Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qub_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A N TYR 22.A O no hydrogen 2.972 N/A CYS 4.A SG PRO 48.A O no hydrogen 3.988 N/A SER 13.A N LEU 10.A O no hydrogen 3.300 N/A SER 13.A OG LEU 10.A O no hydrogen 2.611 N/A THR 14.A N SER 31.A O no hydrogen 2.972 N/A VAL 16.A N THR 29.A O no hydrogen 3.022 N/A LYS 19.A N TYR 22.A OH no hydrogen 2.891 N/A LYS 19.A NZ GLU 26.A OE1 no hydrogen 2.762 N/A TYR 22.A N CYS 4.A O no hydrogen 2.883 N/A TYR 22.A OH PRO 17.A O no hydrogen 2.709 N/A GLU 23.A N GLU 26.A OE2 no hydrogen 2.655 N/A GLY 25.A N CYS 47.A O no hydrogen 2.800 N/A GLU 26.A N GLU 23.A O no hydrogen 3.018 N/A ILE 28.A N PHE 45.A O no hydrogen 2.993 N/A THR 29.A N VAL 16.A O no hydrogen 2.830 N/A TYR 30.A N ARG 43.A O no hydrogen 2.892 N/A TYR 30.A OH ASP 8.A O no hydrogen 2.609 N/A SER 31.A N THR 14.A O no hydrogen 3.041 N/A LYS 33.A N PHE 12.A O no hydrogen 2.647 N/A TYR 36.A N LYS 33.A O no hydrogen 2.975 N/A VAL 37.A N THR 61.A O no hydrogen 2.549 N/A SER 38.A OG ARG 39.A O no hydrogen 3.465 N/A SER 38.A OG LYS 59.A O no hydrogen 2.478 N/A GLY 41.A N SER 38.A O no hydrogen 3.315 N/A ARG 43.A N TYR 30.A O no hydrogen 3.244 N/A ARG 43.A NE THR 57.A OG1 no hydrogen 2.799 N/A ARG 43.A NH1 ARG 39.A O no hydrogen 3.398 N/A ARG 43.A NH2 ARG 39.A O no hydrogen 2.881 N/A ARG 43.A NH2 THR 57.A OG1 no hydrogen 3.335 N/A PHE 45.A N ILE 28.A O no hydrogen 3.046 N/A CYS 47.A N GLU 26.A O no hydrogen 2.855 N/A CYS 47.A SG TYR 22.A O no hydrogen 3.687 N/A CYS 47.A SG PRO 48.A O no hydrogen 3.624 N/A GLY 51.A N PRO 48.A O no hydrogen 2.955 N/A LEU 52.A N THR 50.A OG1 no hydrogen 3.234 N/A TRP 53.A NE1 PRO 5.A O no hydrogen 2.742 N/A LEU 58.A N ASN 56.A OD1 no hydrogen 3.240 N/A LYS 59.A N SER 38.A OG no hydrogen 2.963 N/A CYS 60.A SG PHE 12.A O no hydrogen 3.967 N/A THR 61.A N VAL 37.A O no hydrogen 2.705 N/A THR 61.A OG1 VAL 37.A O no hydrogen 3.546 N/A ARG 63.A N GLY 35.A O no hydrogen 2.929 N/A CYS 65.A N PHE 81.A O no hydrogen 2.722 N/A CYS 65.A SG LYS 110.A O no hydrogen 3.637 N/A GLY 74.A N LEU 71.A O no hydrogen 2.856 N/A ALA 75.A N SER 90.A O no hydrogen 2.885 N/A ARG 77.A N SER 88.A O no hydrogen 2.787 N/A THR 80.A OG1 GLU 82.A OE1 no hydrogen 3.176 N/A TYR 83.A N ARG 63.A O no hydrogen 2.943 N/A ASN 85.A N GLU 82.A O no hydrogen 2.674 N/A ASN 85.A ND2 THR 80.A O no hydrogen 3.411 N/A ILE 87.A N ALA 103.A O no hydrogen 2.765 N/A SER 88.A N ARG 77.A O no hydrogen 3.104 N/A PHE 89.A N ASP 101.A O no hydrogen 3.029 N/A SER 90.A N ALA 75.A O no hydrogen 3.076 N/A ASN 92.A N ASN 73.A O no hydrogen 2.672 N/A PHE 95.A N ASN 92.A O no hydrogen 2.976 N/A TYR 96.A N ALA 119.A O no hydrogen 2.722 N/A ASN 98.A N VAL 117.A O no hydrogen 2.787 N/A ALA 103.A N ILE 87.A O no hydrogen 2.893 N/A LYS 104.A N SER 112.A O no hydrogen 2.834 N/A CYS 105.A N ASN 85.A O no hydrogen 2.812 N/A THR 106.A N LYS 110.A O no hydrogen 3.111 N/A THR 106.A OG1 LYS 110.A O no hydrogen 3.189 N/A GLU 108.A N THR 106.A OG1 no hydrogen 3.214 N/A GLY 109.A N THR 106.A O no hydrogen 2.592 N/A LYS 110.A N THR 106.A OG1 no hydrogen 3.329 N/A TRP 111.A NE1 PRO 66.A O no hydrogen 2.882 N/A SER 112.A N LYS 104.A O no hydrogen 2.889 N/A VAL 117.A N ASN 98.A O no hydrogen 3.251 N/A ALA 119.A N TYR 96.A O no hydrogen 2.912 N/A ILE 121.A N GLY 94.A O no hydrogen 2.788 N/A CYS 123.A N SER 145.A O no hydrogen 2.912 N/A CYS 123.A SG THR 170.A O no hydrogen 3.788 N/A CYS 123.A SG ASN 174.A O no hydrogen 3.692 N/A ALA 132.A N PRO 129.A O no hydrogen 3.201 N/A THR 133.A N GLU 154.A O no hydrogen 2.979 N/A THR 133.A OG1 GLU 154.A O no hydrogen 3.284 N/A ARG 135.A N VAL 152.A O no hydrogen 2.900 N/A ARG 135.A NE GLU 154.A OE1 no hydrogen 2.856 N/A TYR 137.A OH SER 145.A OG no hydrogen 3.423 N/A SER 140.A N ASN 144.A O no hydrogen 3.069 N/A SER 140.A OG ASP 149.A OD2 no hydrogen 2.602 N/A ASN 144.A N ALA 141.A O no hydrogen 2.868 N/A SER 145.A N CYS 123.A O no hydrogen 2.848 N/A SER 145.A OG TYR 137.A OH no hydrogen 3.423 N/A LEU 146.A N ASP 149.A OD2 no hydrogen 3.112 N/A ARG 148.A N CYS 169.A O no hydrogen 2.835 N/A ASP 149.A N LEU 146.A O no hydrogen 3.233 N/A ALA 151.A N ILE 167.A O no hydrogen 3.025 N/A VAL 152.A N VAL 136.A O no hydrogen 2.768 N/A PHE 153.A N ASP 165.A O no hydrogen 2.742 N/A GLU 154.A N THR 133.A O no hydrogen 3.110 N/A LEU 156.A N PHE 131.A O no hydrogen 3.128 N/A GLN 158.A NE2 GLU 183.A OE2 no hydrogen 3.422 N/A HIS 159.A N LEU 156.A O no hydrogen 2.862 N/A HIS 159.A ND1 LEU 156.A O no hydrogen 3.203 N/A ALA 160.A N ARG 182.A O no hydrogen 2.807 N/A PHE 162.A N GLU 180.A O no hydrogen 2.847 N/A THR 166.A N ASN 164.A OD1 no hydrogen 2.370 N/A ILE 167.A N ALA 151.A O no hydrogen 2.998 N/A THR 168.A N THR 176.A OG1 no hydrogen 2.923 N/A CYS 169.A N ASP 149.A O no hydrogen 3.043 N/A CYS 169.A SG SER 145.A O no hydrogen 4.047 N/A CYS 169.A SG LEU 146.A O no hydrogen 3.183 N/A CYS 169.A SG THR 170.A O no hydrogen 3.854 N/A THR 170.A N ASN 174.A O no hydrogen 2.992 N/A THR 170.A OG1 ASN 174.A O no hydrogen 2.616 N/A THR 170.A OG1 ASN 174.A OD1 no hydrogen 2.830 N/A GLY 173.A N THR 170.A O no hydrogen 3.138 N/A TRP 175.A NE1 PRO 124.A O no hydrogen 2.817 N/A THR 176.A N THR 168.A O no hydrogen 3.073 N/A LYS 177.A NZ LEU 178.A O no hydrogen 3.551 N/A GLU 180.A N PHE 162.A O no hydrogen 2.965 N/A ARG 182.A N ALA 160.A O no hydrogen 3.226 N/A VAL 184.A N GLN 158.A O no hydrogen 3.379 N/A CYS 186.A N LEU 205.A O no hydrogen 2.823 N/A CYS 186.A SG ASN 234.A O no hydrogen 3.223 N/A ARG 191.A NH1 GLY 195.A O no hydrogen 3.379 N/A GLY 195.A N PRO 192.A O no hydrogen 3.046 N/A PHE 196.A N GLY 214.A O no hydrogen 2.941 N/A ASN 198.A N THR 212.A O no hydrogen 2.914 N/A LYS 202.A NZ ASP 209.A OD1 no hydrogen 2.713 N/A LYS 202.A NZ ASP 209.A OD2 no hydrogen 3.143 N/A TYR 206.A N ASP 209.A OD2 no hydrogen 2.797 N/A TYR 207.A N VAL 184.A O no hydrogen 3.109 N/A LYS 208.A N CYS 229.A O no hydrogen 2.875 N/A ASP 209.A N TYR 206.A O no hydrogen 3.036 N/A LYS 210.A NZ LYS 208.A O no hydrogen 2.804 N/A LYS 210.A NZ GLU 228.A OE1 no hydrogen 3.401 N/A ALA 211.A N ILE 227.A O no hydrogen 2.994 N/A THR 212.A N ASN 198.A O no hydrogen 2.935 N/A PHE 213.A N GLU 225.A O no hydrogen 2.787 N/A GLY 214.A N PHE 196.A O no hydrogen 2.976 N/A HIS 216.A N ASN 194.A O no hydrogen 2.944 N/A TYR 219.A N HIS 216.A O no hydrogen 2.978 N/A SER 220.A N LYS 242.A O no hydrogen 2.974 N/A ASP 222.A N SER 240.A O no hydrogen 3.058 N/A ILE 227.A N ALA 211.A O no hydrogen 2.860 N/A GLU 228.A N SER 236.A OG no hydrogen 2.749 N/A CYS 229.A N ASP 209.A O no hydrogen 3.045 N/A THR 230.A N ASN 234.A O no hydrogen 2.922 N/A THR 230.A OG1 ASN 234.A O no hydrogen 3.061 N/A LYS 231.A NZ MET 161.A O no hydrogen 2.925 N/A GLY 233.A N THR 230.A O no hydrogen 3.038 N/A TRP 235.A NE1 PRO 187.A O no hydrogen 2.823 N/A SER 236.A N GLU 228.A O no hydrogen 2.801 N/A SER 236.A OG GLU 228.A O no hydrogen 3.278 N/A SER 240.A N ASP 222.A OD1 no hydrogen 2.952 N/A CYS 241.A SG ASN 194.A O no hydrogen 3.727 N/A CYS 241.A SG GLY 214.A O no hydrogen 3.431 N/A LYS 242.A N SER 220.A O no hydrogen 2.913 N/A ALA 243.A N ASP 298.A OD1 no hydrogen 2.811 N/A SER 244.A N GLY 218.A O no hydrogen 2.906 N/A SER 244.A OG GLY 218.A O no hydrogen 3.112 N/A CYS 245.A N MET 271.A O no hydrogen 2.809 N/A LYS 250.A N GLU 309.A OE2 no hydrogen 2.822 N/A ALA 252.A N GLN 264.A OE1 no hydrogen 2.929 N/A VAL 254.A N VAL 261.A O no hydrogen 3.017 N/A VAL 255.A N SER 278.A O no hydrogen 2.946 N/A TYR 256.A N GLU 259.A O no hydrogen 2.872 N/A ARG 260.A NH2 SER 314.A O no hydrogen 2.633 N/A VAL 261.A N VAL 254.A O no hydrogen 2.958 N/A ILE 263.A N ALA 252.A O no hydrogen 2.888 N/A GLU 265.A N LYS 262.A O no hydrogen 2.787 N/A LYS 266.A N LYS 262.A O no hydrogen 2.927 N/A PHE 267.A N ILE 263.A O no hydrogen 3.038 N/A LYS 268.A N GLU 265.A O no hydrogen 3.251 N/A GLY 270.A N PHE 267.A O no hydrogen 2.943 N/A MET 271.A N CYS 245.A O no hydrogen 2.910 N/A LEU 272.A N ASP 275.A OD2 no hydrogen 2.686 N/A GLY 274.A N CYS 296.A O no hydrogen 2.731 N/A ASP 275.A N LEU 272.A O no hydrogen 3.005 N/A VAL 277.A N ALA 294.A O no hydrogen 3.030 N/A SER 278.A N VAL 255.A O no hydrogen 2.837 N/A SER 278.A OG ASP 293.A OD1 no hydrogen 3.325 N/A PHE 279.A N GLU 292.A O no hydrogen 2.883 N/A CYS 281.A N TYR 290.A O no hydrogen 2.625 N/A ASN 283.A N CYS 288.A O no hydrogen 2.917 N/A CYS 288.A SG LYS 286.A O no hydrogen 3.894 N/A SER 289.A N LYS 317.A O no hydrogen 2.812 N/A SER 289.A OG VAL 316.A O no hydrogen 3.158 N/A SER 289.A OG LYS 317.A O no hydrogen 3.449 N/A TYR 290.A N CYS 281.A O no hydrogen 2.880 N/A GLU 292.A N PHE 279.A O no hydrogen 3.065 N/A ALA 294.A N VAL 277.A O no hydrogen 3.069 N/A GLN 295.A NE2 GLY 274.A O no hydrogen 2.771 N/A CYS 296.A N ASP 275.A O no hydrogen 2.945 N/A CYS 296.A SG MET 271.A O no hydrogen 3.735 N/A CYS 296.A SG LEU 272.A O no hydrogen 3.553 N/A ILE 297.A N THR 300.A O no hydrogen 2.771 N/A ASP 298.A N HIS 273.A ND1 no hydrogen 2.823 N/A THR 300.A N ILE 297.A O no hydrogen 3.131 N/A CYS 306.A SG TYR 290.A OH no hydrogen 3.579 N/A CYS 306.A SG GLU 292.A OE2 no hydrogen 3.406 N/A PHE 307.A N PRO 304.A O no hydrogen 3.050 N/A SER 314.A OG ASP 312.A OD2 no hydrogen 3.058 N/A ASP 315.A N ASP 312.A O no hydrogen 3.016 N/A VAL 316.A N ALA 313.A O no hydrogen 3.151 N/A