Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hw1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N ASP 171.A OD1 no hydrogen 3.450 N/A MET 6.A N PHE 3.A O no hydrogen 3.009 N/A ASP 8.A N SER 164.A OG no hydrogen 2.752 N/A ASN 9.A N MET 6.A O no hydrogen 3.182 N/A ASN 9.A ND2 HIS 93.A O no hydrogen 2.946 N/A ASN 9.A ND2 MET 165.A O no hydrogen 3.007 N/A LEU 10.A N GLY 163.A O no hydrogen 2.644 N/A ARG 11.A N TYR 19.A O no hydrogen 3.197 N/A ARG 11.A NH1 ASP 8.A O no hydrogen 3.139 N/A ARG 11.A NH1 ASP 8.A OD1 no hydrogen 3.208 N/A ARG 11.A NH1 LEU 10.A O no hydrogen 2.967 N/A ARG 11.A NH2 ASP 8.A OD2 no hydrogen 3.377 N/A GLN 16.A N LYS 13.A O no hydrogen 3.379 N/A TYR 18.A OH CYS 159.A O no hydrogen 2.784 N/A TYR 19.A N ARG 11.A O no hydrogen 2.827 N/A VAL 20.A N ILE 33.A O no hydrogen 2.770 N/A MET 22.A N LEU 31.A O no hydrogen 3.135 N/A THR 23.A N SER 90.A O.A no hydrogen 2.946 N/A THR 23.A N SER 90.A O.B no hydrogen 2.795 N/A THR 23.A OG1 SER 90.A O.B no hydrogen 3.513 N/A VAL 24.A N GLN 29.A O no hydrogen 2.980 N/A GLY 25.A N LEU 88.A O no hydrogen 3.042 N/A SER 26.A N SER 61.A OG no hydrogen 3.075 N/A SER 26.A OG THR 63.A OG1 no hydrogen 2.822 N/A GLN 29.A N VAL 24.A O no hydrogen 2.774 N/A GLN 29.A NE2 GLN 57.A O no hydrogen 2.927 N/A LEU 31.A N MET 22.A O no hydrogen 2.927 N/A ASN 32.A N GLU 120.A OE2 no hydrogen 2.625 N/A ILE 33.A N VAL 20.A O no hydrogen 2.778 N/A LEU 34.A N GLY 121.A O no hydrogen 2.885 N/A VAL 35.A N TYR 18.A O no hydrogen 2.799 N/A ASP 36.A N LEU 123.A O no hydrogen 3.237 N/A THR 37.A N SER 220.A OG no hydrogen 3.253 N/A THR 37.A OG1 VAL 218.A O no hydrogen 2.947 N/A GLY 38.A N ASP 36.A OD1 no hydrogen 3.234 N/A SER 39.A OG ASP 36.A OD2 no hydrogen 2.493 N/A SER 40.A OG TYR 127.A O no hydrogen 2.805 N/A ASN 41.A ND2 ARG 132.A O no hydrogen 2.707 N/A ALA 43.A N ILE 122.A O no hydrogen 3.045 N/A VAL 44.A N ALA 104.A O no hydrogen 2.851 N/A GLY 45.A N GLU 120.A O no hydrogen 2.855 N/A ALA 46.A N ILE 106.A O no hydrogen 3.070 N/A TYR 56.A N GLY 45.A O no hydrogen 2.759 N/A TYR 56.A OH ASP 87.A OD2 no hydrogen 2.425 N/A GLN 57.A N GLN 29.A OE1 no hydrogen 2.873 N/A ARG 58.A NH1 GLU 83.A OE1 no hydrogen 3.205 N/A ARG 58.A NH2 GLU 83.A OE1 no hydrogen 3.348 N/A GLN 59.A N GLN 59.A OE1 no hydrogen 2.659 N/A LEU 60.A N GLN 57.A O no hydrogen 2.840 N/A SER 61.A N ARG 58.A O no hydrogen 3.178 N/A SER 61.A OG ASP 87.A OD1 no hydrogen 3.110 N/A SER 61.A OG ASP 87.A OD2 no hydrogen 2.773 N/A SER 62.A N SER 26.A O no hydrogen 3.008 N/A SER 62.A OG SER 26.A O no hydrogen 2.976 N/A THR 63.A N SER 61.A OG no hydrogen 3.309 N/A THR 63.A OG1 SER 26.A OG no hydrogen 2.822 N/A THR 63.A OG1 SER 61.A OG no hydrogen 3.055 N/A THR 63.A OG1 ASP 87.A OD1 no hydrogen 2.524 N/A TYR 64.A N SER 61.A O no hydrogen 3.417 N/A ARG 65.A N THR 86.A O no hydrogen 2.982 N/A LEU 67.A N LEU 84.A O no hydrogen 3.207 N/A ARG 68.A N ASP 66.A OD1 no hydrogen 2.996 N/A LYS 69.A NZ GLY 70.A O no hydrogen 3.286 N/A VAL 71.A N GLY 82.A O no hydrogen 2.707 N/A VAL 73.A N TRP 80.A O no hydrogen 2.750 N/A TYR 75.A N GLY 78.A O no hydrogen 3.110 N/A TYR 75.A OH LYS 111.A O no hydrogen 2.942 N/A LYS 79.A N ASP 110.A O no hydrogen 3.288 N/A LYS 79.A NZ TYR 72.A OH no hydrogen 3.336 N/A TRP 80.A N VAL 73.A O no hydrogen 2.885 N/A GLU 81.A N GLU 108.A O no hydrogen 3.174 N/A GLY 82.A N VAL 71.A O no hydrogen 2.899 N/A GLU 83.A N ALA 105.A O no hydrogen 2.852 N/A LEU 84.A N LYS 69.A O no hydrogen 2.868 N/A GLY 85.A N ILE 103.A O no hydrogen 3.055 N/A THR 86.A N ARG 65.A O no hydrogen 2.825 N/A ASP 87.A N ALA 101.A O no hydrogen 3.307 N/A LEU 88.A N ASP 87.A OD1 no hydrogen 2.828 N/A VAL 89.A N VAL 99.A O no hydrogen 2.633 N/A SER 90.A N.A THR 23.A O no hydrogen 3.003 N/A SER 90.A N.B THR 23.A O no hydrogen 3.007 N/A SER 90.A OG.A VAL 97.A O no hydrogen 3.372 N/A SER 90.A OG.A THR 98.A OG1 no hydrogen 2.689 N/A SER 90.A OG.B THR 23.A OG1 no hydrogen 2.553 N/A THR 98.A OG1 SER 90.A OG.A no hydrogen 2.689 N/A VAL 99.A N VAL 89.A O no hydrogen 2.874 N/A ARG 100.A N GLN 147.A OE1 no hydrogen 3.077 N/A ARG 100.A NH1 THR 63.A O no hydrogen 3.295 N/A ARG 100.A NH1 THR 86.A OG1 no hydrogen 3.269 N/A ARG 100.A NH2 THR 63.A O no hydrogen 3.283 N/A ALA 101.A N ASP 87.A O no hydrogen 3.283 N/A ASN 102.A ND2 GLU 138.A O no hydrogen 2.866 N/A ILE 103.A N GLY 85.A O no hydrogen 2.833 N/A ALA 104.A N PHE 42.A O no hydrogen 3.001 N/A ALA 105.A N GLU 83.A O no hydrogen 3.015 N/A ILE 106.A N VAL 44.A O no hydrogen 2.745 N/A THR 107.A N GLU 81.A O no hydrogen 2.847 N/A THR 107.A OG1 GLU 81.A O no hydrogen 3.564 N/A GLU 108.A N GLU 81.A O no hydrogen 3.214 N/A ASP 110.A N LYS 79.A O no hydrogen 3.198 N/A SER 117.A OG ILE 114.A O no hydrogen 2.850 N/A ASN 118.A ND2 TYR 19.A OH no hydrogen 3.474 N/A TRP 119.A NE1 GLN 16.A O no hydrogen 3.215 N/A GLU 120.A N ASN 32.A O no hydrogen 2.672 N/A ILE 122.A N ALA 43.A O no hydrogen 2.671 N/A LEU 123.A N LEU 34.A O no hydrogen 2.827 N/A GLY 124.A N ASN 41.A O no hydrogen 3.011 N/A LEU 125.A N ASP 36.A O no hydrogen 2.855 N/A ALA 126.A N SER 39.A O no hydrogen 3.095 N/A TYR 127.A N TRP 188.A O no hydrogen 2.984 N/A ILE 130.A N TYR 127.A O no hydrogen 3.148 N/A ALA 131.A N ALA 128.A O no hydrogen 2.743 N/A ARG 132.A N ASN 41.A OD1 no hydrogen 2.848 N/A SER 136.A N ASP 134.A OD2 no hydrogen 2.999 N/A SER 136.A OG ASP 134.A OD2 no hydrogen 2.222 N/A LEU 137.A N ASP 134.A O no hydrogen 2.928 N/A SER 143.A N PRO 139.A O no hydrogen 3.362 N/A SER 143.A OG GLU 138.A OE1 no hydrogen 3.483 N/A LEU 144.A N PHE 140.A O no hydrogen 2.838 N/A VAL 145.A N PHE 141.A O no hydrogen 2.859 N/A LYS 146.A N ASP 142.A O no hydrogen 2.801 N/A LYS 146.A NZ GLU 138.A OE2 no hydrogen 3.225 N/A GLN 147.A N SER 143.A O no hydrogen 2.924 N/A GLN 147.A NE2 ARG 100.A O no hydrogen 2.586 N/A THR 148.A N VAL 145.A O no hydrogen 3.406 N/A THR 148.A OG1 LEU 144.A O no hydrogen 2.896 N/A VAL 150.A N THR 148.A OG1 no hydrogen 3.031 N/A PHE 154.A N PHE 330.A O no hydrogen 3.437 N/A SER 155.A N ILE 166.A O no hydrogen 2.986 N/A SER 155.A OG GLY 169.A O no hydrogen 2.853 N/A SER 155.A OG TYR 327.A OH no hydrogen 2.470 N/A LEU 156.A N VAL 328.A O no hydrogen 3.063 N/A GLN 157.A N SER 164.A O no hydrogen 3.022 N/A GLN 157.A NE2 LEU 174.A O no hydrogen 3.118 N/A CYS 159.A N GLY 162.A O no hydrogen 2.848 N/A GLY 163.A N LEU 10.A O no hydrogen 3.075 N/A SER 164.A N GLN 157.A O no hydrogen 2.771 N/A SER 164.A OG GLN 157.A OE1 no hydrogen 3.441 N/A MET 165.A N ASN 9.A OD1 no hydrogen 2.675 N/A ILE 166.A N SER 155.A O no hydrogen 3.069 N/A GLY 168.A N LEU 153.A O no hydrogen 2.621 N/A ASP 171.A N TYR 327.A OH no hydrogen 2.856 N/A HIS 172.A ND1 HIS 172.A O no hydrogen 2.650 N/A SER 173.A N ASP 171.A OD2 no hydrogen 2.609 N/A SER 173.A OG ASP 171.A OD2 no hydrogen 2.631 N/A LEU 174.A N ASP 171.A O no hydrogen 3.021 N/A TYR 175.A N HIS 172.A O no hydrogen 3.333 N/A THR 176.A N VAL 341.A O no hydrogen 3.343 N/A TRP 180.A N PHE 339.A O no hydrogen 3.042 N/A THR 182.A N ILE 337.A O no hydrogen 2.908 N/A THR 182.A OG1 MET 279.A O no hydrogen 2.552 N/A ILE 184.A N LYS 335.A O no hydrogen 3.020 N/A ARG 185.A N GLU 191.A O no hydrogen 2.683 N/A ARG 185.A NH1 GLU 191.A OE2 no hydrogen 3.313 N/A ARG 185.A NH1 TYR 369.A O no hydrogen 3.381 N/A ARG 186.A NH2 GLU 129.A OE1 no hydrogen 3.567 N/A TRP 188.A N ARG 186.A O no hydrogen 3.210 N/A TRP 188.A N TYR 189.A O no hydrogen 3.196 N/A TRP 188.A NE1 GLU 191.A OE1 no hydrogen 2.935 N/A TYR 190.A OH LEU 125.A O no hydrogen 2.266 N/A VAL 192.A N SER 216.A O no hydrogen 2.779 N/A ILE 194.A N ASN 212.A OD1 no hydrogen 2.796 N/A VAL 195.A N TYR 277.A O no hydrogen 2.995 N/A ARG 196.A NE GLU 198.A OE2 no hydrogen 3.042 N/A ARG 196.A NH2 GLU 198.A OE2 no hydrogen 3.110 N/A GLU 198.A N SER 275.A O no hydrogen 2.958 N/A ILE 199.A N GLN 202.A O no hydrogen 3.055 N/A ASN 200.A N VAL 273.A O no hydrogen 2.716 N/A GLN 202.A N ILE 199.A O no hydrogen 2.839 N/A LEU 204.A N VAL 197.A O no hydrogen 3.156 N/A LYS 209.A NZ ASP 366.A O no hydrogen 2.667 N/A LYS 209.A NZ GLY 368.A O no hydrogen 3.096 N/A GLU 210.A N ASP 207.A O no hydrogen 2.823 N/A TYR 211.A N CYS 208.A O no hydrogen 3.030 N/A ASN 212.A N LYS 209.A O no hydrogen 3.231 N/A ASN 212.A ND2 ILE 194.A O no hydrogen 2.742 N/A ASN 212.A ND2 CYS 208.A O no hydrogen 3.299 N/A ASN 212.A ND2 CYS 367.A O no hydrogen 2.647 N/A LYS 215.A NZ THR 314.A O no hydrogen 2.970 N/A SER 216.A OG ASN 212.A OD1 no hydrogen 2.682 N/A ILE 217.A N THR 316.A O no hydrogen 2.821 N/A VAL 218.A N TYR 190.A O no hydrogen 3.266 N/A ASP 219.A N MET 318.A O no hydrogen 3.214 N/A SER 220.A N THR 37.A OG1 no hydrogen 3.028 N/A SER 220.A OG VAL 35.A O no hydrogen 2.698 N/A GLY 221.A N ASP 219.A OD1 no hydrogen 2.771 N/A THR 222.A N ASP 219.A O no hydrogen 3.195 N/A THR 222.A OG1 ASP 219.A OD2 no hydrogen 2.692 N/A ASN 224.A ND2 SER 310.A OG no hydrogen 3.203 N/A LEU 225.A N ALA 308.A O no hydrogen 3.073 N/A ARG 226.A N VAL 317.A O no hydrogen 2.979 N/A LEU 227.A N SER 310.A O no hydrogen 3.058 N/A LYS 229.A N SER 312.A O no hydrogen 3.190 N/A LYS 229.A NZ GLU 233.A OE2 no hydrogen 2.901 N/A PHE 232.A N PRO 228.A O no hydrogen 2.797 N/A GLU 233.A N LYS 229.A O no hydrogen 3.008 N/A ALA 234.A N LYS 230.A O no hydrogen 3.500 N/A ALA 235.A N VAL 231.A O no hydrogen 2.965 N/A VAL 236.A N PHE 232.A O no hydrogen 2.876 N/A LYS 237.A N GLU 233.A O no hydrogen 2.932 N/A SER 238.A N ALA 234.A O no hydrogen 2.990 N/A ILE 239.A N ALA 235.A O no hydrogen 2.844 N/A LYS 240.A N VAL 236.A O no hydrogen 2.738 N/A ALA 241.A N LYS 237.A O no hydrogen 3.150 N/A ALA 242.A N SER 238.A O no hydrogen 3.088 N/A SER 243.A N ILE 239.A O no hydrogen 3.057 N/A SER 243.A N LYS 240.A O no hydrogen 3.158 N/A SER 243.A OG ILE 239.A O no hydrogen 2.926 N/A SER 243.A OG LYS 240.A O no hydrogen 3.438 N/A SER 244.A OG ALA 241.A O no hydrogen 2.869 N/A LYS 247.A NZ LYS 240.A O no hydrogen 3.232 N/A PHE 252.A N PRO 249.A O no hydrogen 2.778 N/A LEU 254.A N ASP 250.A O no hydrogen 3.218 N/A GLY 255.A N PHE 252.A O no hydrogen 3.037 N/A GLU 256.A N GLY 251.A O no hydrogen 3.183 N/A GLN 257.A N GLY 251.A O no hydrogen 3.175 N/A VAL 259.A N TYR 305.A O no hydrogen 2.937 N/A TRP 261.A N ASP 303.A O no hydrogen 3.075 N/A TRP 261.A NE1 GLU 246.A OE1 no hydrogen 3.109 N/A GLY 264.A N ASP 303.A OD2 no hydrogen 2.830 N/A THR 265.A N GLN 262.A O no hydrogen 2.988 N/A THR 265.A OG1 GLN 262.A O no hydrogen 2.674 N/A TRP 268.A N THR 266.A O no hydrogen 2.926 N/A ILE 270.A N PRO 267.A O no hydrogen 3.172 N/A PHE 271.A N TRP 268.A O no hydrogen 2.917 N/A VAL 273.A N ASN 200.A OD1 no hydrogen 3.035 N/A ILE 274.A N ILE 291.A O no hydrogen 3.001 N/A SER 275.A N GLU 198.A O no hydrogen 2.825 N/A SER 275.A OG THR 290.A OG1 no hydrogen 2.899 N/A LEU 276.A N ILE 289.A O no hydrogen 2.762 N/A TYR 277.A N ARG 196.A O no hydrogen 2.954 N/A TYR 277.A OH GLU 198.A OE2 no hydrogen 2.435 N/A LEU 278.A N PHE 287.A O no hydrogen 2.836 N/A MET 279.A N ILE 193.A O no hydrogen 2.918 N/A GLY 280.A N GLN 285.A O no hydrogen 2.871 N/A GLN 285.A N VAL 282.A O no hydrogen 3.317 N/A SER 286.A N PHE 359.A O no hydrogen 2.854 N/A SER 286.A OG PHE 359.A O no hydrogen 3.495 N/A SER 286.A OG THR 361.A OG1 no hydrogen 2.590 N/A PHE 287.A N LEU 278.A O no hydrogen 3.345 N/A ARG 288.A N GLU 356.A O no hydrogen 2.813 N/A ARG 288.A NE GLU 356.A OE2 no hydrogen 3.302 N/A ARG 288.A NH1 TYR 277.A OH no hydrogen 3.164 N/A ARG 288.A NH2 GLU 356.A OE2 no hydrogen 3.025 N/A ILE 289.A N LEU 276.A O no hydrogen 2.818 N/A THR 290.A N ALA 354.A O no hydrogen 3.034 N/A THR 290.A OG1 SER 275.A OG no hydrogen 2.899 N/A ILE 291.A N ILE 274.A O no hydrogen 2.836 N/A LEU 292.A N GLN 295.A OE1 no hydrogen 3.479 N/A GLN 294.A N GLN 294.A OE1 no hydrogen 2.632 N/A GLN 294.A NE2 ASP 348.A OD2 no hydrogen 2.479 N/A GLN 295.A N LEU 292.A O no hydrogen 2.902 N/A GLN 295.A NE2 VAL 346.A O no hydrogen 2.970 N/A TYR 296.A N LEU 292.A O no hydrogen 3.312 N/A TYR 296.A OH PRO 272.A O no hydrogen 2.471 N/A LEU 297.A N PRO 293.A O no hydrogen 2.633 N/A ARG 298.A N LYS 306.A O no hydrogen 2.874 N/A ARG 298.A NH1 SER 14.A OG no hydrogen 3.373 N/A VAL 300.A N CYS 304.A O no hydrogen 3.099 N/A ASP 303.A N TRP 261.A O no hydrogen 2.854 N/A TYR 305.A N VAL 259.A O no hydrogen 2.781 N/A LYS 306.A N ARG 298.A O no hydrogen 2.900 N/A ALA 308.A N TYR 296.A O no hydrogen 2.962 N/A SER 310.A N LEU 225.A O no hydrogen 3.115 N/A SER 312.A OG GLY 315.A O no hydrogen 2.757 N/A THR 314.A N SER 312.A OG no hydrogen 3.338 N/A THR 314.A OG1 SER 312.A OG no hydrogen 3.425 N/A THR 316.A N LYS 215.A O no hydrogen 2.739 N/A THR 316.A OG1 TYR 211.A O no hydrogen 2.569 N/A VAL 317.A N ARG 226.A O no hydrogen 2.974 N/A MET 318.A N ILE 217.A O no hydrogen 2.666 N/A ALA 320.A N THR 222.A O no hydrogen 2.799 N/A VAL 321.A N THR 223.A O no hydrogen 2.921 N/A ILE 322.A N GLY 319.A O no hydrogen 3.069 N/A MET 323.A N GLY 319.A O no hydrogen 2.935 N/A GLU 324.A N ALA 320.A O no hydrogen 2.808 N/A GLY 325.A N ILE 322.A O no hydrogen 3.186 N/A PHE 326.A N MET 323.A O no hydrogen 3.275 N/A TYR 327.A N ALA 340.A O no hydrogen 2.724 N/A VAL 328.A N LEU 156.A O no hydrogen 3.218 N/A VAL 329.A N GLY 338.A O no hydrogen 2.501 N/A PHE 330.A N PHE 154.A O no hydrogen 2.612 N/A ASP 331.A N ARG 336.A O no hydrogen 2.837 N/A ARG 332.A N PHE 330.A O no hydrogen 2.944 N/A ARG 332.A NE ASN 152.A OD1 no hydrogen 2.980 N/A ARG 332.A NH1 TYR 190.A OH no hydrogen 2.936 N/A ARG 332.A NH2 ASP 142.A OD2 no hydrogen 3.033 N/A ALA 333.A N ASN 152.A O no hydrogen 3.088 N/A ARG 334.A N ASP 331.A O no hydrogen 3.240 N/A ARG 334.A N ASP 331.A OD1 no hydrogen 3.412 N/A LYS 335.A N ARG 332.A O no hydrogen 3.334 N/A ARG 336.A N ASP 331.A O no hydrogen 3.087 N/A ARG 336.A NE ASP 331.A OD2 no hydrogen 2.858 N/A ARG 336.A NH1 GLU 281.A OE1 no hydrogen 3.193 N/A ARG 336.A NH2 ASP 331.A OD2 no hydrogen 3.436 N/A ILE 337.A N THR 182.A O no hydrogen 2.873 N/A GLY 338.A N VAL 329.A O no hydrogen 2.649 N/A PHE 339.A N TRP 180.A O no hydrogen 2.792 N/A ALA 340.A N TYR 327.A O no hydrogen 2.912 N/A SER 342.A N GLY 325.A O no hydrogen 2.912 N/A ALA 343.A N LEU 174.A O no hydrogen 3.078 N/A CYS 344.A N SER 342.A OG no hydrogen 3.144 N/A CYS 344.A SG SER 342.A OG no hydrogen 3.441 N/A HIS 345.A N SER 342.A O no hydrogen 3.369 N/A HIS 345.A ND1 SER 342.A O no hydrogen 2.531 N/A HIS 347.A ND1 HIS 345.A O no hydrogen 2.989 N/A PHE 350.A N ASP 348.A OD1 no hydrogen 3.086 N/A ARG 351.A NH1 PHE 271.A O no hydrogen 3.274 N/A ARG 351.A NH2 TRP 268.A O no hydrogen 3.036 N/A ARG 351.A NH2 PHE 271.A O no hydrogen 3.149 N/A THR 352.A OG1 HIS 345.A NE2 no hydrogen 3.182 N/A THR 352.A OG1 ALA 353.A O no hydrogen 2.926 N/A ALA 353.A N HIS 345.A NE2 no hydrogen 3.128 N/A ALA 354.A N THR 290.A O no hydrogen 3.127 N/A GLU 356.A N ARG 288.A O no hydrogen 3.079 N/A PHE 359.A N SER 286.A O no hydrogen 2.776 N/A THR 361.A N ASN 284.A O no hydrogen 2.939 N/A THR 361.A OG1 SER 286.A OG no hydrogen 2.590 N/A THR 361.A OG1 PHE 359.A O no hydrogen 3.507 N/A ASP 366.A N ASP 363.A O no hydrogen 3.007 N/A CYS 367.A N MET 364.A O no hydrogen 2.888 N/A