USER MOD reduce.3.24.130724 H: found=0, std=0, add=372, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 374 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 230 TYR OH : rot 177:sc= -4.04! USER MOD Set 1.2: A 246 CYS SG : rot 116:sc= -0.735! USER MOD Set 2.1: A 184 ASN : amide:sc= -0.0688 K(o=-16,f=-17) USER MOD Set 2.2: A 185 HIS : no HD1:sc= -9.32! C(o=-16!,f=-32!) USER MOD Set 2.3: A 245 TYR OH : rot 28:sc= -6.43! USER MOD Single : A 210 ASN : amide:sc= -0.0979 X(o=-0.098,f=0) USER MOD Single : A 211 TYR OH : rot 180:sc= 0 USER MOD Single : A 216 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 225 ASN : amide:sc= -1.8 K(o=-1.8,f=-0.16) USER MOD Single : A 226 THR OG1 : rot -81:sc= -0.74! USER MOD Single : A 229 THR OG1 : rot 180:sc= 0 USER MOD Single : A 232 SER OG : rot 180:sc= 0 USER MOD Single : A 235 GLN : amide:sc= -0.0279 X(o=-0.028,f=0) USER MOD Single : A 240 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 ASN : amide:sc= -0.475 X(o=-0.48,f=-0.12) USER MOD Single : A 247 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 248 GLN : amide:sc= -0.282 X(o=-0.28,f=0) USER MOD ----------------------------------------------------------------- ATOM 105 N ILE A 179 5.903 -1.207 -4.046 1.00 0.00 N ATOM 106 CA ILE A 179 5.290 -2.230 -3.151 1.00 0.00 C ATOM 107 C ILE A 179 6.007 -3.576 -3.320 1.00 0.00 C ATOM 108 O ILE A 179 6.081 -4.114 -4.405 1.00 0.00 O ATOM 109 CB ILE A 179 3.813 -2.303 -3.594 1.00 0.00 C ATOM 110 CG1 ILE A 179 2.916 -2.253 -2.362 1.00 0.00 C ATOM 111 CG2 ILE A 179 3.514 -3.600 -4.360 1.00 0.00 C ATOM 112 CD1 ILE A 179 1.451 -2.319 -2.799 1.00 0.00 C ATOM 0 HA ILE A 179 5.373 -1.977 -2.094 1.00 0.00 H new ATOM 0 HB ILE A 179 3.621 -1.457 -4.254 1.00 0.00 H new ATOM 0 HG12 ILE A 179 3.147 -3.085 -1.696 1.00 0.00 H new ATOM 0 HG13 ILE A 179 3.099 -1.336 -1.802 1.00 0.00 H new ATOM 0 HG21 ILE A 179 2.465 -3.615 -4.655 1.00 0.00 H new ATOM 0 HG22 ILE A 179 4.142 -3.650 -5.250 1.00 0.00 H new ATOM 0 HG23 ILE A 179 3.723 -4.457 -3.720 1.00 0.00 H new ATOM 0 HD11 ILE A 179 0.807 -2.283 -1.920 1.00 0.00 H new ATOM 0 HD12 ILE A 179 1.226 -1.472 -3.448 1.00 0.00 H new ATOM 0 HD13 ILE A 179 1.274 -3.248 -3.341 1.00 0.00 H new ATOM 124 N ASP A 180 6.527 -4.130 -2.258 1.00 0.00 N ATOM 125 CA ASP A 180 7.220 -5.439 -2.383 1.00 0.00 C ATOM 126 C ASP A 180 6.209 -6.573 -2.244 1.00 0.00 C ATOM 127 O ASP A 180 6.193 -7.500 -3.028 1.00 0.00 O ATOM 128 CB ASP A 180 8.233 -5.479 -1.239 1.00 0.00 C ATOM 129 CG ASP A 180 9.445 -6.311 -1.662 1.00 0.00 C ATOM 130 OD1 ASP A 180 9.242 -7.343 -2.281 1.00 0.00 O ATOM 131 OD2 ASP A 180 10.554 -5.903 -1.361 1.00 0.00 O ATOM 0 H ASP A 180 6.501 -3.735 -1.318 1.00 0.00 H new ATOM 0 HA ASP A 180 7.708 -5.555 -3.350 1.00 0.00 H new ATOM 0 HB2 ASP A 180 8.545 -4.467 -0.980 1.00 0.00 H new ATOM 0 HB3 ASP A 180 7.775 -5.910 -0.348 1.00 0.00 H new ATOM 136 N ILE A 181 5.365 -6.508 -1.251 1.00 0.00 N ATOM 137 CA ILE A 181 4.366 -7.595 -1.068 1.00 0.00 C ATOM 138 C ILE A 181 3.180 -7.121 -0.220 1.00 0.00 C ATOM 139 O ILE A 181 3.342 -6.462 0.788 1.00 0.00 O ATOM 140 CB ILE A 181 5.133 -8.683 -0.321 1.00 0.00 C ATOM 141 CG1 ILE A 181 6.075 -9.415 -1.279 1.00 0.00 C ATOM 142 CG2 ILE A 181 4.150 -9.687 0.287 1.00 0.00 C ATOM 143 CD1 ILE A 181 6.635 -10.656 -0.584 1.00 0.00 C ATOM 0 H ILE A 181 5.325 -5.755 -0.564 1.00 0.00 H new ATOM 0 HA ILE A 181 3.952 -7.933 -2.018 1.00 0.00 H new ATOM 0 HB ILE A 181 5.717 -8.217 0.473 1.00 0.00 H new ATOM 0 HG12 ILE A 181 5.541 -9.701 -2.185 1.00 0.00 H new ATOM 0 HG13 ILE A 181 6.888 -8.756 -1.583 1.00 0.00 H new ATOM 0 HG21 ILE A 181 4.703 -10.461 0.819 1.00 0.00 H new ATOM 0 HG22 ILE A 181 3.487 -9.172 0.982 1.00 0.00 H new ATOM 0 HG23 ILE A 181 3.559 -10.144 -0.507 1.00 0.00 H new ATOM 0 HD11 ILE A 181 7.307 -11.181 -1.263 1.00 0.00 H new ATOM 0 HD12 ILE A 181 7.183 -10.357 0.309 1.00 0.00 H new ATOM 0 HD13 ILE A 181 5.815 -11.316 -0.302 1.00 0.00 H new ATOM 155 N VAL A 182 1.992 -7.485 -0.608 1.00 0.00 N ATOM 156 CA VAL A 182 0.792 -7.102 0.184 1.00 0.00 C ATOM 157 C VAL A 182 0.581 -8.153 1.277 1.00 0.00 C ATOM 158 O VAL A 182 -0.043 -9.173 1.063 1.00 0.00 O ATOM 159 CB VAL A 182 -0.358 -7.101 -0.822 1.00 0.00 C ATOM 160 CG1 VAL A 182 -1.581 -6.426 -0.202 1.00 0.00 C ATOM 161 CG2 VAL A 182 0.073 -6.330 -2.071 1.00 0.00 C ATOM 0 H VAL A 182 1.799 -8.035 -1.445 1.00 0.00 H new ATOM 0 HA VAL A 182 0.878 -6.132 0.674 1.00 0.00 H new ATOM 0 HB VAL A 182 -0.612 -8.126 -1.091 1.00 0.00 H new ATOM 0 HG11 VAL A 182 -2.400 -6.426 -0.921 1.00 0.00 H new ATOM 0 HG12 VAL A 182 -1.883 -6.971 0.692 1.00 0.00 H new ATOM 0 HG13 VAL A 182 -1.333 -5.399 0.065 1.00 0.00 H new ATOM 0 HG21 VAL A 182 -0.742 -6.324 -2.795 1.00 0.00 H new ATOM 0 HG22 VAL A 182 0.323 -5.305 -1.798 1.00 0.00 H new ATOM 0 HG23 VAL A 182 0.946 -6.811 -2.512 1.00 0.00 H new ATOM 171 N ILE A 183 1.133 -7.923 2.436 1.00 0.00 N ATOM 172 CA ILE A 183 1.011 -8.916 3.543 1.00 0.00 C ATOM 173 C ILE A 183 -0.452 -9.243 3.850 1.00 0.00 C ATOM 174 O ILE A 183 -0.794 -10.373 4.136 1.00 0.00 O ATOM 175 CB ILE A 183 1.671 -8.238 4.743 1.00 0.00 C ATOM 176 CG1 ILE A 183 3.134 -7.931 4.415 1.00 0.00 C ATOM 177 CG2 ILE A 183 1.612 -9.169 5.954 1.00 0.00 C ATOM 178 CD1 ILE A 183 3.833 -9.214 3.960 1.00 0.00 C ATOM 0 H ILE A 183 1.667 -7.085 2.666 1.00 0.00 H new ATOM 0 HA ILE A 183 1.480 -9.865 3.284 1.00 0.00 H new ATOM 0 HB ILE A 183 1.143 -7.311 4.968 1.00 0.00 H new ATOM 0 HG12 ILE A 183 3.192 -7.175 3.632 1.00 0.00 H new ATOM 0 HG13 ILE A 183 3.636 -7.521 5.291 1.00 0.00 H new ATOM 0 HG21 ILE A 183 2.083 -8.684 6.809 1.00 0.00 H new ATOM 0 HG22 ILE A 183 0.572 -9.392 6.191 1.00 0.00 H new ATOM 0 HG23 ILE A 183 2.139 -10.096 5.727 1.00 0.00 H new ATOM 0 HD11 ILE A 183 4.875 -8.997 3.726 1.00 0.00 H new ATOM 0 HD12 ILE A 183 3.787 -9.956 4.757 1.00 0.00 H new ATOM 0 HD13 ILE A 183 3.335 -9.604 3.072 1.00 0.00 H new ATOM 190 N ASN A 184 -1.316 -8.272 3.803 1.00 0.00 N ATOM 191 CA ASN A 184 -2.749 -8.542 4.104 1.00 0.00 C ATOM 192 C ASN A 184 -3.568 -7.260 3.946 1.00 0.00 C ATOM 193 O ASN A 184 -3.090 -6.270 3.429 1.00 0.00 O ATOM 194 CB ASN A 184 -2.769 -9.016 5.558 1.00 0.00 C ATOM 195 CG ASN A 184 -3.631 -10.274 5.674 1.00 0.00 C ATOM 196 OD1 ASN A 184 -4.629 -10.404 4.994 1.00 0.00 O ATOM 197 ND2 ASN A 184 -3.285 -11.212 6.512 1.00 0.00 N ATOM 0 H ASN A 184 -1.094 -7.304 3.570 1.00 0.00 H new ATOM 0 HA ASN A 184 -3.181 -9.282 3.431 1.00 0.00 H new ATOM 0 HB2 ASN A 184 -1.754 -9.225 5.897 1.00 0.00 H new ATOM 0 HB3 ASN A 184 -3.165 -8.231 6.202 1.00 0.00 H new ATOM 0 HD21 ASN A 184 -3.853 -12.055 6.596 1.00 0.00 H new ATOM 0 HD22 ASN A 184 -2.447 -11.102 7.083 1.00 0.00 H new ATOM 204 N HIS A 185 -4.798 -7.268 4.384 1.00 0.00 N ATOM 205 CA HIS A 185 -5.630 -6.041 4.251 1.00 0.00 C ATOM 206 C HIS A 185 -6.878 -6.131 5.139 1.00 0.00 C ATOM 207 O HIS A 185 -7.202 -7.173 5.673 1.00 0.00 O ATOM 208 CB HIS A 185 -6.021 -5.991 2.767 1.00 0.00 C ATOM 209 CG HIS A 185 -7.224 -6.868 2.515 1.00 0.00 C ATOM 210 ND1 HIS A 185 -7.115 -8.229 2.274 1.00 0.00 N ATOM 211 CD2 HIS A 185 -8.566 -6.588 2.467 1.00 0.00 C ATOM 212 CE1 HIS A 185 -8.358 -8.710 2.093 1.00 0.00 C ATOM 213 NE2 HIS A 185 -9.280 -7.752 2.199 1.00 0.00 N ATOM 0 H HIS A 185 -5.258 -8.065 4.824 1.00 0.00 H new ATOM 0 HA HIS A 185 -5.094 -5.145 4.565 1.00 0.00 H new ATOM 0 HB2 HIS A 185 -6.243 -4.964 2.476 1.00 0.00 H new ATOM 0 HB3 HIS A 185 -5.185 -6.323 2.152 1.00 0.00 H new ATOM 0 HD2 HIS A 185 -9.003 -5.611 2.615 1.00 0.00 H new ATOM 0 HE1 HIS A 185 -8.582 -9.746 1.887 1.00 0.00 H new ATOM 0 HE2 HIS A 185 -10.291 -7.851 2.104 1.00 0.00 H new ATOM 221 N ARG A 186 -7.584 -5.043 5.280 1.00 0.00 N ATOM 222 CA ARG A 186 -8.822 -5.042 6.112 1.00 0.00 C ATOM 223 C ARG A 186 -9.379 -3.619 6.200 1.00 0.00 C ATOM 224 O ARG A 186 -8.720 -2.664 5.838 1.00 0.00 O ATOM 225 CB ARG A 186 -8.395 -5.540 7.494 1.00 0.00 C ATOM 226 CG ARG A 186 -7.182 -4.747 7.980 1.00 0.00 C ATOM 227 CD ARG A 186 -7.459 -4.206 9.383 1.00 0.00 C ATOM 228 NE ARG A 186 -6.219 -3.475 9.767 1.00 0.00 N ATOM 229 CZ ARG A 186 -6.168 -2.823 10.896 1.00 0.00 C ATOM 230 NH1 ARG A 186 -6.828 -3.262 11.934 1.00 0.00 N ATOM 231 NH2 ARG A 186 -5.459 -1.732 10.987 1.00 0.00 N ATOM 0 H ARG A 186 -7.355 -4.147 4.851 1.00 0.00 H new ATOM 0 HA ARG A 186 -9.603 -5.674 5.690 1.00 0.00 H new ATOM 0 HB2 ARG A 186 -9.218 -5.431 8.200 1.00 0.00 H new ATOM 0 HB3 ARG A 186 -8.152 -6.602 7.449 1.00 0.00 H new ATOM 0 HG2 ARG A 186 -6.298 -5.384 7.992 1.00 0.00 H new ATOM 0 HG3 ARG A 186 -6.973 -3.925 7.296 1.00 0.00 H new ATOM 0 HD2 ARG A 186 -8.325 -3.544 9.387 1.00 0.00 H new ATOM 0 HD3 ARG A 186 -7.673 -5.014 10.082 1.00 0.00 H new ATOM 0 HE ARG A 186 -5.409 -3.484 9.147 1.00 0.00 H new ATOM 0 HH11 ARG A 186 -7.383 -4.115 11.862 1.00 0.00 H new ATOM 0 HH12 ARG A 186 -6.788 -2.752 12.817 1.00 0.00 H new ATOM 0 HH21 ARG A 186 -4.945 -1.389 10.176 1.00 0.00 H new ATOM 0 HH22 ARG A 186 -5.419 -1.222 11.869 1.00 0.00 H new ATOM 612 N ASN A 210 -13.365 1.398 0.503 1.00 0.00 N ATOM 613 CA ASN A 210 -13.307 1.392 1.995 1.00 0.00 C ATOM 614 C ASN A 210 -12.460 0.219 2.496 1.00 0.00 C ATOM 615 O ASN A 210 -12.965 -0.705 3.102 1.00 0.00 O ATOM 616 CB ASN A 210 -14.760 1.232 2.445 1.00 0.00 C ATOM 617 CG ASN A 210 -15.411 2.609 2.578 1.00 0.00 C ATOM 618 OD1 ASN A 210 -16.395 2.895 1.923 1.00 0.00 O ATOM 619 ND2 ASN A 210 -14.899 3.482 3.402 1.00 0.00 N ATOM 0 HA ASN A 210 -12.851 2.299 2.391 1.00 0.00 H new ATOM 0 HB2 ASN A 210 -15.310 0.627 1.724 1.00 0.00 H new ATOM 0 HB3 ASN A 210 -14.800 0.706 3.399 1.00 0.00 H new ATOM 0 HD21 ASN A 210 -15.324 4.404 3.497 1.00 0.00 H new ATOM 0 HD22 ASN A 210 -14.074 3.242 3.951 1.00 0.00 H new ATOM 626 N TYR A 211 -11.178 0.245 2.250 1.00 0.00 N ATOM 627 CA TYR A 211 -10.315 -0.880 2.719 1.00 0.00 C ATOM 628 C TYR A 211 -8.837 -0.482 2.730 1.00 0.00 C ATOM 629 O TYR A 211 -8.376 0.270 1.894 1.00 0.00 O ATOM 630 CB TYR A 211 -10.538 -1.991 1.705 1.00 0.00 C ATOM 631 CG TYR A 211 -11.388 -3.077 2.317 1.00 0.00 C ATOM 632 CD1 TYR A 211 -10.796 -4.063 3.113 1.00 0.00 C ATOM 633 CD2 TYR A 211 -12.767 -3.098 2.086 1.00 0.00 C ATOM 634 CE1 TYR A 211 -11.583 -5.073 3.679 1.00 0.00 C ATOM 635 CE2 TYR A 211 -13.555 -4.107 2.652 1.00 0.00 C ATOM 636 CZ TYR A 211 -12.964 -5.094 3.449 1.00 0.00 C ATOM 637 OH TYR A 211 -13.741 -6.089 4.006 1.00 0.00 O ATOM 0 H TYR A 211 -10.693 0.989 1.749 1.00 0.00 H new ATOM 0 HA TYR A 211 -10.567 -1.176 3.737 1.00 0.00 H new ATOM 0 HB2 TYR A 211 -11.026 -1.592 0.816 1.00 0.00 H new ATOM 0 HB3 TYR A 211 -9.580 -2.402 1.386 1.00 0.00 H new ATOM 0 HD1 TYR A 211 -9.731 -4.045 3.291 1.00 0.00 H new ATOM 0 HD2 TYR A 211 -13.224 -2.336 1.471 1.00 0.00 H new ATOM 0 HE1 TYR A 211 -11.125 -5.835 4.292 1.00 0.00 H new ATOM 0 HE2 TYR A 211 -14.620 -4.124 2.473 1.00 0.00 H new ATOM 0 HH TYR A 211 -14.677 -5.956 3.748 1.00 0.00 H new ATOM 647 N GLU A 212 -8.090 -1.007 3.662 1.00 0.00 N ATOM 648 CA GLU A 212 -6.634 -0.697 3.727 1.00 0.00 C ATOM 649 C GLU A 212 -5.842 -1.964 3.391 1.00 0.00 C ATOM 650 O GLU A 212 -6.400 -3.038 3.293 1.00 0.00 O ATOM 651 CB GLU A 212 -6.392 -0.262 5.174 1.00 0.00 C ATOM 652 CG GLU A 212 -4.964 0.259 5.327 1.00 0.00 C ATOM 653 CD GLU A 212 -4.761 0.777 6.753 1.00 0.00 C ATOM 654 OE1 GLU A 212 -5.298 0.170 7.664 1.00 0.00 O ATOM 655 OE2 GLU A 212 -4.075 1.774 6.906 1.00 0.00 O ATOM 0 H GLU A 212 -8.428 -1.641 4.386 1.00 0.00 H new ATOM 0 HA GLU A 212 -6.323 0.076 3.024 1.00 0.00 H new ATOM 0 HB2 GLU A 212 -7.104 0.515 5.454 1.00 0.00 H new ATOM 0 HB3 GLU A 212 -6.556 -1.103 5.848 1.00 0.00 H new ATOM 0 HG2 GLU A 212 -4.250 -0.536 5.112 1.00 0.00 H new ATOM 0 HG3 GLU A 212 -4.778 1.057 4.609 1.00 0.00 H new ATOM 662 N PHE A 213 -4.558 -1.858 3.198 1.00 0.00 N ATOM 663 CA PHE A 213 -3.768 -3.078 2.852 1.00 0.00 C ATOM 664 C PHE A 213 -2.391 -3.052 3.513 1.00 0.00 C ATOM 665 O PHE A 213 -1.674 -2.074 3.431 1.00 0.00 O ATOM 666 CB PHE A 213 -3.598 -3.019 1.334 1.00 0.00 C ATOM 667 CG PHE A 213 -4.935 -3.149 0.650 1.00 0.00 C ATOM 668 CD1 PHE A 213 -5.694 -2.006 0.371 1.00 0.00 C ATOM 669 CD2 PHE A 213 -5.410 -4.412 0.284 1.00 0.00 C ATOM 670 CE1 PHE A 213 -6.929 -2.128 -0.275 1.00 0.00 C ATOM 671 CE2 PHE A 213 -6.645 -4.535 -0.359 1.00 0.00 C ATOM 672 CZ PHE A 213 -7.404 -3.394 -0.639 1.00 0.00 C ATOM 0 H PHE A 213 -4.024 -0.992 3.263 1.00 0.00 H new ATOM 0 HA PHE A 213 -4.270 -3.983 3.193 1.00 0.00 H new ATOM 0 HB2 PHE A 213 -3.127 -2.077 1.051 1.00 0.00 H new ATOM 0 HB3 PHE A 213 -2.935 -3.819 1.005 1.00 0.00 H new ATOM 0 HD1 PHE A 213 -5.326 -1.031 0.654 1.00 0.00 H new ATOM 0 HD2 PHE A 213 -4.823 -5.293 0.498 1.00 0.00 H new ATOM 0 HE1 PHE A 213 -7.515 -1.247 -0.493 1.00 0.00 H new ATOM 0 HE2 PHE A 213 -7.013 -5.511 -0.640 1.00 0.00 H new ATOM 0 HZ PHE A 213 -8.358 -3.490 -1.137 1.00 0.00 H new ATOM 682 N LEU A 214 -1.989 -4.130 4.132 1.00 0.00 N ATOM 683 CA LEU A 214 -0.633 -4.152 4.742 1.00 0.00 C ATOM 684 C LEU A 214 0.378 -4.220 3.613 1.00 0.00 C ATOM 685 O LEU A 214 0.429 -5.180 2.869 1.00 0.00 O ATOM 686 CB LEU A 214 -0.573 -5.419 5.593 1.00 0.00 C ATOM 687 CG LEU A 214 0.658 -5.403 6.515 1.00 0.00 C ATOM 688 CD1 LEU A 214 0.924 -3.999 7.060 1.00 0.00 C ATOM 689 CD2 LEU A 214 0.410 -6.360 7.679 1.00 0.00 C ATOM 0 H LEU A 214 -2.535 -4.985 4.240 1.00 0.00 H new ATOM 0 HA LEU A 214 -0.422 -3.274 5.352 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -1.480 -5.503 6.192 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -0.536 -6.295 4.946 1.00 0.00 H new ATOM 0 HG LEU A 214 1.531 -5.714 5.941 1.00 0.00 H new ATOM 0 HD11 LEU A 214 1.800 -4.020 7.708 1.00 0.00 H new ATOM 0 HD12 LEU A 214 1.103 -3.315 6.231 1.00 0.00 H new ATOM 0 HD13 LEU A 214 0.059 -3.660 7.630 1.00 0.00 H new ATOM 0 HD21 LEU A 214 1.275 -6.359 8.342 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -0.472 -6.038 8.233 1.00 0.00 H new ATOM 0 HD23 LEU A 214 0.249 -7.367 7.294 1.00 0.00 H new ATOM 701 N ILE A 215 1.151 -3.200 3.446 1.00 0.00 N ATOM 702 CA ILE A 215 2.117 -3.200 2.326 1.00 0.00 C ATOM 703 C ILE A 215 3.534 -3.531 2.787 1.00 0.00 C ATOM 704 O ILE A 215 4.193 -2.730 3.419 1.00 0.00 O ATOM 705 CB ILE A 215 2.067 -1.778 1.792 1.00 0.00 C ATOM 706 CG1 ILE A 215 0.613 -1.338 1.608 1.00 0.00 C ATOM 707 CG2 ILE A 215 2.797 -1.726 0.456 1.00 0.00 C ATOM 708 CD1 ILE A 215 -0.142 -2.387 0.798 1.00 0.00 C ATOM 0 H ILE A 215 1.159 -2.366 4.033 1.00 0.00 H new ATOM 0 HA ILE A 215 1.862 -3.955 1.582 1.00 0.00 H new ATOM 0 HB ILE A 215 2.548 -1.104 2.501 1.00 0.00 H new ATOM 0 HG12 ILE A 215 0.138 -1.203 2.580 1.00 0.00 H new ATOM 0 HG13 ILE A 215 0.576 -0.375 1.099 1.00 0.00 H new ATOM 0 HG21 ILE A 215 2.767 -0.709 0.064 1.00 0.00 H new ATOM 0 HG22 ILE A 215 3.834 -2.030 0.596 1.00 0.00 H new ATOM 0 HG23 ILE A 215 2.313 -2.401 -0.250 1.00 0.00 H new ATOM 0 HD11 ILE A 215 -1.177 -2.071 0.669 1.00 0.00 H new ATOM 0 HD12 ILE A 215 0.328 -2.500 -0.179 1.00 0.00 H new ATOM 0 HD13 ILE A 215 -0.117 -3.341 1.325 1.00 0.00 H new ATOM 720 N LYS A 216 4.026 -4.690 2.440 1.00 0.00 N ATOM 721 CA LYS A 216 5.425 -5.029 2.821 1.00 0.00 C ATOM 722 C LYS A 216 6.371 -4.245 1.906 1.00 0.00 C ATOM 723 O LYS A 216 6.651 -4.649 0.795 1.00 0.00 O ATOM 724 CB LYS A 216 5.585 -6.535 2.585 1.00 0.00 C ATOM 725 CG LYS A 216 7.067 -6.904 2.696 1.00 0.00 C ATOM 726 CD LYS A 216 7.205 -8.378 3.079 1.00 0.00 C ATOM 727 CE LYS A 216 8.689 -8.728 3.230 1.00 0.00 C ATOM 728 NZ LYS A 216 8.754 -9.623 4.418 1.00 0.00 N ATOM 0 H LYS A 216 3.526 -5.408 1.916 1.00 0.00 H new ATOM 0 HA LYS A 216 5.649 -4.779 3.858 1.00 0.00 H new ATOM 0 HB2 LYS A 216 5.002 -7.094 3.317 1.00 0.00 H new ATOM 0 HB3 LYS A 216 5.203 -6.804 1.600 1.00 0.00 H new ATOM 0 HG2 LYS A 216 7.570 -6.716 1.748 1.00 0.00 H new ATOM 0 HG3 LYS A 216 7.553 -6.277 3.444 1.00 0.00 H new ATOM 0 HD2 LYS A 216 6.677 -8.573 4.012 1.00 0.00 H new ATOM 0 HD3 LYS A 216 6.747 -9.008 2.316 1.00 0.00 H new ATOM 0 HE2 LYS A 216 9.070 -9.227 2.339 1.00 0.00 H new ATOM 0 HE3 LYS A 216 9.293 -7.833 3.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 216 9.741 -9.906 4.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 216 8.392 -9.119 5.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 216 8.175 -10.470 4.247 1.00 0.00 H new ATOM 742 N TRP A 217 6.849 -3.115 2.346 1.00 0.00 N ATOM 743 CA TRP A 217 7.758 -2.314 1.477 1.00 0.00 C ATOM 744 C TRP A 217 9.180 -2.877 1.546 1.00 0.00 C ATOM 745 O TRP A 217 9.381 -4.056 1.761 1.00 0.00 O ATOM 746 CB TRP A 217 7.720 -0.897 2.052 1.00 0.00 C ATOM 747 CG TRP A 217 6.308 -0.405 2.101 1.00 0.00 C ATOM 748 CD1 TRP A 217 5.481 -0.525 3.165 1.00 0.00 C ATOM 749 CD2 TRP A 217 5.545 0.278 1.063 1.00 0.00 C ATOM 750 NE1 TRP A 217 4.266 0.057 2.853 1.00 0.00 N ATOM 751 CE2 TRP A 217 4.251 0.557 1.565 1.00 0.00 C ATOM 752 CE3 TRP A 217 5.848 0.680 -0.250 1.00 0.00 C ATOM 753 CZ2 TRP A 217 3.288 1.212 0.788 1.00 0.00 C ATOM 754 CZ3 TRP A 217 4.884 1.336 -1.034 1.00 0.00 C ATOM 755 CH2 TRP A 217 3.609 1.601 -0.518 1.00 0.00 C ATOM 0 H TRP A 217 6.652 -2.713 3.262 1.00 0.00 H new ATOM 0 HA TRP A 217 7.451 -2.336 0.431 1.00 0.00 H new ATOM 0 HB2 TRP A 217 8.152 -0.890 3.053 1.00 0.00 H new ATOM 0 HB3 TRP A 217 8.326 -0.230 1.439 1.00 0.00 H new ATOM 0 HD1 TRP A 217 5.729 -0.998 4.104 1.00 0.00 H new ATOM 0 HE1 TRP A 217 3.476 0.111 3.496 1.00 0.00 H new ATOM 0 HE3 TRP A 217 6.828 0.483 -0.659 1.00 0.00 H new ATOM 0 HZ2 TRP A 217 2.307 1.415 1.192 1.00 0.00 H new ATOM 0 HZ3 TRP A 217 5.128 1.638 -2.042 1.00 0.00 H new ATOM 0 HH2 TRP A 217 2.874 2.105 -1.128 1.00 0.00 H new ATOM 871 N ASN A 225 6.945 -3.441 7.178 1.00 0.00 N ATOM 872 CA ASN A 225 5.554 -3.476 6.632 1.00 0.00 C ATOM 873 C ASN A 225 4.707 -2.363 7.245 1.00 0.00 C ATOM 874 O ASN A 225 4.946 -1.918 8.350 1.00 0.00 O ATOM 875 CB ASN A 225 4.997 -4.846 7.035 1.00 0.00 C ATOM 876 CG ASN A 225 6.078 -5.918 6.873 1.00 0.00 C ATOM 877 OD1 ASN A 225 6.144 -6.852 7.648 1.00 0.00 O ATOM 878 ND2 ASN A 225 6.936 -5.820 5.895 1.00 0.00 N ATOM 0 HA ASN A 225 5.541 -3.328 5.552 1.00 0.00 H new ATOM 0 HB2 ASN A 225 4.653 -4.818 8.069 1.00 0.00 H new ATOM 0 HB3 ASN A 225 4.133 -5.093 6.418 1.00 0.00 H new ATOM 0 HD21 ASN A 225 7.662 -6.527 5.781 1.00 0.00 H new ATOM 0 HD22 ASN A 225 6.881 -5.036 5.245 1.00 0.00 H new ATOM 885 N THR A 226 3.710 -1.922 6.534 1.00 0.00 N ATOM 886 CA THR A 226 2.829 -0.849 7.065 1.00 0.00 C ATOM 887 C THR A 226 1.457 -0.950 6.408 1.00 0.00 C ATOM 888 O THR A 226 1.313 -1.493 5.329 1.00 0.00 O ATOM 889 CB THR A 226 3.511 0.464 6.688 1.00 0.00 C ATOM 890 OG1 THR A 226 3.953 0.399 5.339 1.00 0.00 O ATOM 891 CG2 THR A 226 4.709 0.704 7.610 1.00 0.00 C ATOM 0 H THR A 226 3.466 -2.261 5.603 1.00 0.00 H new ATOM 0 HA THR A 226 2.684 -0.924 8.143 1.00 0.00 H new ATOM 0 HB THR A 226 2.802 1.285 6.798 1.00 0.00 H new ATOM 0 HG1 THR A 226 4.808 -0.079 5.297 1.00 0.00 H new ATOM 0 HG21 THR A 226 5.194 1.642 7.339 1.00 0.00 H new ATOM 0 HG22 THR A 226 4.368 0.757 8.644 1.00 0.00 H new ATOM 0 HG23 THR A 226 5.419 -0.116 7.504 1.00 0.00 H new ATOM 899 N TRP A 227 0.445 -0.443 7.045 1.00 0.00 N ATOM 900 CA TRP A 227 -0.913 -0.525 6.447 1.00 0.00 C ATOM 901 C TRP A 227 -1.227 0.749 5.669 1.00 0.00 C ATOM 902 O TRP A 227 -1.462 1.799 6.234 1.00 0.00 O ATOM 903 CB TRP A 227 -1.850 -0.701 7.636 1.00 0.00 C ATOM 904 CG TRP A 227 -1.778 -2.124 8.076 1.00 0.00 C ATOM 905 CD1 TRP A 227 -0.812 -2.646 8.867 1.00 0.00 C ATOM 906 CD2 TRP A 227 -2.670 -3.221 7.738 1.00 0.00 C ATOM 907 NE1 TRP A 227 -1.063 -3.994 9.043 1.00 0.00 N ATOM 908 CE2 TRP A 227 -2.198 -4.396 8.368 1.00 0.00 C ATOM 909 CE3 TRP A 227 -3.836 -3.310 6.957 1.00 0.00 C ATOM 910 CZ2 TRP A 227 -2.857 -5.614 8.225 1.00 0.00 C ATOM 911 CZ3 TRP A 227 -4.500 -4.537 6.812 1.00 0.00 C ATOM 912 CH2 TRP A 227 -4.009 -5.687 7.446 1.00 0.00 C ATOM 0 H TRP A 227 0.497 0.023 7.951 1.00 0.00 H new ATOM 0 HA TRP A 227 -1.012 -1.345 5.735 1.00 0.00 H new ATOM 0 HB2 TRP A 227 -1.561 -0.036 8.450 1.00 0.00 H new ATOM 0 HB3 TRP A 227 -2.871 -0.440 7.358 1.00 0.00 H new ATOM 0 HD1 TRP A 227 0.018 -2.100 9.291 1.00 0.00 H new ATOM 0 HE1 TRP A 227 -0.480 -4.616 9.603 1.00 0.00 H new ATOM 0 HE3 TRP A 227 -4.222 -2.429 6.466 1.00 0.00 H new ATOM 0 HZ2 TRP A 227 -2.477 -6.498 8.716 1.00 0.00 H new ATOM 0 HZ3 TRP A 227 -5.394 -4.596 6.209 1.00 0.00 H new ATOM 0 HH2 TRP A 227 -4.524 -6.629 7.330 1.00 0.00 H new ATOM 923 N GLU A 228 -1.229 0.658 4.368 1.00 0.00 N ATOM 924 CA GLU A 228 -1.519 1.854 3.537 1.00 0.00 C ATOM 925 C GLU A 228 -2.847 1.675 2.802 1.00 0.00 C ATOM 926 O GLU A 228 -3.550 0.702 2.992 1.00 0.00 O ATOM 927 CB GLU A 228 -0.359 1.935 2.545 1.00 0.00 C ATOM 928 CG GLU A 228 0.962 1.994 3.317 1.00 0.00 C ATOM 929 CD GLU A 228 1.581 3.384 3.164 1.00 0.00 C ATOM 930 OE1 GLU A 228 1.337 4.011 2.146 1.00 0.00 O ATOM 931 OE2 GLU A 228 2.286 3.800 4.069 1.00 0.00 O ATOM 0 H GLU A 228 -1.041 -0.197 3.845 1.00 0.00 H new ATOM 0 HA GLU A 228 -1.608 2.762 4.133 1.00 0.00 H new ATOM 0 HB2 GLU A 228 -0.369 1.068 1.884 1.00 0.00 H new ATOM 0 HB3 GLU A 228 -0.465 2.818 1.915 1.00 0.00 H new ATOM 0 HG2 GLU A 228 0.790 1.775 4.371 1.00 0.00 H new ATOM 0 HG3 GLU A 228 1.649 1.235 2.942 1.00 0.00 H new ATOM 938 N THR A 229 -3.189 2.602 1.957 1.00 0.00 N ATOM 939 CA THR A 229 -4.461 2.499 1.196 1.00 0.00 C ATOM 940 C THR A 229 -4.199 2.930 -0.241 1.00 0.00 C ATOM 941 O THR A 229 -3.268 3.659 -0.509 1.00 0.00 O ATOM 942 CB THR A 229 -5.418 3.475 1.882 1.00 0.00 C ATOM 943 OG1 THR A 229 -4.675 4.554 2.433 1.00 0.00 O ATOM 944 CG2 THR A 229 -6.177 2.756 2.998 1.00 0.00 C ATOM 0 H THR A 229 -2.636 3.436 1.759 1.00 0.00 H new ATOM 0 HA THR A 229 -4.871 1.489 1.179 1.00 0.00 H new ATOM 0 HB THR A 229 -6.131 3.857 1.151 1.00 0.00 H new ATOM 0 HG1 THR A 229 -5.286 5.182 2.872 1.00 0.00 H new ATOM 0 HG21 THR A 229 -6.858 3.455 3.484 1.00 0.00 H new ATOM 0 HG22 THR A 229 -6.747 1.929 2.576 1.00 0.00 H new ATOM 0 HG23 THR A 229 -5.468 2.371 3.731 1.00 0.00 H new ATOM 952 N TYR A 230 -4.994 2.493 -1.171 1.00 0.00 N ATOM 953 CA TYR A 230 -4.744 2.899 -2.579 1.00 0.00 C ATOM 954 C TYR A 230 -4.459 4.401 -2.649 1.00 0.00 C ATOM 955 O TYR A 230 -3.694 4.863 -3.471 1.00 0.00 O ATOM 956 CB TYR A 230 -6.031 2.566 -3.334 1.00 0.00 C ATOM 957 CG TYR A 230 -6.138 1.075 -3.542 1.00 0.00 C ATOM 958 CD1 TYR A 230 -5.260 0.423 -4.415 1.00 0.00 C ATOM 959 CD2 TYR A 230 -7.126 0.346 -2.868 1.00 0.00 C ATOM 960 CE1 TYR A 230 -5.367 -0.959 -4.612 1.00 0.00 C ATOM 961 CE2 TYR A 230 -7.236 -1.035 -3.068 1.00 0.00 C ATOM 962 CZ TYR A 230 -6.356 -1.687 -3.940 1.00 0.00 C ATOM 963 OH TYR A 230 -6.467 -3.048 -4.136 1.00 0.00 O ATOM 0 H TYR A 230 -5.796 1.881 -1.023 1.00 0.00 H new ATOM 0 HA TYR A 230 -3.882 2.386 -3.005 1.00 0.00 H new ATOM 0 HB2 TYR A 230 -6.894 2.926 -2.774 1.00 0.00 H new ATOM 0 HB3 TYR A 230 -6.040 3.077 -4.297 1.00 0.00 H new ATOM 0 HD1 TYR A 230 -4.500 0.986 -4.937 1.00 0.00 H new ATOM 0 HD2 TYR A 230 -7.803 0.850 -2.194 1.00 0.00 H new ATOM 0 HE1 TYR A 230 -4.687 -1.463 -5.282 1.00 0.00 H new ATOM 0 HE2 TYR A 230 -7.999 -1.597 -2.550 1.00 0.00 H new ATOM 0 HH TYR A 230 -7.172 -3.405 -3.557 1.00 0.00 H new ATOM 973 N GLU A 231 -5.072 5.165 -1.787 1.00 0.00 N ATOM 974 CA GLU A 231 -4.841 6.640 -1.795 1.00 0.00 C ATOM 975 C GLU A 231 -3.407 6.949 -1.356 1.00 0.00 C ATOM 976 O GLU A 231 -2.954 8.074 -1.428 1.00 0.00 O ATOM 977 CB GLU A 231 -5.842 7.198 -0.781 1.00 0.00 C ATOM 978 CG GLU A 231 -5.705 8.720 -0.707 1.00 0.00 C ATOM 979 CD GLU A 231 -7.073 9.341 -0.414 1.00 0.00 C ATOM 980 OE1 GLU A 231 -8.067 8.741 -0.787 1.00 0.00 O ATOM 981 OE2 GLU A 231 -7.102 10.407 0.180 1.00 0.00 O ATOM 0 H GLU A 231 -5.724 4.833 -1.076 1.00 0.00 H new ATOM 0 HA GLU A 231 -4.973 7.077 -2.785 1.00 0.00 H new ATOM 0 HB2 GLU A 231 -6.857 6.928 -1.071 1.00 0.00 H new ATOM 0 HB3 GLU A 231 -5.664 6.759 0.200 1.00 0.00 H new ATOM 0 HG2 GLU A 231 -4.994 8.995 0.073 1.00 0.00 H new ATOM 0 HG3 GLU A 231 -5.312 9.107 -1.647 1.00 0.00 H new ATOM 988 N SER A 232 -2.694 5.957 -0.899 1.00 0.00 N ATOM 989 CA SER A 232 -1.290 6.189 -0.450 1.00 0.00 C ATOM 990 C SER A 232 -0.346 5.165 -1.088 1.00 0.00 C ATOM 991 O SER A 232 0.860 5.273 -0.988 1.00 0.00 O ATOM 992 CB SER A 232 -1.328 6.005 1.066 1.00 0.00 C ATOM 993 OG SER A 232 -0.758 7.146 1.691 1.00 0.00 O ATOM 0 H SER A 232 -3.022 4.995 -0.817 1.00 0.00 H new ATOM 0 HA SER A 232 -0.925 7.175 -0.737 1.00 0.00 H new ATOM 0 HB2 SER A 232 -2.356 5.868 1.402 1.00 0.00 H new ATOM 0 HB3 SER A 232 -0.778 5.108 1.349 1.00 0.00 H new ATOM 0 HG SER A 232 -0.782 7.032 2.664 1.00 0.00 H new ATOM 999 N ILE A 233 -0.883 4.170 -1.739 1.00 0.00 N ATOM 1000 CA ILE A 233 -0.013 3.143 -2.380 1.00 0.00 C ATOM 1001 C ILE A 233 -0.449 2.942 -3.837 1.00 0.00 C ATOM 1002 O ILE A 233 0.008 2.044 -4.516 1.00 0.00 O ATOM 1003 CB ILE A 233 -0.173 1.847 -1.534 1.00 0.00 C ATOM 1004 CG1 ILE A 233 -0.389 0.624 -2.435 1.00 0.00 C ATOM 1005 CG2 ILE A 233 -1.356 1.953 -0.567 1.00 0.00 C ATOM 1006 CD1 ILE A 233 -0.730 -0.591 -1.573 1.00 0.00 C ATOM 0 H ILE A 233 -1.886 4.023 -1.855 1.00 0.00 H new ATOM 0 HA ILE A 233 1.035 3.440 -2.406 1.00 0.00 H new ATOM 0 HB ILE A 233 0.749 1.727 -0.965 1.00 0.00 H new ATOM 0 HG12 ILE A 233 -1.195 0.818 -3.143 1.00 0.00 H new ATOM 0 HG13 ILE A 233 0.509 0.427 -3.020 1.00 0.00 H new ATOM 0 HG21 ILE A 233 -1.439 1.031 0.008 1.00 0.00 H new ATOM 0 HG22 ILE A 233 -1.197 2.791 0.112 1.00 0.00 H new ATOM 0 HG23 ILE A 233 -2.274 2.112 -1.132 1.00 0.00 H new ATOM 0 HD11 ILE A 233 -0.883 -1.460 -2.213 1.00 0.00 H new ATOM 0 HD12 ILE A 233 0.090 -0.789 -0.883 1.00 0.00 H new ATOM 0 HD13 ILE A 233 -1.640 -0.392 -1.007 1.00 0.00 H new ATOM 1018 N GLY A 234 -1.328 3.774 -4.321 1.00 0.00 N ATOM 1019 CA GLY A 234 -1.788 3.627 -5.729 1.00 0.00 C ATOM 1020 C GLY A 234 -0.930 4.503 -6.646 1.00 0.00 C ATOM 1021 O GLY A 234 -1.418 5.417 -7.279 1.00 0.00 O ATOM 0 H GLY A 234 -1.747 4.547 -3.804 1.00 0.00 H new ATOM 0 HA2 GLY A 234 -1.719 2.584 -6.037 1.00 0.00 H new ATOM 0 HA3 GLY A 234 -2.836 3.915 -5.811 1.00 0.00 H new ATOM 1025 N GLN A 235 0.345 4.230 -6.723 1.00 0.00 N ATOM 1026 CA GLN A 235 1.229 5.049 -7.603 1.00 0.00 C ATOM 1027 C GLN A 235 2.688 4.616 -7.438 1.00 0.00 C ATOM 1028 O GLN A 235 3.595 5.423 -7.487 1.00 0.00 O ATOM 1029 CB GLN A 235 1.038 6.491 -7.128 1.00 0.00 C ATOM 1030 CG GLN A 235 1.047 6.533 -5.597 1.00 0.00 C ATOM 1031 CD GLN A 235 2.038 7.595 -5.122 1.00 0.00 C ATOM 1032 OE1 GLN A 235 2.907 7.318 -4.320 1.00 0.00 O ATOM 1033 NE2 GLN A 235 1.943 8.810 -5.587 1.00 0.00 N ATOM 0 H GLN A 235 0.812 3.478 -6.216 1.00 0.00 H new ATOM 0 HA GLN A 235 0.982 4.933 -8.658 1.00 0.00 H new ATOM 0 HB2 GLN A 235 1.833 7.123 -7.524 1.00 0.00 H new ATOM 0 HB3 GLN A 235 0.096 6.888 -7.507 1.00 0.00 H new ATOM 0 HG2 GLN A 235 0.048 6.759 -5.223 1.00 0.00 H new ATOM 0 HG3 GLN A 235 1.324 5.557 -5.197 1.00 0.00 H new ATOM 0 HE21 GLN A 235 1.213 9.043 -6.261 1.00 0.00 H new ATOM 0 HE22 GLN A 235 2.599 9.527 -5.277 1.00 0.00 H new ATOM 1042 N VAL A 236 2.919 3.347 -7.245 1.00 0.00 N ATOM 1043 CA VAL A 236 4.319 2.852 -7.078 1.00 0.00 C ATOM 1044 C VAL A 236 4.362 1.344 -7.317 1.00 0.00 C ATOM 1045 O VAL A 236 4.987 0.606 -6.581 1.00 0.00 O ATOM 1046 CB VAL A 236 4.687 3.167 -5.625 1.00 0.00 C ATOM 1047 CG1 VAL A 236 5.006 4.655 -5.485 1.00 0.00 C ATOM 1048 CG2 VAL A 236 3.511 2.809 -4.712 1.00 0.00 C ATOM 0 H VAL A 236 2.198 2.627 -7.195 1.00 0.00 H new ATOM 0 HA VAL A 236 5.010 3.317 -7.781 1.00 0.00 H new ATOM 0 HB VAL A 236 5.562 2.583 -5.340 1.00 0.00 H new ATOM 0 HG11 VAL A 236 5.267 4.875 -4.450 1.00 0.00 H new ATOM 0 HG12 VAL A 236 5.845 4.910 -6.133 1.00 0.00 H new ATOM 0 HG13 VAL A 236 4.134 5.243 -5.772 1.00 0.00 H new ATOM 0 HG21 VAL A 236 3.772 3.033 -3.678 1.00 0.00 H new ATOM 0 HG22 VAL A 236 2.636 3.392 -5.000 1.00 0.00 H new ATOM 0 HG23 VAL A 236 3.286 1.747 -4.808 1.00 0.00 H new ATOM 1058 N ARG A 237 3.681 0.875 -8.329 1.00 0.00 N ATOM 1059 CA ARG A 237 3.659 -0.593 -8.603 1.00 0.00 C ATOM 1060 C ARG A 237 2.835 -1.306 -7.526 1.00 0.00 C ATOM 1061 O ARG A 237 2.693 -2.515 -7.531 1.00 0.00 O ATOM 1062 CB ARG A 237 5.121 -1.041 -8.550 1.00 0.00 C ATOM 1063 CG ARG A 237 5.482 -1.759 -9.852 1.00 0.00 C ATOM 1064 CD ARG A 237 6.740 -1.127 -10.452 1.00 0.00 C ATOM 1065 NE ARG A 237 7.813 -2.139 -10.245 1.00 0.00 N ATOM 1066 CZ ARG A 237 8.931 -2.051 -10.912 1.00 0.00 C ATOM 1067 NH1 ARG A 237 9.041 -2.625 -12.079 1.00 0.00 N ATOM 1068 NH2 ARG A 237 9.938 -1.389 -10.412 1.00 0.00 N ATOM 0 H ARG A 237 3.139 1.445 -8.978 1.00 0.00 H new ATOM 0 HA ARG A 237 3.207 -0.828 -9.566 1.00 0.00 H new ATOM 0 HB2 ARG A 237 5.772 -0.179 -8.405 1.00 0.00 H new ATOM 0 HB3 ARG A 237 5.278 -1.705 -7.700 1.00 0.00 H new ATOM 0 HG2 ARG A 237 5.651 -2.819 -9.661 1.00 0.00 H new ATOM 0 HG3 ARG A 237 4.655 -1.690 -10.559 1.00 0.00 H new ATOM 0 HD2 ARG A 237 6.605 -0.906 -11.511 1.00 0.00 H new ATOM 0 HD3 ARG A 237 6.984 -0.186 -9.958 1.00 0.00 H new ATOM 0 HE ARG A 237 7.674 -2.901 -9.582 1.00 0.00 H new ATOM 0 HH11 ARG A 237 8.253 -3.142 -12.469 1.00 0.00 H new ATOM 0 HH12 ARG A 237 9.915 -2.556 -12.601 1.00 0.00 H new ATOM 0 HH21 ARG A 237 9.851 -0.941 -9.500 1.00 0.00 H new ATOM 0 HH22 ARG A 237 10.812 -1.320 -10.933 1.00 0.00 H new ATOM 1082 N GLY A 238 2.282 -0.559 -6.604 1.00 0.00 N ATOM 1083 CA GLY A 238 1.466 -1.181 -5.532 1.00 0.00 C ATOM 1084 C GLY A 238 0.171 -1.705 -6.136 1.00 0.00 C ATOM 1085 O GLY A 238 -0.118 -2.878 -6.078 1.00 0.00 O ATOM 0 H GLY A 238 2.364 0.456 -6.552 1.00 0.00 H new ATOM 0 HA2 GLY A 238 2.019 -1.995 -5.062 1.00 0.00 H new ATOM 0 HA3 GLY A 238 1.249 -0.451 -4.752 1.00 0.00 H new ATOM 1089 N LEU A 239 -0.612 -0.844 -6.718 1.00 0.00 N ATOM 1090 CA LEU A 239 -1.891 -1.302 -7.325 1.00 0.00 C ATOM 1091 C LEU A 239 -1.673 -2.598 -8.105 1.00 0.00 C ATOM 1092 O LEU A 239 -2.526 -3.457 -8.141 1.00 0.00 O ATOM 1093 CB LEU A 239 -2.313 -0.168 -8.262 1.00 0.00 C ATOM 1094 CG LEU A 239 -2.917 0.974 -7.445 1.00 0.00 C ATOM 1095 CD1 LEU A 239 -2.620 2.308 -8.135 1.00 0.00 C ATOM 1096 CD2 LEU A 239 -4.432 0.783 -7.342 1.00 0.00 C ATOM 0 H LEU A 239 -0.423 0.155 -6.800 1.00 0.00 H new ATOM 0 HA LEU A 239 -2.653 -1.513 -6.575 1.00 0.00 H new ATOM 0 HB2 LEU A 239 -1.452 0.191 -8.826 1.00 0.00 H new ATOM 0 HB3 LEU A 239 -3.040 -0.534 -8.988 1.00 0.00 H new ATOM 0 HG LEU A 239 -2.481 0.975 -6.446 1.00 0.00 H new ATOM 0 HD11 LEU A 239 -3.051 3.123 -7.553 1.00 0.00 H new ATOM 0 HD12 LEU A 239 -1.541 2.446 -8.210 1.00 0.00 H new ATOM 0 HD13 LEU A 239 -3.056 2.306 -9.134 1.00 0.00 H new ATOM 0 HD21 LEU A 239 -4.863 1.597 -6.759 1.00 0.00 H new ATOM 0 HD22 LEU A 239 -4.867 0.782 -8.341 1.00 0.00 H new ATOM 0 HD23 LEU A 239 -4.647 -0.167 -6.852 1.00 0.00 H new ATOM 1108 N LYS A 240 -0.537 -2.753 -8.726 1.00 0.00 N ATOM 1109 CA LYS A 240 -0.283 -4.005 -9.493 1.00 0.00 C ATOM 1110 C LYS A 240 -0.218 -5.196 -8.537 1.00 0.00 C ATOM 1111 O LYS A 240 -0.999 -6.121 -8.634 1.00 0.00 O ATOM 1112 CB LYS A 240 1.064 -3.794 -10.179 1.00 0.00 C ATOM 1113 CG LYS A 240 1.104 -4.597 -11.478 1.00 0.00 C ATOM 1114 CD LYS A 240 2.106 -5.743 -11.336 1.00 0.00 C ATOM 1115 CE LYS A 240 3.354 -5.435 -12.166 1.00 0.00 C ATOM 1116 NZ LYS A 240 4.458 -5.327 -11.173 1.00 0.00 N ATOM 0 H LYS A 240 0.222 -2.072 -8.736 1.00 0.00 H new ATOM 0 HA LYS A 240 -1.072 -4.213 -10.215 1.00 0.00 H new ATOM 0 HB2 LYS A 240 1.216 -2.735 -10.388 1.00 0.00 H new ATOM 0 HB3 LYS A 240 1.873 -4.108 -9.520 1.00 0.00 H new ATOM 0 HG2 LYS A 240 0.114 -4.991 -11.705 1.00 0.00 H new ATOM 0 HG3 LYS A 240 1.388 -3.951 -12.309 1.00 0.00 H new ATOM 0 HD2 LYS A 240 2.377 -5.876 -10.289 1.00 0.00 H new ATOM 0 HD3 LYS A 240 1.656 -6.678 -11.670 1.00 0.00 H new ATOM 0 HE2 LYS A 240 3.551 -6.225 -12.891 1.00 0.00 H new ATOM 0 HE3 LYS A 240 3.236 -4.508 -12.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 240 5.349 -5.117 -11.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 240 4.246 -4.563 -10.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 240 4.551 -6.226 -10.658 1.00 0.00 H new ATOM 1130 N ARG A 241 0.695 -5.175 -7.606 1.00 0.00 N ATOM 1131 CA ARG A 241 0.783 -6.308 -6.642 1.00 0.00 C ATOM 1132 C ARG A 241 -0.429 -6.257 -5.711 1.00 0.00 C ATOM 1133 O ARG A 241 -0.915 -7.268 -5.241 1.00 0.00 O ATOM 1134 CB ARG A 241 2.085 -6.081 -5.875 1.00 0.00 C ATOM 1135 CG ARG A 241 3.254 -6.641 -6.688 1.00 0.00 C ATOM 1136 CD ARG A 241 4.366 -7.106 -5.745 1.00 0.00 C ATOM 1137 NE ARG A 241 5.413 -7.670 -6.642 1.00 0.00 N ATOM 1138 CZ ARG A 241 6.491 -8.201 -6.137 1.00 0.00 C ATOM 1139 NH1 ARG A 241 6.398 -9.097 -5.194 1.00 0.00 N ATOM 1140 NH2 ARG A 241 7.665 -7.838 -6.578 1.00 0.00 N ATOM 0 H ARG A 241 1.378 -4.430 -7.471 1.00 0.00 H new ATOM 0 HA ARG A 241 0.783 -7.286 -7.123 1.00 0.00 H new ATOM 0 HB2 ARG A 241 2.232 -5.017 -5.691 1.00 0.00 H new ATOM 0 HB3 ARG A 241 2.037 -6.569 -4.902 1.00 0.00 H new ATOM 0 HG2 ARG A 241 2.915 -7.474 -7.304 1.00 0.00 H new ATOM 0 HG3 ARG A 241 3.635 -5.878 -7.367 1.00 0.00 H new ATOM 0 HD2 ARG A 241 4.756 -6.277 -5.154 1.00 0.00 H new ATOM 0 HD3 ARG A 241 4.001 -7.855 -5.042 1.00 0.00 H new ATOM 0 HE ARG A 241 5.286 -7.641 -7.654 1.00 0.00 H new ATOM 0 HH11 ARG A 241 5.481 -9.383 -4.851 1.00 0.00 H new ATOM 0 HH12 ARG A 241 7.242 -9.512 -4.800 1.00 0.00 H new ATOM 0 HH21 ARG A 241 7.738 -7.139 -7.317 1.00 0.00 H new ATOM 0 HH22 ARG A 241 8.509 -8.253 -6.183 1.00 0.00 H new ATOM 1154 N LEU A 242 -0.935 -5.080 -5.473 1.00 0.00 N ATOM 1155 CA LEU A 242 -2.133 -4.932 -4.609 1.00 0.00 C ATOM 1156 C LEU A 242 -3.341 -5.459 -5.371 1.00 0.00 C ATOM 1157 O LEU A 242 -4.245 -6.044 -4.808 1.00 0.00 O ATOM 1158 CB LEU A 242 -2.253 -3.423 -4.380 1.00 0.00 C ATOM 1159 CG LEU A 242 -3.008 -3.140 -3.081 1.00 0.00 C ATOM 1160 CD1 LEU A 242 -4.306 -3.945 -3.057 1.00 0.00 C ATOM 1161 CD2 LEU A 242 -2.139 -3.533 -1.884 1.00 0.00 C ATOM 0 H LEU A 242 -0.564 -4.206 -5.845 1.00 0.00 H new ATOM 0 HA LEU A 242 -2.068 -5.477 -3.667 1.00 0.00 H new ATOM 0 HB2 LEU A 242 -1.260 -2.975 -4.336 1.00 0.00 H new ATOM 0 HB3 LEU A 242 -2.774 -2.962 -5.219 1.00 0.00 H new ATOM 0 HG LEU A 242 -3.241 -2.077 -3.024 1.00 0.00 H new ATOM 0 HD11 LEU A 242 -4.843 -3.742 -2.130 1.00 0.00 H new ATOM 0 HD12 LEU A 242 -4.927 -3.660 -3.906 1.00 0.00 H new ATOM 0 HD13 LEU A 242 -4.076 -5.009 -3.117 1.00 0.00 H new ATOM 0 HD21 LEU A 242 -2.680 -3.330 -0.960 1.00 0.00 H new ATOM 0 HD22 LEU A 242 -1.902 -4.595 -1.940 1.00 0.00 H new ATOM 0 HD23 LEU A 242 -1.216 -2.954 -1.899 1.00 0.00 H new ATOM 1173 N ASP A 243 -3.351 -5.264 -6.660 1.00 0.00 N ATOM 1174 CA ASP A 243 -4.493 -5.768 -7.472 1.00 0.00 C ATOM 1175 C ASP A 243 -4.497 -7.294 -7.433 1.00 0.00 C ATOM 1176 O ASP A 243 -5.491 -7.914 -7.112 1.00 0.00 O ATOM 1177 CB ASP A 243 -4.244 -5.263 -8.895 1.00 0.00 C ATOM 1178 CG ASP A 243 -4.878 -3.879 -9.062 1.00 0.00 C ATOM 1179 OD1 ASP A 243 -4.872 -3.127 -8.101 1.00 0.00 O ATOM 1180 OD2 ASP A 243 -5.357 -3.595 -10.147 1.00 0.00 O ATOM 0 H ASP A 243 -2.622 -4.780 -7.184 1.00 0.00 H new ATOM 0 HA ASP A 243 -5.457 -5.423 -7.099 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -3.173 -5.211 -9.092 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -4.668 -5.959 -9.619 1.00 0.00 H new ATOM 1185 N ASN A 244 -3.384 -7.903 -7.735 1.00 0.00 N ATOM 1186 CA ASN A 244 -3.325 -9.389 -7.691 1.00 0.00 C ATOM 1187 C ASN A 244 -3.559 -9.860 -6.255 1.00 0.00 C ATOM 1188 O ASN A 244 -3.932 -10.991 -6.014 1.00 0.00 O ATOM 1189 CB ASN A 244 -1.915 -9.751 -8.160 1.00 0.00 C ATOM 1190 CG ASN A 244 -1.809 -11.266 -8.343 1.00 0.00 C ATOM 1191 OD1 ASN A 244 -1.453 -11.978 -7.425 1.00 0.00 O ATOM 1192 ND2 ASN A 244 -2.106 -11.793 -9.500 1.00 0.00 N ATOM 0 H ASN A 244 -2.518 -7.439 -8.009 1.00 0.00 H new ATOM 0 HA ASN A 244 -4.082 -9.861 -8.317 1.00 0.00 H new ATOM 0 HB2 ASN A 244 -1.692 -9.245 -9.099 1.00 0.00 H new ATOM 0 HB3 ASN A 244 -1.180 -9.410 -7.431 1.00 0.00 H new ATOM 0 HD21 ASN A 244 -2.039 -12.802 -9.633 1.00 0.00 H new ATOM 0 HD22 ASN A 244 -2.405 -11.196 -10.271 1.00 0.00 H new ATOM 1199 N TYR A 245 -3.368 -8.993 -5.295 1.00 0.00 N ATOM 1200 CA TYR A 245 -3.611 -9.391 -3.889 1.00 0.00 C ATOM 1201 C TYR A 245 -5.113 -9.328 -3.628 1.00 0.00 C ATOM 1202 O TYR A 245 -5.682 -10.166 -2.957 1.00 0.00 O ATOM 1203 CB TYR A 245 -2.872 -8.361 -3.034 1.00 0.00 C ATOM 1204 CG TYR A 245 -3.370 -8.461 -1.615 1.00 0.00 C ATOM 1205 CD1 TYR A 245 -4.478 -7.708 -1.206 1.00 0.00 C ATOM 1206 CD2 TYR A 245 -2.737 -9.322 -0.713 1.00 0.00 C ATOM 1207 CE1 TYR A 245 -4.949 -7.816 0.106 1.00 0.00 C ATOM 1208 CE2 TYR A 245 -3.206 -9.427 0.599 1.00 0.00 C ATOM 1209 CZ TYR A 245 -4.312 -8.676 1.008 1.00 0.00 C ATOM 1210 OH TYR A 245 -4.777 -8.789 2.300 1.00 0.00 O ATOM 0 H TYR A 245 -3.055 -8.031 -5.429 1.00 0.00 H new ATOM 0 HA TYR A 245 -3.265 -10.400 -3.664 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -1.798 -8.541 -3.071 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -3.040 -7.357 -3.423 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -4.968 -7.045 -1.903 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -1.886 -9.906 -1.030 1.00 0.00 H new ATOM 0 HE1 TYR A 245 -5.803 -7.236 0.423 1.00 0.00 H new ATOM 0 HE2 TYR A 245 -2.714 -10.088 1.297 1.00 0.00 H new ATOM 0 HH TYR A 245 -5.738 -8.598 2.320 1.00 0.00 H new ATOM 1220 N CYS A 246 -5.761 -8.336 -4.174 1.00 0.00 N ATOM 1221 CA CYS A 246 -7.225 -8.208 -3.985 1.00 0.00 C ATOM 1222 C CYS A 246 -7.927 -9.363 -4.694 1.00 0.00 C ATOM 1223 O CYS A 246 -8.945 -9.848 -4.252 1.00 0.00 O ATOM 1224 CB CYS A 246 -7.595 -6.869 -4.622 1.00 0.00 C ATOM 1225 SG CYS A 246 -7.387 -5.547 -3.404 1.00 0.00 S ATOM 0 H CYS A 246 -5.333 -7.607 -4.745 1.00 0.00 H new ATOM 0 HA CYS A 246 -7.522 -8.242 -2.937 1.00 0.00 H new ATOM 0 HB2 CYS A 246 -6.965 -6.680 -5.491 1.00 0.00 H new ATOM 0 HB3 CYS A 246 -8.626 -6.894 -4.975 1.00 0.00 H new ATOM 0 HG CYS A 246 -6.449 -4.738 -3.798 1.00 0.00 H new ATOM 1231 N LYS A 247 -7.380 -9.817 -5.789 1.00 0.00 N ATOM 1232 CA LYS A 247 -8.010 -10.952 -6.512 1.00 0.00 C ATOM 1233 C LYS A 247 -7.609 -12.262 -5.830 1.00 0.00 C ATOM 1234 O LYS A 247 -8.289 -13.264 -5.926 1.00 0.00 O ATOM 1235 CB LYS A 247 -7.467 -10.870 -7.948 1.00 0.00 C ATOM 1236 CG LYS A 247 -6.086 -11.526 -8.036 1.00 0.00 C ATOM 1237 CD LYS A 247 -5.671 -11.645 -9.505 1.00 0.00 C ATOM 1238 CE LYS A 247 -6.173 -12.975 -10.073 1.00 0.00 C ATOM 1239 NZ LYS A 247 -7.163 -12.596 -11.121 1.00 0.00 N ATOM 0 H LYS A 247 -6.527 -9.451 -6.211 1.00 0.00 H new ATOM 0 HA LYS A 247 -9.099 -10.911 -6.510 1.00 0.00 H new ATOM 0 HB2 LYS A 247 -8.156 -11.365 -8.633 1.00 0.00 H new ATOM 0 HB3 LYS A 247 -7.402 -9.828 -8.260 1.00 0.00 H new ATOM 0 HG2 LYS A 247 -5.354 -10.933 -7.487 1.00 0.00 H new ATOM 0 HG3 LYS A 247 -6.110 -12.512 -7.573 1.00 0.00 H new ATOM 0 HD2 LYS A 247 -6.083 -10.814 -10.078 1.00 0.00 H new ATOM 0 HD3 LYS A 247 -4.586 -11.586 -9.593 1.00 0.00 H new ATOM 0 HE2 LYS A 247 -5.355 -13.558 -10.495 1.00 0.00 H new ATOM 0 HE3 LYS A 247 -6.634 -13.587 -9.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 247 -7.553 -13.456 -11.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 247 -7.934 -12.048 -10.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 247 -6.694 -12.020 -11.849 1.00 0.00 H new ATOM 1253 N GLN A 248 -6.509 -12.246 -5.130 1.00 0.00 N ATOM 1254 CA GLN A 248 -6.053 -13.472 -4.421 1.00 0.00 C ATOM 1255 C GLN A 248 -6.565 -13.452 -2.980 1.00 0.00 C ATOM 1256 O GLN A 248 -6.447 -14.418 -2.254 1.00 0.00 O ATOM 1257 CB GLN A 248 -4.525 -13.394 -4.441 1.00 0.00 C ATOM 1258 CG GLN A 248 -3.936 -14.778 -4.154 1.00 0.00 C ATOM 1259 CD GLN A 248 -2.420 -14.665 -3.990 1.00 0.00 C ATOM 1260 OE1 GLN A 248 -1.843 -15.286 -3.120 1.00 0.00 O ATOM 1261 NE2 GLN A 248 -1.744 -13.892 -4.797 1.00 0.00 N ATOM 0 H GLN A 248 -5.904 -11.432 -5.019 1.00 0.00 H new ATOM 0 HA GLN A 248 -6.421 -14.386 -4.887 1.00 0.00 H new ATOM 0 HB2 GLN A 248 -4.182 -13.036 -5.412 1.00 0.00 H new ATOM 0 HB3 GLN A 248 -4.178 -12.678 -3.696 1.00 0.00 H new ATOM 0 HG2 GLN A 248 -4.380 -15.193 -3.249 1.00 0.00 H new ATOM 0 HG3 GLN A 248 -4.174 -15.462 -4.969 1.00 0.00 H new ATOM 0 HE21 GLN A 248 -2.228 -13.370 -5.528 1.00 0.00 H new ATOM 0 HE22 GLN A 248 -0.732 -13.810 -4.696 1.00 0.00 H new ATOM 1270 N PHE A 249 -7.121 -12.347 -2.557 1.00 0.00 N ATOM 1271 CA PHE A 249 -7.623 -12.261 -1.156 1.00 0.00 C ATOM 1272 C PHE A 249 -9.005 -11.596 -1.094 1.00 0.00 C ATOM 1273 O PHE A 249 -9.698 -11.703 -0.102 1.00 0.00 O ATOM 1274 CB PHE A 249 -6.589 -11.403 -0.428 1.00 0.00 C ATOM 1275 CG PHE A 249 -5.310 -12.188 -0.263 1.00 0.00 C ATOM 1276 CD1 PHE A 249 -5.245 -13.228 0.671 1.00 0.00 C ATOM 1277 CD2 PHE A 249 -4.188 -11.876 -1.042 1.00 0.00 C ATOM 1278 CE1 PHE A 249 -4.060 -13.956 0.827 1.00 0.00 C ATOM 1279 CE2 PHE A 249 -3.003 -12.604 -0.885 1.00 0.00 C ATOM 1280 CZ PHE A 249 -2.939 -13.644 0.049 1.00 0.00 C ATOM 0 H PHE A 249 -7.248 -11.505 -3.119 1.00 0.00 H new ATOM 0 HA PHE A 249 -7.742 -13.248 -0.710 1.00 0.00 H new ATOM 0 HB2 PHE A 249 -6.398 -10.489 -0.991 1.00 0.00 H new ATOM 0 HB3 PHE A 249 -6.972 -11.102 0.547 1.00 0.00 H new ATOM 0 HD1 PHE A 249 -6.110 -13.469 1.272 1.00 0.00 H new ATOM 0 HD2 PHE A 249 -4.238 -11.074 -1.763 1.00 0.00 H new ATOM 0 HE1 PHE A 249 -4.010 -14.759 1.548 1.00 0.00 H new ATOM 0 HE2 PHE A 249 -2.138 -12.363 -1.485 1.00 0.00 H new ATOM 0 HZ PHE A 249 -2.025 -14.206 0.170 1.00 0.00 H new ATOM 1290 N ILE A 250 -9.418 -10.901 -2.124 1.00 0.00 N ATOM 1291 CA ILE A 250 -10.756 -10.240 -2.063 1.00 0.00 C ATOM 1292 C ILE A 250 -11.639 -10.677 -3.239 1.00 0.00 C ATOM 1293 O ILE A 250 -12.847 -10.720 -3.131 1.00 0.00 O ATOM 1294 CB ILE A 250 -10.453 -8.735 -2.109 1.00 0.00 C ATOM 1295 CG1 ILE A 250 -10.160 -8.239 -0.694 1.00 0.00 C ATOM 1296 CG2 ILE A 250 -11.654 -7.967 -2.660 1.00 0.00 C ATOM 1297 CD1 ILE A 250 -8.693 -7.818 -0.594 1.00 0.00 C ATOM 0 H ILE A 250 -8.897 -10.764 -2.990 1.00 0.00 H new ATOM 0 HA ILE A 250 -11.311 -10.511 -1.165 1.00 0.00 H new ATOM 0 HB ILE A 250 -9.592 -8.569 -2.757 1.00 0.00 H new ATOM 0 HG12 ILE A 250 -10.808 -7.397 -0.451 1.00 0.00 H new ATOM 0 HG13 ILE A 250 -10.374 -9.025 0.030 1.00 0.00 H new ATOM 0 HG21 ILE A 250 -11.424 -6.902 -2.686 1.00 0.00 H new ATOM 0 HG22 ILE A 250 -11.877 -8.315 -3.669 1.00 0.00 H new ATOM 0 HG23 ILE A 250 -12.519 -8.135 -2.019 1.00 0.00 H new ATOM 0 HD11 ILE A 250 -8.484 -7.464 0.416 1.00 0.00 H new ATOM 0 HD12 ILE A 250 -8.053 -8.671 -0.819 1.00 0.00 H new ATOM 0 HD13 ILE A 250 -8.495 -7.018 -1.307 1.00 0.00 H new ATOM 1309 N ILE A 251 -11.056 -11.002 -4.357 1.00 0.00 N ATOM 1310 CA ILE A 251 -11.885 -11.431 -5.521 1.00 0.00 C ATOM 1311 C ILE A 251 -11.331 -12.732 -6.110 1.00 0.00 C ATOM 1312 O ILE A 251 -10.802 -13.567 -5.404 1.00 0.00 O ATOM 1313 CB ILE A 251 -11.787 -10.294 -6.548 1.00 0.00 C ATOM 1314 CG1 ILE A 251 -11.623 -8.944 -5.839 1.00 0.00 C ATOM 1315 CG2 ILE A 251 -13.066 -10.263 -7.386 1.00 0.00 C ATOM 1316 CD1 ILE A 251 -11.520 -7.829 -6.881 1.00 0.00 C ATOM 0 H ILE A 251 -10.049 -10.990 -4.517 1.00 0.00 H new ATOM 0 HA ILE A 251 -12.919 -11.619 -5.233 1.00 0.00 H new ATOM 0 HB ILE A 251 -10.920 -10.469 -7.185 1.00 0.00 H new ATOM 0 HG12 ILE A 251 -12.471 -8.762 -5.179 1.00 0.00 H new ATOM 0 HG13 ILE A 251 -10.730 -8.956 -5.214 1.00 0.00 H new ATOM 0 HG21 ILE A 251 -13.002 -9.457 -8.117 1.00 0.00 H new ATOM 0 HG22 ILE A 251 -13.185 -11.215 -7.904 1.00 0.00 H new ATOM 0 HG23 ILE A 251 -13.924 -10.095 -6.735 1.00 0.00 H new ATOM 0 HD11 ILE A 251 -11.403 -6.870 -6.377 1.00 0.00 H new ATOM 0 HD12 ILE A 251 -10.657 -8.009 -7.522 1.00 0.00 H new ATOM 0 HD13 ILE A 251 -12.426 -7.813 -7.487 1.00 0.00 H new