Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8uin_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 2.A N ASP 2.A OD1 no hydrogen 2.424 N/A ARG 12.A N GLY 172.A O no hydrogen 2.613 N/A ARG 12.A NE ASP 171.A OD1 no hydrogen 2.373 N/A ARG 12.A NE ASP 171.A OD2 no hydrogen 3.209 N/A ARG 12.A NH1 ASP 45.A O no hydrogen 2.659 N/A ARG 12.A NH2 ILE 79.A O no hydrogen 3.180 N/A ARG 12.A NH2 ASP 171.A OD1 no hydrogen 3.009 N/A GLU 14.A N GLU 14.A OE1 no hydrogen 2.603 N/A LYS 27.A NZ ASP 25.A OD2 no hydrogen 3.221 N/A ILE 34.A N LYS 31.A O no hydrogen 3.225 N/A SER 35.A OG GLU 28.A O no hydrogen 3.436 N/A SER 35.A OG GLU 28.A OE2 no hydrogen 2.439 N/A THR 36.A N GLU 28.A OE2 no hydrogen 2.650 N/A LYS 37.A NZ ASP 25.A O no hydrogen 3.065 N/A THR 49.A N THR 48.A OG1 no hydrogen 2.662 N/A THR 49.A OG1 GLU 70.A OE1 no hydrogen 3.479 N/A THR 49.A OG1 VAL 71.A O no hydrogen 2.849 N/A TRP 50.A N VAL 71.A O no hydrogen 2.771 N/A ILE 52.A N PHE 69.A O no hydrogen 2.938 N/A SER 56.A N CYS 64.A O no hydrogen 2.950 N/A SER 58.A N GLY 62.A O no hydrogen 2.903 N/A LYS 60.A N SER 58.A OG no hydrogen 3.181 N/A LYS 61.A N SER 58.A OG no hydrogen 2.714 N/A ALA 66.A N ALA 54.A O no hydrogen 2.712 N/A PHE 69.A N ILE 52.A O no hydrogen 3.046 N/A VAL 71.A N TRP 50.A O no hydrogen 3.091 N/A VAL 73.A N THR 48.A O no hydrogen 2.966 N/A GLN 75.A NE2 PHE 77.A O no hydrogen 2.791 N/A GLN 75.A NE2 ASP 171.A OD2 no hydrogen 2.830 N/A ASP 80.A N VAL 98.A O no hydrogen 3.248 N/A ARG 82.A N ARG 96.A O no hydrogen 3.413 N/A VAL 87.A N LYS 178.A O no hydrogen 3.180 N/A ARG 89.A NH1 GLU 748.A O no hydrogen 2.452 N/A ARG 89.A NH2 GLU 748.A O no hydrogen 3.170 N/A ASN 90.A N PRO 150.A O no hydrogen 3.473 N/A GLN 92.A NE2 GLY 739.A O no hydrogen 3.013 N/A VAL 93.A N ILE 148.A O no hydrogen 3.470 N/A ILE 95.A N TYR 146.A O no hydrogen 2.768 N/A ALA 97.A N VAL 144.A O no hydrogen 3.184 N/A LEU 99.A N LEU 142.A O no hydrogen 3.311 N/A TYR 100.A N PHE 78.A O no hydrogen 3.256 N/A ASN 101.A ND2 ILE 136.A O no hydrogen 3.506 N/A TYR 102.A N ASP 76.A O no hydrogen 3.042 N/A ARG 103.A N ASN 101.A OD1 no hydrogen 3.386 N/A GLN 104.A N GLN 104.A OE1 no hydrogen 2.779 N/A ARG 111.A N ALA 163.A O no hydrogen 3.056 N/A VAL 112.A N GLN 132.A O no hydrogen 3.126 N/A GLU 113.A N LYS 161.A O no hydrogen 3.161 N/A LEU 114.A N HIS 130.A O no hydrogen 3.359 N/A HIS 116.A ND1 ALA 124.A O no hydrogen 3.174 N/A ALA 119.A N ASN 117.A OD1 no hydrogen 2.773 N/A PHE 120.A N ASN 117.A O no hydrogen 3.173 N/A CYS 121.A N VAL 149.A O no hydrogen 2.989 N/A CYS 121.A SG GLU 754.A OE1 no hydrogen 3.258 N/A CYS 121.A SG GLU 754.A OE2 no hydrogen 3.300 N/A ALA 124.A N SER 122.A OG no hydrogen 3.402 N/A ARG 128.A N THR 125.A OG1 no hydrogen 3.036 N/A ARG 128.A NH1 ARG 129.A O no hydrogen 2.870 N/A ARG 129.A NH1 GLU 113.A OE1 no hydrogen 3.092 N/A GLN 131.A NE2 GLU 113.A OE1 no hydrogen 3.353 N/A GLN 132.A N VAL 112.A O no hydrogen 3.041 N/A VAL 134.A N VAL 110.A O no hydrogen 2.882 N/A ILE 136.A N LEU 108.A O no hydrogen 3.050 N/A SER 140.A OG PRO 137.A O no hydrogen 2.274 N/A VAL 144.A N ALA 97.A O no hydrogen 2.875 N/A TYR 146.A N ILE 95.A O no hydrogen 2.894 N/A TYR 146.A OH GLN 132.A OE1 no hydrogen 3.188 N/A ILE 148.A N VAL 93.A O no hydrogen 3.377 N/A VAL 149.A N CYS 121.A O no hydrogen 3.315 N/A LEU 155.A N GLN 156.A OE1 no hydrogen 3.198 N/A VAL 158.A N LYS 175.A O no hydrogen 3.007 N/A VAL 160.A N VAL 173.A O no hydrogen 3.299 N/A LYS 161.A N GLU 113.A O no hydrogen 3.224 N/A LYS 161.A NZ ILE 9.A O no hydrogen 3.034 N/A ALA 163.A N ARG 111.A O no hydrogen 3.017 N/A VAL 164.A N ILE 169.A O no hydrogen 3.290 N/A HIS 167.A ND1 TYR 165.A O no hydrogen 2.884 N/A ASP 171.A N ALA 162.A O no hydrogen 3.317 N/A VAL 173.A N VAL 160.A O no hydrogen 3.192 N/A ARG 174.A NH1 GLU 157.A OE1 no hydrogen 2.986 N/A LYS 175.A N VAL 158.A O no hydrogen 3.230 N/A LYS 175.A NZ LEU 81.A O no hydrogen 3.356 N/A VAL 180.A N VAL 87.A O no hydrogen 3.306 N/A ARG 185.A NE HIS 597.A NE2 no hydrogen 3.076 N/A ARG 193.A N LEU 590.A O no hydrogen 3.345 N/A LEU 195.A N GLY 588.A O no hydrogen 2.463 N/A ASP 196.A N GLN 206.A OE1 no hydrogen 2.394 N/A LEU 200.A N ASP 196.A O no hydrogen 2.473 N/A VAL 205.A N ARG 202.A O no hydrogen 3.018 N/A GLN 206.A N ALA 582.A O no hydrogen 2.871 N/A GLN 206.A NE2 THR 194.A O no hydrogen 3.030 N/A GLU 208.A N VAL 580.A O no hydrogen 2.723 N/A ILE 210.A N PHE 578.A O no hydrogen 3.369 N/A ALA 213.A N ASN 575.A OD1 no hydrogen 3.119 N/A GLN 218.A N LEU 215.A O no hydrogen 3.140 N/A VAL 219.A N HIS 597.A O no hydrogen 3.120 N/A THR 222.A OG1 VAL 219.A O no hydrogen 2.215 N/A SER 224.A OG GLN 218.A OE1 no hydrogen 3.491 N/A THR 226.A OG1 GLU 225.A O no hydrogen 2.858 N/A THR 226.A OG1 THR 594.A OG1 no hydrogen 3.286 N/A ARG 227.A N VAL 593.A O no hydrogen 3.082 N/A ILE 228.A N GLU 570.A O no hydrogen 2.375 N/A LEU 229.A N SER 591.A O no hydrogen 3.124 N/A LEU 230.A N ARG 568.A O no hydrogen 3.009 N/A GLN 231.A N THR 589.A O no hydrogen 3.043 N/A THR 233.A N GLN 587.A O no hydrogen 3.121 N/A THR 233.A OG1 THR 233.A O no hydrogen 2.542 N/A THR 233.A OG1 GLN 587.A O no hydrogen 2.510 N/A GLU 240.A N TYR 530.A OH no hydrogen 2.619 N/A VAL 243.A N TYR 275.A OH no hydrogen 3.063 N/A LYS 249.A NZ GLU 246.A O no hydrogen 2.422 N/A LEU 251.A N LEU 248.A O no hydrogen 3.348 N/A ILE 252.A N LYS 249.A O no hydrogen 3.524 N/A VAL 253.A N THR 269.A OG1 no hydrogen 2.910 N/A THR 254.A OG1 PRO 255.A O no hydrogen 3.366 N/A ASN 262.A N CYS 258.A O no hydrogen 2.758 N/A ASN 262.A ND2 GLN 303.A OE1 no hydrogen 2.320 N/A MET 263.A N GLY 259.A O no hydrogen 2.894 N/A ILE 264.A N GLU 260.A O no hydrogen 2.920 N/A GLY 265.A N GLN 261.A O no hydrogen 2.893 N/A MET 266.A N ASN 262.A O no hydrogen 2.921 N/A THR 267.A N MET 263.A O no hydrogen 2.909 N/A THR 267.A OG1 TYR 329.A OH no hydrogen 2.967 N/A THR 269.A OG1 LEU 251.A O no hydrogen 2.912 N/A THR 269.A OG1 VAL 253.A O no hydrogen 3.358 N/A VAL 270.A N MET 266.A O no hydrogen 2.944 N/A ILE 271.A N THR 267.A O no hydrogen 2.946 N/A ALA 272.A N PRO 268.A O no hydrogen 2.856 N/A VAL 273.A N THR 269.A O no hydrogen 2.918 N/A HIS 274.A N VAL 270.A O no hydrogen 2.956 N/A TYR 275.A N ILE 271.A O no hydrogen 2.904 N/A LEU 276.A N ALA 272.A O no hydrogen 2.882 N/A ASP 277.A N VAL 273.A O no hydrogen 2.897 N/A GLU 278.A N HIS 274.A O no hydrogen 2.922 N/A THR 279.A N TYR 275.A O no hydrogen 2.802 N/A THR 279.A OG1 TYR 275.A O no hydrogen 2.461 N/A THR 279.A OG1 LEU 276.A O no hydrogen 3.228 N/A THR 279.A OG1 GLN 281.A OE1 no hydrogen 3.043 N/A GLN 281.A N LEU 276.A O no hydrogen 3.436 N/A GLN 281.A NE2 VAL 243.A O no hydrogen 2.651 N/A TRP 282.A NE1 ASP 277.A OD1 no hydrogen 2.305 N/A LYS 284.A N GLN 281.A O no hydrogen 3.330 N/A PHE 285.A N GLN 281.A O no hydrogen 3.174 N/A GLY 286.A N TRP 282.A O no hydrogen 3.063 N/A LYS 289.A NZ PHE 285.A O no hydrogen 2.392 N/A ARG 290.A N LEU 287.A O no hydrogen 3.472 N/A GLN 291.A NE2 GLU 288.A O no hydrogen 3.469 N/A ALA 293.A N LYS 289.A O no hydrogen 2.917 N/A LEU 294.A N ARG 290.A O no hydrogen 2.879 N/A GLU 295.A N GLN 291.A O no hydrogen 2.916 N/A LEU 296.A N GLY 292.A O no hydrogen 2.898 N/A ILE 297.A N ALA 293.A O no hydrogen 2.908 N/A LYS 298.A N LEU 294.A O no hydrogen 2.895 N/A LYS 299.A N GLU 295.A O no hydrogen 2.949 N/A LYS 299.A NZ LEU 296.A O no hydrogen 3.364 N/A GLY 300.A N LEU 296.A O no hydrogen 2.920 N/A TYR 301.A N ILE 297.A O no hydrogen 2.878 N/A TYR 301.A OH ALA 342.A O no hydrogen 2.538 N/A THR 302.A N LYS 298.A O no hydrogen 2.937 N/A GLN 303.A N LYS 299.A O no hydrogen 2.873 N/A GLN 304.A N GLY 300.A O no hydrogen 2.910 N/A GLN 304.A NE2 TYR 301.A O no hydrogen 2.862 N/A ALA 306.A N GLN 303.A O no hydrogen 3.261 N/A PHE 307.A N GLN 304.A O no hydrogen 3.222 N/A ARG 308.A N LEU 305.A O no hydrogen 3.313 N/A ARG 308.A NH2 SER 312.A OG no hydrogen 2.444 N/A GLN 309.A N ALA 313.A O no hydrogen 2.379 N/A GLN 309.A NE2 VAL 318.A O no hydrogen 2.520 N/A SER 312.A N GLN 309.A O no hydrogen 3.121 N/A SER 323.A N PHE 314.A O no hydrogen 3.373 N/A SER 323.A OG GLU 368.A OE2 no hydrogen 2.330 N/A SER 323.A OG ALA 370.A O no hydrogen 2.814 N/A THR 324.A OG1 GLN 367.A O no hydrogen 2.951 N/A TRP 325.A N GLU 368.A OE1 no hydrogen 2.796 N/A TRP 325.A N GLU 368.A OE2 no hydrogen 2.776 N/A THR 327.A N SER 323.A O no hydrogen 2.919 N/A THR 327.A OG1 SER 323.A O no hydrogen 2.463 N/A ALA 328.A N THR 324.A O no hydrogen 2.911 N/A TYR 329.A N TRP 325.A O no hydrogen 2.880 N/A VAL 330.A N LEU 326.A O no hydrogen 2.883 N/A VAL 331.A N THR 327.A O no hydrogen 2.889 N/A LYS 332.A N ALA 328.A O no hydrogen 2.914 N/A VAL 333.A N TYR 329.A O no hydrogen 2.919 N/A PHE 334.A N VAL 330.A O no hydrogen 2.868 N/A SER 335.A N VAL 331.A O no hydrogen 2.899 N/A SER 335.A OG VAL 331.A O no hydrogen 2.840 N/A SER 335.A OG GLU 401.A OE2 no hydrogen 3.209 N/A LEU 336.A N LYS 332.A O no hydrogen 2.920 N/A ALA 337.A N VAL 333.A O no hydrogen 2.905 N/A LEU 340.A N ALA 337.A O no hydrogen 2.913 N/A ILE 341.A N ALA 337.A O no hydrogen 2.899 N/A ILE 343.A N ILE 341.A O no hydrogen 2.975 N/A GLN 346.A N ASP 344.A OD1 no hydrogen 3.232 N/A LEU 348.A N ASP 344.A O no hydrogen 3.365 N/A CYS 349.A N SER 345.A O no hydrogen 2.913 N/A CYS 349.A SG SER 345.A O no hydrogen 3.181 N/A CYS 349.A SG ILE 405.A O no hydrogen 3.983 N/A GLY 350.A N GLN 346.A O no hydrogen 2.880 N/A ALA 351.A N VAL 347.A O no hydrogen 2.919 N/A VAL 352.A N LEU 348.A O no hydrogen 2.906 N/A LYS 353.A N CYS 349.A O no hydrogen 2.915 N/A TRP 354.A N GLY 350.A O no hydrogen 2.854 N/A LEU 355.A N ALA 351.A O no hydrogen 2.924 N/A ILE 356.A N VAL 352.A O no hydrogen 2.907 N/A LEU 357.A N LYS 353.A O no hydrogen 2.885 N/A LYS 359.A N LEU 355.A O no hydrogen 3.239 N/A LYS 359.A NZ ASP 369.A OD2 no hydrogen 2.335 N/A LYS 361.A N VAL 365.A O no hydrogen 2.662 N/A GLY 364.A N LYS 361.A O no hydrogen 2.872 N/A GLN 367.A NE2 GLU 358.A O no hydrogen 3.661 N/A ARG 382.A N GLY 379.A O no hydrogen 3.441 N/A LYS 387.A N ASN 384.A O no hydrogen 3.374 N/A ALA 390.A N GLU 386.A O no hydrogen 3.201 N/A LEU 391.A N LYS 387.A O no hydrogen 2.906 N/A THR 392.A N ASP 388.A O no hydrogen 2.875 N/A THR 392.A OG1 ASP 388.A O no hydrogen 2.682 N/A ALA 393.A N MET 389.A O no hydrogen 2.941 N/A PHE 394.A N ALA 390.A O no hydrogen 2.898 N/A VAL 395.A N LEU 391.A O no hydrogen 2.934 N/A LEU 396.A N THR 392.A O no hydrogen 2.884 N/A ILE 397.A N ALA 393.A O no hydrogen 2.944 N/A SER 398.A N PHE 394.A O no hydrogen 2.888 N/A SER 398.A OG PHE 394.A O no hydrogen 2.688 N/A LEU 399.A N VAL 395.A O no hydrogen 2.904 N/A GLN 400.A N LEU 396.A O no hydrogen 2.912 N/A GLU 401.A N ILE 397.A O no hydrogen 2.916 N/A LYS 403.A NZ GLN 400.A O no hydrogen 2.378 N/A SER 416.A N SER 412.A O no hydrogen 3.250 N/A SER 416.A OG GLN 360.A OE1 no hydrogen 2.662 N/A ILE 417.A N LEU 413.A O no hydrogen 2.896 N/A THR 418.A N PRO 414.A O no hydrogen 2.909 N/A THR 418.A OG1 PRO 414.A O no hydrogen 2.893 N/A LYS 419.A N GLY 415.A O no hydrogen 2.918 N/A ALA 420.A N SER 416.A O no hydrogen 2.901 N/A GLY 421.A N ILE 417.A O no hydrogen 2.894 N/A ASP 422.A N THR 418.A O no hydrogen 2.911 N/A PHE 423.A N LYS 419.A O no hydrogen 2.918 N/A LEU 424.A N ALA 420.A O no hydrogen 2.892 N/A GLU 425.A N GLY 421.A O no hydrogen 2.896 N/A ALA 426.A N ASP 422.A O no hydrogen 2.922 N/A ARG 433.A NH2 GLY 380.A O no hydrogen 3.309 N/A SER 434.A OG GLU 469.A O no hydrogen 3.293 N/A THR 436.A OG1 GLU 386.A OE1 no hydrogen 3.484 N/A VAL 437.A N ARG 433.A O no hydrogen 2.736 N/A ALA 438.A N SER 434.A O no hydrogen 2.845 N/A ILE 439.A N TYR 435.A O no hydrogen 2.950 N/A ALA 440.A N THR 436.A O no hydrogen 2.913 N/A GLY 441.A N VAL 437.A O no hydrogen 2.869 N/A TYR 442.A N ALA 438.A O no hydrogen 2.890 N/A ALA 443.A N ILE 439.A O no hydrogen 2.934 N/A LEU 444.A N ALA 440.A O no hydrogen 2.893 N/A ALA 445.A N GLY 441.A O no hydrogen 2.870 N/A GLN 446.A N TYR 442.A O no hydrogen 2.929 N/A GLN 446.A NE2 GLN 446.A O no hydrogen 2.838 N/A GLN 446.A NE2 GLN 490.A OE1 no hydrogen 2.784 N/A MET 447.A N LEU 444.A O no hydrogen 3.403 N/A GLY 448.A N LEU 444.A O no hydrogen 2.899 N/A ARG 449.A N LEU 444.A O no hydrogen 2.865 N/A ARG 449.A NH2 GLU 425.A OE1 no hydrogen 2.464 N/A ASN 456.A N GLY 452.A O no hydrogen 2.907 N/A LYS 457.A N PRO 453.A O no hydrogen 2.879 N/A PHE 458.A N LEU 454.A O no hydrogen 2.918 N/A LEU 459.A N LEU 455.A O no hydrogen 2.901 N/A THR 460.A N ASN 456.A O no hydrogen 2.900 N/A THR 460.A OG1 ASN 456.A O no hydrogen 2.924 N/A THR 460.A OG1 LYS 457.A O no hydrogen 2.944 N/A THR 461.A N LYS 457.A O no hydrogen 2.904 N/A THR 461.A N PHE 458.A O no hydrogen 3.139 N/A THR 461.A OG1 LYS 457.A O no hydrogen 2.299 N/A THR 461.A OG1 PHE 458.A O no hydrogen 3.372 N/A ALA 462.A N LEU 459.A O no hydrogen 3.377 N/A LYS 463.A N ARG 467.A O no hydrogen 2.535 N/A LYS 463.A NZ GLU 469.A O no hydrogen 3.075 N/A ASN 466.A N LYS 463.A O no hydrogen 3.271 N/A ARG 467.A N LYS 463.A O no hydrogen 3.238 N/A ASP 470.A N ASN 477.A OD1 no hydrogen 2.457 N/A TYR 476.A OH GLY 379.A O no hydrogen 2.323 N/A VAL 478.A N GLN 474.A O no hydrogen 2.906 N/A GLU 479.A N LEU 475.A O no hydrogen 2.900 N/A ALA 480.A N TYR 476.A O no hydrogen 2.902 N/A THR 481.A N ASN 477.A O no hydrogen 2.894 N/A THR 481.A OG1 ASN 477.A O no hydrogen 2.517 N/A SER 482.A N VAL 478.A O no hydrogen 2.885 N/A SER 482.A OG VAL 478.A O no hydrogen 3.374 N/A SER 482.A OG GLU 479.A O no hydrogen 2.432 N/A TYR 483.A N GLU 479.A O no hydrogen 2.915 N/A TYR 483.A OH GLU 479.A OE2 no hydrogen 3.043 N/A ALA 484.A N ALA 480.A O no hydrogen 2.920 N/A LEU 485.A N THR 481.A O no hydrogen 2.851 N/A LEU 486.A N SER 482.A O no hydrogen 2.931 N/A ALA 487.A N TYR 483.A O no hydrogen 2.946 N/A LEU 488.A N ALA 484.A O no hydrogen 2.865 N/A LEU 489.A N LEU 485.A O no hydrogen 2.912 N/A GLN 490.A N LEU 486.A O no hydrogen 2.925 N/A GLN 490.A NE2 ALA 445.A O no hydrogen 3.405 N/A LEU 491.A N ALA 487.A O no hydrogen 2.895 N/A LYS 492.A N LEU 489.A O no hydrogen 3.254 N/A ASP 493.A N LEU 488.A O no hydrogen 3.280 N/A VAL 501.A N VAL 497.A O no hydrogen 2.960 N/A ARG 502.A N PRO 498.A O no hydrogen 2.902 N/A TRP 503.A N PRO 499.A O no hydrogen 2.907 N/A LEU 504.A N VAL 500.A O no hydrogen 2.938 N/A ASN 505.A N VAL 501.A O no hydrogen 2.917 N/A GLU 506.A N ARG 502.A O no hydrogen 2.841 N/A GLN 507.A N TRP 503.A O no hydrogen 3.035 N/A ARG 508.A N LEU 504.A O no hydrogen 3.257 N/A SER 516.A OG GLY 512.A O no hydrogen 2.514 N/A SER 516.A OG GLY 513.A O no hydrogen 2.608 N/A GLN 518.A NE2 GLN 518.A O no hydrogen 2.653 N/A THR 520.A N SER 516.A O no hydrogen 3.138 N/A THR 520.A OG1 TYR 509.A OH no hydrogen 2.629 N/A THR 520.A OG1 SER 516.A O no hydrogen 2.674 N/A PHE 521.A N THR 517.A O no hydrogen 2.899 N/A MET 522.A N GLN 518.A O no hydrogen 2.938 N/A VAL 523.A N ALA 519.A O no hydrogen 2.897 N/A PHE 524.A N THR 520.A O no hydrogen 2.986 N/A GLN 525.A N PHE 521.A O no hydrogen 2.891 N/A ALA 526.A N MET 522.A O no hydrogen 2.846 N/A LEU 527.A N VAL 523.A O no hydrogen 2.949 N/A ALA 528.A N PHE 524.A O no hydrogen 2.879 N/A GLN 529.A N GLN 525.A O no hydrogen 2.888 N/A TYR 530.A N ALA 526.A O no hydrogen 2.912 N/A GLN 531.A N ALA 528.A O no hydrogen 2.798 N/A HIS 537.A N ASP 536.A OD1 no hydrogen 2.604 N/A ASN 541.A N LYS 585.A O no hydrogen 2.638 N/A LEU 542.A N ILE 559.A O no hydrogen 3.035 N/A ASP 543.A N GLU 583.A O no hydrogen 2.442 N/A VAL 544.A N HIS 557.A O no hydrogen 2.752 N/A SER 545.A N THR 581.A O no hydrogen 2.931 N/A SER 545.A OG THR 581.A O no hydrogen 2.791 N/A LEU 546.A N ILE 555.A O no hydrogen 2.897 N/A GLN 547.A N THR 579.A O no hydrogen 3.135 N/A SER 550.A OG SER 552.A OG no hydrogen 3.285 N/A ARG 551.A N LEU 548.A O no hydrogen 2.976 N/A SER 552.A OG SER 550.A OG no hydrogen 3.285 N/A LYS 554.A NZ ARG 551.A O no hydrogen 3.542 N/A HIS 557.A N VAL 544.A O no hydrogen 2.686 N/A ILE 559.A N LEU 542.A O no hydrogen 3.010 N/A HIS 560.A N SER 563.A OG no hydrogen 2.583 N/A GLU 562.A N GLU 562.A OE1 no hydrogen 2.841 N/A SER 563.A N HIS 560.A O no hydrogen 2.979 N/A SER 563.A OG HIS 560.A O no hydrogen 3.168 N/A ALA 564.A N TRP 561.A O no hydrogen 3.280 N/A LEU 566.A N SER 563.A O no hydrogen 3.281 N/A ARG 568.A N LEU 230.A O no hydrogen 3.309 N/A GLU 570.A N ILE 228.A O no hydrogen 2.779 N/A THR 572.A N THR 226.A O no hydrogen 3.005 N/A THR 572.A OG1 THR 226.A O no hydrogen 3.419 N/A THR 572.A OG1 GLU 574.A O no hydrogen 3.511 N/A VAL 580.A N GLU 208.A O no hydrogen 2.727 N/A THR 581.A N SER 545.A O no hydrogen 3.082 N/A ALA 582.A N GLN 206.A O no hydrogen 2.813 N/A GLU 583.A N ASP 543.A O no hydrogen 3.007 N/A GLY 588.A N LEU 195.A O no hydrogen 2.623 N/A THR 589.A N GLN 231.A O no hydrogen 2.598 N/A THR 589.A OG1 GLN 231.A O no hydrogen 2.416 N/A LEU 590.A N ARG 193.A O no hydrogen 2.932 N/A SER 591.A N LEU 229.A O no hydrogen 3.308 N/A VAL 592.A N ALA 191.A O no hydrogen 3.309 N/A VAL 593.A N ARG 227.A O no hydrogen 3.338 N/A THR 594.A OG1 GLU 225.A O no hydrogen 3.048 N/A THR 594.A OG1 THR 226.A OG1 no hydrogen 3.286 N/A MET 595.A N GLU 225.A O no hydrogen 3.384 N/A LYS 599.A N ASP 217.A O no hydrogen 2.844 N/A ASN 607.A ND2 GLU 726.A OE1 no hydrogen 2.748 N/A ASP 610.A N ARG 630.A O no hydrogen 3.244 N/A LYS 612.A N CYS 628.A O no hydrogen 2.583 N/A THR 614.A N GLU 626.A O no hydrogen 2.826 N/A THR 614.A OG1 GLU 626.A O no hydrogen 2.228 N/A THR 614.A OG1 GLU 626.A OE1 no hydrogen 3.147 N/A THR 622.A OG1 VAL 702.A O no hydrogen 2.395 N/A THR 622.A OG1 HIS 703.A ND1 no hydrogen 3.196 N/A MET 623.A N VAL 702.A O no hydrogen 3.037 N/A ILE 624.A N LYS 616.A O no hydrogen 3.288 N/A LEU 625.A N PHE 700.A O no hydrogen 2.704 N/A GLU 626.A N THR 614.A O no hydrogen 2.983 N/A ILE 627.A N LEU 698.A O no hydrogen 3.246 N/A CYS 628.A N LYS 612.A O no hydrogen 2.820 N/A THR 629.A N ASP 696.A O no hydrogen 2.703 N/A ARG 630.A N ASP 610.A O no hydrogen 3.014 N/A ARG 630.A NH1 ASP 695.A OD1 no hydrogen 3.090 N/A ARG 632.A N LYS 608.A O no hydrogen 3.462 N/A GLN 635.A N ASP 634.A OD1 no hydrogen 2.669 N/A MET 639.A N THR 638.A OG1 no hydrogen 2.589 N/A SER 640.A N LEU 687.A O no hydrogen 2.892 N/A LEU 642.A N ILE 685.A O no hydrogen 2.753 N/A ASP 643.A N LYS 717.A O no hydrogen 2.956 N/A ILE 644.A N LEU 683.A O no hydrogen 2.878 N/A SER 645.A N ALA 715.A O no hydrogen 2.813 N/A SER 645.A OG ALA 715.A O no hydrogen 3.057 N/A MET 646.A N ASN 681.A O no hydrogen 2.937 N/A LEU 657.A N ASP 653.A O no hydrogen 3.046 N/A LYS 658.A N THR 654.A O no hydrogen 3.128 N/A GLN 659.A N ASP 655.A O no hydrogen 2.947 N/A LEU 660.A N ASP 656.A O no hydrogen 2.926 N/A ALA 661.A N LEU 657.A O no hydrogen 2.878 N/A ASN 662.A N LYS 658.A O no hydrogen 2.921 N/A ASN 662.A N GLN 659.A O no hydrogen 3.264 N/A ASN 662.A ND2 LYS 658.A O no hydrogen 2.441 N/A GLY 663.A N LEU 660.A O no hydrogen 3.187 N/A TYR 667.A N TYR 686.A O no hydrogen 2.960 N/A GLU 672.A N SER 669.A O no hydrogen 3.364 N/A LEU 673.A N LYS 670.A O no hydrogen 3.016 N/A ASP 674.A N LYS 670.A O no hydrogen 3.313 N/A LYS 675.A NZ TYR 671.A O no hydrogen 2.837 N/A ARG 680.A NE THR 682.A O no hydrogen 3.404 N/A ARG 680.A NH1 ASP 679.A OD2 no hydrogen 2.802 N/A THR 682.A OG1 SER 143.A O no hydrogen 3.453 N/A LEU 683.A N ILE 644.A O no hydrogen 2.976 N/A ILE 685.A N LEU 642.A O no hydrogen 2.964 N/A TYR 686.A N TYR 667.A O no hydrogen 2.872 N/A LEU 687.A N SER 640.A O no hydrogen 2.926 N/A LYS 689.A NZ ASP 636.A OD2 no hydrogen 2.579 N/A SER 691.A OG GLU 694.A O no hydrogen 3.526 N/A SER 691.A OG GLU 694.A OE2 no hydrogen 3.275 N/A SER 693.A OG HIS 692.A NE2 no hydrogen 3.002 N/A ASP 696.A N THR 629.A O no hydrogen 2.745 N/A CYS 697.A SG ASP 695.A O no hydrogen 3.468 N/A LEU 698.A N ILE 627.A O no hydrogen 3.148 N/A PHE 700.A N LEU 625.A O no hydrogen 2.837 N/A LYS 701.A N ASP 656.A OD2 no hydrogen 3.071 N/A VAL 702.A N MET 623.A O no hydrogen 2.992 N/A HIS 703.A N ALA 651.A O no hydrogen 3.177 N/A GLN 704.A N ASN 621.A O no hydrogen 2.687 N/A GLU 709.A N GLU 709.A OE1 no hydrogen 2.764 N/A GLN 712.A NE2 PRO 145.A O no hydrogen 2.293 N/A ALA 715.A N SER 645.A O no hydrogen 3.260 N/A ALA 715.A N SER 645.A OG no hydrogen 3.213 N/A VAL 716.A N ARG 730.A O no hydrogen 3.150 N/A LYS 717.A N ASP 643.A O no hydrogen 2.882 N/A VAL 718.A N CYS 728.A O no hydrogen 3.213 N/A GLU 725.A N GLU 725.A OE1 no hydrogen 2.792 N/A ARG 730.A N VAL 716.A O no hydrogen 3.100 N/A TYR 732.A N GLY 714.A O no hydrogen 3.132 N/A HIS 733.A NE2 ILE 711.A O no hydrogen 2.993 N/A LYS 740.A NZ ASP 738.A O no hydrogen 3.551 N/A ARG 746.A N LEU 749.A O no hydrogen 3.236 N/A LEU 749.A N ARG 746.A O no hydrogen 3.020 N/A CYS 752.A SG GLU 754.A OE1 no hydrogen 3.180 N/A CYS 752.A SG GLU 754.A OE2 no hydrogen 3.046 N/A LEU 765.A N LEU 761.A O no hydrogen 2.917 N/A ASP 766.A N GLU 762.A O no hydrogen 2.877 N/A LYS 767.A N GLU 763.A O no hydrogen 2.919 N/A ALA 768.A N ARG 764.A O no hydrogen 2.915 N/A ALA 768.A N LEU 765.A O no hydrogen 3.175 N/A CYS 769.A N ASP 766.A O no hydrogen 3.386 N/A GLU 770.A N GLU 770.A OE1 no hydrogen 2.828 N/A VAL 773.A N GLU 770.A O no hydrogen 3.271 N/A ASP 774.A N GLY 838.A O no hydrogen 3.382 N/A TYR 775.A OH ASP 842.A OD2 no hydrogen 2.332 N/A VAL 776.A N LYS 802.A O no hydrogen 3.391 N/A TYR 777.A N MET 836.A O no hydrogen 3.323 N/A LYS 778.A NZ GLU 798.A OE2 no hydrogen 2.814 N/A THR 779.A N TYR 834.A O no hydrogen 3.030 N/A ARG 780.A N ALA 796.A O no hydrogen 3.342 N/A LEU 781.A N LYS 832.A O no hydrogen 3.270 N/A VAL 782.A N ILE 794.A O no hydrogen 3.273 N/A SER 787.A OG LEU 786.A O no hydrogen 3.022 N/A SER 787.A OG GLU 792.A OE1 no hydrogen 3.229 N/A SER 787.A OG GLU 792.A OE2 no hydrogen 2.231 N/A ASP 791.A N SER 818.A O no hydrogen 3.210 N/A TYR 793.A N PHE 816.A O no hydrogen 2.568 N/A TYR 793.A OH ASP 791.A OD2 no hydrogen 2.495 N/A ILE 794.A N LYS 783.A O no hydrogen 3.153 N/A MET 795.A N ARG 814.A O no hydrogen 2.805 N/A ILE 797.A N GLN 812.A O no hydrogen 3.035 N/A GLU 798.A N LYS 778.A O no hydrogen 2.729 N/A ILE 801.A N VAL 776.A O no hydrogen 2.902 N/A LYS 802.A N VAL 776.A O no hydrogen 3.291 N/A LYS 802.A NZ VAL 773.A O no hydrogen 3.021 N/A SER 805.A OG ASP 774.A O no hydrogen 3.313 N/A ASP 806.A N GLY 804.A O no hydrogen 2.460 N/A VAL 810.A N VAL 808.A O no hydrogen 2.417 N/A GLY 811.A N ILE 797.A O no hydrogen 3.242 N/A PHE 816.A N TYR 793.A O no hydrogen 2.617 N/A ILE 817.A N TYR 852.A O no hydrogen 2.577 N/A SER 818.A N ASP 791.A O no hydrogen 2.755 N/A SER 818.A OG ASP 791.A OD1 no hydrogen 3.355 N/A SER 818.A OG PRO 819.A O no hydrogen 3.166 N/A CYS 822.A N PRO 819.A O no hydrogen 2.993 N/A ALA 825.A N CYS 822.A O no hydrogen 3.164 N/A GLU 829.A N TYR 834.A OH no hydrogen 2.553 N/A LYS 831.A N LEU 781.A O no hydrogen 2.542 N/A LYS 832.A NZ GLU 829.A OE1 no hydrogen 3.253 N/A TYR 834.A N THR 779.A O no hydrogen 2.396 N/A TYR 834.A OH GLU 829.A O no hydrogen 2.347 N/A LEU 835.A N GLU 861.A O no hydrogen 2.785 N/A MET 836.A N TYR 777.A O no hydrogen 3.529 N/A GLY 838.A N TYR 775.A O no hydrogen 3.211 N/A ASP 842.A N LEU 839.A O no hydrogen 3.135 N/A TRP 844.A N SER 851.A O no hydrogen 2.623 N/A ASN 849.A N GLU 846.A O no hydrogen 2.598 N/A SER 851.A N TRP 844.A O no hydrogen 2.788 N/A TYR 852.A N THR 815.A O no hydrogen 3.374 N/A ILE 853.A N ASP 842.A O no hydrogen 2.543 N/A ILE 854.A N ILE 817.A O no hydrogen 2.956 N/A THR 858.A N GLY 855.A O no hydrogen 3.153 N/A THR 858.A OG1 GLY 855.A O no hydrogen 2.771 N/A GLU 861.A N LEU 835.A O no hydrogen 3.219 N/A HIS 862.A ND1 HIS 833.A O no hydrogen 2.516 N/A TRP 863.A N HIS 833.A O no hydrogen 3.056 N/A CYS 869.A N GLU 865.A O no hydrogen 2.540 N/A CYS 869.A SG PRO 864.A O no hydrogen 3.240 N/A CYS 869.A SG GLU 865.A O no hydrogen 3.147 N/A GLN 870.A N ASP 867.A O no hydrogen 3.247 N/A ASP 871.A N GLU 868.A O no hydrogen 3.359 N/A LYS 876.A NZ ASP 880.A OD1 no hydrogen 2.868 N/A LYS 876.A NZ ASP 880.A OD2 no hydrogen 3.170 N/A GLN 877.A NE2 GLU 861.A OE2 no hydrogen 3.420 N/A GLN 877.A NE2 HIS 862.A O no hydrogen 3.472 N/A CYS 878.A N ASN 874.A O no hydrogen 2.900 N/A CYS 878.A SG ASN 874.A O no hydrogen 3.211 N/A GLN 879.A N GLN 875.A O no hydrogen 2.911 N/A ASP 880.A N LYS 876.A O no hydrogen 2.899 N/A LEU 881.A N GLN 877.A O no hydrogen 2.905 N/A GLY 882.A N CYS 878.A O no hydrogen 2.907 N/A ALA 883.A N GLN 879.A O no hydrogen 2.909 N/A PHE 884.A N ASP 880.A O no hydrogen 2.900 N/A THR 885.A N LEU 881.A O no hydrogen 2.876 N/A GLU 886.A N GLY 882.A O no hydrogen 2.941 N/A SER 887.A N ALA 883.A O no hydrogen 2.884 N/A MET 888.A N PHE 884.A O no hydrogen 2.881 N/A VAL 890.A N GLU 886.A O no hydrogen 2.931 N/A VAL 890.A N SER 887.A O no hydrogen 3.241 N/A PHE 891.A N SER 887.A O no hydrogen 2.872 N/A ASN 895.A N CYS 893.A O no hydrogen 2.561 N/A