Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6hiw_Ca.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 19.A N LYS 16.A O no hydrogen 2.790 N/A LEU 20.A N HIS 17.A O no hydrogen 3.366 N/A ARG 30.A NH1 LEU 27.A O no hydrogen 3.499 N/A LYS 33.A N ASP 31.A OD1 no hydrogen 2.818 N/A TRP 35.A N ASP 31.A O no hydrogen 3.063 N/A THR 36.A N VAL 41.A O no hydrogen 3.002 N/A THR 36.A OG1 VAL 41.A O no hydrogen 2.761 N/A LEU 39.A N THR 36.A O no hydrogen 3.013 N/A LYS 43.A N VAL 34.A O no hydrogen 3.043 N/A ASP 51.A N ASP 51.A OD1 no hydrogen 2.426 N/A GLN 54.A N ASP 51.A O no hydrogen 2.929 N/A SER 55.A N LEU 52.A O no hydrogen 3.068 N/A SER 55.A OG LEU 52.A O no hydrogen 2.769 N/A ARG 56.A NE ASP 61.A OD2 no hydrogen 3.131 N/A ARG 56.A NH2 ASP 61.A OD1 no hydrogen 3.215 N/A ARG 56.A NH2 ASP 61.A OD2 no hydrogen 3.471 N/A ARG 56.A NH2 ASP 71.A OD1 no hydrogen 2.358 N/A ARG 58.A NE ASP 61.A OD1 no hydrogen 3.199 N/A ARG 58.A NH1 MET 70.A O no hydrogen 2.352 N/A GLU 60.A N GLU 60.A OE1 no hydrogen 2.681 N/A ASP 63.A N GLU 60.A O no hydrogen 3.035 N/A GLU 64.A N ASP 61.A O no hydrogen 3.088 N/A ALA 65.A N ASN 171.A OD1 no hydrogen 3.401 N/A MET 70.A N GLN 67.A O no hydrogen 2.797 N/A ASP 71.A N GLN 67.A O no hydrogen 3.178 N/A ASP 71.A N PRO 68.A O no hydrogen 3.152 N/A LEU 76.A N PRO 73.A O no hydrogen 3.254 N/A LYS 77.A N PRO 73.A O no hydrogen 3.325 N/A ASP 78.A N LYS 74.A O no hydrogen 2.982 N/A ARG 79.A N LEU 76.A O no hydrogen 2.812 N/A ALA 87.A N PRO 84.A O no hydrogen 2.772 N/A PHE 90.A N ASN 88.A OD1 no hydrogen 3.142 N/A ALA 92.A N ASN 88.A O no hydrogen 2.852 N/A TRP 93.A N PRO 89.A O no hydrogen 2.932 N/A TYR 94.A N PHE 90.A O no hydrogen 2.863 N/A LEU 95.A N GLY 91.A O no hydrogen 2.895 N/A GLN 96.A N ALA 92.A O no hydrogen 2.886 N/A ASN 97.A N TRP 93.A O no hydrogen 2.942 N/A ASN 97.A ND2 TRP 93.A O no hydrogen 2.868 N/A ILE 98.A N TYR 94.A O no hydrogen 3.164 N/A LEU 99.A N TYR 94.A O no hydrogen 3.101 N/A SER 100.A OG LEU 95.A O no hydrogen 2.275 N/A GLU 102.A N GLU 102.A OE1 no hydrogen 2.636 N/A LEU 104.A N LEU 101.A O no hydrogen 2.677 N/A THR 110.A N GLU 113.A OE1 no hydrogen 2.912 N/A GLU 113.A N THR 110.A OG1 no hydrogen 3.187 N/A LYS 114.A N THR 110.A O no hydrogen 2.928 N/A ILE 115.A N ASN 111.A O no hydrogen 2.966 N/A ALA 116.A N ALA 112.A O no hydrogen 2.926 N/A THR 117.A N GLU 113.A O no hydrogen 2.913 N/A THR 117.A OG1 GLU 113.A O no hydrogen 2.884 N/A TYR 118.A N LYS 114.A O no hydrogen 2.974 N/A ARG 119.A N ILE 115.A O no hydrogen 2.953 N/A SER 120.A N ALA 116.A O no hydrogen 2.912 N/A TYR 121.A N THR 117.A O no hydrogen 2.919 N/A MET 122.A N TYR 118.A O no hydrogen 2.974 N/A ARG 123.A N ARG 119.A O no hydrogen 3.452 N/A THR 132.A OG1 ASN 131.A O no hydrogen 2.731 N/A ASP 136.A N SER 134.A OG no hydrogen 3.276 N/A VAL 138.A N SER 134.A O no hydrogen 3.151 N/A ILE 139.A N ASP 135.A O no hydrogen 2.866 N/A ARG 140.A N ASP 136.A O no hydrogen 2.936 N/A ASN 141.A N ASP 137.A O no hydrogen 2.872 N/A ILE 142.A N VAL 138.A O no hydrogen 2.891 N/A ILE 143.A N ILE 139.A O no hydrogen 2.932 N/A LYS 144.A N ARG 140.A O no hydrogen 2.961 N/A GLU 145.A N ASN 141.A O no hydrogen 2.938 N/A ARG 146.A N ILE 142.A O no hydrogen 2.965 N/A ARG 146.A NH1 ASN 97.A O no hydrogen 3.012 N/A TRP 147.A N ILE 143.A O no hydrogen 3.004 N/A LYS 148.A N LYS 144.A O no hydrogen 2.986 N/A THR 149.A N GLU 145.A O no hydrogen 2.829 N/A THR 149.A OG1 GLU 145.A O no hydrogen 3.060 N/A THR 149.A OG1 ARG 146.A O no hydrogen 3.247 N/A LEU 150.A N ARG 146.A O no hydrogen 3.251 N/A PHE 152.A N GLN 213.A OE1 no hydrogen 3.058 N/A GLY 153.A N CYS 161.A O no hydrogen 2.628 N/A TYR 166.A N THR 162.A O no hydrogen 2.963 N/A ILE 167.A N PHE 163.A O no hydrogen 2.965 N/A GLN 168.A N GLY 164.A O no hydrogen 2.919 N/A PHE 169.A N ASP 165.A O no hydrogen 3.006 N/A LEU 170.A N TYR 166.A O no hydrogen 2.905 N/A ASN 171.A N ILE 167.A O no hydrogen 2.908 N/A GLU 172.A N GLN 168.A O no hydrogen 2.971 N/A TRP 173.A N PHE 169.A O no hydrogen 2.988 N/A PHE 174.A N LEU 170.A O no hydrogen 2.871 N/A LYS 175.A N ASN 171.A O no hydrogen 3.290 N/A LYS 175.A NZ GLU 64.A OE2 no hydrogen 3.526 N/A SER 176.A N TRP 173.A O no hydrogen 3.030 N/A MET 182.A N ASP 178.A O no hydrogen 3.229 N/A GLN 183.A N GLU 179.A O no hydrogen 2.945 N/A ARG 184.A N GLU 180.A O no hydrogen 2.917 N/A LEU 185.A N GLY 181.A O no hydrogen 2.956 N/A ARG 186.A N MET 182.A O no hydrogen 2.897 N/A ARG 186.A NE MET 182.A O no hydrogen 3.504 N/A GLU 187.A N GLN 183.A O no hydrogen 2.923 N/A HIS 188.A N ARG 184.A O no hydrogen 2.964 N/A PHE 189.A N LEU 185.A O no hydrogen 2.920 N/A PHE 189.A N ARG 186.A O no hydrogen 3.013 N/A ASP 190.A N ARG 186.A O no hydrogen 2.933 N/A ARG 191.A N GLU 187.A O no hydrogen 2.968 N/A ARG 192.A N HIS 188.A O no hydrogen 3.301 N/A ARG 194.A N PHE 189.A O no hydrogen 3.037 N/A ARG 194.A NH1 ASP 190.A OD1 no hydrogen 3.245 N/A LEU 197.A N ILE 193.A O no hydrogen 2.912 N/A ALA 198.A N ARG 194.A O no hydrogen 3.081 N/A ALA 198.A N PRO 195.A O no hydrogen 2.849 N/A VAL 199.A N PRO 195.A O no hydrogen 3.000 N/A SER 201.A OG ASP 204.A OD2 no hydrogen 3.360 N/A ASP 204.A N SER 201.A O no hydrogen 2.880 N/A ILE 205.A N PRO 202.A O no hydrogen 2.977 N/A LEU 208.A N ASP 204.A O no hydrogen 2.655 N/A GLU 209.A N ILE 205.A O no hydrogen 2.895 N/A GLU 209.A N LEU 206.A O no hydrogen 2.932 N/A ALA 210.A N TRP 207.A O no hydrogen 2.952 N/A GLN 213.A NE2 LEU 150.A O no hydrogen 3.499 N/A ASN 214.A N GLU 209.A O no hydrogen 3.211 N/A ASN 214.A ND2 GLU 209.A OE2 no hydrogen 3.544 N/A ASN 218.A ND2 ASN 218.A O no hydrogen 3.142 N/A ASN 218.A ND2 GLN 221.A OE1 no hydrogen 2.999 N/A LEU 222.A N ASN 218.A O no hydrogen 3.311 N/A GLN 223.A N LYS 219.A O no hydrogen 2.937 N/A ARG 224.A N GLU 220.A O no hydrogen 3.008 N/A LYS 225.A N GLN 221.A O no hydrogen 2.936 N/A ILE 226.A N LEU 222.A O no hydrogen 2.952 N/A ALA 227.A N GLN 223.A O no hydrogen 2.924 N/A PHE 228.A N ARG 224.A O no hydrogen 2.939 N/A GLN 229.A N LYS 225.A O no hydrogen 2.934 N/A THR 230.A N ILE 226.A O no hydrogen 2.915 N/A THR 230.A OG1 ILE 226.A O no hydrogen 2.631 N/A SER 231.A N ALA 227.A O no hydrogen 2.965 N/A SER 231.A OG PHE 228.A O no hydrogen 2.601 N/A LEU 232.A N GLN 229.A O no hydrogen 3.066 N/A SER 241.A OG ASP 239.A OD2 no hydrogen 2.745 N/A ARG 243.A N MET 240.A O no hydrogen 3.270 N/A ARG 243.A NH1 VAL 199.A O no hydrogen 2.680 N/A ARG 243.A NH1 ASP 204.A OD2 no hydrogen 3.134 N/A ARG 243.A NH2 ASP 204.A OD2 no hydrogen 2.696 N/A ARG 243.A NH2 PHE 238.A O no hydrogen 2.749 N/A LYS 253.A NZ GLU 247.A OE1 no hydrogen 2.867 N/A LYS 253.A NZ GLU 250.A OE2 no hydrogen 3.255 N/A ASP 256.A N LYS 253.A O no hydrogen 2.877 N/A GLU 257.A N VAL 254.A O no hydrogen 3.333 N/A LEU 265.A N LEU 262.A O no hydrogen 3.111 N/A TRP 266.A N LEU 262.A O no hydrogen 3.379 N/A SER 267.A OG PHE 263.A O no hydrogen 2.216 N/A LYS 268.A N LEU 265.A O no hydrogen 2.922 N/A ALA 269.A N LEU 265.A O no hydrogen 3.422 N/A ARG 272.A N ALA 269.A O no hydrogen 2.922 N/A GLU 276.A N GLU 276.A OE1 no hydrogen 2.478 N/A ARG 277.A NH1 ARG 272.A O no hydrogen 3.109 N/A SER 279.A N PRO 275.A O no hydrogen 2.899 N/A SER 279.A OG GLU 276.A O no hydrogen 3.087 N/A LYS 280.A N GLU 276.A O no hydrogen 3.104 N/A MET 281.A N LEU 278.A O no hydrogen 2.695 N/A TYR 282.A N SER 279.A O no hydrogen 3.496 N/A GLY 283.A N TYR 252.A OH no hydrogen 2.794 N/A ASP 285.A N ASP 285.A OD1 no hydrogen 2.553 N/A VAL 289.A N ASP 285.A O no hydrogen 3.056 N/A ARG 290.A N PHE 286.A O no hydrogen 3.016 N/A ARG 290.A NE LEU 316.A O no hydrogen 2.926 N/A ARG 290.A NH2 GLU 320.A OE1 no hydrogen 3.537 N/A LYS 291.A N THR 287.A O no hydrogen 3.012 N/A ILE 292.A N LEU 288.A O no hydrogen 2.961 N/A LEU 293.A N VAL 289.A O no hydrogen 2.960 N/A VAL 294.A N ARG 290.A O no hydrogen 3.003 N/A TRP 295.A N LYS 291.A O no hydrogen 3.101 N/A HIS 296.A N ILE 292.A O no hydrogen 2.895 N/A HIS 297.A N LEU 293.A O no hydrogen 2.985 N/A PHE 298.A N VAL 294.A O no hydrogen 3.021 N/A LYS 299.A N TRP 295.A O no hydrogen 2.940 N/A ALA 300.A N HIS 296.A O no hydrogen 2.902 N/A CYS 301.A N HIS 297.A O no hydrogen 2.965 N/A CYS 301.A SG HIS 297.A NE2 no hydrogen 3.626 N/A CYS 301.A SG HIS 297.A O no hydrogen 3.572 N/A TYR 302.A N PHE 298.A O no hydrogen 2.960 N/A ASP 303.A N LYS 299.A O no hydrogen 2.900 N/A ALA 304.A N ALA 300.A O no hydrogen 2.964 N/A VAL 306.A N CYS 301.A O no hydrogen 3.229 N/A ASP 309.A N HIS 297.A NE2 no hydrogen 3.214 N/A SER 311.A N ASP 309.A OD1 no hydrogen 2.713 N/A SER 311.A OG ASP 309.A OD1 no hydrogen 2.492 N/A SER 311.A OG ASP 309.A OD2 no hydrogen 2.672 N/A LEU 312.A N ASP 309.A O no hydrogen 3.326 N/A ARG 315.A N SER 311.A O no hydrogen 2.959 N/A ARG 315.A NH1 ASP 309.A OD2 no hydrogen 3.038 N/A LEU 316.A N LEU 312.A O no hydrogen 2.917 N/A GLU 320.A N GLU 320.A OE1 no hydrogen 2.597 N/A TRP 321.A N PHE 317.A O no hydrogen 2.852 N/A ILE 322.A N ALA 318.A O no hydrogen 2.969 N/A ARG 323.A N LEU 319.A O no hydrogen 2.943 N/A ARG 323.A NH1 ASP 324.A OD1 no hydrogen 2.083 N/A ASP 324.A N GLU 320.A O no hydrogen 2.958 N/A VAL 325.A N TRP 321.A O no hydrogen 2.880 N/A ARG 326.A N ILE 322.A O no hydrogen 2.930 N/A ARG 326.A NE ASP 385.A OD2 no hydrogen 3.347 N/A ARG 326.A NH2 ASP 382.A OD1 no hydrogen 2.379 N/A ALA 327.A N ARG 323.A O no hydrogen 2.943 N/A ARG 328.A N ASP 324.A O no hydrogen 2.887 N/A ARG 328.A NE ARG 492.A O no hydrogen 3.240 N/A ARG 328.A NH1 GLY 335.A O no hydrogen 2.618 N/A ARG 328.A NH2 ARG 492.A O no hydrogen 3.330 N/A LYS 329.A N VAL 325.A O no hydrogen 2.955 N/A HIS 330.A N ARG 326.A O no hydrogen 2.884 N/A TYR 334.A OH PHE 493.A O no hydrogen 3.349 N/A GLU 341.A N ARG 338.A O no hydrogen 3.254 N/A GLN 342.A N PHE 339.A O no hydrogen 3.129 N/A PHE 353.A N ARG 350.A O no hydrogen 3.003 N/A LEU 356.A N LEU 352.A O no hydrogen 2.794 N/A VAL 357.A N PHE 353.A O no hydrogen 2.911 N/A ASN 358.A N ARG 354.A O no hydrogen 3.044 N/A ARG 359.A N ASP 355.A O no hydrogen 2.880 N/A ARG 359.A NE ASP 355.A OD2 no hydrogen 2.648 N/A ARG 360.A N LEU 356.A O no hydrogen 2.937 N/A ARG 360.A NE GLU 361.A OE2 no hydrogen 3.467 N/A GLU 361.A N VAL 357.A O no hydrogen 3.198 N/A ALA 362.A N ARG 359.A O no hydrogen 3.127 N/A ALA 365.A N GLU 369.A OE1 no hydrogen 2.926 N/A GLU 369.A N ASN 366.A OD1 no hydrogen 2.946 N/A ASP 371.A N VAL 367.A O no hydrogen 3.133 N/A TYR 374.A N ASP 372.A OD2 no hydrogen 2.349 N/A LEU 377.A N TYR 374.A O no hydrogen 3.070 N/A GLN 378.A N ASP 382.A OD2 no hydrogen 3.031 N/A GLU 384.A N GLU 380.A O no hydrogen 2.871 N/A GLU 384.A N GLN 381.A O no hydrogen 2.973 N/A ASP 385.A N GLN 381.A O no hydrogen 2.928 N/A TYR 386.A N ASP 382.A O no hydrogen 2.883 N/A TRP 387.A N TYR 383.A O no hydrogen 3.262 N/A TYR 394.A N ASN 390.A O no hydrogen 3.164 N/A TYR 394.A OH GLU 384.A OE2 no hydrogen 3.351 N/A ARG 395.A N TYR 391.A O no hydrogen 2.907 N/A ARG 396.A N ASP 392.A O no hydrogen 3.041 N/A MET 397.A N VAL 393.A O no hydrogen 2.897 N/A PHE 398.A N TYR 394.A O no hydrogen 2.787 N/A MET 401.A N PHE 398.A O no hydrogen 3.191 N/A GLN 410.A N SER 473.A OG no hydrogen 3.087 N/A TYR 412.A N LEU 471.A O no hydrogen 2.766 N/A GLY 420.A N ILE 417.A O no hydrogen 3.134 N/A ARG 423.A N GLY 420.A O no hydrogen 2.963 N/A GLN 424.A N PRO 421.A O no hydrogen 2.955 N/A ALA 426.A N ARG 423.A O no hydrogen 2.833 N/A LYS 428.A N HIS 425.A O no hydrogen 3.175 N/A TRP 433.A N ARG 465.A O no hydrogen 2.899 N/A TRP 433.A NE1 SER 429.A OG no hydrogen 3.180 N/A PHE 435.A N VAL 463.A O no hydrogen 2.876 N/A GLU 437.A N ARG 461.A O no hydrogen 3.211 N/A VAL 442.A N GLY 439.A O no hydrogen 2.951 N/A GLY 443.A N GLU 451.A OE1 no hydrogen 3.214 N/A GLY 443.A N GLU 451.A OE2 no hydrogen 3.008 N/A HIS 444.A NE2 VAL 440.A O no hydrogen 2.924 N/A LEU 447.A N HIS 444.A O no hydrogen 3.040 N/A LYS 448.A N GLU 445.A O no hydrogen 2.952 N/A LYS 448.A NZ GLU 486.A OE1 no hydrogen 3.394 N/A GLU 451.A N LEU 447.A O no hydrogen 3.203 N/A GLU 451.A N LYS 448.A O no hydrogen 2.939 N/A LEU 452.A N LYS 448.A O no hydrogen 3.068 N/A LEU 452.A N LYS 449.A O no hydrogen 2.981 N/A THR 455.A N ASP 453.A OD1 no hydrogen 3.077 N/A THR 455.A OG1 ASP 453.A OD1 no hydrogen 3.508 N/A ASN 456.A ND2 LEU 450.A O no hydrogen 3.249 N/A GLU 457.A N GLU 457.A OE1 no hydrogen 2.294 N/A LYS 458.A N ASN 456.A OD1 no hydrogen 2.937 N/A ARG 460.A NE GLU 437.A O no hydrogen 2.821 N/A ARG 461.A N GLU 437.A OE1 no hydrogen 2.894 N/A ARG 461.A NE GLU 437.A OE1 no hydrogen 3.373 N/A ARG 461.A NH2 GLU 437.A OE2 no hydrogen 3.553 N/A VAL 463.A N PHE 435.A O no hydrogen 2.964 N/A ILE 464.A N ARG 472.A O no hydrogen 2.990 N/A ARG 465.A N TRP 433.A O no hydrogen 2.923 N/A GLN 466.A N THR 470.A O no hydrogen 3.034 N/A GLY 469.A N GLN 466.A O no hydrogen 2.746 N/A THR 470.A N ASP 468.A OD1 no hydrogen 3.447 N/A THR 470.A OG1 ASP 468.A OD2 no hydrogen 3.051 N/A ARG 472.A N ILE 464.A O no hydrogen 3.021 N/A ARG 472.A NH1 SER 473.A O no hydrogen 3.176 N/A ARG 472.A NH1 GLU 478.A OE1 no hydrogen 3.568 N/A ARG 472.A NH2 GLU 478.A OE2 no hydrogen 3.357 N/A SER 473.A N GLN 410.A O no hydrogen 2.831 N/A SER 473.A OG GLN 410.A O no hydrogen 3.564 N/A LYS 475.A N GLU 478.A OE1 no hydrogen 2.678 N/A MET 479.A N LYS 475.A O no hydrogen 2.958 N/A ARG 480.A N MET 476.A O no hydrogen 2.949 N/A ARG 480.A NH2 GLU 486.A OE1 no hydrogen 3.322 N/A ALA 481.A N SER 477.A O no hydrogen 2.960 N/A ALA 481.A N GLU 478.A O no hydrogen 3.076 N/A TRP 482.A N MET 479.A O no hydrogen 3.176 N/A TYR 483.A N ARG 480.A O no hydrogen 3.191 N/A TYR 483.A OH GLU 451.A OE1 no hydrogen 3.066 N/A LYS 485.A NZ GLU 487.A OE2 no hydrogen 3.294 N/A ARG 492.A NH2 GLU 384.A OE2 no hydrogen 3.360 N/A GLN 497.A N GLY 546.A O no hydrogen 2.973 N/A GLU 499.A N PHE 548.A O no hydrogen 3.429 N/A THR 505.A N GLY 501.A O no hydrogen 3.306 N/A THR 505.A OG1 GLY 501.A O no hydrogen 3.087 N/A GLN 510.A N PRO 506.A O no hydrogen 3.490 N/A GLN 510.A NE2 ILE 502.A O no hydrogen 3.290 N/A TYR 511.A N SER 507.A O no hydrogen 2.830 N/A THR 519.A OG1 GLN 530.A O no hydrogen 2.898 N/A ASP 520.A N THR 518.A OG1 no hydrogen 3.160 N/A ALA 521.A N ARG 528.A O no hydrogen 3.016 N/A GLN 526.A N PHE 523.A O no hydrogen 3.027 N/A ARG 527.A N ASP 522.A O no hydrogen 3.218 N/A ARG 528.A NH1 TRP 53.A O no hydrogen 3.310 N/A ARG 528.A NH1 ARG 58.A O no hydrogen 3.414 N/A ARG 528.A NH2 ARG 58.A O no hydrogen 3.510 N/A GLN 530.A N THR 519.A O no hydrogen 2.921 N/A ARG 532.A NH2 ASP 517.A O no hydrogen 3.055 N/A LYS 535.A NZ GLU 539.A OE2 no hydrogen 3.131 N/A PHE 537.A N VAL 534.A O no hydrogen 3.209 N/A THR 543.A N SER 540.A O no hydrogen 3.326 N/A ARG 544.A N HIS 541.A O no hydrogen 3.208 N/A THR 545.A OG1 TRP 494.A O no hydrogen 3.202 N/A PHE 551.A N ALA 549.A O no hydrogen 2.966 N/A ARG 555.A NH1 ARG 555.A O no hydrogen 2.586 N/A PHE 556.A N PRO 553.A O no hydrogen 2.830 N/A MET 557.A N PRO 553.A O no hydrogen 3.142 N/A THR 561.A OG1 GLN 558.A O no hydrogen 3.558 N/A ARG 566.A NH1 ARG 566.A O no hydrogen 2.405 N/A GLN 576.A N ALA 573.A O no hydrogen 3.141 N/A GLN 576.A NE2 GLN 512.A OE1 no hydrogen 3.343 N/A GLN 578.A NE2 GLN 512.A O no hydrogen 3.675 N/A LYS 579.A N GLU 513.A OE2 no hydrogen 3.404 N/A