Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7mca_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 18.A OG GLN 17.A O no hydrogen 2.740 N/A LYS 23.A N ASN 21.A OD1 no hydrogen 3.188 N/A HIS 24.A N ASP 22.A O no hydrogen 2.714 N/A SER 32.A OG LEU 31.A O no hydrogen 2.817 N/A GLY 33.A N LEU 30.A O no hydrogen 2.973 N/A LYS 34.A N LEU 30.A O no hydrogen 3.157 N/A VAL 40.A N SER 36.A O no hydrogen 3.278 N/A GLU 41.A N GLU 37.A O no hydrogen 2.966 N/A LYS 42.A N VAL 38.A O no hydrogen 2.890 N/A ARG 43.A N ASN 39.A O no hydrogen 2.822 N/A ARG 43.A NE PHE 297.A O no hydrogen 3.076 N/A ARG 43.A NH1 GLU 35.A OE1 no hydrogen 2.809 N/A ARG 43.A NH2 VAL 28.A O no hydrogen 3.556 N/A TRP 44.A N VAL 40.A O no hydrogen 2.962 N/A GLU 45.A N GLU 41.A O no hydrogen 2.991 N/A LEU 46.A N LYS 42.A O no hydrogen 2.856 N/A TYR 47.A N ARG 43.A O no hydrogen 2.932 N/A HIS 48.A N TRP 44.A O no hydrogen 2.996 N/A GLN 49.A N GLU 45.A O no hydrogen 2.945 N/A LEU 50.A N LEU 46.A O no hydrogen 2.985 N/A HIS 51.A N TYR 47.A O no hydrogen 2.859 N/A SER 52.A N HIS 48.A O no hydrogen 2.935 N/A HIS 53.A N GLN 49.A O no hydrogen 2.964 N/A PHE 54.A N LEU 50.A O no hydrogen 2.955 N/A HIS 55.A N HIS 51.A O no hydrogen 2.958 N/A HIS 55.A NE2 ASP 290.A OD2 no hydrogen 2.586 N/A ASP 56.A N SER 52.A O no hydrogen 2.943 N/A GLN 57.A N PHE 54.A O no hydrogen 3.101 N/A VAL 58.A N PHE 54.A O no hydrogen 3.020 N/A ASP 59.A N HIS 55.A O no hydrogen 2.930 N/A ILE 61.A N GLN 57.A O no hydrogen 3.009 N/A ILE 62.A N VAL 58.A O no hydrogen 2.910 N/A ASP 63.A N ASP 59.A O no hydrogen 2.892 N/A ASN 64.A N ILE 61.A O no hydrogen 3.037 N/A ILE 65.A N ILE 61.A O no hydrogen 2.972 N/A ASP 68.A N ASN 64.A O no hydrogen 2.917 N/A LEU 69.A N ILE 65.A O no hydrogen 2.887 N/A LYS 70.A N GLU 66.A O no hydrogen 2.877 N/A GLU 72.A N ASP 68.A O no hydrogen 2.899 N/A ILE 73.A N LEU 69.A O no hydrogen 2.901 N/A SER 74.A N LYS 70.A O no hydrogen 3.448 N/A SER 74.A OG LYS 70.A O no hydrogen 3.188 N/A SER 74.A OG GLU 103.A O no hydrogen 3.104 N/A ASP 75.A N GLU 72.A O no hydrogen 3.389 N/A LEU 77.A N ILE 73.A O no hydrogen 2.961 N/A SER 79.A OG ASP 75.A O no hydrogen 3.467 N/A SER 79.A OG TYR 78.A O no hydrogen 2.826 N/A ARG 85.A N THR 82.A O no hydrogen 3.241 N/A ARG 86.A NH1 ASP 198.A OD1 no hydrogen 2.577 N/A THR 90.A OG1 PHE 88.A O no hydrogen 3.469 N/A ILE 91.A N LEU 204.A O no hydrogen 2.881 N/A PHE 92.A N HIS 232.A O no hydrogen 2.894 N/A LEU 93.A N PHE 206.A O no hydrogen 2.703 N/A LEU 94.A N LEU 234.A O no hydrogen 2.897 N/A SER 96.A OG ASP 97.A O no hydrogen 2.967 N/A SER 98.A OG SER 98.A O no hydrogen 2.447 N/A THR 99.A OG1 THR 99.A O no hydrogen 2.452 N/A SER 109.A OG SER 109.A O no hydrogen 2.318 N/A ARG 110.A NH1 GLU 107.A OE1 no hydrogen 2.980 N/A TYR 111.A N ASP 166.A O no hydrogen 3.028 N/A TYR 111.A OH GLU 143.A O no hydrogen 3.428 N/A ASN 112.A ND2 GLU 107.A OE2 no hydrogen 3.269 N/A ILE 115.A N VAL 170.A O no hydrogen 3.163 N/A LEU 117.A N ASN 172.A O no hydrogen 2.762 N/A THR 118.A OG1 GLU 121.A OE1 no hydrogen 2.494 N/A SER 122.A OG THR 118.A O no hydrogen 2.345 N/A LEU 129.A N VAL 125.A O no hydrogen 2.992 N/A ARG 130.A N ARG 126.A O no hydrogen 2.869 N/A ARG 131.A N MET 127.A O no hydrogen 2.904 N/A SER 132.A N MET 128.A O no hydrogen 2.918 N/A SER 132.A OG MET 128.A O no hydrogen 2.301 N/A MET 133.A N LEU 129.A O no hydrogen 2.929 N/A TYR 134.A N ARG 130.A O no hydrogen 2.854 N/A LYS 135.A N ARG 131.A O no hydrogen 2.908 N/A LYS 135.A NZ GLU 116.A O no hydrogen 2.805 N/A LYS 135.A NZ GLU 121.A OE2 no hydrogen 2.824 N/A LEU 136.A N SER 132.A O no hydrogen 2.913 N/A TYR 137.A N MET 133.A O no hydrogen 2.885 N/A TYR 137.A OH ASN 147.A O no hydrogen 2.818 N/A SER 138.A N TYR 134.A O no hydrogen 2.902 N/A SER 138.A OG TYR 134.A O no hydrogen 2.874 N/A ALA 139.A N LYS 135.A O no hydrogen 2.883 N/A ASP 141.A N TYR 137.A O no hydrogen 2.930 N/A ALA 142.A N SER 138.A O no hydrogen 2.960 N/A SER 150.A OG ASP 152.A OD2 no hydrogen 2.646 N/A ASP 152.A N SER 150.A O no hydrogen 3.083 N/A SER 154.A N ASP 152.A OD1 no hydrogen 2.890 N/A SER 154.A OG ASP 152.A OD1 no hydrogen 3.266 N/A LEU 155.A N ASP 152.A O no hydrogen 3.320 N/A GLU 157.A N LEU 153.A O no hydrogen 2.995 N/A ASN 158.A N SER 154.A O no hydrogen 2.935 N/A LYS 160.A NZ GLY 164.A O no hydrogen 2.546 N/A LYS 160.A NZ ASP 166.A OD1 no hydrogen 3.393 N/A LEU 162.A N ASN 158.A O no hydrogen 2.882 N/A PHE 163.A N PHE 159.A O no hydrogen 3.317 N/A LEU 167.A N HIS 199.A O no hydrogen 2.767 N/A VAL 170.A N VAL 113.A O no hydrogen 2.928 N/A PHE 171.A N SER 203.A O no hydrogen 2.729 N/A ASN 172.A N ILE 115.A O no hydrogen 3.048 N/A PHE 173.A N ILE 205.A O no hydrogen 3.109 N/A LYS 174.A N LEU 117.A O no hydrogen 2.720 N/A LYS 174.A NZ THR 100.A O no hydrogen 3.492 N/A LYS 174.A NZ ASN 172.A OD1 no hydrogen 3.563 N/A VAL 176.A N ASN 207.A O no hydrogen 3.298 N/A SER 178.A N ASP 175.A O no hydrogen 2.737 N/A ILE 179.A N ASP 175.A O no hydrogen 3.086 N/A LEU 184.A N ASN 180.A O no hydrogen 3.021 N/A ASP 185.A N PHE 181.A O no hydrogen 2.868 N/A PHE 187.A N THR 183.A O no hydrogen 2.916 N/A ILE 188.A N LEU 184.A O no hydrogen 2.899 N/A ILE 189.A N ASP 185.A O no hydrogen 2.876 N/A LEU 190.A N ASN 186.A O no hydrogen 2.907 N/A LEU 191.A N PHE 187.A O no hydrogen 2.888 N/A LYS 192.A N ILE 188.A O no hydrogen 2.909 N/A LYS 192.A N ILE 189.A O no hydrogen 3.137 N/A ALA 194.A N LEU 191.A O no hydrogen 2.989 N/A PHE 195.A N LYS 192.A O no hydrogen 3.316 N/A LYS 196.A NZ SER 193.A O no hydrogen 2.908 N/A HIS 199.A NE2 VAL 156.A O no hydrogen 2.881 N/A LYS 201.A NZ LEU 77.A O no hydrogen 3.544 N/A LYS 201.A NZ SER 203.A OG no hydrogen 2.531 N/A SER 203.A N MET 169.A O no hydrogen 3.103 N/A LEU 204.A N ASN 89.A O no hydrogen 2.625 N/A PHE 206.A N ILE 91.A O no hydrogen 2.872 N/A ASN 207.A N PHE 173.A O no hydrogen 3.264 N/A ILE 208.A N LEU 93.A O no hydrogen 2.963 N/A THR 210.A OG1 ASP 177.A OD2 no hydrogen 2.306 N/A LEU 212.A N ASN 211.A OD1 no hydrogen 2.814 N/A ASN 214.A N ASN 211.A O no hydrogen 3.404 N/A GLU 216.A N LEU 212.A O no hydrogen 3.445 N/A ASN 218.A ND2 ASN 214.A O no hydrogen 2.850 N/A ASN 218.A ND2 ASN 214.A OD1 no hydrogen 3.579 N/A LEU 219.A N ILE 215.A O no hydrogen 3.146 N/A THR 223.A OG1 ARG 220.A O no hydrogen 2.336 N/A ILE 224.A N ARG 220.A O no hydrogen 3.049 N/A ARG 225.A N GLN 221.A O no hydrogen 2.923 N/A LEU 226.A N SER 222.A O no hydrogen 2.938 N/A LEU 227.A N THR 223.A O no hydrogen 2.874 N/A HIS 232.A N THR 90.A O no hydrogen 2.893 N/A LEU 234.A N PHE 92.A O no hydrogen 2.917 N/A VAL 236.A N LEU 94.A O no hydrogen 2.946 N/A SER 237.A OG ASP 235.A OD1 no hydrogen 3.557 N/A ASN 239.A ND2 ASN 281.A OD1 no hydrogen 2.717 N/A LYS 240.A N SER 237.A OG no hydrogen 3.404 N/A ASN 246.A ND2 PHE 390.A O no hydrogen 3.436 N/A PHE 249.A N GLY 245.A O no hydrogen 3.394 N/A SER 251.A OG GLN 247.A O no hydrogen 2.371 N/A PHE 252.A N ILE 248.A O no hydrogen 3.123 N/A LEU 253.A N GLN 250.A O no hydrogen 3.193 N/A THR 255.A OG1 PHE 252.A O no hydrogen 2.936 N/A ASN 261.A N PHE 434.A O no hydrogen 3.008 N/A SER 263.A N LEU 436.A O no hydrogen 3.000 N/A SER 263.A OG ASP 437.A OD2 no hydrogen 3.080 N/A VAL 267.A N SER 263.A O no hydrogen 3.441 N/A GLU 268.A N ASP 264.A O no hydrogen 3.053 N/A PHE 269.A N ARG 265.A O no hydrogen 2.910 N/A ILE 270.A N PHE 266.A O no hydrogen 2.928 N/A LEU 271.A N VAL 267.A O no hydrogen 2.958 N/A SER 272.A N GLU 268.A O no hydrogen 2.882 N/A LYS 273.A N PHE 269.A O no hydrogen 2.978 N/A MET 274.A N ILE 270.A O no hydrogen 2.852 N/A ASN 281.A ND2 ASN 277.A O no hydrogen 2.400 N/A LEU 285.A N ASN 281.A O no hydrogen 3.066 N/A THR 286.A OG1 GLN 283.A O no hydrogen 3.184 N/A LYS 287.A N GLN 283.A O no hydrogen 2.962 N/A MET 288.A N LEU 285.A O no hydrogen 3.398 N/A LEU 289.A N LEU 285.A O no hydrogen 3.126 N/A ASP 290.A N THR 286.A O no hydrogen 2.915 N/A TYR 291.A OH SER 446.A OG no hydrogen 2.874 N/A SER 292.A N MET 288.A O no hydrogen 2.906 N/A SER 292.A OG LEU 289.A O no hydrogen 2.650 N/A LEU 293.A N LEU 289.A O no hydrogen 2.944 N/A MET 294.A N ASP 290.A O no hydrogen 2.872 N/A SER 295.A N TYR 291.A O no hydrogen 3.236 N/A SER 295.A OG SER 292.A O no hydrogen 3.502 N/A TYR 296.A N LEU 293.A O no hydrogen 3.170 N/A PHE 297.A N LEU 293.A O no hydrogen 3.241 N/A GLN 299.A N TYR 296.A O no hydrogen 2.955 N/A ASN 300.A N TYR 296.A O no hydrogen 2.670 N/A ASN 300.A ND2 LEU 433.A O no hydrogen 2.287 N/A PHE 302.A N ASN 300.A OD1 no hydrogen 3.139 N/A SER 303.A N ASN 300.A O no hydrogen 3.357 N/A SER 303.A OG ASN 300.A O no hydrogen 2.353 N/A VAL 304.A N ALA 301.A O no hydrogen 3.011 N/A PHE 305.A N PHE 302.A O no hydrogen 2.959 N/A ILE 306.A N SER 303.A O no hydrogen 3.010 N/A ASN 310.A N ASP 307.A O no hydrogen 3.450 N/A ASN 310.A ND2 ASN 39.A OD1 no hydrogen 3.200 N/A ASN 310.A ND2 VAL 304.A O no hydrogen 3.274 N/A ASP 312.A N ASP 312.A OD1 no hydrogen 2.453 N/A ASP 316.A N ASN 315.A OD1 no hydrogen 2.743 N/A LYS 320.A N ASP 316.A O no hydrogen 2.925 N/A ILE 321.A N ASP 317.A O no hydrogen 2.901 N/A LEU 322.A N TYR 318.A O no hydrogen 2.914 N/A SER 323.A N LEU 319.A O no hydrogen 3.375 N/A SER 323.A OG LEU 319.A O no hydrogen 2.817 N/A SER 323.A OG LYS 320.A O no hydrogen 2.611 N/A ARG 324.A N ILE 321.A O no hydrogen 3.410 N/A CYS 325.A N LEU 322.A O no hydrogen 3.384 N/A CYS 325.A SG THR 327.A OG1 no hydrogen 2.748 N/A MET 329.A N CYS 325.A O no hydrogen 3.108 N/A PHE 330.A N PRO 326.A O no hydrogen 2.883 N/A PHE 331.A N THR 327.A O no hydrogen 2.936 N/A VAL 332.A N PHE 328.A O no hydrogen 2.878 N/A GLU 333.A N MET 329.A O no hydrogen 2.871 N/A GLY 334.A N PHE 330.A O no hydrogen 2.894 N/A LEU 335.A N PHE 331.A O no hydrogen 2.900 N/A ILE 336.A N VAL 332.A O no hydrogen 2.906 N/A LYS 337.A N GLU 333.A O no hydrogen 2.924 N/A GLN 338.A N GLY 334.A O no hydrogen 3.244 N/A LEU 346.A N ALA 342.A O no hydrogen 2.905 N/A SER 347.A OG GLU 344.A O no hydrogen 2.570 N/A LEU 348.A N GLU 344.A O no hydrogen 2.913 N/A LYS 352.A N SER 347.A O no hydrogen 2.776 N/A GLU 357.A N ASN 353.A O no hydrogen 2.874 N/A GLU 358.A N ARG 354.A O no hydrogen 2.910 N/A GLU 362.A N PHE 359.A O no hydrogen 3.356 N/A PHE 363.A N PHE 360.A O no hydrogen 3.005 N/A HIS 373.A N ILE 370.A O no hydrogen 3.342 N/A ALA 374.A N ILE 370.A O no hydrogen 2.909 N/A PHE 376.A N HIS 373.A O no hydrogen 3.018 N/A VAL 377.A N HIS 373.A O no hydrogen 3.211 N/A ALA 378.A N ALA 374.A O no hydrogen 2.912 N/A ARG 379.A N LYS 375.A O no hydrogen 2.880 N/A PHE 380.A N PHE 376.A O no hydrogen 2.882 N/A LEU 381.A N VAL 377.A O no hydrogen 2.944 N/A GLU 382.A N ALA 378.A O no hydrogen 2.918 N/A GLU 383.A N ARG 379.A O no hydrogen 2.904 N/A LEU 385.A N PHE 380.A O no hydrogen 2.946 N/A ILE 387.A N LEU 381.A O no hydrogen 2.707 N/A ASN 391.A N TYR 407.A OH no hydrogen 3.427 N/A LEU 392.A N ASN 246.A OD1 no hydrogen 3.195 N/A LEU 395.A N ASN 391.A O no hydrogen 2.924 N/A TYR 396.A N LEU 392.A O no hydrogen 2.876 N/A HIS 397.A N ILE 393.A O no hydrogen 2.876 N/A ASN 398.A N GLU 394.A O no hydrogen 2.978 N/A LEU 399.A N LEU 395.A O no hydrogen 2.893 N/A LEU 400.A N TYR 396.A O no hydrogen 2.863 N/A ILE 401.A N HIS 397.A O no hydrogen 2.921 N/A GLY 402.A N ASN 398.A O no hydrogen 2.643 N/A SER 406.A OG LYS 403.A O no hydrogen 2.659 N/A LEU 408.A N LEU 404.A O no hydrogen 2.888 N/A ASP 409.A N ASP 405.A O no hydrogen 2.908 N/A CYS 414.A SG LEU 408.A O no hydrogen 3.348 N/A LYS 415.A NZ ASP 409.A OD1 no hydrogen 2.972 N/A TYR 417.A N CYS 414.A O no hydrogen 3.156 N/A LEU 421.A N TYR 417.A O no hydrogen 2.832 N/A HIS 422.A N ASP 419.A O no hydrogen 3.334 N/A HIS 422.A NE2 GLU 424.A OE1 no hydrogen 2.773 N/A PHE 434.A N GLN 431.A O no hydrogen 2.686 N/A THR 435.A OG1 GLN 431.A O no hydrogen 3.238 N/A LEU 436.A N ASN 261.A O no hydrogen 2.698 N/A ARG 439.A NH1 GLU 432.A OE2 no hydrogen 3.207 N/A GLN 445.A N GLY 441.A O no hydrogen 3.345 N/A SER 446.A N LEU 442.A O no hydrogen 3.237 N/A SER 446.A OG TYR 291.A OH no hydrogen 2.874 N/A SER 446.A OG LEU 442.A O no hydrogen 3.500 N/A LYS 452.A NZ TRP 581.A O no hydrogen 2.682 N/A LYS 452.A NZ ILE 584.A O no hydrogen 3.241 N/A ASN 454.A N SER 450.A O no hydrogen 2.943 N/A ASN 454.A ND2 GLN 445.A OE1 no hydrogen 2.746 N/A ILE 455.A N TYR 451.A O no hydrogen 3.025 N/A GLU 456.A N LYS 452.A O no hydrogen 2.975 N/A ASP 457.A N SER 453.A O no hydrogen 2.877 N/A ASN 458.A N ASN 454.A O no hydrogen 2.970 N/A LEU 459.A N ILE 455.A O no hydrogen 2.970 N/A LEU 460.A N GLU 456.A O no hydrogen 2.932 N/A SER 461.A N ASP 457.A O no hydrogen 3.101 N/A SER 461.A OG ASP 457.A O no hydrogen 2.814 N/A SER 461.A OG GLN 464.A OE1 no hydrogen 3.466 N/A LEU 466.A N TRP 462.A O no hydrogen 3.123 N/A ASN 473.A N LYS 471.A O no hydrogen 3.117 N/A THR 476.A OG1 ASN 473.A O no hydrogen 2.959 N/A LYS 483.A NZ GLY 479.A O no hydrogen 3.037 N/A MET 485.A N LEU 481.A O no hydrogen 3.246 N/A GLY 490.A N PRO 487.A O no hydrogen 2.856 N/A GLN 491.A N PRO 487.A O no hydrogen 2.784 N/A LYS 494.A N GLN 491.A O no hydrogen 3.162 N/A LEU 495.A N LEU 492.A O no hydrogen 3.189 N/A TYR 496.A N LEU 492.A O no hydrogen 2.905 N/A TYR 496.A OH LEU 564.A O no hydrogen 2.715 N/A TYR 496.A OH VAL 580.A O no hydrogen 2.817 N/A ARG 497.A N PHE 493.A O no hydrogen 2.892 N/A ILE 503.A N VAL 576.A O no hydrogen 2.884 N/A ILE 505.A N ASP 574.A O no hydrogen 3.238 N/A PHE 508.A N ASN 504.A O no hydrogen 2.734 N/A TYR 509.A N ILE 505.A O no hydrogen 2.917 N/A TYR 509.A N TYR 506.A O no hydrogen 3.221 N/A ILE 510.A N TYR 506.A O no hydrogen 2.906 N/A ALA 511.A N ASP 507.A O no hydrogen 2.942 N/A ARG 513.A N TYR 509.A O no hydrogen 2.851 N/A ARG 513.A N ILE 510.A O no hydrogen 3.052 N/A GLU 514.A N ILE 510.A O no hydrogen 3.008 N/A THR 515.A OG1 THR 515.A O no hydrogen 2.484 N/A LEU 522.A N LYS 518.A O no hydrogen 3.342 N/A ASN 523.A N GLU 520.A O no hydrogen 3.207 N/A PHE 524.A N GLU 520.A O no hydrogen 2.809 N/A ILE 525.A N ILE 521.A O no hydrogen 2.930 N/A ARG 526.A NH2 ALA 538.A O no hydrogen 3.386 N/A LYS 533.A NZ ASN 531.A OD1 no hydrogen 3.093 N/A GLU 539.A N LEU 535.A O no hydrogen 3.234 N/A GLU 539.A N GLU 536.A O no hydrogen 2.914 N/A LYS 546.A N ASP 542.A O no hydrogen 3.487 N/A VAL 547.A N ALA 543.A O no hydrogen 2.941 N/A ALA 548.A N PHE 544.A O no hydrogen 2.896 N/A LEU 549.A N ASP 545.A O no hydrogen 2.869 N/A PHE 552.A N ALA 548.A O no hydrogen 3.028 N/A MET 553.A N LEU 549.A O no hydrogen 2.867 N/A GLN 554.A N ILE 550.A O no hydrogen 2.959 N/A ALA 555.A N LEU 551.A O no hydrogen 2.954 N/A ILE 556.A N PHE 552.A O no hydrogen 2.884 N/A PHE 557.A N MET 553.A O no hydrogen 2.974 N/A PHE 559.A N ALA 555.A O no hydrogen 2.912 N/A GLU 560.A N ILE 556.A O no hydrogen 3.115 N/A ASN 561.A N ASN 561.A OD1 no hydrogen 2.457 N/A MET 562.A N PHE 559.A O no hydrogen 2.954 N/A GLY 563.A N PHE 559.A O no hydrogen 3.115 N/A LYS 566.A N GLU 577.A O no hydrogen 3.202 N/A SER 569.A OG GLN 568.A O no hydrogen 2.600 N/A SER 572.A N SER 569.A O no hydrogen 3.054 N/A TYR 573.A N SER 569.A O no hydrogen 3.106 N/A VAL 576.A N ILE 503.A O no hydrogen 2.941 N/A GLU 577.A N LYS 566.A O no hydrogen 2.904 N/A LYS 578.A N MET 501.A O no hydrogen 2.947 N/A LYS 578.A NZ TYR 496.A O no hydrogen 3.016 N/A LYS 578.A NZ ALA 499.A O no hydrogen 3.276 N/A CYS 579.A SG GLY 563.A O no hydrogen 3.772 N/A CYS 579.A SG GLU 577.A O no hydrogen 3.541 N/A VAL 580.A N TYR 496.A OH no hydrogen 3.058 N/A