Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qqc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N LYS 21.A O no hydrogen 3.226 N/A LEU 3.A N PHE 19.A O no hydrogen 2.851 N/A ALA 5.A N ASP 4.A OD2 no hydrogen 2.626 N/A ASP 6.A N ARG 17.A O no hydrogen 3.145 N/A ILE 8.A N VAL 15.A O no hydrogen 3.067 N/A GLU 10.A N LYS 13.A O no hydrogen 3.049 N/A LYS 13.A N GLU 10.A O no hydrogen 3.081 N/A VAL 15.A N ILE 8.A O no hydrogen 2.906 N/A ILE 16.A N ASP 31.A O no hydrogen 3.068 N/A ARG 17.A N ASP 6.A O no hydrogen 3.112 N/A ARG 17.A NE ASP 6.A OD1 no hydrogen 3.117 N/A ARG 17.A NH1 ASP 235.A OD2 no hydrogen 3.498 N/A ARG 17.A NH2 ASP 6.A OD1 no hydrogen 3.532 N/A ARG 17.A NH2 ASP 6.A OD2 no hydrogen 2.947 N/A VAL 18.A N ASP 29.A O no hydrogen 3.015 N/A PHE 19.A N ASP 4.A O no hydrogen 2.905 N/A LYS 20.A N LYS 27.A O no hydrogen 2.960 N/A LYS 20.A NZ ASP 29.A OD2 no hydrogen 3.105 N/A LYS 21.A N MET 1.A O no hydrogen 3.016 N/A LYS 21.A NZ ASP 204.A OD1 no hydrogen 3.285 N/A GLU 22.A N GLU 25.A O no hydrogen 3.166 N/A LYS 23.A N GLU 133.A OE2 no hydrogen 2.632 N/A LYS 27.A N LYS 20.A O no hydrogen 2.993 N/A ASP 29.A N VAL 18.A O no hydrogen 3.059 N/A ASP 31.A N ILE 16.A O no hydrogen 3.056 N/A ARG 32.A NH1 GLU 10.A OE1 no hydrogen 3.447 N/A ARG 32.A NH2 GLU 10.A OE1 no hydrogen 3.141 N/A ASP 33.A N ASP 31.A OD1 no hydrogen 3.015 N/A TYR 37.A OH ASP 123.A OD2 no hydrogen 2.706 N/A ILE 38.A N LEU 85.A O no hydrogen 2.924 N/A TYR 39.A N TYR 110.A O no hydrogen 2.998 N/A ALA 40.A N TRP 83.A O no hydrogen 2.949 N/A LEU 41.A N ASP 108.A O no hydrogen 3.056 N/A LYS 43.A N ALA 105.A O no hydrogen 2.908 N/A SER 46.A N ASP 44.A OD2 no hydrogen 3.272 N/A SER 46.A OG ASP 44.A OD2 no hydrogen 2.670 N/A ALA 47.A N ASP 44.A O no hydrogen 2.972 N/A ILE 48.A N ASP 45.A O no hydrogen 3.171 N/A ASP 50.A N ALA 47.A O no hydrogen 2.893 N/A ILE 51.A N ALA 47.A O no hydrogen 2.961 N/A LYS 52.A N ILE 48.A O no hydrogen 2.796 N/A LYS 53.A N ASP 50.A O no hydrogen 3.123 N/A ILE 54.A N ILE 51.A O no hydrogen 3.200 N/A THR 55.A OG1 ALA 56.A O no hydrogen 3.505 N/A THR 55.A OG1 VAL 63.A O no hydrogen 2.705 N/A ALA 56.A N VAL 63.A O no hydrogen 3.240 N/A ARG 58.A N THR 61.A O no hydrogen 3.059 N/A THR 61.A N ARG 58.A O no hydrogen 3.067 N/A VAL 63.A N ALA 56.A O no hydrogen 2.622 N/A THR 66.A N TYR 86.A O no hydrogen 2.990 N/A ARG 67.A NH2 GLU 35.A OE1 no hydrogen 3.305 N/A GLU 69.A N LYS 84.A O no hydrogen 3.336 N/A ARG 70.A NE GLU 81.A OE1 no hydrogen 2.904 N/A ARG 70.A NE GLU 81.A OE2 no hydrogen 2.540 N/A VAL 71.A N VAL 82.A O no hydrogen 2.816 N/A LYS 73.A N VAL 80.A O no hydrogen 3.029 N/A LYS 73.A NZ TYR 39.A OH no hydrogen 3.234 N/A LYS 73.A NZ ASN 365.A OD1 no hydrogen 3.299 N/A LYS 74.A N ASN 365.A O no hydrogen 3.329 N/A LYS 74.A NZ ARG 364.A O no hydrogen 3.460 N/A PHE 75.A N ARG 78.A O no hydrogen 3.128 N/A VAL 80.A N LYS 73.A O no hydrogen 2.905 N/A VAL 82.A N VAL 71.A O no hydrogen 3.111 N/A TRP 83.A N ALA 40.A O no hydrogen 2.860 N/A LYS 84.A N GLU 69.A O no hydrogen 3.005 N/A LYS 84.A NZ TYR 86.A OH no hydrogen 2.728 N/A LEU 85.A N ILE 38.A O no hydrogen 2.977 N/A TYR 86.A N ARG 67.A O no hydrogen 3.207 N/A TYR 86.A OH GLU 69.A OE2 no hydrogen 3.279 N/A PHE 87.A N PRO 36.A O no hydrogen 3.284 N/A ASP 92.A N HIS 89.A O no hydrogen 2.830 N/A VAL 93.A N PRO 90.A O no hydrogen 3.163 N/A ALA 95.A N ASP 92.A O no hydrogen 3.038 N/A ILE 96.A N VAL 93.A O no hydrogen 3.243 N/A ARG 97.A N VAL 93.A O no hydrogen 3.101 N/A ARG 97.A NH1 TYR 112.A O no hydrogen 3.105 N/A ILE 100.A N ILE 96.A O no hydrogen 3.391 N/A ARG 101.A N ARG 97.A O no hydrogen 3.171 N/A ARG 101.A N ASP 98.A O no hydrogen 3.079 N/A ARG 101.A NH1 TYR 112.A OH no hydrogen 3.183 N/A GLU 102.A N LYS 99.A O no hydrogen 2.901 N/A ALA 105.A N HIS 103.A ND1 no hydrogen 2.873 N/A VAL 107.A N LEU 41.A O no hydrogen 2.763 N/A ILE 109.A N ASP 108.A OD1 no hydrogen 2.560 N/A TYR 110.A N TYR 39.A O no hydrogen 2.850 N/A ARG 119.A N PRO 115.A O no hydrogen 2.983 N/A ARG 119.A NH1 ASP 123.A OD1 no hydrogen 2.725 N/A ARG 119.A NH1 ASP 123.A OD2 no hydrogen 3.524 N/A TYR 120.A N PHE 116.A O no hydrogen 3.072 N/A TYR 120.A OH ASP 31.A OD2 no hydrogen 2.791 N/A LEU 121.A N ALA 117.A O no hydrogen 3.011 N/A ILE 122.A N LYS 118.A O no hydrogen 3.010 N/A ASP 123.A N ARG 119.A O no hydrogen 2.945 N/A ARG 124.A N TYR 120.A O no hydrogen 2.917 N/A ARG 124.A NH1 ASP 31.A OD2 no hydrogen 2.888 N/A GLY 125.A N ILE 122.A O no hydrogen 3.326 N/A LEU 126.A N LEU 121.A O no hydrogen 2.904 N/A MET 129.A N ILE 2.A O no hydrogen 3.042 N/A ARG 136.A N ASP 204.A OD2 no hydrogen 3.136 N/A ARG 136.A NH1 LYS 201.A O no hydrogen 2.675 N/A LEU 138.A N VAL 205.A O no hydrogen 3.055 N/A ALA 139.A N ALA 163.A O no hydrogen 3.249 N/A ASP 141.A N SER 161.A O no hydrogen 2.790 N/A GLU 143.A N MET 159.A O no hydrogen 2.801 N/A GLU 154.A N GLU 151.A O no hydrogen 3.501 N/A ILE 157.A N GLU 187.A OE1 no hydrogen 3.240 N/A MET 159.A N GLU 143.A O no hydrogen 3.155 N/A SER 161.A N ASP 141.A O no hydrogen 2.902 N/A TYR 162.A N ARG 169.A O no hydrogen 3.200 N/A ALA 163.A N ALA 139.A O no hydrogen 3.130 N/A ASP 164.A N GLY 167.A O no hydrogen 3.298 N/A GLU 166.A N ASP 164.A OD1 no hydrogen 2.786 N/A VAL 170.A N TYR 180.A O no hydrogen 3.390 N/A ILE 171.A N ILE 160.A O no hydrogen 3.207 N/A THR 172.A N GLU 182.A O no hydrogen 2.549 N/A THR 172.A OG1 GLU 182.A O no hydrogen 2.854 N/A SER 183.A OG LYS 174.A O no hydrogen 2.664 N/A VAL 184.A N THR 172.A O no hydrogen 2.645 N/A MET 190.A N THR 186.A O no hydrogen 2.979 N/A MET 190.A N GLU 187.A O no hydrogen 2.925 N/A ILE 191.A N GLU 187.A O no hydrogen 2.763 N/A LYS 192.A N LYS 188.A O no hydrogen 3.034 N/A ARG 193.A N GLU 189.A O no hydrogen 3.221 N/A PHE 194.A N MET 190.A O no hydrogen 2.917 N/A LEU 195.A N ILE 191.A O no hydrogen 3.141 N/A LYS 196.A N LYS 192.A O no hydrogen 3.085 N/A VAL 197.A N ARG 193.A O no hydrogen 3.150 N/A VAL 197.A N PHE 194.A O no hydrogen 3.064 N/A ILE 198.A N PHE 194.A O no hydrogen 3.405 N/A GLN 199.A N LEU 195.A O no hydrogen 3.123 N/A GLU 200.A N VAL 197.A O no hydrogen 2.738 N/A LYS 201.A N VAL 197.A O no hydrogen 3.107 N/A ASP 202.A N ILE 198.A O no hydrogen 2.649 N/A ASP 204.A N ARG 136.A O no hydrogen 2.990 N/A VAL 205.A N ARG 136.A O no hydrogen 3.306 N/A LEU 206.A N ILE 256.A O no hydrogen 2.924 N/A ILE 207.A N LEU 138.A O no hydrogen 2.886 N/A THR 208.A N PHE 258.A O no hydrogen 3.124 N/A ASN 210.A N ASP 259.A OD1 no hydrogen 2.971 N/A ASP 212.A N ASP 259.A OD2 no hydrogen 2.880 N/A ASN 213.A N ASN 210.A O no hydrogen 3.163 N/A ASN 213.A ND2 ASN 210.A OD1 no hydrogen 3.529 N/A PHE 214.A N ASN 210.A O no hydrogen 3.241 N/A TYR 218.A OH GLY 155.A O no hydrogen 2.773 N/A LEU 219.A N ASP 215.A O no hydrogen 3.361 N/A LYS 221.A NZ PHE 152.A O no hydrogen 2.810 N/A ARG 222.A N TYR 218.A O no hydrogen 3.022 N/A SER 223.A N LYS 220.A O no hydrogen 2.784 N/A SER 223.A OG VAL 228.A O no hydrogen 3.095 N/A GLU 224.A N LYS 220.A O no hydrogen 3.111 N/A GLU 224.A N LYS 221.A O no hydrogen 3.254 N/A VAL 228.A N SER 223.A O no hydrogen 2.955 N/A LEU 232.A N SER 237.A O no hydrogen 3.395 N/A GLY 233.A N SER 237.A O no hydrogen 3.376 N/A ARG 234.A N LYS 253.A O no hydrogen 3.013 N/A ARG 234.A NE ASP 202.A OD1 no hydrogen 3.193 N/A ARG 234.A NH1 ASP 204.A OD1 no hydrogen 3.185 N/A ARG 234.A NH1 GLY 254.A O no hydrogen 3.084 N/A ARG 234.A NH2 ASP 202.A O no hydrogen 3.323 N/A ARG 234.A NH2 ASP 202.A OD2 no hydrogen 3.436 N/A ARG 234.A NH2 ASP 204.A OD1 no hydrogen 2.674 N/A GLY 236.A N GLY 233.A O no hydrogen 2.629 N/A SER 237.A N ASP 235.A OD1 no hydrogen 3.010 N/A SER 237.A OG ASP 235.A OD1 no hydrogen 2.886 N/A LYS 240.A N GLU 251.A O no hydrogen 2.967 N/A GLN 242.A N ALA 249.A O no hydrogen 2.931 N/A PHE 248.A N ASN 213.A OD1 no hydrogen 3.258 N/A ALA 249.A N GLN 242.A O no hydrogen 3.303 N/A VAL 250.A N ASP 212.A OD1 no hydrogen 2.522 N/A GLU 251.A N LYS 240.A O no hydrogen 3.166 N/A LYS 253.A NZ ASP 6.A OD2 no hydrogen 2.930 N/A LYS 253.A NZ GLU 251.A OE1 no hydrogen 3.134 N/A ARG 255.A N VAL 252.A O no hydrogen 2.851 N/A PHE 258.A N LEU 206.A O no hydrogen 2.908 N/A LEU 260.A N THR 208.A O no hydrogen 2.958 N/A TYR 261.A N ASP 259.A OD1 no hydrogen 2.952 N/A ILE 264.A N LEU 260.A O no hydrogen 3.044 N/A ARG 265.A N TYR 261.A O no hydrogen 2.911 N/A ARG 266.A N VAL 263.A O no hydrogen 2.667 N/A ARG 266.A NH1 VAL 344.A O no hydrogen 3.539 N/A THR 267.A N VAL 263.A O no hydrogen 2.710 N/A THR 267.A OG1 VAL 263.A O no hydrogen 3.431 N/A ILE 268.A N ILE 264.A O no hydrogen 3.333 N/A LEU 270.A N TYR 273.A OH no hydrogen 3.319 N/A TYR 273.A OH ILE 268.A O no hydrogen 3.290 N/A THR 274.A OG1 TYR 273.A O no hydrogen 2.512 N/A VAL 278.A N THR 274.A O no hydrogen 2.752 N/A GLU 280.A N THR 277.A O no hydrogen 2.860 N/A GLY 284.A N GLU 280.A O no hydrogen 3.182 N/A LYS 287.A NZ GLU 276.A OE1 no hydrogen 2.993 N/A LYS 287.A NZ ASP 315.A OD2 no hydrogen 2.416 N/A ILE 295.A N ALA 292.A O no hydrogen 3.003 N/A ARG 297.A N GLU 293.A O no hydrogen 2.918 N/A ALA 298.A N GLU 294.A O no hydrogen 3.017 N/A TRP 299.A N ILE 295.A O no hydrogen 3.135 N/A GLU 300.A N ALA 296.A O no hydrogen 3.025 N/A ARG 307.A N GLY 304.A O no hydrogen 2.796 N/A VAL 308.A N GLY 304.A O no hydrogen 3.089 N/A ALA 309.A N LEU 305.A O no hydrogen 3.082 N/A TYR 311.A N ARG 307.A O no hydrogen 3.409 N/A SER 312.A N VAL 308.A O no hydrogen 3.381 N/A MET 313.A N ALA 309.A O no hydrogen 3.363 N/A GLU 314.A N ARG 310.A O no hydrogen 3.065 N/A ASP 315.A N TYR 311.A O no hydrogen 2.897 N/A ALA 316.A N SER 312.A O no hydrogen 2.880 N/A LYS 317.A N MET 313.A O no hydrogen 2.944 N/A ALA 318.A N GLU 314.A O no hydrogen 2.811 N/A THR 319.A N ASP 315.A O no hydrogen 2.993 N/A THR 319.A OG1 ASP 315.A O no hydrogen 2.516 N/A TYR 320.A N ALA 316.A O no hydrogen 3.224 N/A GLU 321.A N LYS 317.A O no hydrogen 3.154 N/A GLY 323.A N THR 319.A O no hydrogen 3.099 N/A LYS 324.A NZ GLU 165.A OE1 no hydrogen 2.981 N/A LYS 324.A NZ GLU 165.A OE2 no hydrogen 3.054 N/A GLU 325.A N LEU 322.A O no hydrogen 2.873 N/A PHE 326.A N LEU 322.A O no hydrogen 3.112 N/A ALA 331.A N PHE 327.A O no hydrogen 2.879 N/A GLN 332.A N PRO 328.A O no hydrogen 3.028 N/A LEU 333.A N MET 329.A O no hydrogen 3.061 N/A SER 334.A N GLU 330.A O no hydrogen 3.113 N/A SER 334.A OG GLU 330.A O no hydrogen 3.017 N/A ARG 335.A N ALA 331.A O no hydrogen 3.154 N/A LEU 336.A N GLN 332.A O no hydrogen 2.916 N/A VAL 337.A N LEU 333.A O no hydrogen 2.978 N/A GLY 338.A N SER 334.A O no hydrogen 2.796 N/A SER 340.A OG ASP 4.A OD2 no hydrogen 3.506 N/A SER 340.A OG ASP 343.A OD2 no hydrogen 3.075 N/A TRP 342.A NE1 VAL 250.A O no hydrogen 3.078 N/A VAL 344.A N SER 340.A O no hydrogen 2.964 N/A SER 345.A N LEU 341.A O no hydrogen 2.991 N/A SER 345.A OG LEU 341.A O no hydrogen 2.792 N/A SER 345.A OG TRP 342.A O no hydrogen 3.164 N/A ARG 346.A N ASP 343.A O no hydrogen 3.190 N/A ARG 346.A NE ASP 212.A OD2 no hydrogen 2.923 N/A ARG 346.A NH1 HIS 257.A O no hydrogen 3.267 N/A ARG 346.A NH1 TRP 342.A O no hydrogen 3.002 N/A ARG 346.A NH2 ASP 212.A OD1 no hydrogen 3.221 N/A ARG 346.A NH2 ASP 212.A OD2 no hydrogen 3.121 N/A ARG 346.A NH2 HIS 257.A O no hydrogen 2.933 N/A SER 347.A N VAL 344.A O no hydrogen 3.237 N/A SER 347.A OG VAL 344.A O no hydrogen 3.387 N/A ASN 351.A N SER 348.A OG no hydrogen 3.415 N/A LEU 352.A N SER 348.A O no hydrogen 3.111 N/A VAL 353.A N THR 349.A O no hydrogen 2.987 N/A GLU 354.A N GLY 350.A O no hydrogen 3.098 N/A TRP 355.A N ASN 351.A O no hydrogen 3.005 N/A PHE 356.A N LEU 352.A O no hydrogen 3.102 N/A LEU 357.A N VAL 353.A O no hydrogen 2.900 N/A LEU 358.A N GLU 354.A O no hydrogen 3.010 N/A ARG 359.A NH2 LEU 121.A O no hydrogen 3.020 N/A LYS 360.A N PHE 356.A O no hydrogen 3.335 N/A ALA 361.A N LEU 357.A O no hydrogen 2.793 N/A TYR 362.A N LEU 358.A O no hydrogen 3.184 N/A GLU 363.A N ARG 359.A O no hydrogen 3.019 N/A ARG 364.A N LYS 360.A O no hydrogen 2.884 N/A ASN 365.A N TYR 362.A O no hydrogen 3.062 N/A ASN 365.A ND2 LYS 72.A O no hydrogen 3.135 N/A ASP 366.A N ALA 361.A O no hydrogen 2.866 N/A VAL 367.A N LYS 74.A O no hydrogen 2.807 N/A ALA 368.A N GLU 111.A OE1 no hydrogen 3.436 N/A ASN 370.A ND2 ILE 109.A O no hydrogen 3.114 N/A GLU 376.A N ASP 373.A OD2 no hydrogen 2.921 N/A LEU 377.A N ASP 373.A O no hydrogen 2.993 N/A ALA 378.A N GLU 374.A O no hydrogen 3.117 N/A ARG 379.A N ARG 375.A O no hydrogen 2.995 N/A ARG 380.A N GLU 376.A O no hydrogen 3.160 N/A ARG 380.A NH1 ALA 496.A O no hydrogen 2.796 N/A ARG 380.A NH1 ALA 498.A O no hydrogen 3.119 N/A THR 381.A N ALA 378.A O no hydrogen 3.463 N/A THR 381.A OG1 ALA 378.A O no hydrogen 2.745 N/A GLU 382.A N ARG 379.A O no hydrogen 3.201 N/A GLU 389.A N LEU 533.A O no hydrogen 3.021 N/A TRP 393.A N GLY 582.A O no hydrogen 3.133 N/A TRP 393.A NE1 LYS 390.A O no hydrogen 3.174 N/A ASN 395.A N ARG 580.A O no hydrogen 3.172 N/A ASN 395.A ND2 ALA 547.A O no hydrogen 2.586 N/A ILE 396.A N TYR 579.A O no hydrogen 2.863 N/A VAL 397.A N ALA 542.A O no hydrogen 2.924 N/A TYR 398.A N GLY 577.A O no hydrogen 3.301 N/A LEU 399.A N PHE 540.A O no hydrogen 2.928 N/A ASP 400.A N GLU 574.A O no hydrogen 2.925 N/A TYR 401.A OH THR 520.A OG1 no hydrogen 2.664 N/A LYS 402.A N GLU 572.A O no hydrogen 2.980 N/A SER 407.A N SER 403.A O no hydrogen 2.945 N/A ILE 408.A N LEU 404.A O no hydrogen 3.029 N/A ILE 409.A N TYR 405.A O no hydrogen 2.861 N/A ILE 410.A N PRO 406.A O no hydrogen 3.168 N/A THR 411.A N SER 407.A O no hydrogen 3.034 N/A THR 411.A OG1 SER 407.A O no hydrogen 2.898 N/A HIS 412.A N ILE 408.A O no hydrogen 2.994 N/A ASN 413.A N ILE 410.A O no hydrogen 3.110 N/A ASN 413.A ND2 CYS 438.A O no hydrogen 2.936 N/A ASN 413.A ND2 PHE 441.A O no hydrogen 3.119 N/A VAL 414.A N ILE 409.A O no hydrogen 3.136 N/A SER 415.A N THR 418.A OG1 no hydrogen 3.256 N/A SER 415.A OG ASP 417.A OD1 no hydrogen 2.423 N/A THR 418.A N SER 415.A O no hydrogen 3.095 N/A THR 418.A OG1 ASN 413.A O no hydrogen 3.039 N/A THR 418.A OG1 SER 415.A O no hydrogen 3.122 N/A ASN 420.A N ARG 436.A O no hydrogen 2.774 N/A ARG 421.A NH1 GLY 77.A O no hydrogen 2.946 N/A CYS 424.A SG GLU 426.A O no hydrogen 3.018 N/A CYS 424.A SG ASP 440.A OD2 no hydrogen 3.644 N/A ARG 425.A N ASP 440.A OD2 no hydrogen 2.956 N/A ASP 428.A N PHE 437.A O no hydrogen 3.174 N/A ALA 430.A N HIS 435.A O no hydrogen 2.837 N/A ARG 436.A N ASN 420.A OD1 no hydrogen 3.164 N/A PHE 437.A N ASP 428.A O no hydrogen 3.077 N/A CYS 438.A N THR 418.A O no hydrogen 2.966 N/A CYS 438.A SG GLU 426.A O no hydrogen 3.921 N/A CYS 438.A SG ASP 440.A OD2 no hydrogen 3.333 N/A LYS 439.A N GLU 426.A O no hydrogen 2.868 N/A LYS 439.A NZ THR 411.A O no hydrogen 3.273 N/A LYS 439.A NZ ASP 428.A OD1 no hydrogen 2.746 N/A GLY 443.A N ASN 413.A OD1 no hydrogen 2.876 N/A PHE 444.A N ASP 417.A OD2 no hydrogen 3.064 N/A SER 447.A N GLY 443.A O no hydrogen 3.071 N/A SER 447.A OG GLY 443.A O no hydrogen 3.126 N/A LEU 448.A N PHE 444.A O no hydrogen 3.498 N/A LEU 449.A N ILE 445.A O no hydrogen 2.911 N/A GLY 450.A N PRO 446.A O no hydrogen 2.832 N/A ASP 451.A N SER 447.A O no hydrogen 2.964 N/A LEU 452.A N LEU 448.A O no hydrogen 2.974 N/A LEU 453.A N LEU 449.A O no hydrogen 3.069 N/A GLU 454.A N GLY 450.A O no hydrogen 3.424 N/A GLU 455.A N LEU 452.A O no hydrogen 2.953 N/A ARG 456.A N LEU 452.A O no hydrogen 3.016 N/A GLN 457.A N LEU 453.A O no hydrogen 3.213 N/A LYS 458.A N GLU 454.A O no hydrogen 3.216 N/A LYS 458.A N GLU 455.A O no hydrogen 2.989 N/A VAL 459.A N GLU 455.A O no hydrogen 3.120 N/A LYS 460.A N ARG 456.A O no hydrogen 3.056 N/A LYS 461.A N GLN 457.A O no hydrogen 3.286 N/A LYS 462.A N LYS 458.A O no hydrogen 3.268 N/A MET 463.A N VAL 459.A O no hydrogen 2.802 N/A LYS 464.A N LYS 460.A O no hydrogen 2.890 N/A ALA 465.A N LYS 462.A O no hydrogen 3.393 N/A THR 466.A N LYS 462.A O no hydrogen 3.234 N/A THR 466.A OG1 GLU 471.A OE1 no hydrogen 2.543 N/A ILE 470.A N ASP 468.A OD1 no hydrogen 2.578 N/A GLU 471.A N ASP 468.A OD1 no hydrogen 3.276 N/A ARG 472.A N ASP 468.A O no hydrogen 2.933 N/A LYS 473.A N PRO 469.A O no hydrogen 3.206 N/A LEU 474.A N ILE 470.A O no hydrogen 3.247 N/A LEU 475.A N GLU 471.A O no hydrogen 2.926 N/A ASP 476.A N ARG 472.A O no hydrogen 3.092 N/A TYR 477.A N LYS 473.A O no hydrogen 3.102 N/A ARG 478.A N LEU 474.A O no hydrogen 3.060 N/A ARG 478.A NE GLN 332.A OE1 no hydrogen 3.111 N/A GLN 479.A N LEU 475.A O no hydrogen 3.016 N/A ARG 480.A N ASP 476.A O no hydrogen 3.080 N/A ARG 480.A NE ASP 476.A OD2 no hydrogen 3.382 N/A ALA 481.A N TYR 477.A O no hydrogen 3.026 N/A ILE 482.A N ARG 478.A O no hydrogen 3.435 N/A ILE 484.A N ARG 480.A O no hydrogen 3.031 N/A LEU 485.A N ALA 481.A O no hydrogen 2.984 N/A ALA 486.A N ILE 482.A O no hydrogen 2.951 N/A ASN 487.A N LYS 483.A O no hydrogen 2.923 N/A SER 488.A N LEU 485.A O no hydrogen 2.840 N/A SER 488.A OG ILE 484.A O no hydrogen 2.827 N/A TYR 489.A N ALA 486.A O no hydrogen 3.481 N/A TYR 490.A OH THR 510.A OG1 no hydrogen 2.478 N/A TYR 492.A N SER 488.A O no hydrogen 3.064 N/A TYR 492.A OH GLU 354.A OE2 no hydrogen 2.479 N/A TYR 493.A N TYR 489.A O no hydrogen 3.095 N/A TYR 493.A OH VAL 414.A O no hydrogen 2.804 N/A ALA 494.A N GLY 491.A O no hydrogen 3.245 N/A TYR 495.A N TYR 492.A O no hydrogen 2.719 N/A ALA 498.A N TYR 495.A O no hydrogen 2.805 N/A ARG 499.A N GLU 354.A OE1 no hydrogen 3.479 N/A ARG 499.A N GLU 354.A OE2 no hydrogen 3.255 N/A ARG 499.A NH2 ASP 113.A OD2 no hydrogen 2.966 N/A TRP 500.A N TYR 492.A OH no hydrogen 3.059 N/A CYS 502.A N TYR 493.A O no hydrogen 3.060 N/A ARG 503.A NE TYR 384.A OH no hydrogen 3.030 N/A ARG 503.A NH2 GLU 382.A O no hydrogen 2.434 N/A GLU 504.A N GLU 504.A OE2 no hydrogen 2.389 N/A CYS 505.A N CYS 502.A O no hydrogen 3.211 N/A ALA 506.A N CYS 502.A O no hydrogen 3.242 N/A GLU 507.A N ARG 503.A O no hydrogen 3.157 N/A SER 508.A N GLU 504.A O no hydrogen 3.276 N/A SER 508.A OG GLU 504.A O no hydrogen 2.581 N/A VAL 509.A N CYS 505.A O no hydrogen 2.907 N/A THR 510.A N ALA 506.A O no hydrogen 3.067 N/A THR 510.A OG1 TYR 490.A OH no hydrogen 2.478 N/A THR 510.A OG1 ALA 506.A O no hydrogen 3.028 N/A ALA 511.A N GLU 507.A O no hydrogen 2.929 N/A TRP 512.A N SER 508.A O no hydrogen 2.973 N/A GLY 513.A N VAL 509.A O no hydrogen 3.164 N/A ARG 514.A N THR 510.A O no hydrogen 3.402 N/A GLN 515.A N ALA 511.A O no hydrogen 3.229 N/A TYR 516.A N TRP 512.A O no hydrogen 3.064 N/A ILE 517.A N GLY 513.A O no hydrogen 3.250 N/A GLU 518.A N ARG 514.A O no hydrogen 3.043 N/A THR 519.A N GLN 515.A O no hydrogen 3.017 N/A THR 519.A OG1 TYR 516.A O no hydrogen 3.347 N/A THR 520.A N TYR 516.A O no hydrogen 3.093 N/A THR 520.A OG1 TYR 401.A OH no hydrogen 2.664 N/A THR 520.A OG1 TYR 516.A O no hydrogen 2.822 N/A MET 521.A N ILE 517.A O no hydrogen 3.129 N/A ARG 522.A N GLU 518.A O no hydrogen 3.215 N/A ARG 522.A N THR 519.A O no hydrogen 3.270 N/A ARG 522.A NE GLU 526.A OE1 no hydrogen 3.170 N/A GLU 523.A N THR 519.A O no hydrogen 3.123 N/A ILE 524.A N THR 520.A O no hydrogen 3.286 N/A GLU 526.A N ARG 522.A O no hydrogen 3.114 N/A LYS 527.A N GLU 523.A O no hydrogen 2.887 N/A PHE 528.A N ILE 524.A O no hydrogen 3.280 N/A PHE 530.A N ILE 524.A O no hydrogen 3.203 N/A LYS 531.A N THR 543.A O no hydrogen 2.893 N/A LYS 531.A NZ GLU 389.A OE1 no hydrogen 3.388 N/A VAL 532.A N GLU 525.A OE1 no hydrogen 3.117 N/A LEU 533.A N PHE 541.A O no hydrogen 2.957 N/A TYR 534.A OH LYS 587.A O no hydrogen 2.952 N/A ASP 536.A N GLY 539.A O no hydrogen 2.929 N/A PHE 540.A N LEU 399.A O no hydrogen 3.164 N/A PHE 541.A N TYR 534.A O no hydrogen 2.929 N/A ALA 542.A N VAL 397.A O no hydrogen 2.920 N/A THR 543.A OG1 GLU 394.A O no hydrogen 3.431 N/A THR 543.A OG1 ASN 395.A O no hydrogen 2.688 N/A ALA 547.A N ILE 544.A O no hydrogen 3.344 N/A GLU 550.A N ASP 548.A OD1 no hydrogen 2.620 N/A VAL 552.A N ASP 548.A O no hydrogen 2.990 N/A VAL 552.A N ALA 549.A O no hydrogen 3.206 N/A LYS 553.A N ALA 549.A O no hydrogen 3.101 N/A LYS 553.A NZ GLU 550.A OE2 no hydrogen 3.123 N/A LYS 553.A NZ GLU 595.A OE1 no hydrogen 3.477 N/A LYS 553.A NZ GLU 595.A OE2 no hydrogen 3.378 N/A ASN 554.A N GLU 550.A O no hydrogen 3.112 N/A LYS 555.A N THR 551.A O no hydrogen 3.225 N/A ALA 556.A N VAL 552.A O no hydrogen 3.050 N/A LYS 557.A N LYS 553.A O no hydrogen 3.322 N/A LYS 557.A N ASN 554.A O no hydrogen 3.028 N/A GLU 558.A N ASN 554.A O no hydrogen 3.100 N/A PHE 559.A N LYS 555.A O no hydrogen 3.213 N/A LEU 560.A N ALA 556.A O no hydrogen 3.163 N/A ASN 561.A N LYS 557.A O no hydrogen 3.409 N/A TYR 562.A N PHE 559.A O no hydrogen 2.921 N/A ILE 563.A N PHE 559.A O no hydrogen 3.036 N/A ILE 563.A N LEU 560.A O no hydrogen 3.093 N/A ASN 564.A N LEU 560.A O no hydrogen 3.176 N/A ARG 566.A N ILE 563.A O no hydrogen 3.040 N/A LEU 567.A N ASN 564.A O no hydrogen 3.035 N/A GLU 574.A N ASP 400.A O no hydrogen 2.535 N/A GLU 576.A N TYR 398.A O no hydrogen 3.255 N/A TYR 579.A N ILE 396.A O no hydrogen 2.684 N/A TYR 579.A OH GLU 576.A OE1 no hydrogen 3.008 N/A ARG 580.A N ILE 593.A O no hydrogen 2.916 N/A ARG 581.A NH1 LEU 627.A O no hydrogen 2.766 N/A ARG 581.A NH1 LYS 628.A O no hydrogen 3.266 N/A GLY 582.A N TRP 393.A O no hydrogen 3.212 N/A PHE 583.A N ALA 591.A O no hydrogen 3.223 N/A VAL 585.A N LYS 589.A O no hydrogen 2.871 N/A THR 586.A N LYS 589.A O no hydrogen 3.489 N/A TYR 590.A N ARG 602.A O no hydrogen 3.277 N/A ALA 591.A N PHE 583.A O no hydrogen 3.281 N/A VAL 592.A N THR 600.A O no hydrogen 2.754 N/A ILE 593.A N ARG 581.A O no hydrogen 3.085 N/A ASP 594.A N LYS 598.A O no hydrogen 2.993 N/A ASP 597.A N ASP 594.A O no hydrogen 3.167 N/A LYS 598.A N ASP 594.A OD2 no hydrogen 2.693 N/A THR 600.A N VAL 592.A O no hydrogen 2.784 N/A THR 601.A OG1 GLU 605.A OE2 no hydrogen 3.422 N/A ARG 602.A N TYR 590.A O no hydrogen 2.870 N/A ARG 602.A NH1 TYR 534.A OH no hydrogen 3.542 N/A ARG 608.A NH1 GLN 720.A OE1 no hydrogen 2.483 N/A ILE 614.A N LYS 655.A O no hydrogen 2.976 N/A LYS 616.A N SER 612.A O no hydrogen 3.283 N/A LYS 616.A N GLU 613.A O no hydrogen 2.946 N/A GLU 617.A N GLU 613.A O no hydrogen 2.979 N/A THR 618.A N ILE 614.A O no hydrogen 3.282 N/A THR 618.A OG1 ILE 614.A O no hydrogen 3.072 N/A GLN 619.A N ALA 615.A O no hydrogen 3.492 N/A GLN 619.A NE2 LEU 604.A O no hydrogen 3.042 N/A ARG 621.A N GLU 617.A O no hydrogen 3.127 N/A VAL 622.A N THR 618.A O no hydrogen 3.007 N/A LEU 623.A N GLN 619.A O no hydrogen 3.192 N/A GLU 624.A N ALA 620.A O no hydrogen 3.176 N/A ALA 625.A N ARG 621.A O no hydrogen 3.175 N/A ILE 626.A N VAL 622.A O no hydrogen 3.316 N/A LEU 627.A N LEU 623.A O no hydrogen 3.070 N/A LYS 628.A N GLU 624.A O no hydrogen 2.894 N/A HIS 629.A N GLU 624.A O no hydrogen 3.177 N/A ASP 631.A N ALA 625.A O no hydrogen 2.828 N/A GLU 634.A N ASP 631.A OD1 no hydrogen 2.556 N/A ALA 635.A N VAL 632.A O no hydrogen 3.011 N/A VAL 636.A N VAL 632.A O no hydrogen 3.254 N/A ARG 637.A N GLU 633.A O no hydrogen 3.197 N/A ILE 638.A N GLU 634.A O no hydrogen 3.031 N/A VAL 639.A N ALA 635.A O no hydrogen 3.223 N/A LYS 640.A N ARG 637.A O no hydrogen 2.968 N/A GLU 641.A N ARG 637.A O no hydrogen 3.208 N/A VAL 642.A N ILE 638.A O no hydrogen 3.333 N/A THR 643.A N VAL 639.A O no hydrogen 3.428 N/A THR 643.A OG1 VAL 639.A O no hydrogen 3.143 N/A THR 643.A OG1 LYS 640.A O no hydrogen 3.098 N/A THR 643.A OG1 LEU 739.A O no hydrogen 3.406 N/A THR 643.A OG1 ARG 740.A O no hydrogen 3.562 N/A GLU 644.A N LYS 640.A O no hydrogen 2.999 N/A GLU 644.A N GLU 641.A O no hydrogen 2.968 N/A LYS 645.A N GLU 641.A O no hydrogen 3.042 N/A LYS 645.A NZ GLU 641.A OE2 no hydrogen 3.065 N/A LEU 646.A N VAL 642.A O no hydrogen 3.066 N/A SER 647.A N GLU 644.A O no hydrogen 3.095 N/A ARG 648.A N LYS 645.A O no hydrogen 3.037 N/A GLU 650.A N LYS 645.A O no hydrogen 2.901 N/A LYS 655.A N PRO 652.A O no hydrogen 3.005 N/A LYS 655.A NZ GLU 617.A OE1 no hydrogen 3.356 N/A VAL 657.A N GLU 654.A O no hydrogen 3.490 N/A ILE 658.A N TYR 685.A O no hydrogen 3.060 N/A GLU 660.A N ILE 683.A O no hydrogen 2.748 N/A ALA 665.A N PRO 662.A O no hydrogen 3.145 N/A VAL 666.A N PRO 662.A O no hydrogen 3.200 N/A ALA 667.A N HIS 663.A O no hydrogen 3.069 N/A LYS 668.A N ALA 665.A O no hydrogen 2.737 N/A ILE 675.A N LEU 670.A O no hydrogen 3.153 N/A TYR 685.A N ILE 658.A O no hydrogen 3.019 N/A ILE 686.A N ILE 699.A O no hydrogen 3.344 N/A VAL 687.A N TYR 716.A OH no hydrogen 3.386 N/A LEU 688.A N ARG 697.A O no hydrogen 2.813 N/A ARG 697.A NH1 LYS 689.A O no hydrogen 3.435 N/A ILE 699.A N ILE 686.A O no hydrogen 3.452 N/A PHE 704.A N ASP 702.A O no hydrogen 2.841 N/A LYS 708.A N ASP 705.A O no hydrogen 3.000 N/A HIS 709.A N ASP 705.A O no hydrogen 3.064 N/A ASP 712.A N VAL 687.A O no hydrogen 3.304 N/A TYR 715.A N ASP 712.A O no hydrogen 3.067 N/A TYR 715.A N ASP 712.A OD1 no hydrogen 2.880 N/A TYR 716.A OH LEU 656.A O no hydrogen 2.683 N/A ILE 717.A N ALA 713.A O no hydrogen 3.228 N/A GLU 718.A N GLU 714.A O no hydrogen 2.998 N/A ASN 719.A N TYR 715.A O no hydrogen 2.838 N/A GLN 720.A NE2 SER 612.A OG no hydrogen 2.472 N/A VAL 721.A N TYR 716.A O no hydrogen 2.768 N/A LEU 722.A N ILE 717.A O no hydrogen 3.370 N/A ALA 724.A N VAL 721.A O no hydrogen 3.205 N/A VAL 725.A N LEU 722.A O no hydrogen 2.865 N/A GLU 726.A N LEU 722.A O no hydrogen 2.872 N/A LEU 729.A N VAL 725.A O no hydrogen 3.280 N/A ARG 730.A N GLU 726.A O no hydrogen 2.915 N/A ALA 731.A N ILE 728.A O no hydrogen 3.297 N/A PHE 732.A N LEU 729.A O no hydrogen 2.919 N/A TYR 734.A N LEU 729.A O no hydrogen 3.182 N/A ARG 735.A N ASP 738.A OD2 no hydrogen 3.440 N/A ASP 738.A N ARG 735.A O no hydrogen 2.894 N/A LEU 739.A N LYS 736.A O no hydrogen 3.154 N/A ARG 740.A NH2 GLU 718.A OE2 no hydrogen 2.907 N/A