Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hag_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 14.A N PHE 189.A O no hydrogen 2.934 N/A ARG 16.A NE GLU 186.A OE2 no hydrogen 3.104 N/A ARG 16.A NH2 GLU 186.A OE2 no hydrogen 2.565 N/A ARG 17.A N LEU 187.A O no hydrogen 3.041 N/A ARG 17.A NH1 GLN 18.A O no hydrogen 2.908 N/A TYR 19.A N LEU 185.A O no hydrogen 2.840 N/A TYR 19.A OH GLU 59.A OE1 no hydrogen 2.969 N/A LEU 21.A N PHE 183.A O no hydrogen 3.046 N/A THR 23.A N LEU 181.A O no hydrogen 3.015 N/A THR 23.A OG1 SER 24.A O no hydrogen 3.149 N/A SER 24.A N LEU 47.A O no hydrogen 3.116 N/A LEU 26.A N GLY 179.A O no hydrogen 2.706 N/A THR 32.A N ASP 254.A OD1 no hydrogen 2.998 N/A THR 32.A OG1 ASP 254.A OD2 no hydrogen 2.764 N/A LEU 34.A N ILE 161.A O no hydrogen 3.168 N/A VAL 35.A N GLN 271.A OE1 no hydrogen 2.340 N/A LEU 36.A N LEU 159.A O no hydrogen 2.808 N/A TYR 37.A N LEU 159.A O no hydrogen 3.133 N/A TYR 37.A OH PRO 46.A O no hydrogen 2.723 N/A ALA 39.A N VAL 157.A O no hydrogen 3.166 N/A LEU 41.A N GLY 155.A O no hydrogen 2.649 N/A LEU 44.A N SER 42.A OG no hydrogen 3.036 N/A LEU 45.A N SER 42.A O no hydrogen 3.020 N/A ASP 49.A N SER 24.A OG no hydrogen 3.071 N/A GLY 50.A N ARG 203.A O no hydrogen 2.923 N/A THR 51.A OG1 SER 202.A OG no hydrogen 2.981 N/A THR 51.A OG1 TYR 204.A OH no hydrogen 2.581 N/A ASN 52.A N VAL 201.A O no hydrogen 2.961 N/A ASN 52.A ND2 GLN 48.A O no hydrogen 3.345 N/A ASN 52.A ND2 ASP 49.A O no hydrogen 3.232 N/A THR 53.A OG1 THR 199.A O no hydrogen 2.878 N/A ALA 57.A N HIS 54.A O no hydrogen 3.031 N/A THR 58.A N HIS 54.A O no hydrogen 2.751 N/A THR 58.A OG1 HIS 54.A O no hydrogen 2.979 N/A GLU 59.A N ILE 55.A O no hydrogen 2.327 N/A SER 61.A N ALA 57.A O no hydrogen 3.030 N/A SER 61.A OG THR 197.A O no hydrogen 2.582 N/A SER 61.A OG THR 197.A OG1 no hydrogen 3.356 N/A TYR 63.A N ALA 60.A O no hydrogen 2.831 N/A TYR 66.A N ARG 140.A O no hydrogen 2.922 N/A TYR 66.A OH LEU 41.A O no hydrogen 3.213 N/A TYR 66.A OH ALA 152.A O no hydrogen 3.161 N/A ARG 67.A N GLU 188.A O no hydrogen 2.976 N/A VAL 69.A N GLU 186.A O no hydrogen 2.826 N/A THR 72.A N ALA 184.A O no hydrogen 2.967 N/A ILE 73.A N LEU 125.A O no hydrogen 2.902 N/A ARG 74.A N ASP 182.A O no hydrogen 2.910 N/A ARG 74.A NH1 GLU 124.A OE2 no hydrogen 2.466 N/A TYR 75.A N SER 123.A O no hydrogen 3.078 N/A ARG 76.A N LEU 180.A O no hydrogen 3.093 N/A LEU 78.A N LEU 178.A O no hydrogen 2.481 N/A VAL 79.A N LEU 178.A O no hydrogen 2.985 N/A VAL 83.A N PRO 80.A O no hydrogen 3.379 N/A GLY 84.A N VAL 166.A O no hydrogen 3.103 N/A ALA 87.A N HIS 162.A O no hydrogen 2.715 N/A ILE 88.A N VAL 117.A O no hydrogen 3.121 N/A SER 89.A N CYS 160.A O no hydrogen 2.752 N/A SER 89.A OG HIS 162.A NE2 no hydrogen 2.719 N/A ILE 90.A N ILE 115.A O no hydrogen 3.312 N/A SER 91.A N MET 158.A O no hydrogen 2.938 N/A SER 91.A OG MET 158.A O no hydrogen 3.183 N/A PHE 92.A N VAL 113.A O no hydrogen 3.308 N/A TRP 93.A N LEU 156.A O no hydrogen 2.860 N/A THR 96.A N GLU 150.A OE1 no hydrogen 2.769 N/A THR 96.A OG1 GLU 150.A OE1 no hydrogen 3.160 N/A THR 98.A N GLN 95.A O no hydrogen 3.081 N/A SER 102.A OG SER 107.A OG no hydrogen 3.297 N/A ASP 104.A N SER 102.A OG no hydrogen 3.186 N/A ASN 106.A N ASP 104.A OD1 no hydrogen 2.602 N/A SER 107.A N ASP 104.A O no hydrogen 3.096 N/A SER 107.A OG SER 102.A OG no hydrogen 3.297 N/A ILE 108.A N ASP 104.A O no hydrogen 3.240 N/A THR 109.A N MET 105.A O no hydrogen 2.691 N/A SER 110.A N SER 107.A O no hydrogen 3.433 N/A THR 111.A N ILE 108.A O no hydrogen 3.150 N/A ILE 115.A N ILE 90.A O no hydrogen 3.170 N/A VAL 117.A N ILE 88.A O no hydrogen 2.703 N/A ILE 121.A N GLN 118.A O no hydrogen 3.427 N/A LEU 125.A N ILE 73.A O no hydrogen 2.741 N/A ILE 127.A N ALA 71.A O no hydrogen 3.221 N/A ARG 131.A N PRO 128.A O no hydrogen 2.937 N/A ARG 131.A NH2 ASP 112.A OD1 no hydrogen 3.468 N/A HIS 133.A N SER 129.A O no hydrogen 2.843 N/A GLY 138.A N ARG 135.A O no hydrogen 3.045 N/A TRP 139.A N ASN 136.A O no hydrogen 2.917 N/A ARG 140.A N TYR 66.A O no hydrogen 2.806 N/A ARG 140.A NH2 ARG 135.A O no hydrogen 3.457 N/A SER 141.A N GLU 151.A O no hydrogen 2.819 N/A SER 141.A OG GLU 143.A O no hydrogen 3.052 N/A VAL 142.A N ALA 64.A O no hydrogen 2.619 N/A THR 144.A N GLU 143.A OE2 no hydrogen 3.220 N/A THR 144.A OG1 TYR 320.A O no hydrogen 3.027 N/A SER 145.A N GLU 143.A OE2 no hydrogen 3.274 N/A GLU 151.A N ALA 148.A O no hydrogen 2.882 N/A ALA 152.A N GLU 149.A O no hydrogen 3.252 N/A THR 153.A OG1 LEU 41.A O no hydrogen 3.485 N/A SER 154.A N LEU 41.A O no hydrogen 2.717 N/A LEU 156.A N TRP 93.A O no hydrogen 2.749 N/A VAL 157.A N ALA 39.A O no hydrogen 2.879 N/A MET 158.A N SER 91.A O no hydrogen 2.955 N/A LEU 159.A N TYR 37.A O no hydrogen 2.664 N/A CYS 160.A N SER 89.A O no hydrogen 2.888 N/A ILE 161.A N LEU 34.A O no hydrogen 2.909 N/A HIS 162.A N ALA 87.A O no hydrogen 2.638 N/A HIS 162.A NE2 SER 89.A OG no hydrogen 2.719 N/A GLY 163.A N THR 32.A O no hydrogen 3.196 N/A VAL 166.A N GLY 84.A O no hydrogen 2.903 N/A ASN 167.A N THR 172.A O no hydrogen 2.787 N/A SER 168.A N ALA 82.A O no hydrogen 3.218 N/A TYR 169.A N ASN 167.A OD1 no hydrogen 3.135 N/A ASN 171.A N ASN 167.A O no hydrogen 2.838 N/A ASN 171.A ND2 ASN 171.A O no hydrogen 2.942 N/A TYR 174.A N PRO 165.A O no hydrogen 3.111 N/A TYR 174.A OH ALA 177.A O no hydrogen 2.662 N/A THR 175.A OG1 THR 175.A O no hydrogen 1.729 N/A LEU 178.A N LEU 26.A O no hydrogen 2.989 N/A LEU 180.A N ARG 76.A O no hydrogen 2.878 N/A LEU 181.A N THR 23.A OG1 no hydrogen 2.957 N/A ASP 182.A N ARG 74.A O no hydrogen 2.743 N/A PHE 183.A N LEU 21.A O no hydrogen 2.699 N/A ALA 184.A N THR 72.A O no hydrogen 2.999 N/A LEU 185.A N TYR 19.A O no hydrogen 2.942 N/A GLU 186.A N ARG 70.A O no hydrogen 3.025 N/A LEU 187.A N ARG 17.A O no hydrogen 2.912 N/A GLU 188.A N ARG 67.A O no hydrogen 2.928 N/A PHE 189.A N LEU 15.A O no hydrogen 2.907 N/A ARG 190.A N GLN 65.A O no hydrogen 2.777 N/A ARG 190.A NH1 GLN 65.A OE1 no hydrogen 3.334 N/A THR 193.A N ASN 62.A O no hydrogen 2.752 N/A THR 193.A OG1 LEU 192.A O no hydrogen 2.508 N/A ASN 196.A N THR 193.A O no hydrogen 2.981 N/A THR 197.A N SER 61.A OG no hydrogen 3.092 N/A THR 197.A OG1 SER 61.A OG no hydrogen 3.356 N/A THR 197.A OG1 ASN 198.A O no hydrogen 2.908 N/A ASN 198.A ND2 ARG 200.A O no hydrogen 2.985 N/A VAL 201.A N ASN 52.A O no hydrogen 2.828 N/A SER 202.A N ASP 319.A OD2 no hydrogen 3.379 N/A SER 202.A OG THR 51.A OG1 no hydrogen 2.981 N/A ARG 203.A N GLY 50.A O no hydrogen 2.834 N/A TYR 204.A N ILE 317.A O no hydrogen 2.861 N/A TYR 204.A OH THR 51.A OG1 no hydrogen 2.581 N/A SER 206.A N VAL 315.A O no hydrogen 2.782 N/A SER 206.A OG THR 225.A OG1 no hydrogen 3.202 N/A ALA 208.A N SER 313.A O no hydrogen 3.300 N/A HIS 210.A NE2 SER 206.A O no hydrogen 2.997 N/A LEU 212.A N ILE 308.A O no hydrogen 2.375 N/A ARG 214.A NE ILE 304.A O no hydrogen 2.829 N/A GLY 215.A N THR 219.A O no hydrogen 3.130 N/A GLY 218.A N GLY 215.A O no hydrogen 2.965 N/A THR 219.A OG1 ASP 217.A OD1 no hydrogen 3.162 N/A THR 219.A OG1 ASP 217.A OD2 no hydrogen 3.207 N/A ALA 220.A N ILE 302.A O no hydrogen 2.978 N/A GLU 221.A N ARG 213.A O no hydrogen 3.179 N/A LEU 222.A N VAL 287.A O no hydrogen 2.839 N/A THR 223.A OG1 THR 286.A OG1 no hydrogen 2.976 N/A THR 224.A N PRO 285.A O no hydrogen 2.885 N/A THR 225.A OG1 SER 206.A OG no hydrogen 3.202 N/A ALA 226.A N THR 224.A OG1 no hydrogen 3.381 N/A ALA 227.A N THR 224.A O no hydrogen 2.925 N/A THR 228.A N THR 225.A O no hydrogen 2.942 N/A THR 228.A OG1 THR 225.A O no hydrogen 2.797 N/A ARG 229.A NH2 ASP 327.A OD2 no hydrogen 2.665 N/A MET 231.A N THR 228.A O no hydrogen 3.330 N/A LYS 232.A N ARG 229.A O no hydrogen 3.190 N/A ASP 233.A N MET 231.A O no hydrogen 2.722 N/A HIS 235.A N ASP 233.A OD2 no hydrogen 3.483 N/A THR 237.A OG1 PHE 236.A O no hydrogen 2.897 N/A GLY 239.A N VAL 279.A O no hydrogen 2.772 N/A GLY 242.A N PRO 277.A O no hydrogen 2.846 N/A ILE 245.A N ASP 321.A O no hydrogen 3.386 N/A ALA 246.A N SER 275.A O no hydrogen 2.939 N/A THR 248.A N PHE 273.A O no hydrogen 2.450 N/A THR 248.A OG1 ALA 246.A O no hydrogen 3.240 N/A THR 248.A OG1 SER 275.A OG no hydrogen 2.563 N/A LEU 249.A N VAL 316.A O no hydrogen 2.950 N/A ASN 251.A ND2 VAL 35.A O no hydrogen 3.584 N/A LEU 257.A N ASP 254.A O no hydrogen 3.257 N/A LEU 260.A N LEU 257.A O no hydrogen 2.951 N/A ILE 265.A N PRO 261.A O no hydrogen 3.088 N/A SER 266.A N THR 262.A O no hydrogen 2.900 N/A SER 266.A OG THR 262.A O no hydrogen 3.238 N/A SER 267.A N LEU 264.A O no hydrogen 3.097 N/A SER 267.A OG LEU 272.A O no hydrogen 2.785 N/A GLN 271.A NE2 ASN 33.A O no hydrogen 2.822 N/A PHE 273.A N THR 248.A O no hydrogen 3.070 N/A TYR 274.A N TYR 290.A O no hydrogen 3.047 N/A TYR 274.A OH GLU 149.A OE2 no hydrogen 3.202 N/A SER 275.A N ALA 246.A O no hydrogen 2.802 N/A SER 275.A OG THR 248.A OG1 no hydrogen 2.563 N/A ARG 276.A N LYS 288.A O no hydrogen 3.202 N/A ARG 276.A NE GLY 242.A O no hydrogen 3.100 N/A ARG 276.A NH1 ALA 296.A O no hydrogen 2.650 N/A ARG 276.A NH2 GLY 242.A O no hydrogen 3.231 N/A VAL 278.A N THR 286.A O no hydrogen 2.698 N/A VAL 279.A N GLU 240.A O no hydrogen 3.005 N/A GLY 283.A N SER 280.A O no hydrogen 2.617 N/A THR 286.A OG1 THR 223.A OG1 no hydrogen 2.976 N/A THR 286.A OG1 GLU 284.A O no hydrogen 3.125 N/A VAL 287.A N LEU 222.A O no hydrogen 2.776 N/A LYS 288.A N ARG 276.A O no hydrogen 2.675 N/A LYS 288.A NZ ASP 299.A OD1 no hydrogen 2.745 N/A LEU 289.A N ALA 220.A O no hydrogen 3.116 N/A TYR 290.A N TYR 274.A O no hydrogen 2.898 N/A TYR 290.A OH ASP 299.A OD1 no hydrogen 2.587 N/A GLU 294.A N SER 292.A OG no hydrogen 2.968 N/A ALA 296.A N SER 292.A O no hydrogen 2.856 N/A GLN 297.A N VAL 293.A O no hydrogen 3.254 N/A GLN 298.A N GLU 294.A O no hydrogen 2.995 N/A ASP 299.A N ALA 296.A O no hydrogen 3.285 N/A LYS 300.A N ASN 295.A O no hydrogen 3.035 N/A ILE 302.A N LEU 289.A O no hydrogen 3.347 N/A ILE 304.A N GLY 218.A O no hydrogen 3.075 N/A ILE 308.A N LEU 212.A O no hydrogen 3.040 N/A LEU 310.A N HIS 210.A O no hydrogen 2.440 N/A GLY 311.A N HIS 210.A O no hydrogen 3.112 N/A ARG 314.A N ASN 251.A O no hydrogen 3.237 N/A ARG 314.A NE ASN 251.A OD1 no hydrogen 3.270 N/A ARG 314.A NH1 THR 27.A O no hydrogen 2.557 N/A ARG 314.A NH1 THR 27.A OG1 no hydrogen 3.172 N/A ARG 314.A NH2 THR 27.A O no hydrogen 2.595 N/A ARG 314.A NH2 ASN 251.A OD1 no hydrogen 3.075 N/A VAL 315.A N SER 206.A O no hydrogen 3.364 N/A VAL 316.A N LEU 249.A O no hydrogen 3.024 N/A ILE 317.A N TYR 204.A O no hydrogen 2.710 N/A GLN 318.A N LEU 247.A O no hydrogen 3.076 N/A ASP 319.A N SER 202.A O no hydrogen 2.917 N/A TYR 320.A N ILE 245.A O no hydrogen 2.801 N/A ASP 321.A N ILE 245.A O no hydrogen 3.154 N/A ASN 322.A ND2 ARG 200.A O no hydrogen 3.556 N/A ASN 322.A ND2 ASP 327.A OD2 no hydrogen 2.900 N/A GLN 323.A NE2 ASN 322.A O no hydrogen 3.006 N/A HIS 324.A N ASN 322.A OD1 no hydrogen 2.702 N/A GLU 325.A N LYS 232.A O no hydrogen 3.410 N/A ARG 328.A NE ASN 322.A O no hydrogen 2.904 N/A ARG 328.A NH1 GLU 143.A OE2 no hydrogen 3.307 N/A ARG 328.A NH2 GLU 143.A OE2 no hydrogen 3.012 N/A ARG 328.A NH2 ASN 322.A O no hydrogen 3.470 N/A VAL 341.A N PRO 338.A O no hydrogen 3.190 N/A LEU 342.A N THR 391.A O no hydrogen 2.927 N/A ASN 345.A N LEU 464.A O no hydrogen 3.197 N/A LEU 348.A N GLY 462.A O no hydrogen 2.942 N/A LEU 350.A N ALA 460.A O no hydrogen 2.783 N/A SER 351.A N THR 370.A O no hydrogen 2.964 N/A LEU 352.A N ILE 458.A O no hydrogen 2.799 N/A THR 353.A N THR 368.A O no hydrogen 2.871 N/A ASP 358.A N MET 363.A O no hydrogen 3.451 N/A ASN 361.A ND2 SER 450.A OG no hydrogen 3.075 N/A MET 363.A N ASP 358.A O no hydrogen 3.297 N/A TYR 364.A N ILE 449.A O no hydrogen 2.714 N/A VAL 365.A N GLU 356.A O no hydrogen 2.902 N/A SER 366.A N VAL 447.A O no hydrogen 2.664 N/A SER 366.A OG THR 368.A O no hydrogen 3.231 N/A THR 368.A OG1 ASP 367.A OD2 no hydrogen 3.297 N/A THR 370.A N SER 351.A O no hydrogen 2.981 N/A PHE 371.A N GLY 380.A O no hydrogen 3.089 N/A VAL 372.A N TRP 349.A O no hydrogen 3.028 N/A ASN 373.A N ALA 378.A O no hydrogen 2.690 N/A VAL 374.A N VAL 347.A O no hydrogen 3.115 N/A THR 376.A N ASN 373.A OD1 no hydrogen 3.099 N/A GLY 377.A N ASN 373.A O no hydrogen 2.591 N/A GLY 380.A N PHE 371.A O no hydrogen 3.191 N/A SER 382.A N VAL 369.A O no hydrogen 2.930 N/A SER 382.A OG VAL 369.A O no hydrogen 3.138 N/A SER 384.A N VAL 381.A O no hydrogen 2.958 N/A LEU 385.A N VAL 381.A O no hydrogen 3.104 N/A VAL 390.A N TRP 387.A O no hydrogen 2.817 N/A THR 391.A N SER 340.A O no hydrogen 2.854 N/A LEU 392.A N ARG 395.A O no hydrogen 2.806 N/A ASP 393.A N LEU 342.A O no hydrogen 2.617 N/A LEU 397.A N VAL 390.A O no hydrogen 3.285 N/A ILE 400.A N PHE 407.A O no hydrogen 2.976 N/A GLN 402.A N LYS 405.A O no hydrogen 2.971 N/A LYS 405.A N GLN 402.A O no hydrogen 2.813 N/A PHE 407.A N ILE 400.A O no hydrogen 2.871 N/A PHE 408.A N ILE 442.A O no hydrogen 3.142 N/A VAL 409.A N THR 398.A O no hydrogen 2.913 N/A LEU 412.A N ASP 438.A O no hydrogen 3.388 N/A ARG 413.A N VAL 463.A O no hydrogen 2.791 N/A LYS 415.A NZ ASN 431.A O no hydrogen 3.307 N/A LYS 415.A NZ THR 434.A O no hydrogen 2.663 N/A LYS 415.A NZ ALA 436.A O no hydrogen 2.572 N/A LEU 416.A N ASP 438.A OD2 no hydrogen 3.447 N/A TRP 419.A N SER 459.A O no hydrogen 3.046 N/A GLU 420.A N LYS 425.A O no hydrogen 3.169 N/A ALA 421.A N SER 457.A O no hydrogen 3.081 N/A THR 423.A N GLU 420.A O no hydrogen 3.332 N/A LYS 425.A N THR 423.A OG1 no hydrogen 3.138 N/A LYS 425.A NZ GLU 420.A OE1 no hydrogen 3.420 N/A ASP 438.A N GLY 414.A O no hydrogen 3.037 N/A GLN 439.A N ASP 438.A OD1 no hydrogen 3.024 N/A ILE 440.A N LEU 410.A O no hydrogen 3.186 N/A LEU 441.A N CYS 448.A O no hydrogen 3.370 N/A GLU 443.A N ARG 446.A O no hydrogen 2.475 N/A HIS 445.A ND1 GLU 443.A O no hydrogen 2.629 N/A VAL 447.A N SER 366.A O no hydrogen 3.092 N/A CYS 448.A N LEU 441.A O no hydrogen 3.215 N/A ILE 449.A N TYR 364.A O no hydrogen 2.763 N/A THR 451.A N PRO 362.A O no hydrogen 3.130 N/A ASN 455.A N THR 453.A O no hydrogen 2.766 N/A ILE 458.A N LEU 352.A O no hydrogen 3.132 N/A SER 459.A N TRP 419.A O no hydrogen 3.146 N/A ALA 460.A N LEU 350.A O no hydrogen 3.047 N/A VAL 461.A N SER 417.A O no hydrogen 2.886 N/A GLY 462.A N LEU 348.A O no hydrogen 3.196 N/A LEU 464.A N ASP 346.A O no hydrogen 2.821 N/A ALA 465.A N PRO 411.A O no hydrogen 2.706 N/A