Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7w3k_a.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A N PRO 2.A O no hydrogen 2.938 N/A GLN 7.A N GLY 3.A O no hydrogen 2.901 N/A SER 8.A N PHE 4.A O no hydrogen 2.902 N/A SER 8.A OG PHE 4.A O no hydrogen 2.639 N/A SER 8.A OG LEU 5.A O no hydrogen 3.233 N/A GLN 9.A N LEU 5.A O no hydrogen 2.897 N/A GLN 15.A N GLN 15.A OE1 no hydrogen 2.821 N/A TRP 19.A N GLN 15.A O no hydrogen 2.885 N/A HIS 20.A N PRO 16.A O no hydrogen 2.931 N/A LEU 22.A N VAL 18.A O no hydrogen 2.895 N/A GLU 23.A N TRP 19.A O no hydrogen 2.930 N/A GLU 24.A N HIS 20.A O no hydrogen 2.930 N/A LEU 25.A N ARG 21.A O no hydrogen 2.914 N/A TYR 26.A N LEU 22.A O no hydrogen 2.975 N/A THR 27.A N GLU 23.A O no hydrogen 2.934 N/A THR 27.A OG1 GLU 23.A O no hydrogen 3.411 N/A THR 27.A OG1 GLU 24.A O no hydrogen 2.538 N/A LYS 28.A NZ GLU 24.A O no hydrogen 2.831 N/A GLN 33.A N GLN 33.A OE1 no hydrogen 2.741 N/A THR 35.A N TRP 31.A O no hydrogen 2.913 N/A THR 35.A OG1 TRP 31.A O no hydrogen 2.343 N/A LEU 36.A N HIS 32.A O no hydrogen 2.941 N/A GLN 37.A N GLN 33.A O no hydrogen 2.912 N/A VAL 38.A N LEU 34.A O no hydrogen 2.887 N/A LEU 39.A N THR 35.A O no hydrogen 2.911 N/A ASP 40.A N LEU 36.A O no hydrogen 2.924 N/A PHE 41.A N GLN 37.A O no hydrogen 2.863 N/A VAL 42.A N VAL 38.A O no hydrogen 2.920 N/A CYS 46.A N ASP 44.A O no hydrogen 2.588 N/A CYS 46.A SG ASP 44.A OD2 no hydrogen 3.262 N/A CYS 46.A SG PRO 45.A O no hydrogen 3.290 N/A ASP 51.A N GLN 49.A O no hydrogen 2.815 N/A ILE 54.A N GLY 50.A O no hydrogen 3.194 N/A LYS 55.A N ASP 51.A O no hydrogen 2.900 N/A LEU 56.A N GLY 52.A O no hydrogen 2.928 N/A TYR 57.A N LEU 53.A O no hydrogen 2.937 N/A GLU 58.A N ILE 54.A O no hydrogen 2.911 N/A ASN 59.A N LYS 55.A O no hydrogen 2.878 N/A PHE 60.A N LEU 56.A O no hydrogen 2.914 N/A ILE 61.A N TYR 57.A O no hydrogen 2.868 N/A SER 62.A N GLU 58.A O no hydrogen 2.890 N/A GLU 63.A N ASN 59.A O no hydrogen 2.883 N/A PHE 64.A N PHE 60.A O no hydrogen 2.942 N/A GLU 65.A N ILE 61.A O no hydrogen 2.922 N/A LEU 71.A N ASN 69.A OD1 no hydrogen 3.455 N/A SER 72.A OG ASN 69.A O no hydrogen 2.493 N/A LEU 73.A N ASN 69.A O no hydrogen 3.040 N/A VAL 74.A N PRO 70.A O no hydrogen 2.924 N/A GLU 75.A N LEU 71.A O no hydrogen 2.916 N/A ILE 76.A N SER 72.A O no hydrogen 2.864 N/A ILE 76.A N LEU 73.A O no hydrogen 3.239 N/A ILE 77.A N LEU 73.A O no hydrogen 2.960 N/A VAL 81.A N ILE 77.A O no hydrogen 2.915 N/A ARG 82.A N LEU 78.A O no hydrogen 2.907 N/A ARG 82.A NH1 LEU 78.A O no hydrogen 3.319 N/A GLN 83.A N HIS 79.A O no hydrogen 2.905 N/A GLN 83.A N VAL 80.A O no hydrogen 3.208 N/A MET 84.A N VAL 80.A O no hydrogen 2.887 N/A THR 85.A OG1 ARG 82.A O no hydrogen 2.903 N/A ALA 90.A N ASP 86.A O no hydrogen 2.895 N/A LEU 91.A N PRO 87.A O no hydrogen 2.922 N/A THR 92.A OG1 VAL 89.A O no hydrogen 2.528 N/A PHE 93.A N VAL 89.A O no hydrogen 2.881 N/A LEU 94.A N ALA 90.A O no hydrogen 2.840 N/A GLU 95.A N LEU 91.A O no hydrogen 2.931 N/A LYS 96.A N THR 92.A O no hydrogen 2.875 N/A LYS 96.A NZ ASN 59.A OD1 no hydrogen 3.235 N/A THR 97.A N PHE 93.A O no hydrogen 2.878 N/A THR 97.A OG1 PHE 93.A O no hydrogen 2.889 N/A THR 97.A OG1 LEU 94.A O no hydrogen 2.743 N/A ARG 98.A N LEU 94.A O no hydrogen 2.920 N/A GLU 99.A N GLU 95.A O no hydrogen 2.905 N/A LYS 100.A N LYS 96.A O no hydrogen 2.902 N/A VAL 101.A N THR 97.A O no hydrogen 3.024 N/A LYS 102.A NZ GLU 99.A O no hydrogen 3.333 N/A SER 103.A OG ASP 105.A OD1 no hydrogen 3.097 N/A SER 103.A OG ASP 105.A OD2 no hydrogen 2.882 N/A LEU 110.A N GLU 106.A O no hydrogen 3.311 N/A CYS 111.A N ALA 107.A O no hydrogen 2.896 N/A LYS 112.A N VAL 108.A O no hydrogen 2.868 N/A THR 113.A N ILE 109.A O no hydrogen 2.934 N/A THR 113.A OG1 LEU 110.A O no hydrogen 2.436 N/A ALA 114.A N LEU 110.A O no hydrogen 2.930 N/A ILE 115.A N CYS 111.A O no hydrogen 2.894 N/A GLY 116.A N LYS 112.A O no hydrogen 2.868 N/A ALA 117.A N THR 113.A O no hydrogen 2.883 N/A LEU 118.A N ALA 114.A O no hydrogen 2.913 N/A LYS 119.A N ILE 115.A O no hydrogen 2.913 N/A LEU 120.A N GLY 116.A O no hydrogen 2.852 N/A ASN 121.A N LEU 118.A O no hydrogen 3.257 N/A GLN 126.A N GLN 126.A OE1 no hydrogen 2.798 N/A THR 128.A OG1 ASP 124.A O no hydrogen 2.785 N/A LYS 129.A NZ LEU 125.A O no hydrogen 3.403 N/A THR 131.A N VAL 127.A O no hydrogen 3.144 N/A ILE 132.A N THR 128.A O no hydrogen 2.911 N/A GLU 133.A N LYS 129.A O no hydrogen 2.916 N/A GLU 136.A N GLU 136.A OE1 no hydrogen 2.611 N/A GLU 137.A N GLU 137.A OE1 no hydrogen 2.669 N/A LEU 139.A N GLU 136.A O no hydrogen 3.236 N/A THR 146.A N HIS 149.A ND1 no hydrogen 3.074 N/A HIS 149.A NE2 LEU 142.A O no hydrogen 2.913 N/A SER 150.A N THR 146.A O no hydrogen 3.137 N/A ARG 151.A N SER 147.A O no hydrogen 2.930 N/A PHE 152.A N VAL 148.A O no hydrogen 2.893 N/A TYR 153.A N HIS 149.A O no hydrogen 2.889 N/A ASP 154.A N SER 150.A O no hydrogen 2.893 N/A LEU 155.A N ARG 151.A O no hydrogen 2.897 N/A SER 156.A N PHE 152.A O no hydrogen 2.905 N/A SER 156.A OG PHE 152.A O no hydrogen 2.819 N/A SER 156.A OG TYR 153.A O no hydrogen 3.127 N/A SER 156.A OG ASP 172.A OD2 no hydrogen 2.471 N/A SER 157.A N TYR 153.A O no hydrogen 2.852 N/A SER 157.A OG ASP 154.A O no hydrogen 2.617 N/A LYS 158.A N ASP 154.A O no hydrogen 2.933 N/A TYR 159.A N SER 156.A O no hydrogen 3.288 N/A TYR 160.A N SER 157.A O no hydrogen 3.215 N/A THR 162.A N TYR 160.A O no hydrogen 2.654 N/A THR 162.A OG1 TYR 159.A O no hydrogen 2.781 N/A ASN 165.A ND2 SER 156.A O no hydrogen 3.145 N/A HIS 166.A N GLY 164.A O no hydrogen 2.879 N/A SER 168.A OG ASN 165.A OD1 no hydrogen 2.305 N/A TYR 169.A OH THR 196.A OG1 no hydrogen 3.127 N/A TYR 170.A N HIS 166.A O no hydrogen 3.004 N/A LYS 171.A N ALA 167.A O no hydrogen 2.915 N/A ASP 172.A N SER 168.A O no hydrogen 2.901 N/A ALA 173.A N TYR 169.A O no hydrogen 2.841 N/A LEU 174.A N TYR 170.A O no hydrogen 2.939 N/A ARG 175.A N LYS 171.A O no hydrogen 2.895 N/A PHE 176.A N ASP 172.A O no hydrogen 2.885 N/A LEU 177.A N ALA 173.A O no hydrogen 2.882 N/A GLY 178.A N LEU 174.A O no hydrogen 2.892 N/A CYS 179.A N ARG 175.A O no hydrogen 2.886 N/A CYS 179.A SG PHE 176.A O no hydrogen 3.226 N/A VAL 180.A N PHE 176.A O no hydrogen 3.465 N/A GLU 189.A N PRO 186.A O no hydrogen 3.109 N/A GLN 190.A N PRO 186.A O no hydrogen 3.308 N/A GLN 190.A NE2 LYS 183.A O no hydrogen 3.421 N/A GLN 191.A N VAL 187.A O no hydrogen 2.926 N/A ARG 193.A N GLU 189.A O no hydrogen 2.948 N/A ARG 193.A NH1 ASP 154.A OD1 no hydrogen 3.527 N/A ALA 194.A N GLN 190.A O no hydrogen 2.880 N/A PHE 195.A N GLN 191.A O no hydrogen 2.862 N/A THR 196.A N GLU 192.A O no hydrogen 2.913 N/A THR 196.A OG1 TYR 169.A OH no hydrogen 3.127 N/A LEU 197.A N ARG 193.A O no hydrogen 2.903 N/A GLY 198.A N ALA 194.A O no hydrogen 2.906 N/A LEU 199.A N PHE 195.A O no hydrogen 2.893 N/A ALA 200.A N THR 196.A O no hydrogen 2.879 N/A GLY 201.A N LEU 197.A O no hydrogen 2.901 N/A LEU 202.A N GLY 198.A O no hydrogen 2.900 N/A LEU 203.A N LEU 199.A O no hydrogen 2.864 N/A GLY 204.A N ALA 200.A O no hydrogen 2.716 N/A PHE 210.A N ASN 209.A OD1 no hydrogen 2.480 N/A HIS 216.A N LEU 213.A O no hydrogen 3.318 N/A LEU 219.A N HIS 216.A O no hydrogen 3.407 N/A SER 221.A OG PRO 217.A O no hydrogen 3.361 N/A ARG 223.A NE GLN 191.A O no hydrogen 2.982 N/A ARG 227.A N ASP 226.A OD1 no hydrogen 2.719 N/A GLN 228.A NE2 THR 225.A O no hydrogen 2.476 N/A LEU 230.A N ARG 227.A O no hydrogen 3.352 N/A ASP 232.A N GLN 228.A O no hydrogen 2.886 N/A THR 233.A N TRP 229.A O no hydrogen 2.906 N/A LEU 234.A N LEU 230.A O no hydrogen 2.903 N/A TYR 235.A N ILE 231.A O no hydrogen 2.895 N/A ALA 236.A N ASP 232.A O no hydrogen 2.896 N/A PHE 237.A N THR 233.A O no hydrogen 2.891 N/A ASN 238.A N LEU 234.A O no hydrogen 2.878 N/A SER 239.A N TYR 235.A O no hydrogen 2.715 N/A SER 239.A OG ASN 241.A OD1 no hydrogen 3.292 N/A GLY 240.A N ALA 236.A O no hydrogen 2.715 N/A ARG 244.A NE ARG 244.A O no hydrogen 2.839 N/A THR 247.A N GLU 243.A O no hydrogen 2.967 N/A LEU 248.A N ARG 244.A O no hydrogen 2.887 N/A LYS 249.A N PHE 245.A O no hydrogen 2.898 N/A THR 250.A N GLN 246.A O no hydrogen 2.915 N/A ALA 251.A N LEU 248.A O no hydrogen 3.184 N/A GLY 253.A N THR 250.A O no hydrogen 3.087 N/A GLU 262.A N ALA 259.A O no hydrogen 3.282 N/A LEU 265.A N ASN 261.A O no hydrogen 2.725 N/A LEU 266.A N GLU 262.A O no hydrogen 2.874 N/A ARG 267.A N ALA 263.A O no hydrogen 2.940 N/A LYS 268.A N GLN 264.A O no hydrogen 2.883 N/A LYS 268.A NZ VAL 207.A O no hydrogen 2.426 N/A ILE 269.A N LEU 265.A O no hydrogen 2.911 N/A GLN 270.A N LEU 266.A O no hydrogen 2.887 N/A LEU 271.A N ARG 267.A O no hydrogen 2.934 N/A LEU 272.A N LYS 268.A O no hydrogen 2.898 N/A CYS 273.A N ILE 269.A O no hydrogen 2.889 N/A CYS 273.A SG GLN 270.A O no hydrogen 3.253 N/A LEU 274.A N LEU 271.A O no hydrogen 3.449 N/A GLU 276.A N CYS 273.A O no hydrogen 3.365 N/A PHE 279.A N MET 275.A O no hydrogen 2.908 N/A THR 280.A N GLU 276.A O no hydrogen 2.933 N/A THR 280.A OG1 GLU 276.A O no hydrogen 2.873 N/A ARG 281.A NH1 HIS 285.A ND1 no hydrogen 3.045 N/A GLU 292.A N THR 289.A O no hydrogen 2.961 N/A ILE 293.A N THR 289.A O no hydrogen 3.462 N/A ALA 294.A N PHE 290.A O no hydrogen 2.915 N/A LYS 295.A N GLU 291.A O no hydrogen 2.853 N/A SER 296.A N GLU 292.A O no hydrogen 2.921 N/A SER 296.A OG GLU 292.A O no hydrogen 2.350 N/A SER 296.A OG GLU 292.A OE2 no hydrogen 3.142 N/A ALA 297.A N ILE 293.A O no hydrogen 2.753 N/A ILE 299.A N ALA 294.A O no hydrogen 3.213 N/A VAL 304.A N VAL 301.A O no hydrogen 3.430 N/A GLU 305.A N GLU 305.A OE1 no hydrogen 2.990 N/A LEU 307.A N GLU 303.A O no hydrogen 2.882 N/A VAL 308.A N VAL 304.A O no hydrogen 2.934 N/A MET 309.A N GLU 305.A O no hydrogen 2.961 N/A LYS 310.A N LEU 306.A O no hydrogen 2.896 N/A ALA 311.A N LEU 307.A O no hydrogen 2.896 N/A LEU 312.A N VAL 308.A O no hydrogen 2.908 N/A SER 313.A N MET 309.A O no hydrogen 2.892 N/A SER 313.A OG LYS 310.A O no hydrogen 2.402 N/A VAL 314.A N LYS 310.A O no hydrogen 2.904 N/A GLY 315.A N ALA 311.A O no hydrogen 3.112 N/A LYS 318.A N THR 331.A O no hydrogen 3.275 N/A ASP 322.A N ARG 327.A O no hydrogen 2.771 N/A GLU 323.A N ASP 322.A OD1 no hydrogen 2.518 N/A VAL 324.A N ASP 322.A OD1 no hydrogen 2.979 N/A HIS 329.A N SER 320.A O no hydrogen 2.711 N/A THR 331.A OG1 THR 331.A O no hydrogen 2.613 N/A VAL 333.A N LEU 316.A O no hydrogen 3.135 N/A GLN 342.A N ASP 339.A O no hydrogen 2.571 N/A LYS 344.A NZ GLN 341.A O no hydrogen 2.904 N/A LYS 347.A N ILE 343.A O no hydrogen 2.911 N/A ASP 348.A N LYS 344.A O no hydrogen 2.923 N/A ARG 349.A N GLY 345.A O no hydrogen 2.930 N/A LEU 350.A N MET 346.A O no hydrogen 2.887 N/A GLU 351.A N LYS 347.A O no hydrogen 2.908 N/A PHE 352.A N ASP 348.A O no hydrogen 2.930 N/A TRP 353.A N ARG 349.A O no hydrogen 2.887 N/A CYS 354.A N LEU 350.A O no hydrogen 2.870 N/A THR 355.A N GLU 351.A O no hydrogen 2.942 N/A ASP 356.A N TRP 353.A O no hydrogen 3.355 N/A VAL 357.A N TRP 353.A O no hydrogen 2.929 N/A LYS 358.A N CYS 354.A O no hydrogen 2.903 N/A SER 359.A OG ASP 356.A O no hydrogen 2.644 N/A MET 360.A N ASP 356.A O no hydrogen 2.952 N/A GLU 361.A N VAL 357.A O no hydrogen 2.918 N/A MET 362.A N LYS 358.A O no hydrogen 2.941 N/A LEU 363.A N SER 359.A O no hydrogen 2.916 N/A VAL 364.A N MET 360.A O no hydrogen 2.943 N/A GLU 365.A N GLU 361.A O no hydrogen 2.888 N/A HIS 366.A N MET 362.A O no hydrogen 2.897 N/A GLN 367.A N LEU 363.A O no hydrogen 2.941 N/A ALA 368.A N VAL 364.A O no hydrogen 2.887 N/A ILE 371.A N ALA 368.A O no hydrogen 3.149 N/A LEU 372.A N ALA 368.A O no hydrogen 2.925 N/A THR 373.A OG1 HIS 369.A O no hydrogen 2.327 N/A