Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6rxz_UV.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE ASP 394.A O no hydrogen 3.172 N/A PHE 5.A N ARG 1.A O no hydrogen 2.937 N/A VAL 6.A N ALA 2.A O no hydrogen 2.935 N/A LEU 7.A N ARG 3.A O no hydrogen 3.002 N/A GLU 8.A N ALA 4.A O no hydrogen 2.889 N/A THR 9.A N PHE 5.A O no hydrogen 2.878 N/A THR 9.A OG1 PHE 5.A O no hydrogen 2.751 N/A THR 9.A OG1 VAL 6.A O no hydrogen 2.459 N/A GLU 10.A N VAL 6.A O no hydrogen 2.981 N/A GLU 11.A N LEU 7.A O no hydrogen 2.938 N/A MET 12.A N GLU 8.A O no hydrogen 3.014 N/A LEU 13.A N THR 9.A O no hydrogen 2.907 N/A ASP 14.A N GLU 10.A O no hydrogen 2.942 N/A SER 15.A N GLU 11.A O no hydrogen 2.950 N/A SER 15.A OG GLU 11.A O no hydrogen 3.471 N/A SER 15.A OG MET 12.A O no hydrogen 2.939 N/A VAL 16.A N MET 12.A O no hydrogen 2.902 N/A ALA 23.A N ASP 19.A O no hydrogen 2.988 N/A PHE 24.A N TYR 20.A O no hydrogen 2.962 N/A ASP 25.A N SER 21.A O no hydrogen 2.906 N/A GLY 26.A N GLU 22.A O no hydrogen 2.882 N/A ALA 27.A N ALA 23.A O no hydrogen 2.985 N/A ALA 29.A N ASP 25.A O no hydrogen 2.963 N/A LEU 31.A N ALA 27.A O no hydrogen 2.984 N/A HIS 32.A N ASP 28.A O no hydrogen 2.941 N/A ARG 33.A N ALA 29.A O no hydrogen 2.970 N/A LEU 34.A N LEU 30.A O no hydrogen 2.796 N/A LYS 35.A N LEU 31.A O no hydrogen 2.997 N/A LYS 35.A NZ GLU 39.A OE2 no hydrogen 3.007 N/A GLY 36.A N HIS 32.A O no hydrogen 2.916 N/A SER 37.A N ARG 33.A O no hydrogen 2.980 N/A SER 37.A OG LEU 34.A O no hydrogen 2.802 N/A ILE 38.A N LEU 34.A O no hydrogen 2.870 N/A GLU 39.A N LYS 35.A O no hydrogen 2.929 N/A GLU 39.A N GLY 36.A O no hydrogen 3.270 N/A THR 40.A N GLY 36.A O no hydrogen 2.924 N/A THR 40.A OG1 GLY 36.A O no hydrogen 3.421 N/A THR 40.A OG1 SER 37.A O no hydrogen 2.872 N/A GLN 47.A N VAL 79.A O no hydrogen 2.693 N/A GLN 47.A NE2 VAL 79.A O no hydrogen 2.579 N/A ALA 52.A N PRO 48.A O no hydrogen 2.972 N/A ALA 53.A N LEU 49.A O no hydrogen 2.939 N/A ALA 54.A N LEU 50.A O no hydrogen 2.850 N/A LYS 55.A N ASP 51.A O no hydrogen 3.008 N/A LEU 56.A N ALA 52.A O no hydrogen 2.928 N/A GLU 57.A N ALA 53.A O no hydrogen 2.953 N/A LYS 59.A N LYS 55.A O no hydrogen 3.010 N/A LYS 59.A NZ ALA 137.A O no hydrogen 3.380 N/A LYS 61.A NZ GLN 144.A OE1 no hydrogen 2.899 N/A ASN 74.A N PRO 71.A O no hydrogen 3.140 N/A SER 75.A N PRO 71.A O no hydrogen 2.918 N/A VAL 79.A N GLN 47.A O no hydrogen 2.985 N/A SER 80.A OG HIS 44.A O no hydrogen 3.471 N/A SER 80.A OG PHE 81.A O no hydrogen 3.072 N/A GLN 86.A NE2 ASN 88.A OD1 no hydrogen 3.086 N/A LYS 96.A N TYR 93.A O no hydrogen 3.210 N/A THR 97.A N SER 92.A O no hydrogen 2.931 N/A THR 97.A OG1 TYR 290.A OH no hydrogen 3.342 N/A THR 101.A OG1 ALA 104.A O no hydrogen 2.794 N/A ILE 107.A N ARG 190.A O no hydrogen 3.413 N/A MET 109.A N ARG 192.A O no hydrogen 3.290 N/A VAL 111.A N ILE 194.A O no hydrogen 3.515 N/A LEU 118.A N GLU 115.A O no hydrogen 3.509 N/A GLN 119.A N ASP 122.A OD2 no hydrogen 3.343 N/A ASP 122.A N GLN 119.A O no hydrogen 2.915 N/A LEU 124.A N LYS 121.A O no hydrogen 2.920 N/A LEU 126.A N TYR 236.A OH no hydrogen 3.402 N/A ARG 127.A NH1 ASN 76.A OD1 no hydrogen 2.677 N/A TYR 128.A N ASP 122.A O no hydrogen 3.314 N/A TYR 130.A N LEU 126.A O no hydrogen 3.042 N/A LYS 131.A N ARG 127.A O no hydrogen 3.007 N/A LYS 131.A NZ ASP 122.A OD1 no hydrogen 3.252 N/A LYS 131.A NZ ASP 122.A OD2 no hydrogen 2.679 N/A ARG 132.A N TYR 128.A O no hydrogen 2.851 N/A ARG 132.A NE PRO 195.A O no hydrogen 2.747 N/A ARG 132.A NH1 PRO 165.A O no hydrogen 3.433 N/A ARG 132.A NH2 PRO 195.A O no hydrogen 3.211 N/A ALA 133.A N PHE 129.A O no hydrogen 2.933 N/A TYR 134.A N TYR 130.A O no hydrogen 3.019 N/A TYR 135.A N LYS 131.A O no hydrogen 2.902 N/A LEU 136.A N ARG 132.A O no hydrogen 3.015 N/A ALA 137.A N ALA 133.A O no hydrogen 2.938 N/A VAL 138.A N TYR 134.A O no hydrogen 2.985 N/A VAL 139.A N TYR 135.A O no hydrogen 2.995 N/A ALA 140.A N LEU 136.A O no hydrogen 2.885 N/A ALA 141.A N ALA 137.A O no hydrogen 2.954 N/A HIS 142.A N VAL 138.A O no hydrogen 3.025 N/A HIS 142.A NE2 HIS 44.A NE2 no hydrogen 3.245 N/A LEU 143.A N VAL 139.A O no hydrogen 2.915 N/A GLN 144.A N ALA 140.A O no hydrogen 2.931 N/A LYS 145.A N ALA 141.A O no hydrogen 2.989 N/A ASP 146.A N HIS 142.A O no hydrogen 2.984 N/A ASP 146.A N LEU 143.A O no hydrogen 3.217 N/A LEU 147.A N LEU 143.A O no hydrogen 2.922 N/A LYS 148.A NZ ASP 146.A O no hydrogen 3.321 N/A THR 152.A N LYS 170.A O no hydrogen 2.987 N/A SER 154.A N SER 168.A O no hydrogen 2.965 N/A SER 154.A OG TYR 155.A O no hydrogen 2.952 N/A SER 154.A OG GLU 156.A OE1 no hydrogen 3.372 N/A SER 154.A OG SER 483.A OG no hydrogen 2.897 N/A SER 154.A OG TRP 484.A O no hydrogen 2.637 N/A TYR 155.A N TRP 484.A O no hydrogen 2.795 N/A TYR 155.A OH LEU 62.A O no hydrogen 2.470 N/A GLU 156.A N VAL 166.A O no hydrogen 2.886 N/A HIS 158.A N LEU 164.A O no hydrogen 3.049 N/A ASN 161.A N HIS 158.A O no hydrogen 2.992 N/A LEU 164.A N ASN 161.A O no hydrogen 3.247 N/A VAL 166.A N GLU 156.A O no hydrogen 2.866 N/A SER 168.A N SER 154.A O no hydrogen 2.922 N/A SER 168.A OG GLU 156.A OE2 no hydrogen 2.954 N/A LYS 170.A N THR 152.A O no hydrogen 2.863 N/A LYS 180.A N ASP 178.A OD2 no hydrogen 3.225 N/A LYS 180.A NZ GLU 150.A OE1 no hydrogen 3.055 N/A LYS 182.A N GLU 174.A OE2 no hydrogen 2.777 N/A LYS 184.A NZ GLU 22.A OE2 no hydrogen 3.108 N/A ASP 188.A N LYS 184.A O no hydrogen 3.161 N/A ILE 193.A N LEU 167.A O no hydrogen 3.087 N/A ILE 194.A N MET 109.A O no hydrogen 3.357 N/A CYS 196.A N VAL 111.A O no hydrogen 3.375 N/A CYS 196.A SG VAL 111.A O no hydrogen 4.034 N/A CYS 196.A SG ILE 194.A O no hydrogen 3.915 N/A ALA 197.A N GLU 243.A O no hydrogen 3.395 N/A LEU 207.A N PRO 203.A O no hydrogen 2.916 N/A GLY 210.A N HIS 208.A ND1 no hydrogen 3.062 N/A ALA 211.A N HIS 208.A O no hydrogen 3.215 N/A ARG 215.A N ASP 125.A OD2 no hydrogen 3.035 N/A THR 230.A OG1 GLU 221.A OE1 no hydrogen 2.796 N/A THR 233.A OG1 ALA 438.A O no hydrogen 3.296 N/A ASN 237.A N THR 233.A O no hydrogen 2.987 N/A ASN 237.A ND2 THR 233.A O no hydrogen 3.122 N/A SER 238.A N PRO 234.A O no hydrogen 2.892 N/A SER 238.A OG ASN 368.A O no hydrogen 3.442 N/A THR 239.A N PHE 235.A O no hydrogen 2.899 N/A THR 239.A OG1 PHE 235.A O no hydrogen 2.395 N/A LEU 240.A N TYR 236.A O no hydrogen 2.972 N/A VAL 241.A N ASN 237.A O no hydrogen 3.050 N/A ALA 242.A N SER 238.A O no hydrogen 2.928 N/A GLU 243.A N THR 239.A O no hydrogen 2.939 N/A SER 244.A N LEU 240.A O no hydrogen 2.998 N/A SER 244.A OG LEU 240.A O no hydrogen 2.971 N/A SER 244.A OG VAL 241.A O no hydrogen 2.879 N/A SER 245.A N ALA 242.A O no hydrogen 2.997 N/A SER 245.A OG VAL 241.A O no hydrogen 2.264 N/A GLN 248.A N GLN 248.A OE1 no hydrogen 2.708 N/A LYS 251.A N LEU 247.A O no hydrogen 3.108 N/A LYS 251.A NZ GLN 255.A OE1 no hydrogen 2.816 N/A LEU 252.A N GLN 248.A O no hydrogen 2.908 N/A LEU 253.A N TYR 249.A O no hydrogen 2.920 N/A ARG 254.A N LEU 250.A O no hydrogen 2.913 N/A GLN 255.A N LYS 251.A O no hydrogen 3.025 N/A THR 256.A N LEU 252.A O no hydrogen 2.948 N/A THR 256.A OG1 LEU 253.A O no hydrogen 2.513 N/A GLU 257.A N LEU 253.A O no hydrogen 2.896 N/A LYS 258.A N ARG 254.A O no hydrogen 3.093 N/A LYS 258.A NZ ARG 254.A O no hydrogen 3.136 N/A LYS 258.A NZ GLN 255.A OE1 no hydrogen 3.011 N/A LYS 259.A N GLN 255.A O no hydrogen 2.943 N/A CYS 260.A N THR 256.A O no hydrogen 2.893 N/A CYS 260.A SG THR 256.A O no hydrogen 3.696 N/A ALA 266.A N ALA 262.A O no hydrogen 2.984 N/A CYS 267.A N PHE 263.A O no hydrogen 2.952 N/A CYS 267.A SG PHE 263.A O no hydrogen 3.683 N/A ILE 268.A N ARG 264.A O no hydrogen 2.906 N/A LEU 269.A N ASN 265.A O no hydrogen 2.924 N/A GLY 270.A N ALA 266.A O no hydrogen 2.958 N/A ARG 271.A N CYS 267.A O no hydrogen 2.821 N/A ARG 271.A NE ARG 271.A O no hydrogen 3.177 N/A ILE 272.A N ILE 268.A O no hydrogen 2.983 N/A TRP 273.A N LEU 269.A O no hydrogen 2.933 N/A LEU 274.A N GLY 270.A O no hydrogen 2.960 N/A GLN 275.A N ARG 271.A O no hydrogen 2.866 N/A GLN 276.A N ILE 272.A O no hydrogen 2.978 N/A ARG 277.A N TRP 273.A O no hydrogen 2.893 N/A VAL 283.A N ASN 159.A O no hydrogen 3.192 N/A SER 284.A N ASP 282.A OD1 no hydrogen 3.160 N/A SER 284.A OG ASP 282.A OD1 no hydrogen 3.521 N/A SER 284.A OG ASP 282.A OD2 no hydrogen 3.342 N/A LYS 285.A N ASP 282.A O no hydrogen 2.984 N/A LYS 285.A NZ ASP 282.A OD2 no hydrogen 3.303 N/A GLY 287.A N ASP 282.A O no hydrogen 2.667 N/A GLY 289.A N GLU 292.A OE2 no hydrogen 2.843 N/A TYR 290.A OH THR 97.A OG1 no hydrogen 3.342 N/A TRP 293.A N GLY 289.A O no hydrogen 2.939 N/A ALA 294.A N TYR 290.A O no hydrogen 2.875 N/A VAL 295.A N PHE 291.A O no hydrogen 2.983 N/A LEU 296.A N GLU 292.A O no hydrogen 2.924 N/A LEU 297.A N TRP 293.A O no hydrogen 2.924 N/A ALA 298.A N ALA 294.A O no hydrogen 2.897 N/A LEU 299.A N VAL 295.A O no hydrogen 2.984 N/A LEU 300.A N LEU 296.A O no hydrogen 2.920 N/A LEU 301.A N LEU 297.A O no hydrogen 2.861 N/A GLN 302.A N ALA 298.A O no hydrogen 3.005 N/A GLY 304.A N ALA 351.A O no hydrogen 3.325 N/A THR 308.A OG1 ASP 307.A O no hydrogen 2.620 N/A LYS 309.A N ASP 307.A OD2 no hydrogen 3.346 N/A LEU 314.A N ALA 311.A O no hydrogen 2.750 N/A LEU 323.A N SER 319.A O no hydrogen 2.969 N/A PHE 324.A N SER 320.A O no hydrogen 2.877 N/A LYS 325.A N THR 321.A O no hydrogen 3.025 N/A LYS 325.A NZ ARG 389.A O no hydrogen 3.235 N/A ALA 326.A N GLN 322.A O no hydrogen 2.828 N/A LEU 327.A N LEU 323.A O no hydrogen 2.927 N/A ILE 328.A N PHE 324.A O no hydrogen 2.953 N/A GLN 329.A N LYS 325.A O no hydrogen 2.941 N/A PHE 330.A N ALA 326.A O no hydrogen 2.869 N/A LEU 331.A N LEU 327.A O no hydrogen 2.884 N/A SER 332.A N ILE 328.A O no hydrogen 2.970 N/A VAL 333.A N GLN 329.A O no hydrogen 2.861 N/A VAL 333.A N PHE 330.A O no hydrogen 3.154 N/A THR 334.A N PHE 330.A O no hydrogen 2.959 N/A THR 334.A OG1 ASN 335.A OD1 no hydrogen 2.998 N/A LYS 339.A NZ SER 332.A O no hydrogen 3.152 N/A CYS 341.A N GLU 338.A O no hydrogen 2.769 N/A VAL 342.A N GLU 338.A O no hydrogen 2.984 N/A LEU 343.A N LYS 339.A O no hydrogen 2.867 N/A GLN 345.A N ILE 354.A O no hydrogen 2.901 N/A GLN 345.A NE2 ALA 346.A O no hydrogen 3.304 N/A ALA 351.A N GLN 302.A O no hydrogen 3.424 N/A PHE 353.A N PRO 305.A O no hydrogen 3.373 N/A ILE 354.A N GLN 345.A O no hydrogen 3.025 N/A LEU 360.A N ASN 368.A OD1 no hydrogen 2.636 N/A ASP 362.A N LEU 367.A O no hydrogen 2.888 N/A GLN 366.A N SER 363.A O no hydrogen 3.241 N/A LEU 367.A N ASP 362.A O no hydrogen 3.013 N/A ILE 369.A N LEU 360.A O no hydrogen 2.881 N/A ALA 370.A N ASN 368.A OD1 no hydrogen 3.209 N/A LYS 372.A NZ SER 281.A O no hydrogen 3.309 N/A LYS 372.A NZ GLY 287.A O no hydrogen 3.437 N/A MET 373.A N ALA 370.A O no hydrogen 3.203 N/A GLY 374.A N SER 377.A OG no hydrogen 3.097 N/A SER 377.A OG GLY 374.A O no hydrogen 2.983 N/A ALA 378.A N GLY 374.A O no hydrogen 2.939 N/A ASP 379.A N PRO 375.A O no hydrogen 2.968 N/A LEU 380.A N TRP 376.A O no hydrogen 3.034 N/A LEU 381.A N SER 377.A O no hydrogen 2.900 N/A HIS 382.A N ALA 378.A O no hydrogen 2.986 N/A GLN 383.A N ASP 379.A O no hydrogen 2.985 N/A HIS 384.A N LEU 380.A O no hydrogen 2.983 N/A ALA 385.A N LEU 381.A O no hydrogen 2.869 N/A ARG 386.A N HIS 382.A O no hydrogen 2.986 N/A TRP 387.A N GLN 383.A O no hydrogen 2.991 N/A THR 388.A N HIS 384.A O no hydrogen 2.932 N/A THR 388.A OG1 HIS 384.A O no hydrogen 3.547 N/A THR 388.A OG1 ALA 385.A O no hydrogen 2.810 N/A ARG 389.A N ALA 385.A O no hydrogen 2.874 N/A ARG 389.A NE SER 332.A OG no hydrogen 2.938 N/A LYS 390.A N ARG 386.A O no hydrogen 3.033 N/A LEU 391.A N TRP 387.A O no hydrogen 2.926 N/A LEU 392.A N THR 388.A O no hydrogen 2.939 N/A ALA 393.A N LYS 390.A O no hydrogen 3.165 N/A ASP 394.A N LYS 390.A O no hydrogen 2.977 N/A PHE 400.A N ASP 398.A OD1 no hydrogen 3.393 N/A ILE 405.A N PRO 832.A O no hydrogen 3.286 N/A LYS 407.A N ILE 405.A O no hydrogen 2.941 N/A LYS 407.A NZ VAL 835.A O no hydrogen 2.707 N/A LEU 410.A N LEU 406.A O no hydrogen 2.947 N/A THR 414.A OG1 THR 414.A O no hydrogen 2.411 N/A ARG 420.A NE ALA 419.A O no hydrogen 2.925 N/A ARG 420.A NH1 ALA 419.A O no hydrogen 3.031 N/A LYS 425.A NZ GLU 424.A OE2 no hydrogen 2.995 N/A SER 427.A N PRO 423.A O no hydrogen 3.159 N/A SER 427.A OG ARG 420.A O no hydrogen 2.472 N/A SER 427.A OG SER 427.A O no hydrogen 2.347 N/A ALA 429.A N LEU 578.A O no hydrogen 3.091 N/A ASP 432.A N GLU 424.A OE1 no hydrogen 3.275 N/A ASP 432.A N GLU 424.A OE2 no hydrogen 3.256 N/A LYS 433.A N HIS 436.A ND1 no hydrogen 3.335 N/A GLU 437.A N LYS 433.A O no hydrogen 2.885 N/A ALA 438.A N VAL 434.A O no hydrogen 2.895 N/A ARG 439.A N ALA 435.A O no hydrogen 2.927 N/A ARG 439.A NE ALA 232.A O no hydrogen 3.046 N/A GLY 440.A N HIS 436.A O no hydrogen 2.914 N/A ARG 441.A NH2 PHE 235.A O no hydrogen 3.116 N/A HIS 447.A N TRP 443.A O no hydrogen 2.968 N/A LYS 448.A N GLN 444.A O no hydrogen 2.883 N/A LYS 448.A NZ HIS 577.A O no hydrogen 3.067 N/A LYS 448.A NZ LEU 578.A O no hydrogen 3.529 N/A VAL 449.A N VAL 445.A O no hydrogen 2.951 N/A TYR 450.A N GLY 446.A O no hydrogen 2.949 N/A ARG 451.A N HIS 447.A O no hydrogen 3.014 N/A ILE 452.A N LYS 448.A O no hydrogen 2.881 N/A LEU 453.A N VAL 449.A O no hydrogen 2.961 N/A ARG 454.A N TYR 450.A O no hydrogen 2.994 N/A ARG 455.A N ARG 451.A O no hydrogen 2.992 N/A ARG 455.A NE ARG 451.A O no hydrogen 3.144 N/A ARG 455.A NH1 GLU 531.A OE2 no hydrogen 3.177 N/A ARG 455.A NH2 GLU 531.A OE2 no hydrogen 2.629 N/A ALA 456.A N ILE 452.A O no hydrogen 2.863 N/A LEU 457.A N LEU 453.A O no hydrogen 2.957 N/A SER 458.A N ARG 454.A O no hydrogen 2.980 N/A SER 458.A OG ARG 454.A O no hydrogen 2.788 N/A ASN 461.A ND2 GLY 465.A O no hydrogen 2.569 N/A ARG 469.A N LEU 457.A O no hydrogen 3.519 N/A ARG 469.A NH1 ARG 512.A O no hydrogen 3.538 N/A ARG 469.A NH2 ASP 515.A OD1 no hydrogen 3.307 N/A ILE 471.A N LEU 504.A O no hydrogen 3.393 N/A VAL 475.A N TYR 450.A OH no hydrogen 2.769 N/A SER 476.A N GLU 500.A O no hydrogen 3.423 N/A GLY 478.A N SER 476.A O no hydrogen 2.749 N/A SER 480.A OG PRO 477.A O no hydrogen 3.393 N/A SER 483.A OG SER 154.A OG no hydrogen 2.897 N/A SER 483.A OG TYR 155.A O no hydrogen 3.279 N/A SER 483.A OG GLU 156.A OE1 no hydrogen 2.648 N/A TRP 484.A N TYR 155.A O no hydrogen 2.737 N/A SER 485.A N GLU 488.A OE2 no hydrogen 2.753 N/A SER 485.A OG GLU 488.A OE1 no hydrogen 2.763 N/A SER 485.A OG GLU 488.A OE2 no hydrogen 2.675 N/A ASN 487.A ND2 HIS 60.A O no hydrogen 3.395 N/A ASP 506.A N ARG 469.A O no hydrogen 2.899 N/A ASN 509.A N ASP 506.A O no hydrogen 3.350 N/A ARG 512.A NE VAL 514.A O no hydrogen 2.860 N/A ALA 520.A N ILE 551.A O no hydrogen 3.266 N/A GLY 521.A N GLU 528.A OE1 no hydrogen 3.246 N/A GLU 525.A N GLU 525.A OE1 no hydrogen 2.861 N/A LYS 527.A NZ LYS 527.A O no hydrogen 3.147 N/A THR 529.A N GLU 525.A O no hydrogen 2.929 N/A THR 529.A OG1 GLU 525.A O no hydrogen 2.580 N/A CYS 530.A SG LYS 527.A O no hydrogen 3.174 N/A TRP 537.A N PHE 533.A O no hydrogen 2.902 N/A GLY 538.A N ARG 534.A O no hydrogen 2.888 N/A GLU 539.A N GLU 539.A OE1 no hydrogen 2.778 N/A LYS 540.A NZ VAL 556.A O no hydrogen 3.166 N/A SER 541.A OG GLU 553.A OE2 no hydrogen 3.389 N/A ARG 552.A NH2 GLY 517.A O no hydrogen 3.475 N/A GLU 553.A N PRO 518.A O no hydrogen 3.240 N/A THR 554.A N GLU 542.A O no hydrogen 3.343 N/A THR 554.A OG1 GLU 542.A O no hydrogen 3.421 N/A THR 554.A OG1 GLU 542.A OE1 no hydrogen 2.656 N/A THR 554.A OG1 ARG 552.A O no hydrogen 3.469 N/A LEU 555.A N ASP 515.A O no hydrogen 3.175 N/A TRP 557.A N THR 513.A O no hydrogen 3.158 N/A SER 558.A OG GLU 568.A OE1 no hydrogen 3.040 N/A SER 558.A OG GLU 568.A OE2 no hydrogen 2.817 N/A CYS 566.A SG MET 510.A O no hydrogen 4.018 N/A CYS 566.A SG ASP 564.A OD2 no hydrogen 3.174 N/A GLU 568.A N ASP 564.A O no hydrogen 3.037 N/A ILE 569.A N LEU 565.A O no hydrogen 2.836 N/A MET 570.A N CYS 566.A O no hydrogen 2.916 N/A ARG 571.A N GLU 567.A O no hydrogen 2.961 N/A ARG 571.A NE LEU 583.A O no hydrogen 3.347 N/A ARG 571.A NH1 GLU 567.A OE2 no hydrogen 3.091 N/A ARG 571.A NH2 GLU 567.A OE2 no hydrogen 3.344 N/A TYR 572.A N GLU 568.A O no hydrogen 2.975 N/A ILE 573.A N ILE 569.A O no hydrogen 2.993 N/A LEU 574.A N MET 570.A O no hydrogen 2.858 N/A GLY 575.A N ARG 571.A O no hydrogen 2.955 N/A LEU 576.A N TYR 572.A O no hydrogen 2.941 N/A HIS 577.A N ILE 573.A O no hydrogen 2.860 N/A HIS 577.A NE2 PHE 536.A O no hydrogen 2.716 N/A LEU 578.A N LEU 574.A O no hydrogen 2.981 N/A GLN 582.A NE2 GLN 584.A OE1 no hydrogen 3.066 N/A TYR 590.A OH HIS 413.A NE2 no hydrogen 3.337 N/A SER 593.A OG LEU 647.A O no hydrogen 2.926 N/A SER 593.A OG HIS 803.A NE2 no hydrogen 3.005 N/A SER 599.A OG LEU 598.A O no hydrogen 2.800 N/A SER 599.A OG SER 599.A O no hydrogen 2.419 N/A THR 605.A N SER 603.A O no hydrogen 2.507 N/A ASN 609.A N THR 605.A O no hydrogen 2.874 N/A ASN 609.A ND2 THR 605.A OG1 no hydrogen 2.902 N/A VAL 610.A N ALA 606.A O no hydrogen 2.978 N/A ALA 611.A N LEU 607.A O no hydrogen 3.010 N/A ARG 612.A N PHE 608.A O no hydrogen 2.927 N/A ARG 612.A NH1 LEU 642.A O no hydrogen 2.445 N/A LYS 613.A N PHE 608.A O no hydrogen 3.350 N/A LYS 613.A N ASN 609.A O no hydrogen 2.975 N/A LYS 613.A NZ ASN 609.A OD1 no hydrogen 3.280 N/A THR 614.A N VAL 610.A O no hydrogen 3.032 N/A THR 614.A OG1 VAL 610.A O no hydrogen 2.407 N/A THR 614.A OG1 ALA 611.A O no hydrogen 3.384 N/A PHE 615.A N ALA 611.A O no hydrogen 2.928 N/A THR 616.A N ARG 612.A O no hydrogen 2.932 N/A THR 616.A OG1 ARG 612.A O no hydrogen 3.549 N/A THR 616.A OG1 LYS 613.A O no hydrogen 2.881 N/A SER 617.A N LYS 613.A O no hydrogen 2.913 N/A GLU 619.A N GLU 619.A OE1 no hydrogen 2.896 N/A ARG 620.A N PHE 615.A O no hydrogen 3.321 N/A LEU 622.A N PHE 618.A O no hydrogen 3.349 N/A ARG 623.A N GLU 619.A O no hydrogen 2.907 N/A ASP 624.A N ARG 620.A O no hydrogen 2.919 N/A LEU 625.A N ASP 621.A O no hydrogen 2.913 N/A LEU 625.A N LEU 622.A O no hydrogen 2.903 N/A ARG 631.A NH1 ARG 623.A O no hydrogen 2.741 N/A ARG 631.A NH2 GLU 626.A O no hydrogen 2.323 N/A ARG 633.A N SER 667.A O no hydrogen 3.148 N/A CYS 639.A SG GLU 663.A O no hydrogen 3.129 N/A LEU 642.A N CYS 639.A O no hydrogen 3.032 N/A ARG 643.A N CYS 639.A O no hydrogen 2.879 N/A SER 645.A N PRO 640.A O no hydrogen 3.084 N/A SER 645.A OG GLU 820.A OE2 no hydrogen 2.421 N/A SER 646.A OG LYS 648.A O no hydrogen 2.799 N/A LYS 648.A NZ SER 593.A O no hydrogen 2.783 N/A SER 651.A OG ALA 596.A O no hydrogen 2.938 N/A LYS 656.A NZ LEU 990.A O no hydrogen 2.489 N/A SER 657.A N PRO 654.A O no hydrogen 3.265 N/A ARG 660.A NE ARG 660.A O no hydrogen 2.918 N/A MET 662.A N CYS 732.A O no hydrogen 2.978 N/A VAL 664.A N ARG 734.A O no hydrogen 2.630 N/A ILE 666.A N ARG 736.A O no hydrogen 2.545 N/A SER 667.A OG ILE 666.A O no hydrogen 2.858 N/A SER 667.A OG GLN 738.A O no hydrogen 2.428 N/A GLU 669.A N ARG 631.A O no hydrogen 2.963 N/A GLU 669.A N GLU 669.A OE2 no hydrogen 2.785 N/A ILE 681.A N SER 677.A O no hydrogen 2.945 N/A GLN 682.A N LEU 678.A O no hydrogen 2.932 N/A GLN 682.A NE2 LEU 678.A O no hydrogen 2.896 N/A GLN 682.A NE2 GLU 742.A OE1 no hydrogen 2.568 N/A GLN 682.A NE2 GLU 742.A OE2 no hydrogen 3.160 N/A ARG 683.A N ILE 679.A O no hydrogen 2.952 N/A THR 684.A N ALA 680.A O no hydrogen 2.939 N/A THR 684.A OG1 ILE 681.A O no hydrogen 2.744 N/A LYS 685.A N ILE 681.A O no hydrogen 2.964 N/A LYS 685.A NZ GLN 682.A OE1 no hydrogen 3.245 N/A LYS 685.A NZ ILE 737.A O no hydrogen 2.596 N/A ILE 686.A N GLN 682.A O no hydrogen 2.923 N/A ALA 687.A N ARG 683.A O no hydrogen 2.942 N/A PHE 688.A N THR 684.A O no hydrogen 3.007 N/A LEU 689.A N LYS 685.A O no hydrogen 2.988 N/A LEU 690.A N ILE 686.A O no hydrogen 2.839 N/A MET 691.A N ALA 687.A O no hydrogen 3.037 N/A ILE 692.A N PHE 688.A O no hydrogen 3.020 N/A GLY 693.A N LEU 689.A O no hydrogen 2.908 N/A ARG 694.A N LEU 690.A O no hydrogen 2.931 N/A LEU 695.A N MET 691.A O no hydrogen 3.111 N/A LEU 696.A N ILE 692.A O no hydrogen 2.935 N/A GLU 697.A N GLY 693.A O no hydrogen 2.954 N/A ARG 698.A N ARG 694.A O no hydrogen 2.959 N/A PHE 699.A N LEU 695.A O no hydrogen 3.007 N/A GLY 702.A N PHE 699.A O no hydrogen 3.041 N/A GLU 703.A N GLU 703.A OE2 no hydrogen 2.867 N/A ILE 704.A N PRO 701.A O no hydrogen 2.801 N/A ARG 714.A NH1 THR 773.A OG1 no hydrogen 2.554 N/A THR 717.A OG1 TYR 715.A O no hydrogen 3.134 N/A PHE 722.A N GLY 709.A O no hydrogen 3.262 N/A VAL 725.A N PHE 733.A O no hydrogen 3.179 N/A ILE 726.A N ARG 705.A O no hydrogen 3.342 N/A TYR 727.A N ALA 731.A O no hydrogen 2.973 N/A GLY 730.A N TYR 727.A O no hydrogen 2.927 N/A CYS 732.A SG ASP 724.A OD2 no hydrogen 3.796 N/A ARG 734.A N MET 662.A O no hydrogen 2.454 N/A VAL 735.A N LEU 723.A O no hydrogen 3.372 N/A ARG 736.A N VAL 664.A O no hydrogen 2.930 N/A GLN 738.A N ILE 666.A O no hydrogen 3.144 N/A GLN 738.A N SER 667.A OG no hydrogen 3.202 N/A GLN 738.A NE2 GLU 743.A OE2 no hydrogen 3.046 N/A GLU 743.A N ALA 739.A O no hydrogen 2.964 N/A SER 744.A N ASP 740.A O no hydrogen 2.956 N/A SER 744.A OG ASP 740.A O no hydrogen 3.427 N/A SER 744.A OG LEU 741.A O no hydrogen 3.021 N/A LEU 745.A N LEU 741.A O no hydrogen 2.884 N/A LEU 746.A N GLU 742.A O no hydrogen 3.031 N/A GLU 747.A N GLU 743.A O no hydrogen 2.953 N/A ARG 748.A N SER 744.A O no hydrogen 2.933 N/A GLN 749.A N LEU 745.A O no hydrogen 2.888 N/A GLN 749.A NE2 LEU 745.A O no hydrogen 2.848 N/A THR 750.A N LEU 746.A O no hydrogen 2.978 N/A THR 750.A OG1 LEU 746.A O no hydrogen 2.837 N/A LYS 751.A N GLU 747.A O no hydrogen 2.910 N/A ASP 752.A N ARG 748.A O no hydrogen 2.968 N/A LYS 753.A NZ GLN 749.A O no hydrogen 3.259 N/A LYS 753.A NZ GLN 749.A OE1 no hydrogen 3.388 N/A LYS 753.A NZ ASP 752.A OD1 no hydrogen 3.051 N/A ALA 763.A N LEU 759.A O no hydrogen 2.953 N/A SER 764.A N ARG 760.A O no hydrogen 2.887 N/A SER 764.A OG ARG 760.A O no hydrogen 2.432 N/A THR 765.A N GLN 761.A O no hydrogen 2.970 N/A THR 765.A OG1 GLN 761.A O no hydrogen 3.257 N/A THR 765.A OG1 ARG 762.A O no hydrogen 2.696 N/A GLN 766.A N ARG 762.A O no hydrogen 2.985 N/A LEU 767.A N ALA 763.A O no hydrogen 2.950 N/A ALA 768.A N SER 764.A O no hydrogen 2.935 N/A SER 769.A N THR 765.A O no hydrogen 2.943 N/A SER 769.A OG THR 765.A O no hydrogen 3.306 N/A SER 769.A OG GLN 766.A O no hydrogen 2.724 N/A PHE 770.A N GLN 766.A O no hydrogen 2.973 N/A ARG 771.A N LEU 767.A O no hydrogen 2.935 N/A ARG 772.A N ALA 768.A O no hydrogen 2.927 N/A THR 773.A N SER 769.A O no hydrogen 2.928 N/A THR 773.A OG1 SER 769.A O no hydrogen 3.443 N/A THR 773.A OG1 PHE 770.A O no hydrogen 2.492 N/A PHE 774.A N PHE 770.A O no hydrogen 3.044 N/A VAL 775.A N ARG 771.A O no hydrogen 2.927 N/A HIS 780.A N HIS 776.A O no hydrogen 3.037 N/A THR 781.A N LEU 777.A O no hydrogen 3.008 N/A GLN 782.A N PRO 778.A O no hydrogen 2.964 N/A GLN 782.A NE2 PRO 778.A O no hydrogen 2.775 N/A TYR 783.A N LEU 779.A O no hydrogen 3.000 N/A ILE 784.A N HIS 780.A O no hydrogen 3.056 N/A THR 785.A N THR 781.A O no hydrogen 2.906 N/A THR 785.A OG1 THR 781.A O no hydrogen 2.290 N/A THR 785.A OG1 GLN 782.A O no hydrogen 3.144 N/A THR 786.A N GLN 782.A O no hydrogen 2.944 N/A THR 786.A N TYR 783.A O no hydrogen 3.221 N/A THR 786.A OG1 GLN 782.A O no hydrogen 2.557 N/A ALA 787.A N TYR 783.A O no hydrogen 2.956 N/A THR 788.A N ILE 784.A O no hydrogen 2.947 N/A THR 789.A OG1 THR 786.A O no hydrogen 2.821 N/A ARG 790.A N ALA 787.A O no hydrogen 3.258 N/A PHE 791.A N ALA 787.A O no hydrogen 2.990 N/A THR 797.A N ALA 793.A O no hydrogen 3.043 N/A THR 797.A OG1 ALA 793.A O no hydrogen 2.315 N/A ILE 798.A N LEU 794.A O no hydrogen 2.858 N/A ARG 799.A N SER 795.A O no hydrogen 2.948 N/A ARG 799.A NH2 SER 593.A O no hydrogen 2.480 N/A LEU 800.A N PRO 796.A O no hydrogen 2.934 N/A VAL 801.A N THR 797.A O no hydrogen 2.984 N/A LYS 802.A N ILE 798.A O no hydrogen 2.938 N/A LYS 802.A NZ SER 806.A OG no hydrogen 3.038 N/A LYS 802.A NZ SER 811.A OG no hydrogen 2.493 N/A LYS 802.A NZ VAL 1021.A O no hydrogen 3.470 N/A HIS 803.A N ARG 799.A O no hydrogen 2.888 N/A TRP 804.A N LEU 800.A O no hydrogen 2.985 N/A PHE 805.A N VAL 801.A O no hydrogen 2.977 N/A SER 806.A N LYS 802.A O no hydrogen 2.869 N/A SER 806.A OG LYS 802.A O no hydrogen 2.249 N/A VAL 807.A N HIS 803.A O no hydrogen 2.902 N/A HIS 808.A N TRP 804.A O no hydrogen 2.991 N/A LYS 809.A N SER 806.A O no hydrogen 3.250 N/A LYS 809.A NZ HIS 808.A O no hydrogen 2.683 N/A LEU 810.A N PHE 805.A O no hydrogen 3.232 N/A ASN 812.A ND2 SER 1015.A OG no hydrogen 2.471 N/A ASN 812.A ND2 GLY 1016.A O no hydrogen 2.874 N/A HIS 813.A N LEU 810.A O no hydrogen 3.279 N/A PHE 814.A N LEU 810.A O no hydrogen 2.996 N/A GLU 820.A N PRO 816.A O no hydrogen 2.903 N/A LEU 821.A N GLU 817.A O no hydrogen 2.910 N/A PHE 822.A N LEU 818.A O no hydrogen 2.945 N/A VAL 823.A N LEU 819.A O no hydrogen 2.972 N/A VAL 823.A N GLU 820.A O no hydrogen 3.153 N/A LEU 824.A N GLU 820.A O no hydrogen 2.899 N/A HIS 825.A N LEU 821.A O no hydrogen 2.897 N/A THR 826.A OG1 VAL 823.A O no hydrogen 2.819 N/A PHE 827.A N VAL 823.A O no hydrogen 2.947 N/A LEU 828.A N LEU 824.A O no hydrogen 2.853 N/A TRP 833.A N PRO 830.A O no hydrogen 2.753 N/A SER 837.A OG PHE 505.A O no hydrogen 2.885 N/A SER 837.A OG VAL 835.A O no hydrogen 3.556 N/A SER 838.A N THR 841.A OG1 no hydrogen 3.210 N/A THR 841.A OG1 SER 838.A O no hydrogen 2.494 N/A GLY 842.A N SER 838.A O no hydrogen 2.958 N/A PHE 843.A N PRO 839.A O no hydrogen 2.864 N/A LEU 844.A N THR 840.A O no hydrogen 2.969 N/A ARG 845.A N THR 841.A O no hydrogen 2.865 N/A ARG 845.A NH1 PRO 830.A O no hydrogen 2.803 N/A THR 846.A N GLY 842.A O no hydrogen 2.977 N/A THR 846.A OG1 PHE 843.A O no hydrogen 2.794 N/A LEU 847.A N PHE 843.A O no hydrogen 2.982 N/A LEU 848.A N LEU 844.A O no hydrogen 2.908 N/A PHE 849.A N ARG 845.A O no hydrogen 2.907 N/A LEU 850.A N THR 846.A O no hydrogen 2.915 N/A ALA 851.A N LEU 847.A O no hydrogen 2.942 N/A ARG 852.A N LEU 848.A O no hydrogen 2.920 N/A ARG 852.A N PHE 849.A O no hydrogen 3.154 N/A TRP 853.A NE1 ASP 858.A O no hydrogen 2.618 N/A LEU 860.A N PHE 881.A O no hydrogen 3.002 N/A THR 864.A N ILE 862.A O no hydrogen 3.125 N/A TRP 868.A N LEU 865.A O no hydrogen 3.066 N/A ARG 869.A N LEU 865.A O no hydrogen 2.921 N/A LYS 870.A NZ ASP 866.A OD1 no hydrogen 3.147 N/A ASP 872.A N TRP 868.A O no hydrogen 2.966 N/A HIS 877.A ND1 THR 878.A OG1 no hydrogen 3.313 N/A THR 878.A OG1 HIS 877.A ND1 no hydrogen 3.313 N/A THR 878.A OG1 SER 895.A OG no hydrogen 2.472 N/A ALA 883.A N LEU 860.A O no hydrogen 3.245 N/A THR 884.A N GLU 887.A O no hydrogen 2.606 N/A GLU 887.A N THR 884.A OG1 no hydrogen 2.836 N/A THR 891.A OG1 SER 889.A O no hydrogen 3.192 N/A SER 895.A OG HIS 877.A ND1 no hydrogen 3.330 N/A SER 895.A OG HIS 877.A O no hydrogen 2.604 N/A SER 895.A OG THR 878.A OG1 no hydrogen 2.472 N/A ARG 901.A NH1 THR 894.A O no hydrogen 2.391 N/A ARG 901.A NH2 HIS 877.A O no hydrogen 2.521 N/A LYS 904.A NZ LYS 904.A O no hydrogen 2.683 N/A ARG 909.A N VAL 905.A O no hydrogen 3.122 N/A ARG 909.A NH1 LYS 939.A O no hydrogen 3.107 N/A ARG 909.A NH2 GLU 940.A O no hydrogen 2.630 N/A MET 910.A N VAL 906.A O no hydrogen 2.864 N/A THR 911.A N ALA 907.A O no hydrogen 2.993 N/A THR 911.A OG1 ALA 907.A O no hydrogen 3.040 N/A ALA 912.A N ALA 908.A O no hydrogen 2.909 N/A LEU 913.A N ARG 909.A O no hydrogen 2.891 N/A ALA 914.A N MET 910.A O no hydrogen 3.051 N/A LYS 915.A N THR 911.A O no hydrogen 2.961 N/A LYS 915.A NZ LEU 850.A O no hydrogen 2.876 N/A LYS 915.A NZ THR 911.A O no hydrogen 2.861 N/A SER 916.A N ALA 912.A O no hydrogen 2.923 N/A SER 916.A OG LEU 913.A O no hydrogen 2.735 N/A ALA 917.A N LEU 913.A O no hydrogen 2.936 N/A ALA 918.A N ALA 914.A O no hydrogen 3.018 N/A ARG 919.A N LYS 915.A O no hydrogen 2.858 N/A VAL 920.A N SER 916.A O no hydrogen 2.931 N/A ILE 921.A N ALA 917.A O no hydrogen 3.048 N/A ARG 922.A N ALA 918.A O no hydrogen 2.965 N/A GLU 923.A N ARG 919.A O no hydrogen 2.826 N/A GLN 924.A N VAL 920.A O no hydrogen 3.024 N/A GLN 924.A NE2 VAL 920.A O no hydrogen 2.800 N/A ARG 932.A NH1 SER 916.A OG no hydrogen 3.218 N/A LEU 933.A N VAL 930.A O no hydrogen 2.560 N/A PHE 934.A N ARG 931.A O no hydrogen 3.107 N/A VAL 935.A N ARG 931.A O no hydrogen 2.924 N/A VAL 943.A N ALA 1039.A O no hydrogen 2.935 N/A LEU 945.A N ILE 1037.A O no hydrogen 2.944 N/A LEU 947.A N LYS 1035.A O no hydrogen 2.923 N/A THR 949.A OG1 HIS 995.A NE2 no hydrogen 3.177 N/A SER 954.A N GLU 967.A OE2 no hydrogen 2.685 N/A SER 954.A OG LYS 953.A O no hydrogen 2.796 N/A THR 958.A N SER 954.A O no hydrogen 3.265 N/A TYR 959.A N LEU 956.A O no hydrogen 2.920 N/A ILE 960.A N LEU 956.A O no hydrogen 2.963 N/A THR 961.A OG1 ILE 960.A O no hydrogen 2.647 N/A VAL 962.A N ARG 957.A O no hydrogen 3.061 N/A MET 968.A N ALA 965.A O no hydrogen 2.976 N/A GLY 973.A N GLY 970.A O no hydrogen 3.171 N/A ALA 982.A N PHE 978.A O no hydrogen 2.937 N/A GLU 984.A N GLU 984.A OE2 no hydrogen 2.725 N/A GLU 987.A N THR 985.A OG1 no hydrogen 3.148 N/A LEU 990.A N GLU 987.A O no hydrogen 2.973 N/A HIS 995.A ND1 ASP 998.A OD2 no hydrogen 2.565 N/A LEU 1000.A N PRO 996.A O no hydrogen 3.020 N/A LEU 1001.A N VAL 997.A O no hydrogen 2.872 N/A LYS 1002.A N ASP 998.A O no hydrogen 2.915 N/A LYS 1002.A NZ ASP 998.A O no hydrogen 3.268 N/A GLN 1003.A N VAL 999.A O no hydrogen 3.036 N/A LEU 1004.A N LEU 1000.A O no hydrogen 2.919 N/A SER 1005.A N LYS 1002.A O no hydrogen 2.908 N/A ALA 1006.A N GLN 1003.A O no hydrogen 2.696 N/A SER 1010.A OG TYR 1008.A O no hydrogen 3.232 N/A SER 1010.A OG PRO 1055.A O no hydrogen 2.342 N/A SER 1015.A OG LYS 809.A O no hydrogen 2.617 N/A THR 1017.A OG1 ASP 1034.A O no hydrogen 3.567 N/A VAL 1021.A N SER 811.A O no hydrogen 3.204 N/A ARG 1024.A NE LYS 656.A O no hydrogen 3.062 N/A ARG 1024.A NH1 LYS 656.A O no hydrogen 3.287 N/A THR 1027.A N ASP 1026.A OD1 no hydrogen 2.664 N/A THR 1028.A OG1 THR 1028.A O no hydrogen 2.437 N/A THR 1028.A OG1 ASP 1034.A O no hydrogen 3.220 N/A ALA 1029.A N ASP 1026.A O no hydrogen 2.761 N/A THR 1030.A OG1 THR 1027.A O no hydrogen 3.400 N/A GLU 1032.A N THR 1030.A OG1 no hydrogen 3.249 N/A GLY 1033.A N THR 1030.A O no hydrogen 3.206 N/A LYS 1035.A NZ THR 1017.A OG1 no hydrogen 3.196 N/A ILE 1037.A N LEU 945.A O no hydrogen 2.879 N/A ALA 1039.A N VAL 943.A O no hydrogen 2.895 N/A VAL 1040.A N GLY 1013.A O no hydrogen 3.414 N/A ASN 1042.A ND2 ASP 1009.A O no hydrogen 3.458 N/A ASN 1042.A ND2 ALA 1011.A O no hydrogen 3.266 N/A LEU 1045.A N ASN 1042.A O no hydrogen 3.306 N/A LYS 1047.A NZ ARG 1048.A O no hydrogen 3.494 N/A LYS 1049.A NZ TRP 1050.A O no hydrogen 3.536 N/A