Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6r9g_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 8.A NZ SER 217.A O no hydrogen 3.321 N/A ILE 17.A N SER 13.A O no hydrogen 3.173 N/A ARG 18.A N PRO 14.A O no hydrogen 2.925 N/A SER 19.A N ASP 15.A O no hydrogen 2.898 N/A SER 21.A N ILE 17.A O no hydrogen 2.956 N/A GLU 29.A N LYS 27.A O no hydrogen 2.646 N/A THR 35.A OG1 GLU 39.A OE2 no hydrogen 3.501 N/A LYS 37.A NZ THR 35.A O no hydrogen 2.867 N/A ARG 40.A NH1 LYS 26.A O no hydrogen 2.405 N/A ARG 40.A NH2 LYS 26.A O no hydrogen 3.172 N/A CYS 45.A SG ARG 40.A O no hydrogen 3.815 N/A CYS 45.A SG ASP 41.A O no hydrogen 3.243 N/A ILE 48.A N CYS 45.A O no hydrogen 3.287 N/A CYS 57.A SG GLU 56.A O no hydrogen 3.275 N/A CYS 75.A SG LEU 58.A O no hydrogen 3.305 N/A THR 82.A OG1 ARG 86.A O no hydrogen 2.687 N/A HIS 91.A NE2 GLY 23.A O no hydrogen 2.923 N/A ILE 92.A N LEU 229.A O no hydrogen 3.165 N/A LEU 104.A N HIS 100.A O no hydrogen 3.477 N/A LYS 105.A N ILE 101.A O no hydrogen 2.648 N/A SER 106.A OG ILE 111.A O no hydrogen 2.873 N/A SER 109.A OG PRO 108.A O no hydrogen 2.788 N/A ILE 111.A N SER 106.A OG no hydrogen 3.082 N/A GLU 123.A N LEU 119.A O no hydrogen 2.914 N/A ARG 124.A N ARG 120.A O no hydrogen 2.880 N/A VAL 125.A N ASP 121.A O no hydrogen 2.917 N/A LEU 126.A N ILE 122.A O no hydrogen 3.233 N/A TYR 127.A N ARG 124.A O no hydrogen 3.054 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.797 N/A SER 130.A OG LEU 147.A O no hydrogen 3.443 N/A ILE 134.A N ASP 164.A O no hydrogen 3.101 N/A THR 139.A OG1 LEU 141.A O no hydrogen 3.277 N/A ARG 143.A NH1 SER 178.A OG no hydrogen 3.125 N/A TYR 152.A N THR 148.A O no hydrogen 2.899 N/A LEU 153.A N GLU 149.A O no hydrogen 2.921 N/A ASP 154.A N GLU 150.A O no hydrogen 2.922 N/A ALA 155.A N GLN 151.A O no hydrogen 2.880 N/A LEU 156.A N TYR 152.A O no hydrogen 2.883 N/A GLU 157.A N LEU 153.A O no hydrogen 2.927 N/A GLU 158.A N ASP 154.A O no hydrogen 2.916 N/A PHE 159.A N ALA 155.A O no hydrogen 2.869 N/A GLY 160.A N LEU 156.A O no hydrogen 2.999 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.900 N/A GLN 173.A N ALA 169.A O no hydrogen 2.990 N/A ALA 174.A N GLU 170.A O no hydrogen 2.932 N/A LEU 175.A N ALA 171.A O no hydrogen 2.891 N/A LEU 176.A N ILE 172.A O no hydrogen 2.890 N/A LYS 177.A N GLN 173.A O no hydrogen 2.897 N/A SER 178.A N ALA 174.A O no hydrogen 2.909 N/A SER 178.A OG ALA 174.A O no hydrogen 3.233 N/A SER 178.A OG LEU 175.A O no hydrogen 2.832 N/A MET 179.A N LEU 175.A O no hydrogen 3.110 N/A GLU 184.A N ASP 180.A O no hydrogen 3.196 N/A CYS 185.A N LEU 181.A O no hydrogen 2.926 N/A GLU 186.A N GLU 182.A O no hydrogen 2.909 N/A GLN 187.A N GLN 183.A O no hydrogen 2.925 N/A LEU 188.A N GLU 184.A O no hydrogen 2.911 N/A ARG 189.A N CYS 185.A O no hydrogen 2.916 N/A GLU 190.A N GLU 186.A O no hydrogen 2.936 N/A GLU 191.A N GLN 187.A O no hydrogen 2.900 N/A LEU 192.A N LEU 188.A O no hydrogen 2.891 N/A ASN 193.A N ARG 189.A O no hydrogen 2.926 N/A GLU 194.A N GLU 190.A O no hydrogen 2.914 N/A THR 195.A N GLU 191.A O no hydrogen 3.040 N/A THR 195.A OG1 GLU 191.A O no hydrogen 2.546 N/A SER 197.A OG THR 199.A OG1 no hydrogen 3.345 N/A THR 199.A OG1 SER 197.A OG no hydrogen 3.345 N/A LYS 200.A N SER 197.A O no hydrogen 3.152 N/A ARG 201.A N SER 197.A O no hydrogen 3.192 N/A LEU 204.A N LYS 200.A O no hydrogen 2.922 N/A THR 205.A N ARG 201.A O no hydrogen 2.944 N/A THR 205.A OG1 ARG 201.A O no hydrogen 3.151 N/A THR 205.A OG1 LYS 202.A O no hydrogen 2.799 N/A LYS 206.A N LYS 202.A O no hydrogen 2.947 N/A ARG 207.A N LYS 203.A O no hydrogen 2.935 N/A ILE 208.A N LEU 204.A O no hydrogen 2.900 N/A LYS 209.A N THR 205.A O no hydrogen 2.936 N/A LEU 210.A N LYS 206.A O no hydrogen 2.931 N/A LEU 211.A N ARG 207.A O no hydrogen 2.949 N/A GLU 212.A N ILE 208.A O no hydrogen 2.867 N/A ALA 213.A N LYS 209.A O no hydrogen 2.913 N/A PHE 214.A N LEU 210.A O no hydrogen 2.946 N/A VAL 215.A N LEU 211.A O no hydrogen 2.895 N/A GLN 216.A N GLU 212.A O no hydrogen 2.899 N/A SER 217.A OG ALA 213.A O no hydrogen 2.735 N/A SER 217.A OG PHE 214.A O no hydrogen 2.775 N/A GLY 218.A N VAL 215.A O no hydrogen 3.112 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.860 N/A TRP 223.A N LYS 220.A O no hydrogen 3.364 N/A MET 224.A N PRO 221.A O no hydrogen 2.939 N/A LEU 236.A N PRO 233.A O no hydrogen 3.296 N/A ARG 237.A N PRO 234.A O no hydrogen 3.361 N/A ARG 246.A N THR 249.A OG1 no hydrogen 3.150 N/A SER 250.A OG ARG 246.A O no hydrogen 2.953 N/A SER 250.A OG PHE 247.A O no hydrogen 3.077 N/A ASN 253.A ND2 ALA 248.A O no hydrogen 2.872 N/A TYR 256.A N LEU 252.A O no hydrogen 2.955 N/A ARG 257.A N ASN 253.A O no hydrogen 2.890 N/A ARG 257.A NE ASP 254.A OD1 no hydrogen 3.241 N/A ARG 258.A N ASP 254.A O no hydrogen 2.925 N/A VAL 259.A N LEU 255.A O no hydrogen 2.964 N/A ILE 260.A N TYR 256.A O no hydrogen 2.953 N/A ASN 261.A N ARG 257.A O no hydrogen 2.851 N/A ARG 262.A N ARG 258.A O no hydrogen 2.956 N/A ASN 263.A N VAL 259.A O no hydrogen 2.946 N/A ASN 263.A ND2 GLU 93.A O no hydrogen 2.697 N/A ASN 264.A N ILE 260.A O no hydrogen 2.918 N/A ARG 265.A N ASN 261.A O no hydrogen 2.907 N/A ARG 265.A NE ASN 261.A OD1 no hydrogen 3.222 N/A LEU 266.A N ARG 262.A O no hydrogen 2.917 N/A LYS 267.A N ASN 263.A O no hydrogen 2.942 N/A LYS 267.A NZ GLU 93.A O no hydrogen 3.232 N/A ARG 268.A N ASN 264.A O no hydrogen 2.900 N/A LEU 269.A N ARG 265.A O no hydrogen 2.914 N/A LEU 270.A N LEU 266.A O no hydrogen 2.919 N/A ASP 271.A N LYS 267.A O no hydrogen 2.925 N/A LEU 272.A N ARG 268.A O no hydrogen 2.899 N/A ALA 274.A N LEU 269.A O no hydrogen 2.971 N/A VAL 279.A N PRO 275.A O no hydrogen 3.182 N/A ARG 280.A N ASP 276.A O no hydrogen 2.931 N/A ARG 280.A NE ASP 276.A O no hydrogen 3.325 N/A ASN 281.A N ILE 277.A O no hydrogen 2.919 N/A GLU 282.A N ILE 278.A O no hydrogen 2.907 N/A LYS 283.A N VAL 279.A O no hydrogen 2.929 N/A LYS 283.A NZ VAL 279.A O no hydrogen 2.948 N/A ARG 284.A N ARG 280.A O no hydrogen 2.888 N/A MET 285.A N ASN 281.A O no hydrogen 2.915 N/A LEU 286.A N GLU 282.A O no hydrogen 2.908 N/A GLN 287.A N LYS 283.A O no hydrogen 2.920 N/A GLN 287.A NE2 LEU 126.A O no hydrogen 3.632 N/A GLU 288.A N ARG 284.A O no hydrogen 2.906 N/A ALA 289.A N MET 285.A O no hydrogen 2.869 N/A VAL 290.A N LEU 286.A O no hydrogen 2.949 N/A ASP 291.A N GLN 287.A O no hydrogen 2.915 N/A ALA 292.A N GLU 288.A O no hydrogen 2.878 N/A LEU 293.A N ALA 289.A O no hydrogen 2.890 N/A LEU 294.A N VAL 290.A O no hydrogen 2.943 N/A SER 306.A OG SER 306.A O no hydrogen 2.599 N/A ASN 307.A N GLY 305.A O no hydrogen 2.662 N/A SER 313.A OG ASP 316.A OD2 no hydrogen 3.481 N/A LEU 314.A N LEU 294.A O no hydrogen 2.756 N/A MET 317.A N LEU 314.A O no hydrogen 3.201 N/A ILE 318.A N LEU 314.A O no hydrogen 2.959 N/A LYS 319.A N ALA 315.A O no hydrogen 2.889 N/A LYS 319.A NZ PHE 1283.A O no hydrogen 3.164 N/A GLY 320.A N ASP 316.A O no hydrogen 2.924 N/A LYS 321.A N ASP 316.A O no hydrogen 3.174 N/A LYS 321.A NZ LEU 239.A O no hydrogen 2.440 N/A GLN 322.A N MET 317.A O no hydrogen 3.071 N/A ARG 324.A N LYS 319.A O no hydrogen 2.954 N/A ARG 326.A NH2 ARG 326.A O no hydrogen 3.317 N/A SER 337.A OG VAL 334.A O no hydrogen 3.495 N/A SER 340.A OG LYS 432.A O no hydrogen 2.741 N/A ILE 342.A N ASP 451.A O no hydrogen 3.412 N/A THR 343.A N ILE 434.A O no hydrogen 2.475 N/A THR 343.A OG1 ILE 434.A O no hydrogen 2.776 N/A GLY 345.A N LEU 436.A O no hydrogen 2.768 N/A CYS 353.A N GLU 425.A O no hydrogen 2.791 N/A CYS 353.A SG GLN 352.A O no hydrogen 3.259 N/A GLY 354.A N GLN 435.A O no hydrogen 2.751 N/A LEU 355.A N VAL 427.A O no hydrogen 2.902 N/A ALA 360.A N PRO 356.A O no hydrogen 2.983 N/A LEU 361.A N LYS 357.A O no hydrogen 2.921 N/A GLU 362.A N MET 359.A O no hydrogen 3.077 N/A LEU 363.A N MET 359.A O no hydrogen 2.885 N/A ILE 368.A N PHE 364.A O no hydrogen 2.716 N/A TYR 369.A N LYS 365.A O no hydrogen 2.960 N/A GLY 370.A N PRO 366.A O no hydrogen 2.870 N/A LYS 371.A N PHE 367.A O no hydrogen 2.931 N/A LEU 372.A N ILE 368.A O no hydrogen 2.907 N/A GLU 373.A N TYR 369.A O no hydrogen 2.940 N/A LEU 374.A N GLY 370.A O no hydrogen 2.883 N/A ARG 375.A N LYS 371.A O no hydrogen 2.907 N/A LEU 377.A N LEU 372.A O no hydrogen 3.249 N/A ALA 378.A N LEU 372.A O no hydrogen 3.281 N/A ALA 383.A N THR 380.A OG1 no hydrogen 3.387 N/A ALA 384.A N THR 380.A O no hydrogen 3.341 N/A LYS 385.A N ILE 381.A O no hydrogen 2.929 N/A LYS 386.A N LYS 382.A O no hydrogen 2.904 N/A MET 387.A N ALA 383.A O no hydrogen 2.895 N/A VAL 388.A N ALA 384.A O no hydrogen 2.937 N/A GLU 389.A N LYS 385.A O no hydrogen 3.335 N/A ARG 390.A N LYS 386.A O no hydrogen 2.897 N/A GLU 391.A N MET 387.A O no hydrogen 3.378 N/A GLU 392.A N GLU 392.A OE1 no hydrogen 2.747 N/A ASP 397.A N ALA 393.A O no hydrogen 2.951 N/A ILE 398.A N VAL 394.A O no hydrogen 2.931 N/A LEU 399.A N VAL 395.A O no hydrogen 2.895 N/A ASP 400.A N TRP 396.A O no hydrogen 2.869 N/A GLU 401.A N ASP 397.A O no hydrogen 2.952 N/A VAL 402.A N ILE 398.A O no hydrogen 2.907 N/A ILE 403.A N LEU 399.A O no hydrogen 2.946 N/A VAL 408.A N PHE 424.A O no hydrogen 2.887 N/A LEU 409.A N HIS 456.A O no hydrogen 2.904 N/A LEU 410.A N GLN 422.A O no hydrogen 2.875 N/A ASN 411.A N ALA 454.A O no hydrogen 2.921 N/A ASN 411.A ND2 HIS 456.A NE2 no hydrogen 3.238 N/A LEU 419.A N HIS 417.A ND1 no hydrogen 3.106 N/A GLN 422.A N LEU 410.A O no hydrogen 2.932 N/A GLN 422.A NE2 LEU 419.A O no hydrogen 3.288 N/A ALA 423.A N MET 471.A O no hydrogen 2.577 N/A PHE 424.A N VAL 408.A O no hydrogen 2.878 N/A VAL 427.A N CYS 353.A O no hydrogen 2.907 N/A ILE 429.A N LEU 355.A O no hydrogen 2.893 N/A ILE 434.A N VAL 341.A O no hydrogen 2.984 N/A LEU 436.A N THR 343.A O no hydrogen 2.724 N/A ALA 446.A N CYS 441.A O no hydrogen 3.456 N/A ASP 449.A N ASP 447.A O no hydrogen 2.929 N/A ALA 454.A N ASN 411.A O no hydrogen 2.856 N/A VAL 455.A N GLY 338.A O no hydrogen 2.996 N/A HIS 456.A N LEU 409.A O no hydrogen 2.866 N/A GLU 462.A N GLU 462.A OE1 no hydrogen 2.830 N/A ALA 463.A N THR 460.A OG1 no hydrogen 3.142 N/A GLN 464.A N THR 460.A O no hydrogen 3.102 N/A LEU 465.A N LEU 461.A O no hydrogen 2.973 N/A GLU 466.A N GLU 462.A O no hydrogen 2.865 N/A ALA 467.A N ALA 463.A O no hydrogen 2.917 N/A ARG 468.A N GLN 464.A O no hydrogen 2.921 N/A LEU 470.A N GLU 466.A O no hydrogen 3.252 N/A SER 473.A OG LEU 350.A O no hydrogen 3.007 N/A SER 479.A N GLU 484.A O no hydrogen 2.726 N/A SER 479.A OG GLU 484.A O no hydrogen 3.136 N/A ASN 482.A N SER 479.A OG no hydrogen 3.134 N/A GLY 483.A N SER 479.A OG no hydrogen 3.170 N/A ILE 486.A N ILE 477.A O no hydrogen 2.941 N/A GLY 496.A N ASP 492.A O no hydrogen 2.954 N/A LEU 497.A N VAL 493.A O no hydrogen 2.894 N/A TYR 498.A N VAL 494.A O no hydrogen 2.887 N/A TYR 498.A OH ASP 714.A OD2 no hydrogen 2.847 N/A TYR 499.A N LEU 495.A O no hydrogen 2.905 N/A MET 500.A N GLY 496.A O no hydrogen 2.906 N/A THR 501.A N LEU 497.A O no hydrogen 3.091 N/A THR 501.A OG1 LEU 497.A O no hydrogen 2.688 N/A CYS 504.A SG VAL 505.A O no hydrogen 3.586 N/A TYR 524.A N ALA 520.A O no hydrogen 2.892 N/A TYR 524.A OH TYR 618.A OH no hydrogen 3.060 N/A ARG 525.A N GLU 521.A O no hydrogen 2.927 N/A SER 526.A OG ARG 525.A O no hydrogen 2.611 N/A VAL 535.A N THR 559.A O no hydrogen 2.880 N/A VAL 537.A N LYS 557.A O no hydrogen 3.253 N/A ILE 539.A N SER 555.A O no hydrogen 2.899 N/A THR 540.A OG1 LYS 553.A O no hydrogen 2.972 N/A GLU 541.A N LYS 553.A O no hydrogen 3.291 N/A GLU 543.A N VAL 551.A O no hydrogen 2.858 N/A GLU 549.A N ALA 546.A O no hydrogen 3.385 N/A VAL 551.A N GLU 543.A O no hydrogen 2.918 N/A LYS 553.A N GLU 541.A O no hydrogen 2.934 N/A LYS 553.A NZ GLU 543.A OE2 no hydrogen 2.720 N/A LYS 557.A N VAL 537.A O no hydrogen 2.925 N/A LYS 557.A NZ ILE 539.A O no hydrogen 3.362 N/A THR 559.A N VAL 535.A O no hydrogen 2.882 N/A THR 559.A OG1 TYR 576.A OH no hydrogen 3.247 N/A THR 560.A N THR 559.A OG1 no hydrogen 2.658 N/A ALA 564.A N THR 560.A O no hydrogen 3.407 N/A ILE 565.A N VAL 561.A O no hydrogen 2.940 N/A LEU 566.A N GLY 562.A O no hydrogen 2.858 N/A TRP 567.A N ARG 563.A O no hydrogen 2.920 N/A MET 568.A N ILE 565.A O no hydrogen 3.145 N/A ILE 569.A N LEU 566.A O no hydrogen 3.114 N/A VAL 579.A N TYR 576.A O no hydrogen 3.301 N/A LYS 585.A NZ ALA 717.A O no hydrogen 2.968 N/A ILE 588.A N GLY 584.A O no hydrogen 3.298 N/A SER 589.A N LYS 585.A O no hydrogen 2.932 N/A LYS 590.A N LYS 586.A O no hydrogen 2.880 N/A MET 591.A N ALA 587.A O no hydrogen 2.885 N/A LEU 592.A N ILE 588.A O no hydrogen 2.927 N/A ASN 593.A N SER 589.A O no hydrogen 2.903 N/A THR 594.A N LYS 590.A O no hydrogen 2.896 N/A THR 594.A OG1 LYS 590.A O no hydrogen 2.992 N/A THR 594.A OG1 MET 591.A O no hydrogen 2.957 N/A CYS 595.A N MET 591.A O no hydrogen 2.912 N/A CYS 595.A SG THR 604.A OG1 no hydrogen 3.693 N/A TYR 596.A N LEU 592.A O no hydrogen 2.938 N/A ARG 597.A N ASN 593.A O no hydrogen 2.919 N/A ARG 597.A NE GLU 853.A OE2 no hydrogen 3.302 N/A ILE 598.A N THR 594.A O no hydrogen 2.909 N/A LEU 599.A N CYS 595.A O no hydrogen 2.926 N/A PHE 607.A N PRO 603.A O no hydrogen 2.915 N/A ALA 608.A N THR 604.A O no hydrogen 2.886 N/A ASP 609.A N VAL 605.A O no hydrogen 2.946 N/A GLN 610.A N ILE 606.A O no hydrogen 2.906 N/A ILE 611.A N PHE 607.A O no hydrogen 2.878 N/A MET 612.A N ALA 608.A O no hydrogen 2.934 N/A TYR 613.A N ASP 609.A O no hydrogen 2.922 N/A THR 614.A N GLN 610.A O no hydrogen 2.909 N/A GLY 615.A N ILE 611.A O no hydrogen 2.899 N/A PHE 616.A N MET 612.A O no hydrogen 2.935 N/A ALA 617.A N TYR 613.A O no hydrogen 2.901 N/A TYR 618.A N THR 614.A O no hydrogen 2.933 N/A TYR 618.A OH TYR 524.A OH no hydrogen 3.060 N/A ALA 619.A N GLY 615.A O no hydrogen 2.877 N/A ALA 620.A N PHE 616.A O no hydrogen 2.942 N/A GLY 623.A N ALA 619.A O no hydrogen 3.456 N/A GLY 627.A N ASP 630.A OD2 no hydrogen 3.010 N/A LYS 637.A N PRO 634.A O no hydrogen 3.441 N/A LYS 637.A NZ GLU 752.A OE2 no hydrogen 3.503 N/A ILE 640.A N LYS 636.A O no hydrogen 2.876 N/A ILE 641.A N LYS 637.A O no hydrogen 2.813 N/A SER 642.A N HIS 638.A O no hydrogen 2.588 N/A SER 642.A OG HIS 638.A O no hydrogen 2.973 N/A GLU 643.A N GLU 639.A O no hydrogen 2.670 N/A ALA 644.A N ILE 640.A O no hydrogen 2.644 N/A GLU 645.A N ILE 641.A O no hydrogen 2.748 N/A ALA 646.A N SER 642.A O no hydrogen 2.733 N/A GLU 647.A N GLU 643.A O no hydrogen 2.876 N/A VAL 648.A N ALA 644.A O no hydrogen 2.934 N/A ALA 649.A N GLU 645.A O no hydrogen 2.739 N/A GLU 650.A N ALA 646.A O no hydrogen 2.949 N/A ILE 651.A N GLU 647.A O no hydrogen 2.870 N/A GLN 652.A N VAL 648.A O no hydrogen 2.597 N/A GLU 653.A N ALA 649.A O no hydrogen 2.709 N/A GLN 654.A N GLU 650.A O no hydrogen 2.921 N/A PHE 655.A N ILE 651.A O no hydrogen 2.645 N/A GLN 656.A N GLN 652.A O no hydrogen 2.907 N/A GLN 656.A N GLU 653.A O no hydrogen 2.971 N/A SER 657.A N GLN 654.A O no hydrogen 2.960 N/A SER 657.A OG GLU 653.A O no hydrogen 2.687 N/A SER 657.A OG GLN 654.A OE1 no hydrogen 3.540 N/A GLY 658.A N GLN 654.A O no hydrogen 3.309 N/A ARG 665.A N THR 661.A O no hydrogen 3.154 N/A TYR 666.A N ALA 662.A O no hydrogen 2.919 N/A ASN 667.A N GLY 663.A O no hydrogen 2.917 N/A LYS 668.A N GLU 664.A O no hydrogen 2.919 N/A VAL 669.A N ARG 665.A O no hydrogen 2.908 N/A ILE 670.A N TYR 666.A O no hydrogen 2.967 N/A ASP 671.A N ASN 667.A O no hydrogen 2.923 N/A ILE 672.A N LYS 668.A O no hydrogen 2.901 N/A TRP 673.A N VAL 669.A O no hydrogen 2.964 N/A ALA 674.A N ILE 670.A O no hydrogen 2.902 N/A ALA 675.A N ASP 671.A O no hydrogen 2.931 N/A ALA 676.A N ILE 672.A O no hydrogen 2.924 N/A ASN 677.A N TRP 673.A O no hydrogen 2.905 N/A ASP 678.A N ALA 674.A O no hydrogen 2.931 N/A ARG 679.A N ALA 675.A O no hydrogen 2.913 N/A ARG 679.A NE ALA 675.A O no hydrogen 3.443 N/A VAL 680.A N ALA 676.A O no hydrogen 2.927 N/A SER 681.A N ASN 677.A O no hydrogen 2.911 N/A LYS 682.A N ASP 678.A O no hydrogen 2.970 N/A ALA 683.A N ARG 679.A O no hydrogen 2.892 N/A MET 684.A N VAL 680.A O no hydrogen 2.877 N/A MET 685.A N SER 681.A O no hydrogen 2.940 N/A ASP 686.A N LYS 682.A O no hydrogen 2.919 N/A ASN 687.A N ALA 683.A O no hydrogen 2.896 N/A LEU 688.A N MET 684.A O no hydrogen 2.930 N/A GLN 689.A NE2 GLU 701.A O no hydrogen 2.382 N/A THR 690.A OG1 LYS 702.A O no hydrogen 3.153 N/A GLU 691.A N SER 705.A OG no hydrogen 2.535 N/A THR 692.A N SER 705.A OG no hydrogen 3.421 N/A ARG 696.A N ILE 694.A O no hydrogen 2.734 N/A ARG 696.A NH1 GLN 699.A OE1 no hydrogen 3.234 N/A LYS 702.A NZ GLN 699.A O no hydrogen 2.523 N/A SER 705.A OG LEU 688.A O no hydrogen 3.393 N/A ASN 707.A ND2 ASP 630.A O no hydrogen 3.508 N/A SER 708.A OG SER 625.A O no hydrogen 3.171 N/A MET 711.A N ASN 707.A O no hydrogen 3.369 N/A MET 712.A N SER 708.A O no hydrogen 2.924 N/A ALA 713.A N ILE 709.A O no hydrogen 2.904 N/A ASP 714.A N TYR 710.A O no hydrogen 2.871 N/A SER 715.A N MET 711.A O no hydrogen 2.910 N/A GLY 716.A N MET 712.A O no hydrogen 3.374 N/A GLN 723.A N SER 720.A O no hydrogen 3.440 N/A ILE 724.A N SER 720.A O no hydrogen 3.301 N/A ARG 725.A N ALA 721.A O no hydrogen 2.927 N/A GLN 726.A N GLN 723.A O no hydrogen 3.244 N/A LEU 727.A N GLN 723.A O no hydrogen 2.910 N/A ALA 728.A N ILE 724.A O no hydrogen 2.949 N/A GLY 739.A N LYS 736.A O no hydrogen 3.269 N/A SER 740.A OG ILE 741.A O no hydrogen 3.386 N/A PHE 750.A N LEU 727.A O no hydrogen 3.341 N/A GLU 752.A N ASN 749.A OD1 no hydrogen 2.721 N/A ASN 755.A N GLN 758.A OE1 no hydrogen 3.208 N/A TYR 759.A N ASN 755.A O no hydrogen 3.263 N/A PHE 760.A N VAL 756.A O no hydrogen 2.943 N/A ILE 761.A N LEU 757.A O no hydrogen 2.907 N/A SER 762.A N GLN 758.A O no hydrogen 2.886 N/A THR 763.A N TYR 759.A O no hydrogen 2.939 N/A THR 763.A OG1 TYR 759.A O no hydrogen 2.590 N/A HIS 764.A N ILE 761.A O no hydrogen 3.105 N/A HIS 764.A ND1 ILE 761.A O no hydrogen 3.117 N/A ARG 767.A N THR 763.A O no hydrogen 2.952 N/A LYS 768.A N HIS 764.A O no hydrogen 2.881 N/A GLY 769.A N GLY 765.A O no hydrogen 2.920 N/A LEU 770.A N ALA 766.A O no hydrogen 2.907 N/A SER 780.A N LYS 776.A O no hydrogen 3.445 N/A SER 780.A OG LYS 776.A O no hydrogen 2.943 N/A GLY 781.A N THR 777.A O no hydrogen 2.944 N/A TYR 782.A N ALA 778.A O no hydrogen 2.871 N/A LEU 783.A N ASN 779.A O no hydrogen 2.943 N/A THR 784.A N SER 780.A O no hydrogen 3.493 N/A THR 784.A OG1 SER 780.A O no hydrogen 3.155 N/A ARG 785.A N GLY 781.A O no hydrogen 2.888 N/A ARG 786.A N TYR 782.A O no hydrogen 2.953 N/A ARG 786.A NH1 GLU 1104.A OE2 no hydrogen 2.345 N/A LEU 787.A N LEU 783.A O no hydrogen 2.935 N/A VAL 788.A N THR 784.A O no hydrogen 2.926 N/A ASP 789.A N ARG 785.A O no hydrogen 2.913 N/A ALA 791.A N VAL 788.A O no hydrogen 3.176 N/A GLN 792.A N GLN 792.A OE1 no hydrogen 2.724 N/A VAL 796.A N GLU 900.A O no hydrogen 3.329 N/A THR 797.A N VAL 881.A O no hydrogen 2.875 N/A THR 797.A OG1 TYR 1321.A OH no hydrogen 2.807 N/A CYS 801.A SG CYS 875.A O no hydrogen 3.825 N/A THR 803.A OG1 GLU 805.A O no hydrogen 2.950 N/A GLU 805.A N THR 803.A OG1 no hydrogen 3.038 N/A ILE 807.A N SER 871.A OG no hydrogen 2.772 N/A MET 809.A N VAL 867.A O no hydrogen 3.144 N/A ARG 825.A N LEU 822.A O no hydrogen 3.037 N/A VAL 826.A N LEU 822.A O no hydrogen 2.913 N/A LEU 827.A N ARG 823.A O no hydrogen 3.288 N/A ALA 832.A N LYS 868.A O no hydrogen 3.047 N/A ARG 847.A NH2 ARG 847.A O no hydrogen 3.408 N/A GLN 854.A N HIS 852.A ND1 no hydrogen 3.423 N/A CYS 856.A N HIS 852.A O no hydrogen 3.287 N/A CYS 856.A SG HIS 852.A O no hydrogen 3.679 N/A ASP 857.A N GLU 853.A O no hydrogen 2.909 N/A LEU 858.A N GLN 854.A O no hydrogen 2.912 N/A LEU 859.A N TRP 855.A O no hydrogen 2.919 N/A GLU 860.A N CYS 856.A O no hydrogen 2.866 N/A GLU 861.A N ASP 857.A O no hydrogen 2.931 N/A ASN 862.A N LEU 858.A O no hydrogen 3.187 N/A LYS 868.A NZ HIS 804.A O no hydrogen 3.289 N/A ARG 870.A NH1 ASP 800.A OD1 no hydrogen 3.452 N/A SER 871.A OG VAL 869.A O no hydrogen 3.547 N/A PHE 879.A N GLU 1239.A OE1 no hydrogen 3.059 N/A GLY 880.A N GLU 1239.A OE2 no hydrogen 3.493 N/A VAL 881.A N VAL 795.A O no hydrogen 3.293 N/A CYS 882.A N THR 877.A OG1 no hydrogen 3.352 N/A CYS 885.A SG SER 871.A O no hydrogen 3.309 N/A TYR 886.A N ALA 883.A O no hydrogen 3.228 N/A TYR 886.A OH ASP 889.A OD1 no hydrogen 2.998 N/A GLY 887.A N CYS 885.A O no hydrogen 2.893 N/A HIS 894.A ND1 ILE 895.A O no hydrogen 2.358 N/A GLY 899.A N VAL 796.A O no hydrogen 2.929 N/A ALA 907.A N GLY 903.A O no hydrogen 3.369 N/A SER 909.A N ILE 905.A O no hydrogen 2.920 N/A SER 909.A OG ILE 905.A O no hydrogen 3.368 N/A SER 909.A OG ALA 906.A O no hydrogen 2.519 N/A ILE 910.A N ALA 906.A O no hydrogen 2.907 N/A GLY 911.A N ALA 907.A O no hydrogen 2.793 N/A THR 915.A OG1 LEU 775.A O no hydrogen 2.384 N/A THR 918.A N GLN 1202.A OE1 no hydrogen 2.896 N/A SER 935.A N TRP 1007.A O no hydrogen 3.463 N/A SER 936.A OG GLN 938.A OE1 no hydrogen 2.852 N/A LYS 946.A N LYS 970.A O no hydrogen 2.898 N/A SER 948.A N GLU 968.A O no hydrogen 2.905 N/A SER 948.A OG ASN 949.A OD1 no hydrogen 3.173 N/A LYS 951.A NZ THR 963.A OG1 no hydrogen 2.840 N/A ASN 955.A ND2 LYS 959.A O no hydrogen 3.609 N/A SER 956.A OG SER 1081.A O no hydrogen 3.023 N/A SER 964.A OG ASN 949.A O no hydrogen 3.196 N/A SER 964.A OG THR 967.A OG1 no hydrogen 2.810 N/A LYS 970.A N LYS 946.A O no hydrogen 2.896 N/A ILE 972.A N SER 944.A O no hydrogen 3.310 N/A SER 981.A OG ILE 813.A O no hydrogen 3.533 N/A ALA 991.A N VAL 1004.A O no hydrogen 2.640 N/A ASN 1006.A N VAL 989.A O no hydrogen 3.382 N/A HIS 1010.A N ASP 1008.A O no hydrogen 2.673 N/A THR 1011.A N ASP 1008.A O no hydrogen 3.379 N/A THR 1011.A OG1 ASP 1008.A O no hydrogen 3.411 N/A VAL 1014.A N MET 1012.A O no hydrogen 2.734 N/A GLY 1020.A N ILE 1079.A O no hydrogen 3.339 N/A THR 1025.A N ASP 1075.A OD2 no hydrogen 3.200 N/A THR 1025.A OG1 ASP 1075.A OD2 no hydrogen 2.869 N/A THR 1034.A OG1 ARG 1035.A O no hydrogen 3.411 N/A ALA 1044.A N ASP 1042.A OD1 no hydrogen 3.262 N/A GLN 1056.A N GLN 1056.A OE1 no hydrogen 2.751 N/A TYR 1063.A OH ILE 1015.A O no hydrogen 3.040 N/A GLN 1072.A N LEU 1085.A O no hydrogen 3.287 N/A GLN 1072.A NE2 ARG 1087.A O no hydrogen 3.646 N/A SER 1080.A N ASP 1083.A OD2 no hydrogen 3.356 N/A SER 1081.A N SER 1019.A OG no hydrogen 3.245 N/A SER 1081.A OG VAL 954.A O no hydrogen 3.244 N/A SER 1081.A OG THR 1016.A O no hydrogen 2.737 N/A SER 1081.A OG GLU 1017.A O no hydrogen 2.943 N/A GLY 1082.A N THR 1016.A O no hydrogen 3.248 N/A ARG 1087.A NH2 HIS 1010.A O no hydrogen 3.561 N/A ARG 1098.A NE ILE 1092.A O no hydrogen 2.445 N/A ARG 1098.A NH1 ARG 1098.A O no hydrogen 3.559 N/A ARG 1098.A NH2 GLU 1194.A OE1 no hydrogen 3.213 N/A VAL 1099.A N GLY 1095.A O no hydrogen 3.282 N/A ASP 1101.A N PRO 1097.A O no hydrogen 2.901 N/A LEU 1102.A N ARG 1098.A O no hydrogen 2.886 N/A PHE 1103.A N VAL 1099.A O no hydrogen 2.934 N/A GLU 1104.A N ALA 1100.A O no hydrogen 2.880 N/A ARG 1106.A NE GLU 1104.A OE1 no hydrogen 2.409 N/A SER 1118.A OG VAL 1162.A O no hydrogen 2.325 N/A ARG 1132.A NH2 GLY 1129.A O no hydrogen 2.749 N/A GLU 1163.A N ASP 1166.A OD2 no hydrogen 2.866 N/A SER 1169.A OG ILE 1168.A O no hydrogen 2.641 N/A ILE 1178.A N ALA 1174.A O no hydrogen 3.378 N/A LEU 1179.A N PRO 1175.A O no hydrogen 2.910 N/A ARG 1180.A N HIS 1176.A O no hydrogen 2.895 N/A LEU 1181.A N ASP 1177.A O no hydrogen 2.912 N/A GLY 1183.A N ILE 1178.A O no hydrogen 2.875 N/A THR 1188.A N VAL 1184.A O no hydrogen 2.908 N/A THR 1188.A OG1 VAL 1184.A O no hydrogen 2.661 N/A ARG 1189.A N HIS 1185.A O no hydrogen 2.949 N/A TYR 1190.A N ALA 1186.A O no hydrogen 2.849 N/A ILE 1191.A N VAL 1187.A O no hydrogen 2.956 N/A VAL 1192.A N THR 1188.A O no hydrogen 2.943 N/A ASN 1193.A N ARG 1189.A O no hydrogen 2.892 N/A GLU 1194.A N TYR 1190.A O no hydrogen 2.985 N/A VAL 1195.A N ILE 1191.A O no hydrogen 2.933 N/A GLN 1196.A N VAL 1192.A O no hydrogen 2.909 N/A ASP 1197.A N ASN 1193.A O no hydrogen 2.874 N/A VAL 1198.A N GLU 1194.A O no hydrogen 2.952 N/A TYR 1199.A N VAL 1195.A O no hydrogen 2.915 N/A ARG 1200.A N GLN 1196.A O no hydrogen 2.895 N/A ARG 1200.A NH1 GLU 820.A OE1 no hydrogen 2.833 N/A GLN 1202.A N TYR 1199.A O no hydrogen 3.443 N/A LYS 1205.A NZ GLY 1203.A O no hydrogen 3.241 N/A ASN 1207.A N ALA 481.A O no hydrogen 3.129 N/A GLU 1212.A N ASP 1208.A O no hydrogen 2.940 N/A VAL 1213.A N LYS 1209.A O no hydrogen 2.913 N/A ILE 1214.A N HIS 1210.A O no hydrogen 2.978 N/A VAL 1215.A N ILE 1211.A O no hydrogen 2.893 N/A ARG 1216.A N GLU 1212.A O no hydrogen 2.878 N/A ARG 1216.A NH1 GLY 880.A O no hydrogen 3.228 N/A GLN 1217.A N VAL 1213.A O no hydrogen 2.914 N/A GLN 1217.A NE2 ASP 793.A OD1 no hydrogen 2.376 N/A MET 1218.A N ILE 1214.A O no hydrogen 2.929 N/A MET 1218.A N VAL 1215.A O no hydrogen 3.022 N/A LEU 1219.A N ARG 1216.A O no hydrogen 3.399 N/A ALA 1222.A N GLU 1236.A O no hydrogen 3.099 N/A THR 1223.A N SER 1261.A O no hydrogen 2.682 N/A THR 1223.A OG1 SER 1261.A O no hydrogen 3.247 N/A ILE 1224.A N GLU 1234.A O no hydrogen 3.288 N/A GLY 1228.A N ASP 1231.A O no hydrogen 3.222 N/A GLU 1236.A N ALA 1222.A O no hydrogen 3.180 N/A GLN 1237.A NE2 ALA 1273.A O no hydrogen 3.224 N/A TYR 1240.A OH GLU 1301.A OE2 no hydrogen 2.508 N/A SER 1241.A N GLN 1237.A O no hydrogen 3.065 N/A SER 1241.A OG GLU 1236.A OE2 no hydrogen 3.193 N/A SER 1241.A OG GLN 1237.A O no hydrogen 2.728 N/A ARG 1242.A N VAL 1238.A O no hydrogen 2.931 N/A VAL 1243.A N GLU 1239.A O no hydrogen 2.932 N/A LYS 1244.A N TYR 1240.A O no hydrogen 2.891 N/A LYS 1244.A NZ SER 1230.A OG no hydrogen 2.547 N/A ILE 1245.A N SER 1241.A O no hydrogen 2.928 N/A ALA 1246.A N ARG 1242.A O no hydrogen 2.916 N/A ASN 1247.A N VAL 1243.A O no hydrogen 2.889 N/A ARG 1248.A N LYS 1244.A O no hydrogen 2.898 N/A GLU 1249.A N ILE 1245.A O no hydrogen 2.930 N/A THR 1259.A OG1 ALA 1258.A O no hydrogen 2.633 N/A SER 1261.A N THR 1223.A O no hydrogen 2.597 N/A ARG 1262.A NH1 LEU 1219.A O no hydrogen 3.539 N/A SER 1271.A OG ILE 1267.A O no hydrogen 2.943 N/A SER 1271.A OG THR 1268.A O no hydrogen 3.110 N/A ALA 1273.A N ALA 1270.A O no hydrogen 3.285 N/A THR 1274.A OG1 SER 1279.A O no hydrogen 2.385 N/A SER 1276.A OG GLU 1307.A OE2 no hydrogen 2.448 N/A SER 1279.A N SER 1276.A O no hydrogen 3.302 N/A GLU 1285.A N GLU 1285.A OE1 no hydrogen 2.911 N/A LEU 1290.A N THR 1286.A O no hydrogen 2.905 N/A THR 1291.A N THR 1287.A O no hydrogen 2.893 N/A THR 1291.A OG1 THR 1287.A O no hydrogen 2.852 N/A ALA 1293.A N VAL 1289.A O no hydrogen 2.947 N/A ALA 1294.A N LEU 1290.A O no hydrogen 2.836 N/A VAL 1295.A N THR 1291.A O no hydrogen 2.969 N/A ALA 1296.A N GLU 1292.A O no hydrogen 2.907 N/A GLY 1297.A N ALA 1293.A O no hydrogen 3.229 N/A ARG 1299.A NE ALA 6.A O no hydrogen 2.928 N/A ARG 1299.A NH1 ALA 6.A O no hydrogen 2.777 N/A LYS 1306.A NZ ASP 789.A OD1 no hydrogen 3.394 N/A VAL 1309.A N LYS 1306.A O no hydrogen 3.195 N/A ILE 1310.A N LYS 1306.A O no hydrogen 2.924 N/A VAL 1311.A N GLU 1307.A O no hydrogen 2.928 N/A ARG 1313.A N ASN 1308.A O no hydrogen 3.141 N/A ARG 1313.A NH1 ASP 5.A OD1 no hydrogen 2.814 N/A ALA 1317.A N ILE 1315.A O no hydrogen 2.897 N/A GLY 1318.A N GLY 899.A O no hydrogen 2.419 N/A THR 1319.A OG1 GLU 466.A OE2 no hydrogen 2.470 N/A GLY 1320.A N ALA 1317.A O no hydrogen 3.239 N/A TYR 1321.A OH THR 797.A O no hydrogen 2.804 N/A TYR 1321.A OH THR 797.A OG1 no hydrogen 2.807 N/A TYR 1323.A N THR 1319.A O no hydrogen 3.324 N/A HIS 1324.A N GLY 1320.A O no hydrogen 2.919 N/A HIS 1324.A ND1 GLY 1320.A O no hydrogen 2.425 N/A GLN 1325.A N TYR 1321.A O no hydrogen 2.906 N/A ASP 1326.A N ALA 1322.A O no hydrogen 2.897 N/A ARG 1327.A N TYR 1323.A O no hydrogen 2.928 N/A MET 1328.A N HIS 1324.A O no hydrogen 2.923 N/A ARG 1329.A N GLN 1325.A O no hydrogen 2.911 N/A ARG 1329.A NE GLN 1325.A O no hydrogen 3.395 N/A ARG 1329.A NH2 ASP 1326.A OD1 no hydrogen 2.401 N/A ARG 1330.A N ASP 1326.A O no hydrogen 2.909 N/A ARG 1331.A N ARG 1327.A O no hydrogen 2.911 N/A ALA 1333.A N ARG 1329.A O no hydrogen 2.904 N/A