Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xcn_A.pdb H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 29.A N VAL 62.A O no hydrogen 2.899 N/A SER 31.A N SER 60.A O no hydrogen 3.109 N/A ARG 34.A NE PRO 217.A O no hydrogen 2.652 N/A ARG 34.A NH2 PRO 217.A O no hydrogen 2.741 N/A TYR 37.A OH LEU 54.A O no hydrogen 2.176 N/A TYR 38.A N LEU 223.A O no hydrogen 3.457 N/A SER 45.A OG SER 46.A OG no hydrogen 3.253 N/A SER 46.A N ASN 280.A O no hydrogen 2.806 N/A SER 46.A OG SER 45.A OG no hydrogen 3.253 N/A HIS 49.A N LEU 277.A O no hydrogen 2.999 N/A SER 50.A OG PHE 275.A O no hydrogen 3.529 N/A PHE 55.A N GLN 271.A O no hydrogen 2.902 N/A PHE 59.A N PHE 32.A O no hydrogen 3.386 N/A SER 60.A N SER 31.A OG no hydrogen 2.802 N/A ASN 61.A N SER 60.A OG no hydrogen 2.687 N/A VAL 62.A N THR 29.A O no hydrogen 3.162 N/A PHE 65.A N TYR 265.A O no hydrogen 3.192 N/A ASN 81.A N TYR 265.A OH no hydrogen 2.356 N/A LEU 84.A N PHE 238.A O no hydrogen 2.999 N/A TYR 91.A OH GLU 191.A OE2 no hydrogen 2.117 N/A ALA 93.A N TYR 266.A O no hydrogen 3.298 N/A THR 95.A N ALA 264.A O no hydrogen 3.077 N/A GLU 96.A N ASN 188.A O no hydrogen 3.039 N/A ARG 102.A NE ASN 99.A O no hydrogen 2.991 N/A ARG 102.A NH1 ASN 121.A O no hydrogen 3.477 N/A TRP 104.A N ILE 119.A O no hydrogen 2.754 N/A PHE 106.A N LEU 117.A O no hydrogen 3.071 N/A THR 108.A OG1 ASN 234.A O no hydrogen 2.161 N/A THR 109.A OG1 ASP 111.A O no hydrogen 3.085 N/A THR 109.A OG1 SER 112.A O no hydrogen 3.491 N/A SER 112.A N ASP 111.A OD2 no hydrogen 2.648 N/A SER 112.A OG ASP 111.A OD2 no hydrogen 2.834 N/A THR 114.A OG1 LYS 113.A O no hydrogen 2.650 N/A LEU 118.A N LYS 129.A O no hydrogen 3.033 N/A ALA 123.A N ASN 121.A OD1 no hydrogen 3.106 N/A VAL 127.A N VAL 120.A O no hydrogen 2.924 N/A LYS 129.A N LEU 118.A O no hydrogen 3.150 N/A GLU 132.A N ASN 164.A O no hydrogen 3.287 N/A PHE 135.A N ASP 111.A OD1 no hydrogen 2.771 N/A THR 167.A OG1 GLN 115.A OE1 no hydrogen 3.410 N/A LYS 187.A N GLU 96.A O no hydrogen 3.360 N/A LEU 189.A N THR 208.A O no hydrogen 3.129 N/A ARG 190.A N SER 94.A O no hydrogen 3.233 N/A GLU 191.A N LYS 206.A O no hydrogen 3.196 N/A PHE 192.A N PHE 92.A O no hydrogen 2.685 N/A VAL 193.A N TYR 204.A O no hydrogen 2.898 N/A LYS 195.A N LYS 202.A O no hydrogen 3.397 N/A LYS 195.A NZ TYR 37.A OH no hydrogen 2.764 N/A PHE 201.A N LEU 229.A O no hydrogen 3.102 N/A LYS 202.A N LYS 195.A O no hydrogen 2.908 N/A ILE 203.A N VAL 227.A O no hydrogen 3.267 N/A TYR 204.A N VAL 193.A O no hydrogen 2.942 N/A SER 205.A N GLU 224.A O no hydrogen 3.068 N/A LYS 206.A N GLU 191.A O no hydrogen 3.348 N/A HIS 207.A NE2 ASN 188.A OD1 no hydrogen 3.042 N/A THR 208.A N LEU 189.A O no hydrogen 3.233 N/A THR 208.A OG1 PRO 209.A O no hydrogen 3.379 N/A ILE 210.A N LYS 187.A O no hydrogen 3.070 N/A SER 221.A OG PHE 220.A O no hydrogen 2.590 N/A LEU 229.A N PHE 201.A O no hydrogen 2.849 N/A PHE 238.A N LEU 84.A O no hydrogen 3.067 N/A GLN 239.A N ILE 105.A O no hydrogen 2.869 N/A LEU 241.A N GLY 103.A O no hydrogen 2.681 N/A TYR 269.A OH PRO 85.A O no hydrogen 2.500 N/A GLN 271.A N PHE 55.A O no hydrogen 2.880 N/A ARG 273.A N ASP 53.A O no hydrogen 2.953 N/A ARG 273.A NE ASP 290.A OD2 no hydrogen 3.312 N/A ARG 273.A NH2 ASP 290.A OD2 no hydrogen 2.560 N/A PHE 275.A N THR 51.A O no hydrogen 3.171 N/A LEU 277.A N HIS 49.A O no hydrogen 2.704 N/A LYS 278.A N ASP 287.A O no hydrogen 2.833 N/A TYR 279.A N VAL 47.A O no hydrogen 3.342 N/A ASN 280.A N THR 284.A O no hydrogen 3.017 N/A GLY 283.A N ASN 280.A O no hydrogen 3.406 N/A THR 284.A N ASN 280.A OD1 no hydrogen 2.649 N/A ILE 285.A N TYR 38.A OH no hydrogen 3.194 N/A THR 286.A N LYS 278.A O no hydrogen 3.011 N/A THR 286.A OG1 LYS 278.A O no hydrogen 3.194 N/A VAL 289.A N LEU 276.A O no hydrogen 3.033 N/A CYS 291.A N THR 274.A O no hydrogen 3.204 N/A ALA 292.A N ASP 290.A OD1 no hydrogen 2.606 N/A LEU 293.A N ASP 290.A O no hydrogen 3.212 N/A SER 297.A N ASP 294.A O no hydrogen 2.569 N/A SER 297.A OG ASP 294.A OD1 no hydrogen 3.155 N/A GLU 298.A N ASP 294.A O no hydrogen 3.044 N/A THR 299.A N PRO 295.A O no hydrogen 2.952 N/A THR 299.A OG1 PRO 295.A O no hydrogen 3.139 N/A LYS 300.A N LEU 296.A O no hydrogen 2.933 N/A CYS 301.A N SER 297.A O no hydrogen 2.891 N/A CYS 301.A N GLU 298.A O no hydrogen 3.256 N/A THR 302.A N GLU 298.A O no hydrogen 2.938 N/A THR 302.A OG1 GLU 298.A O no hydrogen 3.206 N/A THR 302.A OG1 THR 299.A O no hydrogen 3.005 N/A LEU 303.A N THR 299.A O no hydrogen 2.947 N/A LYS 304.A N CYS 301.A O no hydrogen 3.359 N/A SER 305.A N LYS 300.A O no hydrogen 3.178 N/A SER 305.A OG THR 307.A O no hydrogen 2.322 N/A THR 307.A N SER 305.A OG no hydrogen 2.611 N/A THR 307.A OG1 THR 602.A OG1 no hydrogen 2.501 N/A VAL 308.A N THR 602.A OG1 no hydrogen 3.211 N/A LYS 310.A NZ ASP 663.A OD1 no hydrogen 2.415 N/A GLY 311.A N THR 599.A O no hydrogen 3.084 N/A TYR 313.A OH GLU 309.A O no hydrogen 2.157 N/A THR 315.A N VAL 595.A O no hydrogen 2.937 N/A THR 315.A OG1 VAL 595.A O no hydrogen 3.443 N/A SER 316.A OG GLU 298.A OE1 no hydrogen 3.070 N/A VAL 320.A N SER 591.A O no hydrogen 3.336 N/A THR 323.A N CYS 538.A O no hydrogen 2.678 N/A SER 325.A OG ASN 540.A O no hydrogen 3.405 N/A ILE 326.A N ASN 540.A O no hydrogen 3.456 N/A VAL 327.A N THR 531.A OG1 no hydrogen 3.040 N/A ARG 328.A N ASN 542.A O no hydrogen 3.300 N/A ARG 328.A NE ASP 578.A OD1 no hydrogen 2.895 N/A ARG 328.A NH2 ASP 578.A OD1 no hydrogen 2.619 N/A ARG 328.A NH2 ASP 578.A OD2 no hydrogen 2.813 N/A ASN 334.A ND2 ASN 360.A OD1 no hydrogen 3.318 N/A CYS 336.A N VAL 362.A O no hydrogen 2.831 N/A PHE 338.A N CYS 336.A O no hydrogen 2.640 N/A GLU 340.A N PRO 337.A O no hydrogen 3.272 N/A PHE 342.A N PHE 338.A O no hydrogen 2.909 N/A ASN 343.A N GLY 339.A O no hydrogen 2.612 N/A ALA 352.A N SER 349.A OG no hydrogen 3.416 N/A TRP 353.A N VAL 350.A O no hydrogen 3.179 N/A ARG 355.A N ASN 354.A OD1 no hydrogen 2.650 N/A ASN 360.A N THR 523.A OG1 no hydrogen 3.040 N/A CYS 361.A N THR 523.A O no hydrogen 3.198 N/A CYS 361.A SG SER 359.A O no hydrogen 3.444 N/A VAL 362.A N ASN 334.A O no hydrogen 3.313 N/A ALA 363.A N CYS 525.A O no hydrogen 3.214 N/A TYR 365.A N ASN 388.A OD1 no hydrogen 3.140 N/A TYR 369.A N TYR 365.A O no hydrogen 2.893 N/A ASN 370.A N SER 366.A O no hydrogen 3.068 N/A SER 371.A OG LEU 368.A O no hydrogen 3.010 N/A SER 375.A N ALA 435.A O no hydrogen 2.244 N/A THR 376.A N ALA 435.A O no hydrogen 2.965 N/A LYS 378.A N VAL 433.A O no hydrogen 2.969 N/A CYS 379.A SG SER 383.A O no hydrogen 4.031 N/A TYR 380.A N GLY 431.A O no hydrogen 2.867 N/A SER 383.A OG THR 385.A O no hydrogen 2.728 N/A ASN 388.A ND2 SER 366.A OG no hydrogen 2.696 N/A LEU 390.A N LEU 387.A O no hydrogen 2.525 N/A PHE 392.A N VAL 524.A O no hydrogen 2.820 N/A THR 393.A N GLU 516.A O no hydrogen 3.167 N/A THR 393.A OG1 GLU 516.A O no hydrogen 2.154 N/A ASN 394.A N GLU 516.A O no hydrogen 3.397 N/A ASN 394.A ND2 ILE 358.A O no hydrogen 3.185 N/A TYR 396.A N SER 514.A O no hydrogen 3.113 N/A TYR 396.A OH GLU 516.A OE1 no hydrogen 2.629 N/A ALA 397.A N LYS 356.A O no hydrogen 3.284 N/A ASP 398.A N VAL 512.A O no hydrogen 2.932 N/A PHE 400.A N VAL 510.A O no hydrogen 2.962 N/A ILE 402.A N TYR 508.A O no hydrogen 2.901 N/A ARG 403.A NE GLY 504.A O no hydrogen 2.697 N/A GLY 404.A N GLY 504.A O no hydrogen 3.300 N/A VAL 407.A N GLY 404.A O no hydrogen 3.187 N/A GLN 409.A N ASP 405.A O no hydrogen 2.986 N/A ILE 410.A N GLU 406.A O no hydrogen 2.952 N/A GLY 413.A N PRO 426.A O no hydrogen 2.639 N/A GLN 414.A NE2 PRO 412.A O no hydrogen 3.512 N/A ALA 419.A N GLN 409.A OE1 no hydrogen 3.289 N/A ASP 420.A N GLY 416.A O no hydrogen 2.487 N/A TYR 421.A N LYS 417.A O no hydrogen 2.922 N/A TYR 421.A N ILE 418.A O no hydrogen 3.195 N/A ASN 422.A N ILE 418.A O no hydrogen 2.561 N/A TYR 423.A N ILE 418.A O no hydrogen 2.867 N/A LYS 424.A NZ GLN 414.A O no hydrogen 2.367 N/A GLY 431.A N TYR 380.A O no hydrogen 2.916 N/A CYS 432.A N LEU 513.A O no hydrogen 2.936 N/A VAL 433.A N LYS 378.A O no hydrogen 2.870 N/A ILE 434.A N VAL 511.A O no hydrogen 2.877 N/A ALA 435.A N THR 376.A O no hydrogen 2.884 N/A TRP 436.A N ARG 509.A O no hydrogen 2.955 N/A ASN 437.A ND2 GLN 506.A OE1 no hydrogen 3.030 N/A SER 438.A N PRO 507.A O no hydrogen 2.756 N/A SER 438.A OG PRO 507.A O no hydrogen 2.548 N/A ASN 439.A N ASN 437.A OD1 no hydrogen 3.079 N/A ASN 439.A ND2 PRO 499.A O no hydrogen 3.265 N/A LEU 441.A N SER 438.A O no hydrogen 3.015 N/A ASP 442.A N SER 438.A O no hydrogen 2.587 N/A SER 443.A OG ASN 439.A OD1 no hydrogen 2.253 N/A LYS 444.A N PHE 497.A O no hydrogen 3.315 N/A LYS 444.A NZ VAL 445.A O no hydrogen 2.642 N/A LYS 444.A NZ GLY 447.A O no hydrogen 3.164 N/A GLY 446.A N GLN 498.A OE1 no hydrogen 2.397 N/A GLY 447.A N LYS 444.A O no hydrogen 3.145 N/A TYR 449.A OH GLY 446.A O no hydrogen 3.224 N/A TYR 451.A OH ASP 442.A OD1 no hydrogen 3.425 N/A TYR 453.A N GLN 493.A O no hydrogen 2.928 N/A ARG 454.A N ASN 422.A OD1 no hydrogen 3.215 N/A ARG 454.A NH1 SER 469.A O no hydrogen 2.734 N/A ARG 454.A NH2 SER 469.A O no hydrogen 3.208 N/A LEU 455.A N PRO 491.A O no hydrogen 2.202 N/A LYS 462.A N GLU 465.A OE1 no hydrogen 2.420 N/A PHE 464.A N LYS 424.A O no hydrogen 2.560 N/A GLU 465.A N LYS 462.A O no hydrogen 2.878 N/A ARG 466.A NE TRP 353.A O no hydrogen 2.410 N/A ARG 466.A NH1 ALA 352.A O no hydrogen 3.486 N/A ARG 466.A NH1 TRP 353.A O no hydrogen 2.976 N/A THR 470.A OG1 ILE 468.A O no hydrogen 3.206 N/A GLN 474.A NE2 GLU 471.A OE1 no hydrogen 2.300 N/A CYS 480.A N GLN 474.A OE1 no hydrogen 3.294 N/A CYS 480.A SG GLN 474.A OE1 no hydrogen 2.941 N/A CYS 480.A SG THR 478.A O no hydrogen 4.026 N/A CYS 488.A N GLY 485.A O no hydrogen 2.968 N/A CYS 488.A SG TYR 473.A O no hydrogen 3.167 N/A GLN 493.A N TYR 453.A O no hydrogen 2.905 N/A SER 494.A OG TYR 449.A O no hydrogen 2.740 N/A TYR 495.A OH GLU 406.A OE1 no hydrogen 2.911 N/A TYR 495.A OH GLU 406.A OE2 no hydrogen 2.640 N/A PHE 497.A N ASN 448.A O no hydrogen 3.116 N/A GLN 498.A N ASN 501.A OD1 no hydrogen 2.813 N/A ASN 501.A N GLN 498.A O no hydrogen 3.121 N/A TYR 505.A N GLY 502.A O no hydrogen 2.863 N/A GLN 506.A N VAL 503.A O no hydrogen 2.948 N/A GLN 506.A NE2 ASN 501.A O no hydrogen 3.348 N/A TYR 508.A N ILE 402.A O no hydrogen 2.863 N/A ARG 509.A NH2 THR 345.A O no hydrogen 3.158 N/A VAL 510.A N PHE 400.A O no hydrogen 2.863 N/A VAL 511.A N ILE 434.A O no hydrogen 2.894 N/A VAL 512.A N ASP 398.A O no hydrogen 2.949 N/A LEU 513.A N CYS 432.A O no hydrogen 3.220 N/A SER 514.A N TYR 396.A O no hydrogen 3.226 N/A PHE 515.A N THR 430.A O no hydrogen 2.957 N/A GLU 516.A N ASN 394.A O no hydrogen 2.986 N/A VAL 524.A N PHE 392.A O no hydrogen 3.263 N/A CYS 525.A N CYS 361.A O no hydrogen 3.280 N/A CYS 525.A SG LEU 390.A O no hydrogen 3.056 N/A CYS 525.A SG GLY 526.A O no hydrogen 3.769 N/A GLY 526.A N LEU 390.A O no hydrogen 3.400 N/A SER 530.A OG PHE 329.A O no hydrogen 3.445 N/A THR 531.A OG1 VAL 327.A O no hydrogen 3.260 N/A THR 531.A OG1 ASN 532.A O no hydrogen 3.408 N/A LEU 533.A N ASN 532.A OD1 no hydrogen 2.463 N/A ASN 536.A N LEU 552.A O no hydrogen 3.082 N/A LYS 537.A NZ LYS 535.A O no hydrogen 3.333 N/A VAL 539.A N GLY 550.A O no hydrogen 2.886 N/A ASN 540.A N GLU 324.A O no hydrogen 3.353 N/A ASN 542.A N ILE 326.A O no hydrogen 2.965 N/A GLY 545.A N ASN 544.A OD1 no hydrogen 2.426 N/A GLY 548.A N PHE 541.A O no hydrogen 2.973 N/A GLY 550.A N VAL 539.A O no hydrogen 2.934 N/A THR 553.A OG1 ASN 536.A OD1 no hydrogen 3.548 N/A THR 553.A OG1 VAL 551.A O no hydrogen 3.251 N/A SER 555.A N ILE 584.A O no hydrogen 3.179 N/A SER 555.A OG ASP 586.A OD1 no hydrogen 3.372 N/A LYS 557.A N SER 555.A OG no hydrogen 2.767 N/A LEU 560.A N GLN 563.A OE1 no hydrogen 2.938 N/A GLN 563.A N LEU 560.A O no hydrogen 2.969 N/A ASP 568.A N THR 572.A O no hydrogen 2.961 N/A ASP 571.A N ASP 568.A O no hydrogen 2.856 N/A ASP 574.A N GLY 566.A O no hydrogen 2.841 N/A VAL 576.A N LEU 585.A O no hydrogen 2.902 N/A ARG 577.A N GLN 564.A O no hydrogen 3.059 N/A ASP 578.A N GLU 583.A O no hydrogen 3.178 N/A GLN 580.A NE2 PHE 329.A O no hydrogen 3.340 N/A THR 581.A N ASP 578.A OD2 no hydrogen 2.855 N/A THR 581.A OG1 ASP 578.A OD2 no hydrogen 2.517 N/A GLU 583.A N THR 581.A O no hydrogen 2.472 N/A LEU 585.A N VAL 576.A O no hydrogen 2.886 N/A ASP 586.A N THR 553.A O no hydrogen 2.783 N/A GLY 593.A N PHE 318.A O no hydrogen 2.928 N/A VAL 595.A N SER 316.A O no hydrogen 2.884 N/A SER 596.A N LEU 611.A O no hydrogen 2.909 N/A VAL 597.A N TYR 313.A O no hydrogen 2.724 N/A ILE 598.A N ALA 609.A O no hydrogen 2.875 N/A THR 599.A N GLY 311.A O no hydrogen 3.247 N/A THR 599.A OG1 PRO 600.A O no hydrogen 2.478 N/A THR 602.A N VAL 308.A O no hydrogen 3.072 N/A THR 602.A OG1 THR 307.A OG1 no hydrogen 2.501 N/A THR 604.A N GLY 601.A O no hydrogen 2.571 N/A SER 605.A N GLY 601.A O no hydrogen 3.291 N/A GLU 607.A N SER 605.A OG no hydrogen 2.950 N/A ALA 609.A N ILE 598.A O no hydrogen 2.938 N/A VAL 610.A N ILE 651.A O no hydrogen 2.912 N/A LEU 611.A N SER 596.A O no hydrogen 2.883 N/A TYR 612.A N CYS 649.A O no hydrogen 3.295 N/A GLN 613.A N GLY 594.A O no hydrogen 2.939 N/A GLN 613.A NE2 SER 596.A OG no hydrogen 2.900 N/A ASP 614.A N ALA 647.A O no hydrogen 3.108 N/A CYS 617.A SG PHE 643.A O no hydrogen 3.871 N/A THR 618.A N GLU 619.A OE1 no hydrogen 3.010 N/A PHE 643.A N LEU 650.A O no hydrogen 2.899 N/A GLN 644.A NE2 THR 645.A O no hydrogen 2.316 N/A THR 645.A N GLY 648.A O no hydrogen 2.893 N/A THR 645.A OG1 GLY 648.A O no hydrogen 3.391 N/A ALA 647.A N THR 645.A OG1 no hydrogen 2.727 N/A GLY 648.A N THR 645.A OG1 no hydrogen 2.865 N/A CYS 649.A N TYR 612.A O no hydrogen 2.905 N/A ILE 651.A N VAL 610.A O no hydrogen 2.870 N/A GLY 652.A N ASN 641.A O no hydrogen 2.997 N/A GLU 654.A N ILE 692.A O no hydrogen 3.154 N/A ASN 658.A ND2 TYR 660.A OH no hydrogen 2.332 N/A SER 659.A OG ASN 658.A O no hydrogen 2.527 N/A ILE 664.A N ALA 672.A O no hydrogen 3.044 N/A ILE 666.A N ILE 670.A O no hydrogen 3.137 N/A ILE 670.A N GLY 667.A O no hydrogen 2.884 N/A CYS 671.A N TYR 695.A O no hydrogen 2.920 N/A ALA 672.A N ILE 664.A O no hydrogen 3.028 N/A SER 673.A N ILE 693.A O no hydrogen 2.875 N/A SER 673.A OG ASP 663.A OD2 no hydrogen 3.247 N/A GLN 675.A N SER 691.A O no hydrogen 2.928 N/A GLN 690.A NE2 THR 676.A OG1 no hydrogen 2.207 N/A SER 691.A N GLN 675.A O no hydrogen 2.891 N/A ILE 693.A N SER 673.A O no hydrogen 2.870 N/A ALA 694.A N GLU 654.A O no hydrogen 2.833 N/A TYR 695.A N CYS 671.A O no hydrogen 2.922 N/A TYR 695.A OH GLU 661.A O no hydrogen 2.983 N/A MET 697.A N GLY 669.A O no hydrogen 3.141 N/A SER 698.A N TYR 660.A O no hydrogen 3.287 N/A TYR 707.A N VAL 705.A O no hydrogen 2.565 N/A SER 708.A OG ASN 710.A OD1 no hydrogen 3.308 N/A ASN 710.A N SER 708.A OG no hydrogen 2.828 N/A ILE 712.A N PHE 1075.A O no hydrogen 2.932 N/A ILE 714.A N LYS 1073.A O no hydrogen 3.295 N/A THR 716.A N GLN 1071.A O no hydrogen 2.852 N/A THR 716.A OG1 GLN 1071.A O no hydrogen 3.120 N/A PHE 718.A N ASN 717.A OD1 no hydrogen 2.772 N/A THR 719.A N VAL 1068.A O no hydrogen 2.856 N/A SER 721.A OG THR 1066.A OG1 no hydrogen 2.850 N/A THR 723.A N HIS 1064.A O no hydrogen 3.336 N/A THR 723.A OG1 THR 724.A O no hydrogen 3.439 N/A GLU 725.A N PHE 1062.A O no hydrogen 2.991 N/A LEU 727.A N VAL 1060.A O no hydrogen 2.928 N/A MET 731.A N GLN 774.A OE1 no hydrogen 2.287 N/A LYS 733.A NZ ASP 775.A OD1 no hydrogen 3.216 N/A LYS 733.A NZ ASP 775.A OD2 no hydrogen 2.346 N/A LYS 733.A NZ PRO 862.A O no hydrogen 3.178 N/A THR 734.A OG1 THR 732.A O no hydrogen 3.153 N/A SER 735.A N THR 859.A O no hydrogen 2.907 N/A CYS 738.A SG THR 739.A OG1 no hydrogen 3.243 N/A THR 739.A N ASP 737.A OD1 no hydrogen 3.322 N/A MET 740.A N ASP 737.A OD2 no hydrogen 3.234 N/A TYR 741.A N ASP 737.A O no hydrogen 3.241 N/A TYR 741.A OH LEU 962.A O no hydrogen 2.849 N/A ILE 742.A N CYS 738.A O no hydrogen 2.835 N/A CYS 743.A N THR 739.A O no hydrogen 2.768 N/A SER 750.A N SER 746.A O no hydrogen 2.964 N/A SER 750.A OG SER 746.A O no hydrogen 3.542 N/A ASN 751.A N THR 747.A O no hydrogen 2.937 N/A LEU 752.A N GLU 748.A O no hydrogen 2.918 N/A LEU 753.A N CYS 749.A O no hydrogen 2.865 N/A LEU 754.A N SER 750.A O no hydrogen 2.956 N/A GLN 755.A N LEU 752.A O no hydrogen 2.902 N/A TYR 756.A N LEU 753.A O no hydrogen 2.716 N/A TYR 756.A OH ASP 994.A OD2 no hydrogen 3.315 N/A TYR 756.A OH THR 998.A OG1 no hydrogen 3.133 N/A GLY 757.A N LEU 754.A O no hydrogen 3.276 N/A GLN 762.A N SER 758.A O no hydrogen 2.960 N/A LEU 763.A N PHE 759.A O no hydrogen 2.895 N/A ASN 764.A N CYS 760.A O no hydrogen 2.904 N/A ARG 765.A N THR 761.A O no hydrogen 2.956 N/A ALA 766.A N GLN 762.A O no hydrogen 2.951 N/A LEU 767.A N LEU 763.A O no hydrogen 2.960 N/A THR 768.A N ASN 764.A O no hydrogen 2.934 N/A THR 768.A OG1 ASN 764.A O no hydrogen 3.229 N/A GLY 769.A N ARG 765.A O no hydrogen 2.896 N/A ILE 770.A N ALA 766.A O no hydrogen 3.017 N/A ALA 771.A N LEU 767.A O no hydrogen 2.927 N/A VAL 772.A N THR 768.A O no hydrogen 2.945 N/A GLU 773.A N GLY 769.A O no hydrogen 2.966 N/A GLN 774.A N ILE 770.A O no hydrogen 3.047 N/A GLN 774.A NE2 ILE 770.A O no hydrogen 3.655 N/A LYS 776.A N VAL 772.A O no hydrogen 3.023 N/A ASN 777.A N GLU 773.A O no hydrogen 2.866 N/A ASN 777.A ND2 VAL 729.A O no hydrogen 3.338 N/A THR 778.A N GLN 774.A O no hydrogen 3.045 N/A GLN 779.A N ASP 775.A O no hydrogen 2.938 N/A GLU 780.A N LYS 776.A O no hydrogen 2.932 N/A VAL 781.A N ASN 777.A O no hydrogen 2.925 N/A PHE 782.A N THR 778.A O no hydrogen 2.994 N/A ALA 783.A N GLN 779.A O no hydrogen 3.076 N/A GLN 784.A N PHE 782.A O no hydrogen 2.532 N/A GLN 784.A NE2 SER 1030.A OG no hydrogen 2.389 N/A LYS 795.A NZ PRO 792.A O no hydrogen 2.928 N/A LYS 795.A NZ PRO 793.A O no hydrogen 2.380 N/A LYS 795.A NZ ILE 794.A O no hydrogen 3.275 N/A PHE 800.A N PHE 797.A O no hydrogen 2.979 N/A ASN 801.A N ASN 928.A OD1 no hydrogen 2.976 N/A SER 803.A N ASN 801.A OD1 no hydrogen 3.199 N/A ILE 805.A N PHE 802.A O no hydrogen 3.076 N/A LEU 806.A N PHE 802.A O no hydrogen 2.878 N/A ASP 808.A N ARG 815.A O no hydrogen 3.422 N/A LYS 811.A NZ ASP 820.A OD2 no hydrogen 2.585 N/A SER 813.A OG SER 813.A O no hydrogen 2.635 N/A LYS 814.A N GLU 868.A OE2 no hydrogen 2.914 N/A ARG 815.A N SER 813.A O no hydrogen 2.559 N/A SER 816.A N GLU 819.A OE1 no hydrogen 3.020 N/A SER 816.A OG GLN 804.A O no hydrogen 3.282 N/A SER 816.A OG LEU 806.A O no hydrogen 2.742 N/A ILE 818.A N GLN 804.A O no hydrogen 3.296 N/A ASP 820.A N SER 816.A O no hydrogen 2.948 N/A LEU 821.A N PHE 817.A O no hydrogen 2.969 N/A LEU 822.A N ILE 818.A O no hydrogen 2.927 N/A PHE 823.A N GLU 819.A O no hydrogen 2.877 N/A ASN 824.A N ASP 820.A O no hydrogen 2.942 N/A LYS 825.A N LEU 821.A O no hydrogen 3.218 N/A THR 859.A N SER 735.A O no hydrogen 2.974 N/A THR 859.A N GLY 857.A O no hydrogen 2.660 N/A LEU 861.A N LYS 733.A O no hydrogen 2.743 N/A LEU 864.A N ASP 775.A OD1 no hydrogen 3.371 N/A MET 869.A N THR 866.A O no hydrogen 2.564 N/A ILE 870.A N THR 866.A O no hydrogen 3.145 N/A ALA 871.A N ASP 867.A O no hydrogen 2.919 N/A GLN 872.A N GLU 868.A O no hydrogen 2.909 N/A TYR 873.A N MET 869.A O no hydrogen 2.944 N/A THR 874.A N ILE 870.A O no hydrogen 2.985 N/A THR 874.A OG1 GLU 819.A OE2 no hydrogen 3.002 N/A THR 874.A OG1 ALA 871.A O no hydrogen 3.084 N/A SER 875.A N ALA 871.A O no hydrogen 2.900 N/A ALA 876.A N GLN 872.A O no hydrogen 2.870 N/A LEU 877.A N TYR 873.A O no hydrogen 2.945 N/A LEU 878.A N THR 874.A O no hydrogen 2.923 N/A ALA 879.A N SER 875.A O no hydrogen 2.893 N/A GLY 880.A N ALA 876.A O no hydrogen 2.906 N/A THR 881.A N LEU 877.A O no hydrogen 2.955 N/A THR 881.A OG1 LEU 877.A O no hydrogen 3.146 N/A ILE 882.A N LEU 878.A O no hydrogen 2.954 N/A THR 883.A N ALA 879.A O no hydrogen 2.973 N/A THR 883.A OG1 ALA 879.A O no hydrogen 2.752 N/A SER 884.A N GLY 880.A O no hydrogen 2.874 N/A SER 884.A OG GLY 880.A O no hydrogen 2.294 N/A THR 887.A OG1 SER 884.A O no hydrogen 2.707 N/A GLY 889.A N TRP 886.A O no hydrogen 2.775 N/A ALA 890.A N THR 887.A O no hydrogen 2.969 N/A LEU 894.A N THR 887.A OG1 no hydrogen 3.351 N/A GLN 895.A N GLN 895.A OE1 no hydrogen 2.439 N/A ILE 896.A N THR 883.A O no hydrogen 3.189 N/A GLN 901.A N PRO 897.A O no hydrogen 3.037 N/A GLN 901.A NE2 THR 881.A O no hydrogen 3.402 N/A MET 902.A N PHE 898.A O no hydrogen 2.925 N/A ALA 903.A N ALA 899.A O no hydrogen 2.954 N/A TYR 904.A N MET 900.A O no hydrogen 2.948 N/A ARG 905.A N GLN 901.A O no hydrogen 2.879 N/A ARG 905.A NH1 LEU 1049.A O no hydrogen 3.179 N/A PHE 906.A N MET 902.A O no hydrogen 2.873 N/A ASN 907.A N ALA 903.A O no hydrogen 2.921 N/A GLY 908.A N TYR 904.A O no hydrogen 2.898 N/A GLY 908.A N ARG 905.A O no hydrogen 3.195 N/A ILE 909.A N PHE 906.A O no hydrogen 2.477 N/A THR 912.A OG1 ASN 914.A OD1 no hydrogen 3.211 N/A THR 912.A OG1 GLN 1106.A OE1 no hydrogen 2.597 N/A ASN 914.A ND2 GLU 918.A OE2 no hydrogen 3.462 N/A ASN 914.A ND2 GLU 1111.A OE2 no hydrogen 2.485 N/A VAL 915.A N THR 912.A O no hydrogen 3.219 N/A TYR 917.A N GLN 913.A O no hydrogen 2.985 N/A GLU 918.A N ASN 914.A O no hydrogen 2.911 N/A ASN 919.A N LEU 916.A O no hydrogen 2.842 N/A GLN 920.A NE2 GLY 798.A O no hydrogen 2.892 N/A ILE 923.A N ASN 919.A O no hydrogen 2.907 N/A ALA 924.A N GLN 920.A O no hydrogen 2.893 N/A ASN 925.A N LYS 921.A O no hydrogen 2.942 N/A GLN 926.A N LEU 922.A O no hydrogen 2.966 N/A GLN 926.A NE2 PHE 718.A O no hydrogen 3.388 N/A PHE 927.A N ILE 923.A O no hydrogen 2.896 N/A ASN 928.A N ALA 924.A O no hydrogen 2.927 N/A ASN 928.A ND2 GLY 799.A O no hydrogen 3.489 N/A SER 929.A N ASN 925.A O no hydrogen 2.941 N/A SER 929.A OG ASN 925.A O no hydrogen 2.846 N/A ALA 930.A N GLN 926.A O no hydrogen 2.911 N/A ILE 931.A N PHE 927.A O no hydrogen 2.970 N/A GLY 932.A N ASN 928.A O no hydrogen 2.970 N/A LYS 933.A N SER 929.A O no hydrogen 2.919 N/A ILE 934.A N ALA 930.A O no hydrogen 2.981 N/A GLN 935.A N ILE 931.A O no hydrogen 2.954 N/A GLN 935.A NE2 GLN 804.A OE1 no hydrogen 2.244 N/A ASP 936.A N GLY 932.A O no hydrogen 2.982 N/A SER 937.A N LYS 933.A O no hydrogen 2.848 N/A LEU 938.A N ILE 934.A O no hydrogen 2.953 N/A SER 939.A N GLN 935.A O no hydrogen 2.903 N/A SER 940.A N ASP 936.A O no hydrogen 2.922 N/A SER 943.A OG SER 943.A O no hydrogen 2.344 N/A LEU 945.A N ALA 942.A O no hydrogen 3.236 N/A GLN 949.A N LEU 945.A O no hydrogen 3.361 N/A ASP 950.A N GLY 946.A O no hydrogen 2.898 N/A VAL 951.A N LYS 947.A O no hydrogen 3.433 N/A VAL 952.A N LEU 948.A O no hydrogen 3.058 N/A ASN 953.A N GLN 949.A O no hydrogen 2.900 N/A GLN 954.A N ASP 950.A O no hydrogen 2.878 N/A ASN 955.A N VAL 951.A O no hydrogen 3.029 N/A ALA 956.A N VAL 952.A O no hydrogen 2.931 N/A GLN 957.A N ASN 953.A O no hydrogen 2.895 N/A ALA 958.A N GLN 954.A O no hydrogen 2.940 N/A LEU 959.A N ASN 955.A O no hydrogen 2.970 N/A ASN 960.A N ALA 956.A O no hydrogen 2.911 N/A THR 961.A N GLN 957.A O no hydrogen 2.888 N/A THR 961.A OG1 GLN 957.A O no hydrogen 3.402 N/A LEU 962.A N ALA 958.A O no hydrogen 2.924 N/A VAL 963.A N LEU 959.A O no hydrogen 2.899 N/A LYS 964.A N ASN 960.A O no hydrogen 2.898 N/A GLN 965.A N THR 961.A O no hydrogen 2.927 N/A GLN 965.A N LEU 962.A O no hydrogen 3.323 N/A LEU 966.A N VAL 963.A O no hydrogen 2.660 N/A SER 967.A N LYS 964.A O no hydrogen 3.417 N/A SER 968.A N GLN 965.A O no hydrogen 3.340 N/A ALA 972.A N ASN 969.A O no hydrogen 2.844 N/A SER 975.A OG ASN 969.A OD1 no hydrogen 2.395 N/A ILE 980.A N VAL 976.A O no hydrogen 3.422 N/A LEU 981.A N LEU 977.A O no hydrogen 2.909 N/A SER 982.A N ASN 978.A O no hydrogen 2.899 N/A ARG 983.A N ASP 979.A O no hydrogen 2.869 N/A LEU 984.A N ILE 980.A O no hydrogen 3.307 N/A GLU 988.A N ASP 985.A O no hydrogen 2.880 N/A ALA 989.A N ASP 985.A O no hydrogen 2.588 N/A GLU 990.A N PRO 986.A O no hydrogen 2.897 N/A GLN 992.A N GLU 988.A O no hydrogen 3.005 N/A ILE 993.A N ALA 989.A O no hydrogen 2.830 N/A ASP 994.A N GLU 990.A O no hydrogen 2.877 N/A ARG 995.A N VAL 991.A O no hydrogen 2.994 N/A LEU 996.A N GLN 992.A O no hydrogen 3.024 N/A ILE 997.A N ILE 993.A O no hydrogen 2.756 N/A THR 998.A N ASP 994.A O no hydrogen 2.944 N/A THR 998.A OG1 TYR 756.A OH no hydrogen 3.133 N/A THR 998.A OG1 ASP 994.A O no hydrogen 2.978 N/A THR 998.A OG1 ASP 994.A OD1 no hydrogen 3.487 N/A GLY 999.A N ARG 995.A O no hydrogen 2.958 N/A ARG 1000.A N LEU 996.A O no hydrogen 2.889 N/A ARG 1000.A NH1 ILE 742.A O no hydrogen 2.642 N/A LEU 1001.A N ILE 997.A O no hydrogen 2.840 N/A GLN 1002.A N THR 998.A O no hydrogen 2.956 N/A SER 1003.A N GLY 999.A O no hydrogen 2.969 N/A LEU 1004.A N ARG 1000.A O no hydrogen 2.882 N/A GLN 1005.A N LEU 1001.A O no hydrogen 2.934 N/A THR 1006.A N GLN 1002.A O no hydrogen 2.961 N/A THR 1006.A OG1 GLN 1002.A O no hydrogen 3.171 N/A TYR 1007.A N SER 1003.A O no hydrogen 2.987 N/A VAL 1008.A N LEU 1004.A O no hydrogen 2.901 N/A THR 1009.A N GLN 1005.A O no hydrogen 2.894 N/A THR 1009.A OG1 GLN 1005.A O no hydrogen 3.390 N/A GLN 1010.A N THR 1006.A O no hydrogen 2.966 N/A GLN 1011.A N TYR 1007.A O no hydrogen 2.914 N/A LEU 1012.A N VAL 1008.A O no hydrogen 2.839 N/A ILE 1013.A N THR 1009.A O no hydrogen 3.011 N/A ARG 1014.A N GLN 1010.A O no hydrogen 2.926 N/A ARG 1014.A NH1 ASN 955.A OD1 no hydrogen 2.992 N/A ALA 1015.A N GLN 1011.A O no hydrogen 2.830 N/A ALA 1016.A N LEU 1012.A O no hydrogen 2.962 N/A GLU 1017.A N ILE 1013.A O no hydrogen 3.002 N/A ILE 1018.A N ARG 1014.A O no hydrogen 2.902 N/A ARG 1019.A N ALA 1015.A O no hydrogen 2.875 N/A ARG 1019.A NE GLU 773.A OE2 no hydrogen 3.036 N/A ALA 1020.A N ALA 1016.A O no hydrogen 2.939 N/A SER 1021.A N GLU 1017.A O no hydrogen 3.016 N/A ALA 1022.A N ILE 1018.A O no hydrogen 2.820 N/A ASN 1023.A N ARG 1019.A O no hydrogen 2.899 N/A LEU 1024.A N ALA 1020.A O no hydrogen 2.967 N/A ALA 1025.A N SER 1021.A O no hydrogen 2.879 N/A ALA 1026.A N ALA 1022.A O no hydrogen 2.873 N/A THR 1027.A N ASN 1023.A O no hydrogen 2.935 N/A THR 1027.A OG1 ASN 1023.A O no hydrogen 3.417 N/A LYS 1028.A N LEU 1024.A O no hydrogen 2.865 N/A LYS 1028.A NZ GLU 725.A OE2 no hydrogen 3.336 N/A MET 1029.A N ALA 1025.A O no hydrogen 2.868 N/A SER 1030.A N ALA 1026.A O no hydrogen 2.908 N/A SER 1030.A OG ALA 1026.A O no hydrogen 3.358 N/A GLU 1031.A N THR 1027.A O no hydrogen 2.904 N/A CYS 1032.A SG SER 1051.A OG no hydrogen 3.656 N/A VAL 1033.A N MET 1029.A O no hydrogen 3.087 N/A LEU 1034.A N MET 1029.A O no hydrogen 3.241 N/A GLN 1036.A NE2 ARG 905.A O no hydrogen 2.921 N/A GLN 1036.A NE2 HIS 1048.A O no hydrogen 2.995 N/A LYS 1038.A NZ GLY 908.A O no hydrogen 3.126 N/A ARG 1039.A N SER 1037.A OG no hydrogen 2.802 N/A PHE 1042.A N ARG 1039.A O no hydrogen 3.089 N/A LEU 1049.A N VAL 1065.A O no hydrogen 3.072 N/A MET 1050.A N VAL 1065.A O no hydrogen 2.978 N/A SER 1051.A OG CYS 1032.A O no hydrogen 2.265 N/A PHE 1052.A N LEU 1063.A O no hydrogen 3.412 N/A GLN 1054.A N VAL 1061.A O no hydrogen 2.839 N/A GLN 1054.A NE2 PRO 1053.A O no hydrogen 2.158 N/A VAL 1060.A N LEU 727.A O no hydrogen 2.949 N/A VAL 1061.A N GLN 1054.A O no hydrogen 2.909 N/A PHE 1062.A N GLU 725.A O no hydrogen 2.883 N/A LEU 1063.A N PHE 1052.A O no hydrogen 2.921 N/A HIS 1064.A NE2 GLU 725.A OE1 no hydrogen 2.425 N/A THR 1066.A N SER 721.A O no hydrogen 3.188 N/A TYR 1067.A N TYR 1047.A O no hydrogen 2.668 N/A VAL 1068.A N THR 719.A O no hydrogen 2.937 N/A ALA 1070.A N ASN 717.A O no hydrogen 2.841 N/A LYS 1073.A N ILE 714.A O no hydrogen 2.938 N/A PHE 1075.A N ILE 712.A O no hydrogen 2.899 N/A PHE 1075.A N LYS 1073.A O no hydrogen 2.975 N/A THR 1076.A N SER 1097.A O no hydrogen 3.481 N/A THR 1077.A N ASN 710.A O no hydrogen 2.896 N/A THR 1077.A OG1 PHE 1095.A O no hydrogen 2.894 N/A ILE 1081.A N HIS 1088.A O no hydrogen 3.287 N/A CYS 1082.A N VAL 1133.A O no hydrogen 3.254 N/A ALA 1087.A N SER 1123.A O no hydrogen 2.984 N/A HIS 1088.A N ILE 1081.A O no hydrogen 2.916 N/A PHE 1089.A N PHE 1121.A O no hydrogen 2.935 N/A ARG 1091.A N ASN 1119.A O no hydrogen 2.759 N/A ARG 1091.A NH1 ASP 1118.A O no hydrogen 2.394 N/A VAL 1094.A N THR 1105.A O no hydrogen 2.910 N/A VAL 1096.A N PHE 1103.A O no hydrogen 2.885 N/A SER 1097.A OG HIS 1101.A O no hydrogen 2.765 N/A GLY 1099.A N SER 1097.A OG no hydrogen 3.077 N/A THR 1100.A OG1 ASN 1098.A OD1 no hydrogen 3.326 N/A THR 1100.A OG1 HIS 1101.A ND1 no hydrogen 2.307 N/A HIS 1101.A N ASN 1098.A OD1 no hydrogen 3.333 N/A PHE 1103.A N VAL 1096.A O no hydrogen 2.903 N/A VAL 1104.A N GLN 1113.A O no hydrogen 3.208 N/A THR 1105.A N VAL 1094.A O no hydrogen 2.949 N/A THR 1105.A OG1 GLN 1106.A O no hydrogen 3.419 N/A GLN 1106.A NE2 PHE 1109.A O no hydrogen 3.570 N/A ASN 1108.A ND2 GLY 910.A O no hydrogen 3.299 N/A TYR 1110.A N PRO 715.A O no hydrogen 2.768 N/A GLU 1111.A N THR 1105.A OG1 no hydrogen 2.813 N/A GLN 1113.A NE2 PRO 1112.A O no hydrogen 3.053 N/A ASP 1118.A N THR 1116.A OG1 no hydrogen 2.540 N/A ASN 1119.A N THR 1116.A OG1 no hydrogen 3.106 N/A ASN 1119.A ND2 ILE 1114.A O no hydrogen 2.699 N/A THR 1120.A OG1 PHE 1089.A O no hydrogen 2.393 N/A THR 1120.A OG1 PHE 1121.A O no hydrogen 3.438 N/A PHE 1121.A N PHE 1089.A O no hydrogen 2.897 N/A SER 1123.A N ALA 1087.A O no hydrogen 2.889 N/A CYS 1126.A N GLY 1085.A O no hydrogen 2.886 N/A ASP 1127.A N ASN 1125.A OD1 no hydrogen 3.405 N/A VAL 1133.A N ALA 1080.A O no hydrogen 3.244 N/A ASN 1135.A N CYS 1082.A O no hydrogen 3.023 N/A LEU 1141.A N ASP 1139.A OD1 no hydrogen 3.217 N/A GLN 1142.A N ASP 1139.A O no hydrogen 3.378 N/A LEU 1145.A N LEU 1141.A O no hydrogen 2.904 N/A ASP 1146.A N GLN 1142.A O no hydrogen 2.886 N/A SER 1147.A N PRO 1143.A O no hydrogen 2.962 N/A