Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7aa3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N ASN 3.A O no hydrogen 3.403 N/A LEU 7.A N LEU 4.A O no hydrogen 3.215 N/A ASP 15.A N ALA 12.A O no hydrogen 3.302 N/A MET 17.A N ASP 15.A OD1 no hydrogen 3.006 N/A TYR 23.A OH LYS 103.A O no hydrogen 3.271 N/A TYR 23.A OH ASP 108.A OD2 no hydrogen 3.337 N/A THR 29.A N GLU 26.A O no hydrogen 2.826 N/A ALA 34.A N ASP 31.A O no hydrogen 2.596 N/A LEU 35.A N ASP 31.A O no hydrogen 3.078 N/A THR 36.A OG1 VAL 32.A O no hydrogen 3.452 N/A ARG 37.A NH1 ASP 33.A O no hydrogen 2.468 N/A ASP 38.A N LEU 35.A O no hydrogen 2.939 N/A ILE 39.A N LEU 35.A O no hydrogen 2.923 N/A GLU 40.A N THR 36.A O no hydrogen 2.880 N/A GLU 41.A N ASP 38.A O no hydrogen 2.982 N/A VAL 42.A N ASP 38.A O no hydrogen 3.128 N/A MET 43.A N ILE 39.A O no hydrogen 3.194 N/A THR 45.A N MET 43.A O no hydrogen 2.844 N/A THR 45.A OG1 GLU 41.A O no hydrogen 3.036 N/A THR 45.A OG1 THR 44.A O no hydrogen 2.762 N/A GLN 47.A N TYR 57.A OH no hydrogen 3.275 N/A TRP 49.A NE1 GLN 47.A OE1 no hydrogen 2.369 N/A GLY 55.A N ALA 52.A O no hydrogen 2.884 N/A TYR 57.A N MET 43.A O no hydrogen 3.363 N/A TYR 57.A OH TRP 50.A O no hydrogen 2.155 N/A PHE 61.A N GLY 58.A O no hydrogen 3.148 N/A ARG 63.A N PRO 59.A O no hydrogen 3.185 N/A MET 64.A N PHE 61.A O no hydrogen 3.370 N/A ALA 65.A N PHE 61.A O no hydrogen 2.955 N/A TRP 66.A N ILE 62.A O no hydrogen 2.930 N/A TYR 72.A OH ASP 297.A OD2 no hydrogen 2.209 N/A ILE 74.A N ARG 155.A O no hydrogen 2.978 N/A GLY 77.A N ARG 73.A O no hydrogen 3.235 N/A ARG 78.A N ASP 76.A OD2 no hydrogen 3.071 N/A ARG 78.A NH1 ASP 76.A OD2 no hydrogen 2.664 N/A ARG 78.A NH2 ASP 422.A OD1 no hydrogen 2.487 N/A ALA 89.A N LEU 86.A O no hydrogen 2.774 N/A LEU 92.A N ALA 89.A O no hydrogen 3.310 N/A LEU 93.A N ARG 90.A O no hydrogen 2.983 N/A TRP 94.A N ARG 91.A O no hydrogen 3.111 N/A VAL 96.A N LEU 93.A O no hydrogen 3.200 N/A LYS 97.A N LEU 93.A O no hydrogen 3.314 N/A LYS 97.A NZ GLY 101.A O no hydrogen 2.897 N/A LYS 98.A N TRP 94.A O no hydrogen 3.019 N/A LYS 99.A N VAL 96.A O no hydrogen 3.225 N/A LYS 99.A NZ ASP 38.A OD2 no hydrogen 2.227 N/A TYR 100.A N LYS 97.A O no hydrogen 3.282 N/A LYS 102.A N TYR 100.A O no hydrogen 2.682 N/A SER 105.A N TYR 23.A OH no hydrogen 3.175 N/A LEU 109.A N SER 105.A O no hydrogen 3.052 N/A ILE 110.A N TRP 106.A O no hydrogen 2.900 N/A VAL 111.A N ALA 107.A O no hydrogen 3.000 N/A PHE 112.A N ASP 108.A O no hydrogen 2.847 N/A ALA 113.A N LEU 109.A O no hydrogen 2.841 N/A GLY 114.A N ILE 110.A O no hydrogen 2.996 N/A ASN 115.A N VAL 111.A O no hydrogen 2.925 N/A CYS 116.A N PHE 112.A O no hydrogen 2.860 N/A ALA 117.A N ALA 113.A O no hydrogen 2.859 N/A LEU 118.A N GLY 114.A O no hydrogen 2.984 N/A GLU 119.A N ASN 115.A O no hydrogen 2.903 N/A SER 120.A N ALA 117.A O no hydrogen 3.233 N/A MET 121.A N LEU 118.A O no hydrogen 3.306 N/A THR 125.A OG1 ASN 115.A OD1 no hydrogen 3.003 N/A THR 125.A OG1 GLU 119.A OE1 no hydrogen 3.326 N/A GLY 129.A N HIS 227.A NE2 no hydrogen 2.829 N/A PHE 130.A N LEU 237.A O no hydrogen 3.344 N/A GLY 131.A N ASP 108.A OD2 no hydrogen 2.953 N/A ARG 132.A N ASP 108.A OD1 no hydrogen 3.201 N/A ARG 132.A NH1 ASP 108.A OD1 no hydrogen 2.864 N/A TRP 136.A NE1 ASP 15.A OD2 no hydrogen 2.880 N/A ASP 141.A N ASN 139.A O no hydrogen 2.618 N/A ALA 144.A N ASP 141.A O no hydrogen 2.890 N/A ALA 145.A N ASP 141.A O no hydrogen 3.287 N/A ILE 149.A N ALA 145.A O no hydrogen 2.853 N/A GLU 151.A N VAL 147.A O no hydrogen 2.905 N/A THR 152.A N ASP 148.A O no hydrogen 2.784 N/A PHE 153.A N ILE 149.A O no hydrogen 3.024 N/A ARG 154.A N GLU 151.A O no hydrogen 3.099 N/A ARG 154.A NE GLU 151.A OE2 no hydrogen 2.629 N/A ARG 155.A N GLU 151.A O no hydrogen 3.243 N/A ALA 157.A N ARG 154.A O no hydrogen 3.197 N/A MET 158.A N PHE 153.A O no hydrogen 3.195 N/A GLU 162.A N ASN 159.A O no hydrogen 2.993 N/A GLU 162.A N ASN 159.A OD1 no hydrogen 3.119 N/A GLY 170.A N LEU 166.A O no hydrogen 2.998 N/A HIS 171.A N GLY 169.A O no hydrogen 2.384 N/A THR 172.A N GLY 169.A O no hydrogen 2.852 N/A ILE 180.A N SER 176.A O no hydrogen 3.291 N/A LEU 181.A N PHE 177.A O no hydrogen 3.169 N/A TYR 182.A N LEU 178.A O no hydrogen 3.198 N/A TYR 182.A OH LEU 194.A O no hydrogen 2.519 N/A GLY 183.A N ILE 180.A O no hydrogen 3.245 N/A TYR 184.A N ILE 180.A O no hydrogen 3.331 N/A SER 193.A OG THR 190.A O no hydrogen 3.126 N/A ARG 195.A N LEU 192.A O no hydrogen 3.133 N/A ARG 195.A NH2 GLU 185.A OE1 no hydrogen 3.010 N/A VAL 196.A N SER 193.A O no hydrogen 3.214 N/A ASP 197.A N SER 193.A O no hydrogen 2.828 N/A ILE 199.A N ASP 197.A OD1 no hydrogen 2.770 N/A TYR 200.A N ASP 197.A OD1 no hydrogen 3.214 N/A GLU 201.A N ASP 197.A O no hydrogen 2.887 N/A ILE 203.A N TYR 200.A O no hydrogen 3.056 N/A THR 204.A N TYR 200.A O no hydrogen 3.039 N/A ARG 206.A N ILE 203.A O no hydrogen 2.940 N/A TRP 207.A N THR 204.A O no hydrogen 2.996 N/A GLU 209.A N GLU 209.A OE2 no hydrogen 2.456 N/A PHE 218.A N LEU 214.A O no hydrogen 2.746 N/A ALA 219.A N ALA 215.A O no hydrogen 2.895 N/A LYS 220.A N ASP 216.A O no hydrogen 2.915 N/A ALA 221.A N GLU 217.A O no hydrogen 2.917 N/A TRP 222.A N PHE 218.A O no hydrogen 2.859 N/A TYR 223.A N ALA 219.A O no hydrogen 2.941 N/A LYS 224.A N LYS 220.A O no hydrogen 2.918 N/A LYS 224.A NZ GLU 162.A OE1 no hydrogen 2.422 N/A LYS 224.A NZ GLU 162.A OE2 no hydrogen 3.275 N/A LEU 225.A N ALA 221.A O no hydrogen 2.862 N/A ILE 226.A N TRP 222.A O no hydrogen 2.989 N/A HIS 227.A N TYR 223.A O no hydrogen 2.918 N/A ALA 234.A N PRO 232.A O no hydrogen 2.832 N/A ARG 235.A NH1 MET 230.A O no hydrogen 3.506 N/A LEU 237.A N PHE 130.A O no hydrogen 3.278 N/A LEU 246.A N GLN 249.A OE1 no hydrogen 2.974 N/A GLN 249.A N LEU 246.A O no hydrogen 3.267 N/A ASP 250.A N LEU 247.A O no hydrogen 3.365 N/A HIS 257.A ND1 HIS 257.A O no hydrogen 2.740 N/A GLU 264.A N GLY 261.A O no hydrogen 3.009 N/A ILE 265.A N GLY 261.A O no hydrogen 2.984 N/A LEU 268.A N GLU 264.A O no hydrogen 2.911 N/A LYS 269.A N ILE 265.A O no hydrogen 2.898 N/A SER 270.A N SER 267.A O no hydrogen 3.222 N/A GLN 271.A N LEU 268.A O no hydrogen 2.835 N/A ILE 272.A N LEU 268.A O no hydrogen 3.056 N/A ARG 273.A NE LYS 269.A O no hydrogen 3.047 N/A ALA 274.A N GLN 271.A O no hydrogen 2.962 N/A LEU 277.A N SER 275.A O no hydrogen 2.566 N/A THR 278.A N GLN 281.A OE1 no hydrogen 3.067 N/A THR 278.A OG1 GLU 461.A OE2 no hydrogen 2.551 N/A VAL 279.A N THR 278.A OG1 no hydrogen 2.584 N/A SER 284.A OG SER 280.A O no hydrogen 3.212 N/A THR 285.A N GLN 281.A O no hydrogen 2.905 N/A THR 285.A OG1 GLN 281.A O no hydrogen 2.931 N/A ALA 286.A N LEU 282.A O no hydrogen 2.923 N/A TRP 287.A N VAL 283.A O no hydrogen 2.908 N/A ALA 288.A N SER 284.A O no hydrogen 2.887 N/A ALA 289.A N THR 285.A O no hydrogen 2.932 N/A ALA 290.A N ALA 286.A O no hydrogen 2.973 N/A ALA 290.A N TRP 287.A O no hydrogen 3.011 N/A SER 291.A OG ASP 402.A OD2 no hydrogen 3.172 N/A ARG 294.A NH1 ILE 74.A O no hydrogen 3.495 N/A ARG 294.A NH2 ASP 297.A OD2 no hydrogen 2.533 N/A GLY 295.A N LEU 426.A O no hydrogen 2.623 N/A ASP 297.A N ARG 294.A O no hydrogen 2.832 N/A LYS 298.A N ARG 294.A O no hydrogen 2.490 N/A LYS 298.A NZ GLY 295.A O no hydrogen 3.036 N/A ARG 299.A NH2 ASP 250.A OD2 no hydrogen 3.236 N/A ARG 299.A NH2 SER 393.A O no hydrogen 3.432 N/A GLY 301.A N SER 292.A O no hydrogen 3.375 N/A ARG 306.A NH2 PRO 251.A O no hydrogen 3.155 N/A ARG 306.A NH2 GLN 388.A O no hydrogen 3.198 N/A LEU 309.A N ARG 306.A O no hydrogen 2.876 N/A GLN 312.A N LEU 309.A O no hydrogen 3.353 N/A VAL 313.A N LEU 309.A O no hydrogen 2.886 N/A ASN 318.A ND2 GLN 312.A O no hydrogen 3.383 N/A ASN 318.A ND2 GLN 312.A OE1 no hydrogen 2.868 N/A ASP 321.A N ASP 319.A OD2 no hydrogen 3.374 N/A GLY 322.A N PRO 320.A O no hydrogen 2.965 N/A THR 330.A OG1 LYS 326.A O no hydrogen 3.386 N/A LEU 331.A N VAL 327.A O no hydrogen 2.990 N/A GLU 332.A N ILE 328.A O no hydrogen 3.030 N/A GLU 333.A N ARG 329.A O no hydrogen 3.216 N/A ILE 334.A N THR 330.A O no hydrogen 2.924 N/A GLN 335.A N LEU 331.A O no hydrogen 2.884 N/A GLN 335.A NE2 VAL 348.A O no hydrogen 3.638 N/A GLU 336.A N GLU 332.A O no hydrogen 2.927 N/A SER 337.A N GLU 333.A O no hydrogen 2.932 N/A SER 337.A OG GLU 333.A O no hydrogen 3.380 N/A SER 337.A OG GLU 336.A OE2 no hydrogen 2.635 N/A PHE 338.A N ILE 334.A O no hydrogen 2.901 N/A ASN 339.A N GLN 335.A O no hydrogen 2.868 N/A ASN 339.A ND2 VAL 348.A O no hydrogen 3.506 N/A SER 340.A N GLU 336.A O no hydrogen 2.932 N/A LYS 347.A N ASP 258.A O no hydrogen 3.504 N/A SER 349.A OG ASP 352.A OD2 no hydrogen 3.336 N/A SER 349.A OG ARG 381.A O no hydrogen 2.409 N/A VAL 354.A N PHE 350.A O no hydrogen 3.445 N/A LEU 356.A N ASP 352.A O no hydrogen 2.349 N/A GLY 357.A N LEU 353.A O no hydrogen 3.214 N/A CYS 359.A N VAL 355.A O no hydrogen 3.012 N/A CYS 359.A SG VAL 355.A O no hydrogen 3.788 N/A CYS 359.A SG PRO 376.A O no hydrogen 3.999 N/A ALA 360.A N LEU 356.A O no hydrogen 3.130 N/A ALA 361.A N GLY 357.A O no hydrogen 2.839 N/A ILE 362.A N GLY 358.A O no hydrogen 2.939 N/A GLU 363.A N CYS 359.A O no hydrogen 2.901 N/A LYS 364.A N ALA 360.A O no hydrogen 2.903 N/A ALA 365.A N ALA 361.A O no hydrogen 2.889 N/A ALA 366.A N ILE 362.A O no hydrogen 2.871 N/A ALA 368.A N ALA 365.A O no hydrogen 3.333 N/A THR 378.A OG1 THR 378.A O no hydrogen 2.439 N/A ARG 381.A NH1 ASP 352.A OD1 no hydrogen 3.463 N/A ARG 381.A NH2 MET 542.A O no hydrogen 3.376 N/A THR 382.A N ASN 303.A OD1 no hydrogen 3.253 N/A THR 382.A OG1 PRO 253.A O no hydrogen 2.944 N/A ALA 384.A N GLY 304.A O no hydrogen 2.555 N/A SER 393.A N ASP 390.A O no hydrogen 2.758 N/A SER 393.A OG ASP 390.A O no hydrogen 3.006 N/A SER 393.A OG ASP 390.A OD2 no hydrogen 2.996 N/A LEU 397.A N PHE 394.A O no hydrogen 3.039 N/A ARG 405.A NH1 ASN 318.A OD1 no hydrogen 3.333 N/A ARG 405.A NH2 ASP 402.A OD2 no hydrogen 2.288 N/A ASN 406.A ND2 ASN 447.A OD1 no hydrogen 2.754 N/A TYR 407.A N ASP 402.A O no hydrogen 3.037 N/A GLY 409.A N LYS 400.A O no hydrogen 3.177 N/A GLU 417.A N GLU 417.A OE1 no hydrogen 2.832 N/A TYR 418.A N PRO 415.A O no hydrogen 3.245 N/A ASP 422.A N TYR 418.A O no hydrogen 2.919 N/A LYS 423.A N MET 419.A O no hydrogen 2.884 N/A LYS 423.A NZ SER 291.A O no hydrogen 3.166 N/A LYS 423.A NZ PHE 293.A O no hydrogen 3.561 N/A ALA 424.A N LEU 420.A O no hydrogen 2.898 N/A ASN 425.A N LEU 421.A O no hydrogen 2.908 N/A LEU 426.A N ASP 422.A O no hydrogen 2.918 N/A LEU 427.A N LYS 423.A O no hydrogen 3.146 N/A THR 428.A N ASN 425.A O no hydrogen 3.068 N/A THR 428.A OG1 LEU 427.A O no hydrogen 2.475 N/A LEU 429.A N ALA 424.A O no hydrogen 3.013 N/A MET 434.A N SER 430.A O no hydrogen 2.741 N/A THR 435.A N ALA 431.A O no hydrogen 2.949 N/A THR 435.A OG1 ALA 431.A O no hydrogen 2.971 N/A VAL 436.A N PRO 432.A O no hydrogen 2.935 N/A LEU 437.A N GLU 433.A O no hydrogen 2.904 N/A VAL 438.A N MET 434.A O no hydrogen 2.952 N/A GLY 439.A N THR 435.A O no hydrogen 2.984 N/A GLY 440.A N VAL 436.A O no hydrogen 2.894 N/A LEU 441.A N LEU 437.A O no hydrogen 2.905 N/A ARG 442.A N VAL 438.A O no hydrogen 2.981 N/A ARG 442.A NH1 GLY 403.A O no hydrogen 3.274 N/A ARG 442.A NH2 GLY 403.A O no hydrogen 3.234 N/A VAL 443.A N GLY 439.A O no hydrogen 2.972 N/A LEU 444.A N GLY 440.A O no hydrogen 2.882 N/A GLY 445.A N LEU 441.A O no hydrogen 3.102 N/A TYR 448.A N ARG 405.A O no hydrogen 2.886 N/A TYR 448.A OH GLU 316.A OE1 no hydrogen 3.077 N/A ARG 450.A N ASN 447.A O no hydrogen 2.811 N/A LEU 451.A N TYR 448.A O no hydrogen 3.439 N/A GLY 454.A N THR 500.A O no hydrogen 3.075 N/A ALA 459.A N THR 457.A OG1 no hydrogen 3.307 N/A SER 462.A OG ALA 459.A O no hydrogen 3.273 N/A THR 464.A N SER 462.A O no hydrogen 2.917 N/A THR 464.A OG1 ASP 466.A OD2 no hydrogen 3.392 N/A ASN 465.A ND2 TYR 521.A O no hydrogen 2.979 N/A ASP 466.A N THR 464.A OG1 no hydrogen 3.426 N/A PHE 468.A N ASN 465.A O no hydrogen 3.009 N/A ASN 470.A N ASP 466.A O no hydrogen 3.121 N/A ASN 470.A ND2 PHE 456.A O no hydrogen 2.662 N/A ASP 473.A N VAL 469.A O no hydrogen 3.375 N/A GLY 475.A N ASP 473.A OD1 no hydrogen 2.947 N/A THR 477.A N LYS 491.A O no hydrogen 3.039 N/A GLU 479.A N GLN 489.A O no hydrogen 3.279 N/A ASP 484.A N SER 481.A O no hydrogen 3.052 N/A THR 487.A OG1 ASP 485.A OD1 no hydrogen 2.367 N/A TYR 488.A N GLY 501.A O no hydrogen 3.347 N/A GLN 489.A N GLU 479.A O no hydrogen 3.186 N/A GLN 489.A NE2 GLU 479.A OE2 no hydrogen 3.206 N/A LYS 491.A N THR 477.A O no hydrogen 3.172 N/A LYS 491.A NZ GLY 495.A O no hydrogen 2.293 N/A ASP 492.A N LYS 496.A O no hydrogen 3.198 N/A LYS 498.A N GLY 490.A O no hydrogen 3.109 N/A SER 502.A N ASP 505.A OD1 no hydrogen 3.068 N/A ARG 503.A NE GLU 417.A OE1 no hydrogen 2.311 N/A ARG 503.A NH2 GLU 417.A OE2 no hydrogen 2.812 N/A LEU 506.A N SER 502.A O no hydrogen 3.368 N/A GLY 509.A N ASP 505.A O no hydrogen 2.993 N/A SER 510.A N VAL 507.A O no hydrogen 3.401 N/A ASN 511.A N VAL 507.A O no hydrogen 3.010 N/A LEU 517.A N GLU 513.A O no hydrogen 2.961 N/A VAL 518.A N LEU 514.A O no hydrogen 2.884 N/A VAL 518.A N ARG 515.A O no hydrogen 3.289 N/A GLU 519.A N ARG 515.A O no hydrogen 2.880 N/A VAL 520.A N ALA 516.A O no hydrogen 2.999 N/A TYR 521.A OH ASP 533.A OD2 no hydrogen 2.279 N/A GLY 522.A N VAL 518.A O no hydrogen 2.665 N/A VAL 531.A N GLN 527.A O no hydrogen 2.918 N/A GLN 532.A N PRO 528.A O no hydrogen 2.939 N/A ASP 533.A N LYS 529.A O no hydrogen 2.907 N/A PHE 534.A N PHE 530.A O no hydrogen 2.859 N/A VAL 535.A N VAL 531.A O no hydrogen 2.957 N/A ALA 536.A N GLN 532.A O no hydrogen 2.949 N/A ALA 537.A N ASP 533.A O no hydrogen 2.903 N/A TRP 538.A N PHE 534.A O no hydrogen 2.874 N/A ASP 539.A N VAL 535.A O no hydrogen 2.910 N/A LYS 540.A N ALA 536.A O no hydrogen 2.918 N/A LYS 540.A NZ THR 428.A O no hydrogen 3.191 N/A LYS 540.A NZ GLU 433.A OE1 no hydrogen 3.188 N/A VAL 541.A N ALA 537.A O no hydrogen 2.921 N/A MET 542.A N TRP 538.A O no hydrogen 2.924 N/A ASN 543.A N ASP 539.A O no hydrogen 3.248 N/A ASN 543.A N LYS 540.A O no hydrogen 3.267 N/A LEU 544.A N VAL 541.A O no hydrogen 3.375 N/A ARG 550.A N PHE 547.A O no hydrogen 3.334 N/A