 -0.309 1.00 0.00 O ATOM 323 CB ILE A 108 2.404 -6.531 -0.197 1.00 0.00 C ATOM 324 CG1 ILE A 108 1.210 -5.648 -0.572 1.00 0.00 C ATOM 325 CG2 ILE A 108 3.661 -6.049 -0.899 1.00 0.00 C ATOM 326 CD1 ILE A 108 1.360 -4.201 -0.145 1.00 0.00 C ATOM 0 H ILE A 108 1.194 -7.603 -2.391 1.00 0.00 H new ATOM 0 HA ILE A 108 2.988 -8.615 -0.280 1.00 0.00 H new ATOM 0 HB ILE A 108 2.555 -6.461 0.880 1.00 0.00 H new ATOM 0 HG12 ILE A 108 1.068 -5.685 -1.652 1.00 0.00 H new ATOM 0 HG13 ILE A 108 0.309 -6.060 -0.117 1.00 0.00 H new ATOM 0 HG21 ILE A 108 3.847 -5.007 -0.637 1.00 0.00 H new ATOM 0 HG22 ILE A 108 4.509 -6.659 -0.587 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.531 -6.134 -1.978 1.00 0.00 H new ATOM 0 HD11 ILE A 108 0.475 -3.639 -0.445 1.00 0.00 H new ATOM 0 HD12 ILE A 108 1.471 -4.151 0.938 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.242 -3.771 -0.620 1.00 0.00 H new ATOM 338 N SER A 109 1.114 -8.853 1.470 1.00 0.00 N ATOM 339 CA SER A 109 0.027 -9.292 2.329 1.00 0.00 C ATOM 340 C SER A 109 -0.877 -8.114 2.677 1.00 0.00 C ATOM 341 O SER A 109 -0.403 -7.005 2.941 1.00 0.00 O ATOM 342 CB SER A 109 0.589 -9.928 3.609 1.00 0.00 C ATOM 343 OG SER A 109 -0.450 -10.353 4.477 1.00 0.00 O ATOM 0 H SER A 109 2.031 -8.858 1.916 1.00 0.00 H new ATOM 0 HA SER A 109 -0.562 -10.039 1.797 1.00 0.00 H new ATOM 0 HB2 SER A 109 1.218 -10.779 3.348 1.00 0.00 H new ATOM 0 HB3 SER A 109 1.225 -9.209 4.125 1.00 0.00 H new ATOM 0 HG SER A 109 -0.060 -10.755 5.281 1.00 0.00 H new ATOM 349 N THR A 110 -2.178 -8.377 2.661 1.00 0.00 N ATOM 350 CA THR A 110 -3.198 -7.389 3.005 1.00 0.00 C ATOM 351 C THR A 110 -2.949 -6.780 4.381 1.00 0.00 C ATOM 352 O THR A 110 -3.250 -5.607 4.619 1.00 0.00 O ATOM 353 CB THR A 110 -4.597 -8.033 2.990 1.00 0.00 C ATOM 354 OG1 THR A 110 -4.527 -9.357 3.533 1.00 0.00 O ATOM 355 CG2 THR A 110 -5.166 -8.089 1.584 1.00 0.00 C ATOM 0 H THR A 110 -2.560 -9.288 2.407 1.00 0.00 H new ATOM 0 HA THR A 110 -3.145 -6.598 2.257 1.00 0.00 H new ATOM 0 HB THR A 110 -5.258 -7.417 3.600 1.00 0.00 H new ATOM 0 HG1 THR A 110 -5.419 -9.762 3.523 1.00 0.00 H new ATOM 0 HG21 THR A 110 -6.154 -8.549 1.609 1.00 0.00 H new ATOM 0 HG22 THR A 110 -5.246 -7.078 1.184 1.00 0.00 H new ATOM 0 HG23 THR A 110 -4.507 -8.680 0.948 1.00 0.00 H new ATOM 363 N ASP A 111 -2.396 -7.578 5.282 1.00 0.00 N ATOM 364 CA ASP A 111 -2.097 -7.120 6.632 1.00 0.00 C ATOM 365 C ASP A 111 -0.990 -6.071 6.614 1.00 0.00 C ATOM 366 O ASP A 111 -1.025 -5.102 7.371 1.00 0.00 O ATOM 367 CB ASP A 111 -1.690 -8.298 7.511 1.00 0.00 C ATOM 368 CG ASP A 111 -1.371 -7.878 8.931 1.00 0.00 C ATOM 369 OD1 ASP A 111 -2.309 -7.562 9.687 1.00 0.00 O ATOM 370 OD2 ASP A 111 -0.179 -7.866 9.296 1.00 0.00 O ATOM 0 H ASP A 111 -2.144 -8.550 5.102 1.00 0.00 H new ATOM 0 HA ASP A 111 -2.996 -6.664 7.046 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -2.495 -9.032 7.525 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -0.819 -8.788 7.076 1.00 0.00 H new ATOM 375 N VAL A 112 -0.029 -6.262 5.716 1.00 0.00 N ATOM 376 CA VAL A 112 1.103 -5.354 5.591 1.00 0.00 C ATOM 377 C VAL A 112 0.638 -3.970 5.139 1.00 0.00 C ATOM 378 O VAL A 112 1.204 -2.951 5.530 1.00 0.00 O ATOM 379 CB VAL A 112 2.151 -5.893 4.590 1.00 0.00 C ATOM 380 CG1 VAL A 112 3.355 -4.965 4.502 1.00 0.00 C ATOM 381 CG2 VAL A 112 2.589 -7.300 4.978 1.00 0.00 C ATOM 0 H VAL A 112 -0.013 -7.043 5.061 1.00 0.00 H new ATOM 0 HA VAL A 112 1.566 -5.278 6.575 1.00 0.00 H new ATOM 0 HB VAL A 112 1.684 -5.933 3.606 1.00 0.00 H new ATOM 0 HG11 VAL A 112 4.075 -5.370 3.791 1.00 0.00 H new ATOM 0 HG12 VAL A 112 3.031 -3.979 4.169 1.00 0.00 H new ATOM 0 HG13 VAL A 112 3.822 -4.881 5.483 1.00 0.00 H new ATOM 0 HG21 VAL A 112 3.327 -7.662 4.262 1.00 0.00 H new ATOM 0 HG22 VAL A 112 3.030 -7.282 5.975 1.00 0.00 H new ATOM 0 HG23 VAL A 112 1.724 -7.964 4.975 1.00 0.00 H new ATOM 391 N MET A 113 -0.414 -3.938 4.323 1.00 0.00 N ATOM 392 CA MET A 113 -0.945 -2.674 3.832 1.00 0.00 C ATOM 393 C MET A 113 -1.480 -1.830 4.987 1.00 0.00 C ATOM 394 O MET A 113 -1.401 -0.603 4.952 1.00 0.00 O ATOM 395 CB MET A 113 -2.036 -2.900 2.777 1.00 0.00 C ATOM 396 CG MET A 113 -2.652 -1.610 2.247 1.00 0.00 C ATOM 397 SD MET A 113 -3.656 -1.857 0.772 1.00 0.00 S ATOM 398 CE MET A 113 -2.393 -2.250 -0.433 1.00 0.00 C ATOM 0 H MET A 113 -0.910 -4.766 3.992 1.00 0.00 H new ATOM 0 HA MET A 113 -0.128 -2.132 3.356 1.00 0.00 H new ATOM 0 HB2 MET A 113 -1.612 -3.459 1.943 1.00 0.00 H new ATOM 0 HB3 MET A 113 -2.824 -3.518 3.208 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.268 -1.162 3.027 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.856 -0.900 2.022 1.00 0.00 H new ATOM 0 HE1 MET A 113 -2.831 -2.255 -1.431 1.00 0.00 H new ATOM 0 HE2 MET A 113 -1.602 -1.502 -0.388 1.00 0.00 H new ATOM 0 HE3 MET A 113 -1.975 -3.233 -0.215 1.00 0.00 H new ATOM 408 N ARG A 114 -1.993 -2.490 6.024 1.00 0.00 N ATOM 409 CA ARG A 114 -2.455 -1.785 7.216 1.00 0.00 C ATOM 410 C ARG A 114 -1.291 -1.072 7.884 1.00 0.00 C ATOM 411 O ARG A 114 -1.415 0.077 8.307 1.00 0.00 O ATOM 412 CB ARG A 114 -3.125 -2.735 8.215 1.00 0.00 C ATOM 413 CG ARG A 114 -4.415 -3.344 7.697 1.00 0.00 C ATOM 414 CD ARG A 114 -5.236 -3.966 8.815 1.00 0.00 C ATOM 415 NE ARG A 114 -4.560 -5.092 9.460 1.00 0.00 N ATOM 416 CZ ARG A 114 -5.016 -5.699 10.558 1.00 0.00 C ATOM 417 NH1 ARG A 114 -6.115 -5.256 11.153 1.00 0.00 N ATOM 418 NH2 ARG A 114 -4.366 -6.736 11.061 1.00 0.00 N ATOM 0 H ARG A 114 -2.098 -3.504 6.062 1.00 0.00 H new ATOM 0 HA ARG A 114 -3.199 -1.054 6.899 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -2.429 -3.536 8.466 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -3.333 -2.193 9.137 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -5.005 -2.575 7.198 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -4.184 -4.104 6.950 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -5.457 -3.205 9.563 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -6.191 -4.304 8.413 1.00 0.00 H new ATOM 0 HE ARG A 114 -3.691 -5.432 9.047 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -6.612 -4.451 10.772 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -6.463 -5.720 11.992 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -3.515 -7.072 10.610 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -4.716 -7.199 11.900 1.00 0.00 H new ATOM 432 N GLU A 115 -0.154 -1.757 7.949 1.00 0.00 N ATOM 433 CA GLU A 115 1.057 -1.189 8.530 1.00 0.00 C ATOM 434 C GLU A 115 1.493 0.044 7.749 1.00 0.00 C ATOM 435 O GLU A 115 1.819 1.076 8.329 1.00 0.00 O ATOM 436 CB GLU A 115 2.188 -2.216 8.524 1.00 0.00 C ATOM 437 CG GLU A 115 1.822 -3.545 9.164 1.00 0.00 C ATOM 438 CD GLU A 115 3.002 -4.490 9.241 1.00 0.00 C ATOM 439 OE1 GLU A 115 3.763 -4.408 10.230 1.00 0.00 O ATOM 440 OE2 GLU A 115 3.181 -5.310 8.319 1.00 0.00 O ATOM 0 H GLU A 115 -0.046 -2.711 7.605 1.00 0.00 H new ATOM 0 HA GLU A 115 0.836 -0.905 9.559 1.00 0.00 H new ATOM 0 HB2 GLU A 115 2.498 -2.394 7.494 1.00 0.00 H new ATOM 0 HB3 GLU A 115 3.048 -1.797 9.047 1.00 0.00 H new ATOM 0 HG2 GLU A 115 1.435 -3.368 10.168 1.00 0.00 H new ATOM 0 HG3 GLU A 115 1.021 -4.013 8.591 1.00 0.00 H new ATOM 447 N ILE A 116 1.485 -0.079 6.425 1.00 0.00 N ATOM 448 CA ILE A 116 1.910 1.003 5.544 1.00 0.00 C ATOM 449 C ILE A 116 0.973 2.207 5.652 1.00 0.00 C ATOM 450 O ILE A 116 1.427 3.351 5.738 1.00 0.00 O ATOM 451 CB ILE A 116 1.979 0.533 4.074 1.00 0.00 C ATOM 452 CG1 ILE A 116 2.928 -0.662 3.943 1.00 0.00 C ATOM 453 CG2 ILE A 116 2.433 1.673 3.171 1.00 0.00 C ATOM 454 CD1 ILE A 116 2.996 -1.233 2.542 1.00 0.00 C ATOM 0 H ILE A 116 1.187 -0.923 5.937 1.00 0.00 H new ATOM 0 HA ILE A 116 2.907 1.303 5.865 1.00 0.00 H new ATOM 0 HB ILE A 116 0.982 0.222 3.762 1.00 0.00 H new ATOM 0 HG12 ILE A 116 3.928 -0.356 4.250 1.00 0.00 H new ATOM 0 HG13 ILE A 116 2.609 -1.445 4.630 1.00 0.00 H new ATOM 0 HG21 ILE A 116 2.476 1.325 2.139 1.00 0.00 H new ATOM 0 HG22 ILE A 116 1.727 2.500 3.246 1.00 0.00 H new ATOM 0 HG23 ILE A 116 3.422 2.011 3.481 1.00 0.00 H new ATOM 0 HD11 ILE A 116 3.687 -2.076 2.526 1.00 0.00 H new ATOM 0 HD12 ILE A 116 2.005 -1.570 2.238 1.00 0.00 H new ATOM 0 HD13 ILE A 116 3.345 -0.464 1.852 1.00 0.00 H new ATOM 466 N LEU A 117 -0.328 1.949 5.658 1.00 0.00 N ATOM 467 CA LEU A 117 -1.317 3.019 5.745 1.00 0.00 C ATOM 468 C LEU A 117 -1.221 3.744 7.084 1.00 0.00 C ATOM 469 O LEU A 117 -1.315 4.969 7.144 1.00 0.00 O ATOM 470 CB LEU A 117 -2.731 2.473 5.540 1.00 0.00 C ATOM 471 CG LEU A 117 -3.012 1.879 4.156 1.00 0.00 C ATOM 472 CD1 LEU A 117 -4.430 1.341 4.088 1.00 0.00 C ATOM 473 CD2 LEU A 117 -2.784 2.919 3.068 1.00 0.00 C ATOM 0 H LEU A 117 -0.724 1.011 5.604 1.00 0.00 H new ATOM 0 HA LEU A 117 -1.103 3.734 4.950 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -2.918 1.705 6.291 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -3.443 3.278 5.723 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.320 1.053 3.990 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -4.613 0.923 3.098 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -4.561 0.563 4.841 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -5.136 2.150 4.276 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -2.989 2.477 2.093 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -3.450 3.766 3.229 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.749 3.260 3.101 1.00 0.00 H new ATOM 485 N ALA A 118 -1.015 2.982 8.153 1.00 0.00 N ATOM 486 CA ALA A 118 -0.893 3.552 9.491 1.00 0.00 C ATOM 487 C ALA A 118 0.440 4.280 9.656 1.00 0.00 C ATOM 488 O ALA A 118 0.597 5.123 10.537 1.00 0.00 O ATOM 489 CB ALA A 118 -1.041 2.464 10.544 1.00 0.00 C ATOM 0 H ALA A 118 -0.929 1.966 8.119 1.00 0.00 H new ATOM 0 HA ALA A 118 -1.693 4.280 9.626 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -0.948 2.904 11.537 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -2.019 1.993 10.446 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -0.262 1.714 10.405 1.00 0.00 H new ATOM 495 N GLU A 119 1.393 3.943 8.801 1.00 0.00 N ATOM 496 CA GLU A 119 2.703 4.575 8.813 1.00 0.00 C ATOM 497 C GLU A 119 2.638 5.903 8.057 1.00 0.00 C ATOM 498 O GLU A 119 3.244 6.897 8.457 1.00 0.00 O ATOM 499 CB GLU A 119 3.717 3.627 8.159 1.00 0.00 C ATOM 500 CG GLU A 119 5.119 3.662 8.752 1.00 0.00 C ATOM 501 CD GLU A 119 5.924 4.880 8.341 1.00 0.00 C ATOM 502 OE1 GLU A 119 6.202 5.036 7.132 1.00 0.00 O ATOM 503 OE2 GLU A 119 6.299 5.670 9.228 1.00 0.00 O ATOM 0 H GLU A 119 1.281 3.227 8.083 1.00 0.00 H new ATOM 0 HA GLU A 119 3.014 4.778 9.838 1.00 0.00 H new ATOM 0 HB2 GLU A 119 3.336 2.608 8.231 1.00 0.00 H new ATOM 0 HB3 GLU A 119 3.783 3.869 7.098 1.00 0.00 H new ATOM 0 HG2 GLU A 119 5.045 3.636 9.839 1.00 0.00 H new ATOM 0 HG3 GLU A 119 5.655 2.763 8.448 1.00 0.00 H new ATOM 510 N LEU A 120 1.870 5.905 6.973 1.00 0.00 N ATOM 511 CA LEU A 120 1.759 7.066 6.100 1.00 0.00 C ATOM 512 C LEU A 120 0.866 8.142 6.723 1.00 0.00 C ATOM 513 O LEU A 120 1.290 9.289 6.887 1.00 0.00 O ATOM 514 CB LEU A 120 1.213 6.621 4.731 1.00 0.00 C ATOM 515 CG LEU A 120 1.340 7.635 3.583 1.00 0.00 C ATOM 516 CD1 LEU A 120 1.220 6.926 2.248 1.00 0.00 C ATOM 517 CD2 LEU A 120 0.280 8.724 3.682 1.00 0.00 C ATOM 0 H LEU A 120 1.310 5.106 6.676 1.00 0.00 H new ATOM 0 HA LEU A 120 2.747 7.505 5.966 1.00 0.00 H new ATOM 0 HB2 LEU A 120 1.729 5.707 4.438 1.00 0.00 H new ATOM 0 HB3 LEU A 120 0.159 6.368 4.849 1.00 0.00 H new ATOM 0 HG LEU A 120 2.320 8.106 3.661 1.00 0.00 H new ATOM 0 HD11 LEU A 120 1.311 7.653 1.441 1.00 0.00 H new ATOM 0 HD12 LEU A 120 2.012 6.183 2.158 1.00 0.00 H new ATOM 0 HD13 LEU A 120 0.250 6.432 2.184 1.00 0.00 H new ATOM 0 HD21 LEU A 120 0.399 9.424 2.855 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -0.711 8.272 3.636 1.00 0.00 H new ATOM 0 HD23 LEU A 120 0.392 9.256 4.627 1.00 0.00 H new ATOM 529 N ASP A 121 -0.363 7.771 7.072 1.00 0.00 N ATOM 530 CA ASP A 121 -1.333 8.736 7.586 1.00 0.00 C ATOM 531 C ASP A 121 -1.015 9.104 9.028 1.00 0.00 C ATOM 532 O ASP A 121 -0.433 8.321 9.780 1.00 0.00 O ATOM 533 CB ASP A 121 -2.759 8.190 7.483 1.00 0.00 C ATOM 534 CG ASP A 121 -3.797 9.201 7.943 1.00 0.00 C ATOM 535 OD1 ASP A 121 -4.131 9.213 9.145 1.00 0.00 O ATOM 536 OD2 ASP A 121 -4.271 9.999 7.107 1.00 0.00 O ATOM 0 H ASP A 121 -0.710 6.814 7.009 1.00 0.00 H new ATOM 0 HA ASP A 121 -1.264 9.635 6.973 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -2.964 7.906 6.451 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -2.844 7.285 8.085 1.00 0.00 H new ATOM 541 N GLU A 122 -1.409 10.313 9.398 1.00 0.00 N ATOM 542 CA GLU A 122 -1.036 10.897 10.673 1.00 0.00 C ATOM 543 C GLU A 122 -1.856 10.345 11.843 1.00 0.00 C ATOM 544 O GLU A 122 -1.334 10.214 12.951 1.00 0.00 O ATOM 545 CB GLU A 122 -1.192 12.416 10.593 1.00 0.00 C ATOM 546 CG GLU A 122 -0.820 13.153 11.869 1.00 0.00 C ATOM 547 CD GLU A 122 -1.043 14.644 11.749 1.00 0.00 C ATOM 548 OE1 GLU A 122 -2.213 15.077 11.787 1.00 0.00 O ATOM 549 OE2 GLU A 122 -0.052 15.391 11.607 1.00 0.00 O ATOM 0 H GLU A 122 -1.996 10.915 8.821 1.00 0.00 H new ATOM 0 HA GLU A 122 0.003 10.629 10.867 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -0.573 12.790 9.778 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -2.226 12.650 10.341 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -1.411 12.764 12.698 1.00 0.00 H new ATOM 0 HG3 GLU A 122 0.226 12.961 12.106 1.00 0.00 H new ATOM 556 N THR A 123 -3.125 10.006 11.615 1.00 0.00 N ATOM 557 CA THR A 123 -3.985 9.616 12.725 1.00 0.00 C ATOM 558 C THR A 123 -5.288 8.933 12.270 1.00 0.00 C ATOM 559 O THR A 123 -6.391 9.325 12.661 1.00 0.00 O ATOM 560 CB THR A 123 -4.292 10.838 13.628 1.00 0.00 C ATOM 561 OG1 THR A 123 -5.090 10.454 14.758 1.00 0.00 O ATOM 562 CG2 THR A 123 -4.994 11.930 12.840 1.00 0.00 C ATOM 0 H THR A 123 -3.569 9.994 10.697 1.00 0.00 H new ATOM 0 HA THR A 123 -3.434 8.873 13.301 1.00 0.00 H new ATOM 0 HB THR A 123 -3.342 11.228 13.992 1.00 0.00 H new ATOM 0 HG1 THR A 123 -5.907 10.011 14.446 1.00 0.00 H new ATOM 0 HG21 THR A 123 -5.199 12.777 13.495 1.00 0.00 H new ATOM 0 HG22 THR A 123 -4.355 12.253 12.018 1.00 0.00 H new ATOM 0 HG23 THR A 123 -5.932 11.545 12.441 1.00 0.00 H new ATOM 570 N LEU A 124 -5.167 7.904 11.443 1.00 0.00 N ATOM 571 CA LEU A 124 -6.311 7.056 11.137 1.00 0.00 C ATOM 572 C LEU A 124 -6.501 6.017 12.240 1.00 0.00 C ATOM 573 O LEU A 124 -5.538 5.618 12.901 1.00 0.00 O ATOM 574 CB LEU A 124 -6.169 6.392 9.755 1.00 0.00 C ATOM 575 CG LEU A 124 -4.792 5.819 9.391 1.00 0.00 C ATOM 576 CD1 LEU A 124 -4.442 4.616 10.251 1.00 0.00 C ATOM 577 CD2 LEU A 124 -4.760 5.436 7.920 1.00 0.00 C ATOM 0 H LEU A 124 -4.300 7.638 10.977 1.00 0.00 H new ATOM 0 HA LEU A 124 -7.202 7.682 11.096 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -6.899 5.585 9.691 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -6.440 7.127 8.997 1.00 0.00 H new ATOM 0 HG LEU A 124 -4.047 6.592 9.581 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -3.461 4.237 9.965 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -4.425 4.911 11.300 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -5.189 3.835 10.106 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -3.779 5.031 7.671 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -5.524 4.684 7.723 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -4.953 6.318 7.310 1.00 0.00 H new ATOM 589 N SER A 125 -7.739 5.608 12.457 1.00 0.00 N ATOM 590 CA SER A 125 -8.057 4.660 13.511 1.00 0.00 C ATOM 591 C SER A 125 -8.011 3.225 12.984 1.00 0.00 C ATOM 592 O SER A 125 -7.882 3.008 11.777 1.00 0.00 O ATOM 593 CB SER A 125 -9.439 4.966 14.088 1.00 0.00 C ATOM 594 OG SER A 125 -9.557 6.339 14.423 1.00 0.00 O ATOM 0 H SER A 125 -8.544 5.920 11.914 1.00 0.00 H new ATOM 0 HA SER A 125 -7.311 4.757 14.300 1.00 0.00 H new ATOM 0 HB2 SER A 125 -10.207 4.698 13.363 1.00 0.00 H new ATOM 0 HB3 SER A 125 -9.610 4.356 14.975 1.00 0.00 H new ATOM 0 HG SER A 125 -10.450 6.511 14.788 1.00 0.00 H new ATOM 600 N SER A 126 -8.127 2.249 13.875 1.00 0.00 N ATOM 601 CA SER A 126 -8.069 0.855 13.466 1.00 0.00 C ATOM 602 C SER A 126 -9.254 0.502 12.567 1.00 0.00 C ATOM 603 O SER A 126 -9.098 -0.216 11.578 1.00 0.00 O ATOM 604 CB SER A 126 -8.013 -0.064 14.692 1.00 0.00 C ATOM 605 OG SER A 126 -9.066 0.214 15.598 1.00 0.00 O ATOM 0 H SER A 126 -8.260 2.396 14.876 1.00 0.00 H new ATOM 0 HA SER A 126 -7.157 0.704 12.889 1.00 0.00 H new ATOM 0 HB2 SER A 126 -8.073 -1.104 14.371 1.00 0.00 H new ATOM 0 HB3 SER A 126 -7.055 0.059 15.197 1.00 0.00 H new ATOM 0 HG SER A 126 -9.003 -0.390 16.368 1.00 0.00 H new ATOM 611 N GLU A 127 -10.430 1.041 12.894 1.00 0.00 N ATOM 612 CA GLU A 127 -11.630 0.779 12.108 1.00 0.00 C ATOM 613 C GLU A 127 -11.494 1.372 10.710 1.00 0.00 C ATOM 614 O GLU A 127 -11.982 0.799 9.739 1.00 0.00 O ATOM 615 CB GLU A 127 -12.877 1.338 12.795 1.00 0.00 C ATOM 616 CG GLU A 127 -14.170 0.923 12.110 1.00 0.00 C ATOM 617 CD GLU A 127 -15.404 1.339 12.880 1.00 0.00 C ATOM 618 OE1 GLU A 127 -15.553 0.907 14.041 1.00 0.00 O ATOM 619 OE2 GLU A 127 -16.237 2.088 12.325 1.00 0.00 O ATOM 0 H GLU A 127 -10.574 1.658 13.694 1.00 0.00 H new ATOM 0 HA GLU A 127 -11.742 -0.302 12.026 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -12.897 1.000 13.831 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -12.817 2.426 12.816 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -14.205 1.363 11.113 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -14.176 -0.159 11.981 1.00 0.00 H new ATOM 626 N ASP A 128 -10.820 2.516 10.615 1.00 0.00 N ATOM 627 CA ASP A 128 -10.544 3.136 9.320 1.00 0.00 C ATOM 628 C ASP A 128 -9.789 2.160 8.435 1.00 0.00 C ATOM 629 O ASP A 128 -10.173 1.909 7.291 1.00 0.00 O ATOM 630 CB ASP A 128 -9.715 4.419 9.472 1.00 0.00 C ATOM 631 CG ASP A 128 -10.464 5.541 10.163 1.00 0.00 C ATOM 632 OD1 ASP A 128 -11.655 5.746 9.858 1.00 0.00 O ATOM 633 OD2 ASP A 128 -9.858 6.234 11.002 1.00 0.00 O ATOM 0 H ASP A 128 -10.456 3.032 11.416 1.00 0.00 H new ATOM 0 HA ASP A 128 -11.501 3.396 8.867 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -8.811 4.194 10.037 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -9.398 4.757 8.485 1.00 0.00 H new ATOM 638 N LEU A 129 -8.722 1.600 8.987 1.00 0.00 N ATOM 639 CA LEU A 129 -7.910 0.620 8.281 1.00 0.00 C ATOM 640 C LEU A 129 -8.730 -0.616 7.945 1.00 0.00 C ATOM 641 O LEU A 129 -8.727 -1.079 6.806 1.00 0.00 O ATOM 642 CB LEU A 129 -6.704 0.233 9.138 1.00 0.00 C ATOM 643 CG LEU A 129 -5.714 1.366 9.394 1.00 0.00 C ATOM 644 CD1 LEU A 129 -4.679 0.958 10.428 1.00 0.00 C ATOM 645 CD2 LEU A 129 -5.032 1.769 8.098 1.00 0.00 C ATOM 0 H LEU A 129 -8.397 1.810 9.931 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.561 1.064 7.349 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -7.062 -0.142 10.097 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -6.178 -0.588 8.651 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.266 2.221 9.784 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -3.985 1.782 10.593 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -5.178 0.711 11.365 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -4.130 0.088 10.069 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -4.328 2.578 8.294 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -4.496 0.913 7.687 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -5.782 2.105 7.382 1.00 0.00 H new ATOM 657 N ASP A 130 -9.443 -1.129 8.939 1.00 0.00 N ATOM 658 CA ASP A 130 -10.265 -2.325 8.773 1.00 0.00 C ATOM 659 C ASP A 130 -11.276 -2.139 7.641 1.00 0.00 C ATOM 660 O ASP A 130 -11.422 -3.002 6.775 1.00 0.00 O ATOM 661 CB ASP A 130 -10.999 -2.641 10.080 1.00 0.00 C ATOM 662 CG ASP A 130 -11.687 -3.988 10.058 1.00 0.00 C ATOM 663 OD1 ASP A 130 -12.836 -4.075 9.568 1.00 0.00 O ATOM 664 OD2 ASP A 130 -11.089 -4.969 10.542 1.00 0.00 O ATOM 0 H ASP A 130 -9.470 -0.732 9.878 1.00 0.00 H new ATOM 0 HA ASP A 130 -9.610 -3.158 8.516 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -10.288 -2.615 10.906 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -11.739 -1.864 10.272 1.00 0.00 H new ATOM 669 N ALA A 131 -11.951 -0.996 7.651 1.00 0.00 N ATOM 670 CA ALA A 131 -12.953 -0.672 6.643 1.00 0.00 C ATOM 671 C ALA A 131 -12.326 -0.529 5.260 1.00 0.00 C ATOM 672 O ALA A 131 -12.784 -1.150 4.299 1.00 0.00 O ATOM 673 CB ALA A 131 -13.685 0.605 7.023 1.00 0.00 C ATOM 0 H ALA A 131 -11.820 -0.270 8.355 1.00 0.00 H new ATOM 0 HA ALA A 131 -13.667 -1.495 6.603 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -14.431 0.837 6.263 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -14.178 0.469 7.986 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -12.972 1.426 7.094 1.00 0.00 H new ATOM 679 N MET A 132 -11.274 0.276 5.160 1.00 0.00 N ATOM 680 CA MET A 132 -10.620 0.514 3.875 1.00 0.00 C ATOM 681 C MET A 132 -10.054 -0.778 3.295 1.00 0.00 C ATOM 682 O MET A 132 -10.207 -1.050 2.105 1.00 0.00 O ATOM 683 CB MET A 132 -9.511 1.562 4.013 1.00 0.00 C ATOM 684 CG MET A 132 -10.029 2.962 4.316 1.00 0.00 C ATOM 685 SD MET A 132 -8.720 4.209 4.369 1.00 0.00 S ATOM 686 CE MET A 132 -7.698 3.580 5.697 1.00 0.00 C ATOM 0 H MET A 132 -10.857 0.773 5.947 1.00 0.00 H new ATOM 0 HA MET A 132 -11.376 0.894 3.188 1.00 0.00 H new ATOM 0 HB2 MET A 132 -8.830 1.256 4.807 1.00 0.00 H new ATOM 0 HB3 MET A 132 -8.932 1.590 3.090 1.00 0.00 H new ATOM 0 HG2 MET A 132 -10.760 3.244 3.558 1.00 0.00 H new ATOM 0 HG3 MET A 132 -10.550 2.950 5.273 1.00 0.00 H new ATOM 0 HE1 MET A 132 -6.898 4.289 5.908 1.00 0.00 H new ATOM 0 HE2 MET A 132 -8.306 3.443 6.591 1.00 0.00 H new ATOM 0 HE3 MET A 132 -7.266 2.623 5.402 1.00 0.00 H new ATOM 696 N ILE A 133 -9.419 -1.586 4.140 1.00 0.00 N ATOM 697 CA ILE A 133 -8.863 -2.864 3.702 1.00 0.00 C ATOM 698 C ILE A 133 -9.976 -3.805 3.256 1.00 0.00 C ATOM 699 O ILE A 133 -9.808 -4.563 2.307 1.00 0.00 O ATOM 700 CB ILE A 133 -8.017 -3.536 4.812 1.00 0.00 C ATOM 701 CG1 ILE A 133 -6.780 -2.688 5.119 1.00 0.00 C ATOM 702 CG2 ILE A 133 -7.602 -4.948 4.409 1.00 0.00 C ATOM 703 CD1 ILE A 133 -5.872 -2.466 3.925 1.00 0.00 C ATOM 0 H ILE A 133 -9.277 -1.380 5.129 1.00 0.00 H new ATOM 0 HA ILE A 133 -8.205 -2.658 2.858 1.00 0.00 H new ATOM 0 HB ILE A 133 -8.631 -3.608 5.710 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -7.102 -1.720 5.502 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -6.209 -3.171 5.912 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.009 -5.395 5.207 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -8.492 -5.553 4.235 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -7.008 -4.906 3.496 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -5.019 -1.857 4.225 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -5.518 -3.428 3.553 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -6.425 -1.954 3.138 1.00 0.00 H new ATOM 715 N ASP A 134 -11.122 -3.730 3.919 1.00 0.00 N ATOM 716 CA ASP A 134 -12.263 -4.569 3.561 1.00 0.00 C ATOM 717 C ASP A 134 -12.744 -4.266 2.146 1.00 0.00 C ATOM 718 O ASP A 134 -13.215 -5.151 1.437 1.00 0.00 O ATOM 719 CB ASP A 134 -13.406 -4.373 4.557 1.00 0.00 C ATOM 720 CG ASP A 134 -14.638 -5.172 4.190 1.00 0.00 C ATOM 721 OD1 ASP A 134 -14.588 -6.419 4.256 1.00 0.00 O ATOM 722 OD2 ASP A 134 -15.671 -4.558 3.844 1.00 0.00 O ATOM 0 H ASP A 134 -11.288 -3.101 4.704 1.00 0.00 H new ATOM 0 HA ASP A 134 -11.938 -5.609 3.597 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -13.071 -4.665 5.552 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -13.664 -3.315 4.605 1.00 0.00 H new ATOM 727 N GLU A 135 -12.614 -3.010 1.741 1.00 0.00 N ATOM 728 CA GLU A 135 -13.025 -2.592 0.407 1.00 0.00 C ATOM 729 C GLU A 135 -12.024 -3.056 -0.646 1.00 0.00 C ATOM 730 O GLU A 135 -12.408 -3.491 -1.733 1.00 0.00 O ATOM 731 CB GLU A 135 -13.157 -1.070 0.344 1.00 0.00 C ATOM 732 CG GLU A 135 -14.196 -0.504 1.284 1.00 0.00 C ATOM 733 CD GLU A 135 -14.342 0.996 1.143 1.00 0.00 C ATOM 734 OE1 GLU A 135 -15.099 1.439 0.258 1.00 0.00 O ATOM 735 OE2 GLU A 135 -13.687 1.739 1.903 1.00 0.00 O ATOM 0 H GLU A 135 -12.227 -2.262 2.317 1.00 0.00 H new ATOM 0 HA GLU A 135 -13.992 -3.051 0.198 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -12.191 -0.622 0.575 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -13.408 -0.779 -0.676 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -15.157 -0.980 1.089 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -13.923 -0.745 2.311 1.00 0.00 H new ATOM 742 N ILE A 136 -10.746 -2.974 -0.308 1.00 0.00 N ATOM 743 CA ILE A 136 -9.677 -3.248 -1.260 1.00 0.00 C ATOM 744 C ILE A 136 -9.340 -4.733 -1.304 1.00 0.00 C ATOM 745 O ILE A 136 -9.322 -5.344 -2.375 1.00 0.00 O ATOM 746 CB ILE A 136 -8.391 -2.475 -0.891 1.00 0.00 C ATOM 747 CG1 ILE A 136 -8.676 -0.978 -0.743 1.00 0.00 C ATOM 748 CG2 ILE A 136 -7.309 -2.706 -1.941 1.00 0.00 C ATOM 749 CD1 ILE A 136 -7.544 -0.213 -0.089 1.00 0.00 C ATOM 0 H ILE A 136 -10.421 -2.718 0.624 1.00 0.00 H new ATOM 0 HA ILE A 136 -10.039 -2.924 -2.236 1.00 0.00 H new ATOM 0 HB ILE A 136 -8.034 -2.851 0.068 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -8.870 -0.553 -1.728 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -9.583 -0.845 -0.154 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -6.410 -2.154 -1.665 1.00 0.00 H new ATOM 0 HG22 ILE A 136 -7.078 -3.770 -1.998 1.00 0.00 H new ATOM 0 HG23 ILE A 136 -7.664 -2.359 -2.912 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -7.812 0.841 -0.015 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -7.364 -0.612 0.909 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -6.640 -0.316 -0.690 1.00 0.00 H new ATOM 761 N ASP A 137 -9.104 -5.300 -0.124 1.00 0.00 N ATOM 762 CA ASP A 137 -8.510 -6.622 0.000 1.00 0.00 C ATOM 763 C ASP A 137 -7.204 -6.673 -0.763 1.00 0.00 C ATOM 764 O ASP A 137 -6.255 -5.965 -0.424 1.00 0.00 O ATOM 765 CB ASP A 137 -9.458 -7.736 -0.452 1.00 0.00 C ATOM 766 CG ASP A 137 -10.552 -8.023 0.561 1.00 0.00 C ATOM 767 OD1 ASP A 137 -10.249 -8.600 1.631 1.00 0.00 O ATOM 768 OD2 ASP A 137 -11.722 -7.689 0.287 1.00 0.00 O ATOM 0 H ASP A 137 -9.319 -4.855 0.768 1.00 0.00 H new ATOM 0 HA ASP A 137 -8.313 -6.798 1.057 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -9.913 -7.457 -1.402 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -8.884 -8.646 -0.628 1.00 0.00 H new ATOM 773 N ALA A 138 -7.159 -7.479 -1.798 1.00 0.00 N ATOM 774 CA ALA A 138 -5.940 -7.624 -2.569 1.00 0.00 C ATOM 775 C ALA A 138 -6.188 -8.109 -3.997 1.00 0.00 C ATOM 776 O ALA A 138 -6.615 -7.344 -4.858 1.00 0.00 O ATOM 777 CB ALA A 138 -4.995 -8.560 -1.848 1.00 0.00 C ATOM 0 H ALA A 138 -7.944 -8.042 -2.126 1.00 0.00 H new ATOM 0 HA ALA A 138 -5.492 -6.634 -2.657 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -4.078 -8.669 -2.428 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -4.757 -8.151 -0.866 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -5.468 -9.535 -1.730 1.00 0.00 H new ATOM 783 N ASP A 139 -5.929 -9.392 -4.229 1.00 0.00 N ATOM 784 CA ASP A 139 -5.990 -9.972 -5.568 1.00 0.00 C ATOM 785 C ASP A 139 -6.214 -11.472 -5.481 1.00 0.00 C ATOM 786 O ASP A 139 -7.130 -12.009 -6.103 1.00 0.00 O ATOM 787 CB ASP A 139 -4.696 -9.676 -6.341 1.00 0.00 C ATOM 788 CG ASP A 139 -4.555 -10.507 -7.604 1.00 0.00 C ATOM 789 OD1 ASP A 139 -5.156 -10.146 -8.635 1.00 0.00 O ATOM 790 OD2 ASP A 139 -3.833 -11.525 -7.571 1.00 0.00 O ATOM 0 H ASP A 139 -5.672 -10.057 -3.499 1.00 0.00 H new ATOM 0 HA ASP A 139 -6.826 -9.521 -6.102 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -4.670 -8.619 -6.604 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -3.841 -9.864 -5.692 1.00 0.00 H new ATOM 795 N GLY A 140 -5.375 -12.144 -4.700 1.00 0.00 N ATOM 796 CA GLY A 140 -5.527 -13.569 -4.505 1.00 0.00 C ATOM 797 C GLY A 140 -5.879 -13.886 -3.073 1.00 0.00 C ATOM 798 O GLY A 140 -6.877 -13.386 -2.550 1.00 0.00 O ATOM 0 H GLY A 140 -4.592 -11.724 -4.199 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -6.305 -13.949 -5.167 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -4.602 -14.077 -4.776 1.00 0.00 H new ATOM 802 N SER A 141 -5.048 -14.681 -2.423 1.00 0.00 N ATOM 803 CA SER A 141 -5.249 -15.027 -1.024 1.00 0.00 C ATOM 804 C SER A 141 -4.743 -13.900 -0.120 1.00 0.00 C ATOM 805 O SER A 141 -3.938 -14.124 0.781 1.00 0.00 O ATOM 806 CB SER A 141 -4.516 -16.331 -0.706 1.00 0.00 C ATOM 807 OG SER A 141 -4.841 -17.339 -1.650 1.00 0.00 O ATOM 0 H SER A 141 -4.221 -15.103 -2.844 1.00 0.00 H new ATOM 0 HA SER A 141 -6.315 -15.163 -0.841 1.00 0.00 H new ATOM 0 HB2 SER A 141 -3.440 -16.158 -0.709 1.00 0.00 H new ATOM 0 HB3 SER A 141 -4.782 -16.667 0.296 1.00 0.00 H new ATOM 0 HG SER A 141 -4.359 -18.163 -1.428 1.00 0.00 H new ATOM 813 N GLY A 142 -5.207 -12.682 -0.377 1.00 0.00 N ATOM 814 CA GLY A 142 -4.759 -11.543 0.400 1.00 0.00 C ATOM 815 C GLY A 142 -3.416 -11.045 -0.084 1.00 0.00 C ATOM 816 O GLY A 142 -2.607 -10.537 0.691 1.00 0.00 O ATOM 0 H GLY A 142 -5.884 -12.464 -1.108 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -5.494 -10.741 0.331 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -4.689 -11.822 1.451 1.00 0.00 H new ATOM 820 N THR A 143 -3.190 -11.184 -1.377 1.00 0.00 N ATOM 821 CA THR A 143 -1.930 -10.820 -1.990 1.00 0.00 C ATOM 822 C THR A 143 -2.108 -9.613 -2.905 1.00 0.00 C ATOM 823 O THR A 143 -2.563 -9.750 -4.038 1.00 0.00 O ATOM 824 CB THR A 143 -1.386 -12.009 -2.796 1.00 0.00 C ATOM 825 OG1 THR A 143 -2.448 -12.584 -3.570 1.00 0.00 O ATOM 826 CG2 THR A 143 -0.802 -13.068 -1.876 1.00 0.00 C ATOM 0 H THR A 143 -3.879 -11.554 -2.032 1.00 0.00 H new ATOM 0 HA THR A 143 -1.221 -10.558 -1.205 1.00 0.00 H new ATOM 0 HB THR A 143 -0.595 -11.649 -3.454 1.00 0.00 H new ATOM 0 HG1 THR A 143 -2.103 -13.342 -4.087 1.00 0.00 H new ATOM 0 HG21 THR A 143 -0.424 -13.899 -2.472 1.00 0.00 H new ATOM 0 HG22 THR A 143 0.014 -12.636 -1.296 1.00 0.00 H new ATOM 0 HG23 THR A 143 -1.576 -13.429 -1.199 1.00 0.00 H new ATOM 834 N VAL A 144 -1.785 -8.431 -2.398 1.00 0.00 N ATOM 835 CA VAL A 144 -1.943 -7.207 -3.169 1.00 0.00 C ATOM 836 C VAL A 144 -0.865 -7.124 -4.235 1.00 0.00 C ATOM 837 O VAL A 144 0.315 -6.968 -3.918 1.00 0.00 O ATOM 838 CB VAL A 144 -1.860 -5.944 -2.286 1.00 0.00 C ATOM 839 CG1 VAL A 144 -2.154 -4.700 -3.111 1.00 0.00 C ATOM 840 CG2 VAL A 144 -2.807 -6.041 -1.099 1.00 0.00 C ATOM 0 H VAL A 144 -1.413 -8.295 -1.458 1.00 0.00 H new ATOM 0 HA VAL A 144 -2.933 -7.243 -3.623 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.845 -5.869 -1.896 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -2.092 -3.818 -2.474 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -1.425 -4.618 -3.917 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -3.156 -4.772 -3.534 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -2.727 -5.137 -0.495 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -3.831 -6.148 -1.458 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -2.543 -6.907 -0.493 1.00 0.00 H new ATOM 850 N ASP A 145 -1.268 -7.224 -5.490 1.00 0.00 N ATOM 851 CA ASP A 145 -0.312 -7.253 -6.584 1.00 0.00 C ATOM 852 C ASP A 145 0.193 -5.848 -6.908 1.00 0.00 C ATOM 853 O ASP A 145 -0.352 -4.858 -6.410 1.00 0.00 O ATOM 854 CB ASP A 145 -0.928 -7.897 -7.830 1.00 0.00 C ATOM 855 CG ASP A 145 -1.433 -6.887 -8.844 1.00 0.00 C ATOM 856 OD1 ASP A 145 -2.465 -6.236 -8.588 1.00 0.00 O ATOM 857 OD2 ASP A 145 -0.796 -6.755 -9.910 1.00 0.00 O ATOM 0 H ASP A 145 -2.245 -7.286 -5.776 1.00 0.00 H new ATOM 0 HA ASP A 145 0.538 -7.858 -6.267 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -0.184 -8.536 -8.305 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -1.754 -8.540 -7.527 1.00 0.00 H new ATOM 862 N PHE A 146 1.222 -5.766 -7.739 1.00 0.00 N ATOM 863 CA PHE A 146 1.831 -4.488 -8.083 1.00 0.00 C ATOM 864 C PHE A 146 0.826 -3.535 -8.723 1.00 0.00 C ATOM 865 O PHE A 146 0.815 -2.345 -8.410 1.00 0.00 O ATOM 866 CB PHE A 146 3.020 -4.700 -9.025 1.00 0.00 C ATOM 867 CG PHE A 146 3.694 -3.422 -9.438 1.00 0.00 C ATOM 868 CD1 PHE A 146 4.450 -2.701 -8.529 1.00 0.00 C ATOM 869 CD2 PHE A 146 3.574 -2.945 -10.734 1.00 0.00 C ATOM 870 CE1 PHE A 146 5.074 -1.528 -8.903 1.00 0.00 C ATOM 871 CE2 PHE A 146 4.196 -1.770 -11.114 1.00 0.00 C ATOM 872 CZ PHE A 146 4.948 -1.061 -10.197 1.00 0.00 C ATOM 0 H PHE A 146 1.655 -6.572 -8.189 1.00 0.00 H new ATOM 0 HA PHE A 146 2.180 -4.034 -7.156 1.00 0.00 H new ATOM 0 HB2 PHE A 146 3.750 -5.345 -8.536 1.00 0.00 H new ATOM 0 HB3 PHE A 146 2.678 -5.225 -9.917 1.00 0.00 H new ATOM 0 HD1 PHE A 146 4.553 -3.061 -7.516 1.00 0.00 H new ATOM 0 HD2 PHE A 146 2.989 -3.497 -11.454 1.00 0.00 H new ATOM 0 HE1 PHE A 146 5.661 -0.975 -8.184 1.00 0.00 H new ATOM 0 HE2 PHE A 146 4.094 -1.407 -12.126 1.00 0.00 H new ATOM 0 HZ PHE A 146 5.436 -0.144 -10.491 1.00 0.00 H new ATOM 882 N GLU A 147 -0.031 -4.056 -9.594 1.00 0.00 N ATOM 883 CA GLU A 147 -0.943 -3.211 -10.355 1.00 0.00 C ATOM 884 C GLU A 147 -1.951 -2.530 -9.438 1.00 0.00 C ATOM 885 O GLU A 147 -2.145 -1.315 -9.521 1.00 0.00 O ATOM 886 CB GLU A 147 -1.660 -4.021 -11.434 1.00 0.00 C ATOM 887 CG GLU A 147 -2.410 -3.156 -12.431 1.00 0.00 C ATOM 888 CD GLU A 147 -2.934 -3.945 -13.609 1.00 0.00 C ATOM 889 OE1 GLU A 147 -2.115 -4.513 -14.361 1.00 0.00 O ATOM 890 OE2 GLU A 147 -4.164 -3.991 -13.804 1.00 0.00 O ATOM 0 H GLU A 147 -0.113 -5.054 -9.790 1.00 0.00 H new ATOM 0 HA GLU A 147 -0.352 -2.436 -10.843 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -0.930 -4.630 -11.968 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -2.361 -4.707 -10.959 1.00 0.00 H new ATOM 0 HG2 GLU A 147 -3.243 -2.667 -11.927 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -1.749 -2.368 -12.792 1.00 0.00 H new ATOM 897 N GLU A 148 -2.581 -3.303 -8.558 1.00 0.00 N ATOM 898 CA GLU A 148 -3.498 -2.733 -7.579 1.00 0.00 C ATOM 899 C GLU A 148 -2.759 -1.787 -6.638 1.00 0.00 C ATOM 900 O GLU A 148 -3.236 -0.689 -6.356 1.00 0.00 O ATOM 901 CB GLU A 148 -4.208 -3.827 -6.782 1.00 0.00 C ATOM 902 CG GLU A 148 -5.393 -4.436 -7.511 1.00 0.00 C ATOM 903 CD GLU A 148 -6.421 -3.393 -7.915 1.00 0.00 C ATOM 904 OE1 GLU A 148 -6.732 -2.508 -7.088 1.00 0.00 O ATOM 905 OE2 GLU A 148 -6.918 -3.447 -9.060 1.00 0.00 O ATOM 0 H GLU A 148 -2.474 -4.316 -8.503 1.00 0.00 H new ATOM 0 HA GLU A 148 -4.254 -2.166 -8.122 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -3.493 -4.615 -6.545 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -4.549 -3.411 -5.834 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -5.040 -4.958 -8.400 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -5.867 -5.181 -6.871 1.00 0.00 H new ATOM 912 N PHE A 149 -1.585 -2.213 -6.177 1.00 0.00 N ATOM 913 CA PHE A 149 -0.731 -1.382 -5.326 1.00 0.00 C ATOM 914 C PHE A 149 -0.456 -0.032 -5.986 1.00 0.00 C ATOM 915 O PHE A 149 -0.625 1.023 -5.372 1.00 0.00 O ATOM 916 CB PHE A 149 0.590 -2.121 -5.046 1.00 0.00 C ATOM 917 CG PHE A 149 1.698 -1.254 -4.511 1.00 0.00 C ATOM 918 CD1 PHE A 149 1.767 -0.936 -3.165 1.00 0.00 C ATOM 919 CD2 PHE A 149 2.679 -0.764 -5.362 1.00 0.00 C ATOM 920 CE1 PHE A 149 2.793 -0.144 -2.679 1.00 0.00 C ATOM 921 CE2 PHE A 149 3.704 0.027 -4.881 1.00 0.00 C ATOM 922 CZ PHE A 149 3.761 0.340 -3.539 1.00 0.00 C ATOM 0 H PHE A 149 -1.200 -3.136 -6.380 1.00 0.00 H new ATOM 0 HA PHE A 149 -1.247 -1.196 -4.384 1.00 0.00 H new ATOM 0 HB2 PHE A 149 0.398 -2.922 -4.332 1.00 0.00 H new ATOM 0 HB3 PHE A 149 0.929 -2.591 -5.969 1.00 0.00 H new ATOM 0 HD1 PHE A 149 1.013 -1.310 -2.488 1.00 0.00 H new ATOM 0 HD2 PHE A 149 2.640 -1.004 -6.414 1.00 0.00 H new ATOM 0 HE1 PHE A 149 2.837 0.096 -1.627 1.00 0.00 H new ATOM 0 HE2 PHE A 149 4.460 0.400 -5.555 1.00 0.00 H new ATOM 0 HZ PHE A 149 4.559 0.961 -3.161 1.00 0.00 H new ATOM 932 N MET A 150 -0.057 -0.082 -7.248 1.00 0.00 N ATOM 933 CA MET A 150 0.293 1.109 -8.008 1.00 0.00 C ATOM 934 C MET A 150 -0.906 2.041 -8.161 1.00 0.00 C ATOM 935 O MET A 150 -0.749 3.255 -8.272 1.00 0.00 O ATOM 936 CB MET A 150 0.821 0.695 -9.385 1.00 0.00 C ATOM 937 CG MET A 150 1.319 1.848 -10.235 1.00 0.00 C ATOM 938 SD MET A 150 1.907 1.301 -11.847 1.00 0.00 S ATOM 939 CE MET A 150 2.454 2.851 -12.554 1.00 0.00 C ATOM 0 H MET A 150 0.033 -0.951 -7.775 1.00 0.00 H new ATOM 0 HA MET A 150 1.067 1.652 -7.466 1.00 0.00 H new ATOM 0 HB2 MET A 150 1.634 -0.019 -9.250 1.00 0.00 H new ATOM 0 HB3 MET A 150 0.028 0.177 -9.925 1.00 0.00 H new ATOM 0 HG2 MET A 150 0.515 2.571 -10.370 1.00 0.00 H new ATOM 0 HG3 MET A 150 2.125 2.362 -9.711 1.00 0.00 H new ATOM 0 HE1 MET A 150 2.846 2.676 -13.556 1.00 0.00 H new ATOM 0 HE2 MET A 150 1.613 3.543 -12.609 1.00 0.00 H new ATOM 0 HE3 MET A 150 3.236 3.280 -11.928 1.00 0.00 H new ATOM 949 N GLY A 151 -2.100 1.470 -8.159 1.00 0.00 N ATOM 950 CA GLY A 151 -3.300 2.264 -8.323 1.00 0.00 C ATOM 951 C GLY A 151 -3.848 2.791 -7.012 1.00 0.00 C ATOM 952 O GLY A 151 -4.124 3.984 -6.884 1.00 0.00 O ATOM 0 H GLY A 151 -2.260 0.469 -8.047 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -3.085 3.104 -8.984 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -4.064 1.660 -8.813 1.00 0.00 H new ATOM 956 N VAL A 152 -3.987 1.910 -6.029 1.00 0.00 N ATOM 957 CA VAL A 152 -4.608 2.271 -4.762 1.00 0.00 C ATOM 958 C VAL A 152 -3.726 3.228 -3.956 1.00 0.00 C ATOM 959 O VAL A 152 -4.222 4.036 -3.171 1.00 0.00 O ATOM 960 CB VAL A 152 -4.955 1.018 -3.915 1.00 0.00 C ATOM 961 CG1 VAL A 152 -3.707 0.277 -3.459 1.00 0.00 C ATOM 962 CG2 VAL A 152 -5.807 1.396 -2.719 1.00 0.00 C ATOM 0 H VAL A 152 -3.678 0.940 -6.086 1.00 0.00 H new ATOM 0 HA VAL A 152 -5.538 2.785 -5.004 1.00 0.00 H new ATOM 0 HB VAL A 152 -5.524 0.345 -4.556 1.00 0.00 H new ATOM 0 HG11 VAL A 152 -3.996 -0.593 -2.869 1.00 0.00 H new ATOM 0 HG12 VAL A 152 -3.138 -0.048 -4.330 1.00 0.00 H new ATOM 0 HG13 VAL A 152 -3.092 0.940 -2.850 1.00 0.00 H new ATOM 0 HG21 VAL A 152 -6.038 0.502 -2.140 1.00 0.00 H new ATOM 0 HG22 VAL A 152 -5.262 2.103 -2.093 1.00 0.00 H new ATOM 0 HG23 VAL A 152 -6.734 1.855 -3.063 1.00 0.00 H new ATOM 972 N MET A 153 -2.420 3.160 -4.162 1.00 0.00 N ATOM 973 CA MET A 153 -1.506 4.036 -3.450 1.00 0.00 C ATOM 974 C MET A 153 -0.995 5.150 -4.353 1.00 0.00 C ATOM 975 O MET A 153 0.173 5.170 -4.738 1.00 0.00 O ATOM 976 CB MET A 153 -0.338 3.242 -2.860 1.00 0.00 C ATOM 977 CG MET A 153 -0.741 2.405 -1.654 1.00 0.00 C ATOM 978 SD MET A 153 0.651 1.558 -0.881 1.00 0.00 S ATOM 979 CE MET A 153 1.683 2.949 -0.418 1.00 0.00 C ATOM 0 H MET A 153 -1.973 2.513 -4.811 1.00 0.00 H new ATOM 0 HA MET A 153 -2.058 4.495 -2.630 1.00 0.00 H new ATOM 0 HB2 MET A 153 0.075 2.588 -3.628 1.00 0.00 H new ATOM 0 HB3 MET A 153 0.454 3.932 -2.569 1.00 0.00 H new ATOM 0 HG2 MET A 153 -1.221 3.049 -0.917 1.00 0.00 H new ATOM 0 HG3 MET A 153 -1.481 1.667 -1.963 1.00 0.00 H new ATOM 0 HE1 MET A 153 2.405 2.632 0.335 1.00 0.00 H new ATOM 0 HE2 MET A 153 2.213 3.317 -1.296 1.00 0.00 H new ATOM 0 HE3 MET A 153 1.060 3.745 -0.010 1.00 0.00 H new ATOM 989 N THR A 154 -1.887 6.066 -4.705 1.00 0.00 N ATOM 990 CA THR A 154 -1.512 7.252 -5.462 1.00 0.00 C ATOM 991 C THR A 154 -2.234 8.486 -4.933 1.00 0.00 C ATOM 992 O THR A 154 -1.607 9.506 -4.639 1.00 0.00 O ATOM 993 CB THR A 154 -1.805 7.094 -6.966 1.00 0.00 C ATOM 994 OG1 THR A 154 -3.091 6.491 -7.153 1.00 0.00 O ATOM 995 CG2 THR A 154 -0.731 6.257 -7.643 1.00 0.00 C ATOM 0 H THR A 154 -2.880 6.010 -4.477 1.00 0.00 H new ATOM 0 HA THR A 154 -0.437 7.378 -5.334 1.00 0.00 H new ATOM 0 HB THR A 154 -1.804 8.084 -7.422 1.00 0.00 H new ATOM 0 HG1 THR A 154 -3.034 5.532 -6.959 1.00 0.00 H new ATOM 0 HG21 THR A 154 -0.960 6.160 -8.704 1.00 0.00 H new ATOM 0 HG22 THR A 154 0.238 6.743 -7.524 1.00 0.00 H new ATOM 0 HG23 THR A 154 -0.699 5.268 -7.187 1.00 0.00 H new ATOM 1003 N GLY A 155 -3.555 8.383 -4.803 1.00 0.00 N ATOM 1004 CA GLY A 155 -4.342 9.494 -4.313 1.00 0.00 C ATOM 1005 C GLY A 155 -4.382 10.634 -5.308 1.00 0.00 C ATOM 1006 O GLY A 155 -4.809 10.455 -6.447 1.00 0.00 O ATOM 0 H GLY A 155 -4.092 7.546 -5.030 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -5.357 9.157 -4.105 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -3.924 9.848 -3.371 1.00 0.00 H new ATOM 1010 N GLY A 156 -3.920 11.797 -4.884 1.00 0.00 N ATOM 1011 CA GLY A 156 -3.871 12.941 -5.767 1.00 0.00 C ATOM 1012 C GLY A 156 -2.489 13.553 -5.823 1.00 0.00 C ATOM 1013 O GLY A 156 -2.317 14.674 -6.307 1.00 0.00 O ATOM 0 H GLY A 156 -3.576 11.970 -3.939 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -4.175 12.639 -6.769 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.586 13.691 -5.429 1.00 0.00 H new ATOM 1017 N ASP A 157 -1.502 12.816 -5.325 1.00 0.00 N ATOM 1018 CA ASP A 157 -0.119 13.279 -5.335 1.00 0.00 C ATOM 1019 C ASP A 157 0.465 13.146 -6.731 1.00 0.00 C ATOM 1020 O ASP A 157 0.325 12.095 -7.363 1.00 0.00 O ATOM 1021 CB ASP A 157 0.736 12.484 -4.340 1.00 0.00 C ATOM 1022 CG ASP A 157 0.321 12.700 -2.900 1.00 0.00 C ATOM 1023 OD1 ASP A 157 0.733 13.716 -2.301 1.00 0.00 O ATOM 1024 OD2 ASP A 157 -0.416 11.849 -2.356 1.00 0.00 O ATOM 0 H ASP A 157 -1.634 11.894 -4.909 1.00 0.00 H new ATOM 0 HA ASP A 157 -0.112 14.327 -5.036 1.00 0.00 H new ATOM 0 HB2 ASP A 157 0.667 11.422 -4.577 1.00 0.00 H new ATOM 0 HB3 ASP A 157 1.781 12.770 -4.458 1.00 0.00 H new ATOM 1029 N GLU A 158 1.109 14.216 -7.197 1.00 0.00 N ATOM 1030 CA GLU A 158 1.685 14.273 -8.539 1.00 0.00 C ATOM 1031 C GLU A 158 0.579 14.200 -9.590 1.00 0.00 C ATOM 1032 O GLU A 158 0.011 15.264 -9.921 1.00 0.00 O ATOM 1033 CB GLU A 158 2.711 13.151 -8.749 1.00 0.00 C ATOM 1034 CG GLU A 158 3.541 13.307 -10.015 1.00 0.00 C ATOM 1035 CD GLU A 158 4.488 14.489 -9.946 1.00 0.00 C ATOM 1036 OE1 GLU A 158 4.076 15.615 -10.285 1.00 0.00 O ATOM 1037 OE2 GLU A 158 5.658 14.292 -9.558 1.00 0.00 O ATOM 1038 OXT GLU A 158 0.263 13.089 -10.063 1.00 0.00 O ATOM 0 H GLU A 158 1.246 15.068 -6.653 1.00 0.00 H new ATOM 0 HA GLU A 158 2.208 15.223 -8.647 1.00 0.00 H new ATOM 0 HB2 GLU A 158 3.380 13.117 -7.889 1.00 0.00 H new ATOM 0 HB3 GLU A 158 2.188 12.195 -8.784 1.00 0.00 H new ATOM 0 HG2 GLU A 158 4.114 12.396 -10.184 1.00 0.00 H new ATOM 0 HG3 GLU A 158 2.875 13.428 -10.870 1.00 0.00 H new TER 1045 GLU A 158