Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bbs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N VAL 147.A O no hydrogen 2.772 N/A THR 2.A OG1 THR 1.A O no hydrogen 3.276 N/A THR 2.A OG1 GLY 170.A O no hydrogen 3.488 N/A SER 3.A N LEU 169.A O no hydrogen 2.927 N/A SER 3.A OG THR 2.A O no hydrogen 2.975 N/A VAL 5.A N ILE 167.A O no hydrogen 2.742 N/A LEU 7.A N GLY 165.A O no hydrogen 2.951 N/A THR 8.A N TYR 16.A O no hydrogen 3.063 N/A TYR 10.A N GLN 14.A O no hydrogen 2.833 N/A THR 13.A N TYR 10.A O no hydrogen 3.142 N/A THR 13.A OG1 TYR 10.A O no hydrogen 3.447 N/A GLN 14.A NE2 LEU 116.A O no hydrogen 2.926 N/A TYR 15.A OH ASN 158.A O no hydrogen 2.711 N/A TYR 16.A N THR 8.A O no hydrogen 3.184 N/A GLY 17.A N VAL 30.A O no hydrogen 2.677 N/A ILE 19.A N PHE 28.A O no hydrogen 3.005 N/A GLY 20.A N THR 93.A O no hydrogen 3.110 N/A ILE 21.A N GLN 26.A O no hydrogen 2.909 N/A GLY 22.A N ILE 91.A O no hydrogen 3.126 N/A THR 23.A N SER 64.A OG no hydrogen 3.067 N/A THR 23.A OG1 SER 66.A OG no hydrogen 2.691 N/A GLN 26.A N ILE 21.A O no hydrogen 2.672 N/A PHE 28.A N ILE 19.A O no hydrogen 3.034 N/A LYS 29.A N ASP 120.A OD2 no hydrogen 3.272 N/A VAL 30.A N GLY 17.A O no hydrogen 2.847 N/A VAL 31.A N GLY 121.A O no hydrogen 3.402 N/A ASP 33.A N VAL 123.A O no hydrogen 3.167 N/A THR 34.A N THR 218.A OG1 no hydrogen 2.984 N/A THR 34.A OG1 VAL 216.A O no hydrogen 2.886 N/A THR 34.A OG1 THR 218.A OG1 no hydrogen 3.154 N/A GLY 35.A N ASP 33.A OD1 no hydrogen 3.017 N/A SER 36.A OG ASP 33.A OD2 no hydrogen 2.748 N/A SER 37.A OG PHE 127.A O no hydrogen 2.882 N/A ASN 38.A ND2 ILE 132.A O no hydrogen 2.690 N/A TRP 40.A N VAL 122.A O no hydrogen 2.845 N/A SER 43.A N VAL 106.A O no hydrogen 3.102 N/A SER 43.A OG GLU 105.A OE1 no hydrogen 3.164 N/A SER 44.A N PHE 59.A O no hydrogen 3.405 N/A SER 44.A OG PHE 59.A O no hydrogen 2.834 N/A SER 44.A OG ASP 60.A OD1 no hydrogen 3.379 N/A LYS 45.A N SER 43.A OG no hydrogen 2.828 N/A CYS 46.A N SER 43.A O no hydrogen 2.677 N/A CYS 46.A SG SER 47.A O no hydrogen 3.682 N/A CYS 46.A SG THR 107.A O no hydrogen 3.379 N/A TYR 50.A N SER 47.A O no hydrogen 2.965 N/A CYS 53.A N TYR 50.A O no hydrogen 2.951 N/A VAL 54.A N THR 51.A O no hydrogen 3.143 N/A TYR 55.A N THR 51.A O no hydrogen 3.251 N/A TYR 55.A N ALA 52.A O no hydrogen 3.137 N/A HIS 56.A ND1 ALA 52.A O no hydrogen 2.737 N/A HIS 56.A NE2 ALA 117.A O no hydrogen 2.801 N/A LYS 57.A N ASP 120.A OD1 no hydrogen 3.164 N/A LYS 57.A NZ THR 27.A O no hydrogen 3.112 N/A PHE 59.A N PRO 42.A O no hydrogen 2.840 N/A SER 62.A OG ASP 60.A OD1 no hydrogen 2.685 N/A ASP 63.A N ASP 60.A O no hydrogen 3.339 N/A SER 64.A N ALA 61.A O no hydrogen 3.328 N/A SER 64.A OG ASP 90.A OD1 no hydrogen 3.322 N/A SER 64.A OG ASP 90.A OD2 no hydrogen 2.797 N/A SER 65.A N THR 23.A O no hydrogen 2.913 N/A SER 65.A OG THR 23.A O no hydrogen 3.216 N/A SER 66.A N SER 64.A OG no hydrogen 3.319 N/A SER 66.A OG THR 23.A OG1 no hydrogen 2.691 N/A SER 66.A OG SER 64.A OG no hydrogen 3.387 N/A SER 66.A OG ASP 90.A OD1 no hydrogen 2.820 N/A LYS 68.A N GLN 89.A O no hydrogen 2.702 N/A THR 72.A OG1 ASN 70.A OD1 no hydrogen 2.893 N/A LEU 74.A N GLY 85.A O no hydrogen 2.682 N/A THR 75.A OG1 SER 84.A OG no hydrogen 2.766 N/A LEU 76.A N VAL 83.A O no hydrogen 2.948 N/A VAL 83.A N LEU 76.A O no hydrogen 3.436 N/A SER 84.A N GLU 108.A O no hydrogen 3.250 N/A SER 84.A OG LEU 74.A O no hydrogen 3.082 N/A SER 84.A OG THR 75.A OG1 no hydrogen 2.766 N/A GLY 85.A N LEU 74.A O no hydrogen 2.773 N/A PHE 86.A N GLU 105.A O no hydrogen 3.130 N/A LEU 87.A N THR 72.A O no hydrogen 2.646 N/A SER 88.A N PHE 103.A O no hydrogen 2.874 N/A SER 88.A OG LEU 87.A O no hydrogen 3.443 N/A SER 88.A OG GLU 105.A OE2 no hydrogen 2.694 N/A GLN 89.A N LYS 68.A O no hydrogen 2.943 N/A ASP 90.A N GLN 101.A O no hydrogen 3.002 N/A ILE 91.A N ASP 90.A OD1 no hydrogen 2.841 N/A ILE 92.A N VAL 99.A O no hydrogen 2.847 N/A THR 93.A N GLY 20.A O no hydrogen 2.741 N/A VAL 94.A N ILE 97.A O no hydrogen 2.834 N/A VAL 99.A N ILE 92.A O no hydrogen 2.783 N/A GLN 101.A N ASP 90.A O no hydrogen 2.808 N/A GLN 101.A NE2 ASN 141.A OD1 no hydrogen 2.693 N/A PHE 103.A N SER 88.A O no hydrogen 2.822 N/A GLY 104.A N VAL 39.A O no hydrogen 2.922 N/A GLU 105.A N PHE 86.A O no hydrogen 2.708 N/A VAL 106.A N VAL 41.A O no hydrogen 3.205 N/A THR 107.A N SER 84.A O no hydrogen 2.682 N/A THR 107.A OG1 SER 84.A O no hydrogen 3.151 N/A GLU 108.A N SER 84.A O no hydrogen 3.041 N/A MET 115.A N ALA 111.A O no hydrogen 2.682 N/A LEU 116.A N PRO 113.A O no hydrogen 2.649 N/A ALA 117.A N PHE 114.A O no hydrogen 3.335 N/A GLU 118.A N GLN 14.A OE1 no hydrogen 2.663 N/A ASP 120.A N LYS 29.A O no hydrogen 2.721 N/A GLY 121.A N LYS 29.A O no hydrogen 3.275 N/A VAL 122.A N TRP 40.A O no hydrogen 2.984 N/A VAL 123.A N VAL 31.A O no hydrogen 3.050 N/A GLY 124.A N ASN 38.A O no hydrogen 2.815 N/A MET 125.A N ASP 33.A O no hydrogen 2.789 N/A GLY 126.A N SER 36.A O no hydrogen 3.024 N/A GLN 130.A N PHE 127.A O no hydrogen 3.416 N/A ILE 132.A N ASN 38.A OD1 no hydrogen 2.682 N/A ARG 134.A N ALA 131.A O no hydrogen 3.146 N/A ASN 141.A N PRO 137.A O no hydrogen 3.379 N/A ILE 142.A N ILE 138.A O no hydrogen 3.216 N/A ILE 143.A N PHE 139.A O no hydrogen 2.895 N/A SER 144.A N ASP 140.A O no hydrogen 3.035 N/A GLN 145.A N ASN 141.A O no hydrogen 3.001 N/A GLN 145.A N ILE 142.A O no hydrogen 3.114 N/A GLY 146.A N ILE 143.A O no hydrogen 2.656 N/A VAL 152.A N GLU 150.A O no hydrogen 2.695 N/A SER 154.A N VAL 168.A O no hydrogen 3.305 N/A SER 154.A OG GLY 171.A O no hydrogen 2.643 N/A SER 154.A OG SER 172.A OG no hydrogen 2.965 N/A PHE 155.A N THR 316.A O no hydrogen 2.880 N/A TYR 156.A N GLN 166.A O no hydrogen 2.953 N/A TYR 156.A OH ARG 331.A O no hydrogen 3.158 N/A TYR 157.A OH THR 218.A O no hydrogen 2.695 N/A ASN 158.A N GLY 164.A O no hydrogen 3.128 N/A SER 161.A OG ASP 160.A O no hydrogen 3.078 N/A GLN 166.A N TYR 156.A O no hydrogen 2.918 N/A ILE 167.A N VAL 5.A O no hydrogen 2.980 N/A VAL 168.A N SER 154.A O no hydrogen 3.142 N/A LEU 169.A N SER 3.A O no hydrogen 2.633 N/A GLY 170.A N VAL 152.A O no hydrogen 2.803 N/A SER 172.A OG SER 154.A OG no hydrogen 2.965 N/A SER 172.A OG GLU 317.A OE2 no hydrogen 3.181 N/A ASP 173.A N TYR 315.A OH no hydrogen 2.958 N/A GLN 175.A N ASP 173.A OD1 no hydrogen 2.691 N/A HIS 176.A N ASP 173.A O no hydrogen 3.059 N/A GLU 178.A N LEU 329.A O no hydrogen 2.859 N/A HIS 182.A N PHE 327.A O no hydrogen 3.235 N/A TYR 183.A OH GLU 317.A OE1 no hydrogen 2.698 N/A ILE 184.A N ILE 325.A O no hydrogen 2.776 N/A LEU 186.A N ASN 323.A O no hydrogen 3.258 N/A ILE 187.A N GLN 193.A O no hydrogen 3.201 N/A THR 189.A OG1 ASN 323.A OD1 no hydrogen 2.699 N/A TRP 192.A NE1 MET 125.A O no hydrogen 3.085 N/A GLN 193.A N VAL 191.A O no hydrogen 2.661 N/A ILE 194.A N ALA 214.A O no hydrogen 2.799 N/A MET 196.A N CYS 212.A O no hydrogen 2.773 N/A LYS 197.A N HIS 262.A O no hydrogen 3.287 N/A VAL 199.A N LEU 207.A O no hydrogen 2.025 N/A SER 200.A N SER 260.A O no hydrogen 2.800 N/A VAL 201.A N SER 204.A O no hydrogen 2.946 N/A GLY 202.A N ASP 258.A O no hydrogen 3.310 N/A SER 204.A N VAL 201.A O no hydrogen 3.074 N/A THR 205.A OG1 THR 205.A O no hydrogen 2.333 N/A LEU 207.A N VAL 199.A O no hydrogen 2.809 N/A CYS 208.A SG MET 196.A O no hydrogen 3.249 N/A GLY 211.A N CYS 208.A O no hydrogen 3.179 N/A CYS 212.A N MET 196.A O no hydrogen 2.879 N/A CYS 212.A SG MET 196.A O no hydrogen 3.484 N/A ALA 214.A N ILE 194.A O no hydrogen 2.720 N/A LEU 215.A N TRP 304.A O no hydrogen 2.852 N/A VAL 216.A N TRP 192.A O no hydrogen 3.100 N/A ASP 217.A N LEU 306.A O no hydrogen 2.829 N/A THR 218.A N THR 34.A OG1 no hydrogen 2.847 N/A THR 218.A OG1 PHE 32.A O no hydrogen 2.696 N/A THR 218.A OG1 THR 34.A OG1 no hydrogen 3.154 N/A GLY 219.A N ASP 217.A OD1 no hydrogen 3.129 N/A SER 221.A OG THR 13.A O no hydrogen 3.023 N/A ILE 223.A N ALA 290.A O no hydrogen 2.960 N/A SER 224.A N ALA 305.A O no hydrogen 3.062 N/A GLY 225.A N HIS 292.A O no hydrogen 3.119 N/A THR 227.A N ASP 295.A OD1 no hydrogen 3.452 N/A THR 227.A N ASP 295.A OD2 no hydrogen 3.422 N/A THR 227.A OG1 ASP 295.A OD2 no hydrogen 2.816 N/A SER 229.A N SER 226.A OG no hydrogen 2.694 N/A ILE 230.A N SER 226.A O no hydrogen 2.906 N/A GLU 231.A N THR 227.A O no hydrogen 2.681 N/A LYS 232.A N SER 228.A O no hydrogen 3.047 N/A LEU 233.A N SER 229.A O no hydrogen 3.040 N/A MET 234.A N ILE 230.A O no hydrogen 2.755 N/A GLU 235.A N GLU 231.A O no hydrogen 3.258 N/A ALA 236.A N LYS 232.A O no hydrogen 3.183 N/A ALA 236.A N LEU 233.A O no hydrogen 3.012 N/A LEU 237.A N LEU 233.A O no hydrogen 3.188 N/A GLY 238.A N MET 234.A O no hydrogen 2.659 N/A ALA 239.A N MET 234.A O no hydrogen 3.357 N/A LYS 240.A N VAL 247.A O no hydrogen 3.073 N/A ARG 242.A N ASP 245.A O no hydrogen 2.872 N/A VAL 247.A N LYS 240.A O no hydrogen 2.847 N/A VAL 248.A N CYS 287.A O no hydrogen 3.041 N/A CYS 250.A SG SER 280.A OG no hydrogen 3.234 N/A CYS 250.A SG LYS 285.A O no hydrogen 3.695 N/A GLU 252.A N LYS 249.A O no hydrogen 2.784 N/A GLY 253.A N LYS 249.A O no hydrogen 3.088 N/A GLY 253.A N CYS 250.A O no hydrogen 3.217 N/A THR 255.A N GLU 252.A O no hydrogen 2.690 N/A THR 255.A OG1 GLU 252.A O no hydrogen 2.904 N/A LEU 256.A N GLY 253.A O no hydrogen 2.988 N/A ILE 259.A N LEU 270.A O no hydrogen 2.857 N/A SER 260.A N SER 200.A O no hydrogen 2.975 N/A SER 260.A OG GLU 267.A OE1 no hydrogen 3.195 N/A SER 260.A OG THR 269.A OG1 no hydrogen 2.990 N/A PHE 261.A N TYR 268.A O no hydrogen 2.797 N/A HIS 262.A N GLY 198.A O no hydrogen 3.112 N/A HIS 262.A ND1 GLY 198.A O no hydrogen 2.594 N/A LEU 263.A N LYS 266.A O no hydrogen 2.933 N/A LYS 266.A NZ HIS 182.A ND1 no hydrogen 2.689 N/A TYR 268.A N PHE 261.A O no hydrogen 2.815 N/A THR 269.A OG1 SER 260.A OG no hydrogen 2.990 N/A LEU 270.A N ILE 259.A O no hydrogen 2.674 N/A THR 271.A N ASP 274.A OD2 no hydrogen 3.074 N/A SER 272.A OG GLY 253.A O no hydrogen 3.515 N/A ASP 274.A N THR 271.A O no hydrogen 3.161 N/A TYR 275.A OH PRO 257.A O no hydrogen 2.695 N/A PHE 277.A N THR 288.A O no hydrogen 2.966 N/A GLU 279.A N PHE 277.A O no hydrogen 3.023 N/A CYS 287.A N VAL 248.A O no hydrogen 2.975 N/A CYS 287.A SG PHE 277.A O no hydrogen 3.159 N/A THR 288.A OG1 ASP 245.A OD2 no hydrogen 2.747 N/A LEU 289.A N TYR 246.A O no hydrogen 3.143 N/A ALA 290.A N TYR 275.A O no hydrogen 3.021 N/A HIS 292.A N ILE 223.A O no hydrogen 2.924 N/A HIS 292.A NE2 PHE 244.A O no hydrogen 2.578 N/A MET 294.A N GLY 225.A O no hydrogen 2.755 N/A GLY 301.A N PRO 297.A O no hydrogen 3.093 N/A THR 303.A OG1 GLN 193.A OE1 no hydrogen 2.770 N/A TRP 304.A N LEU 213.A O no hydrogen 3.133 N/A ALA 305.A N SER 224.A O no hydrogen 2.672 N/A LEU 306.A N LEU 215.A O no hydrogen 2.692 N/A ALA 308.A N ALA 220.A O no hydrogen 2.740 N/A THR 309.A OG1 ALA 290.A O no hydrogen 2.789 N/A PHE 310.A N GLY 307.A O no hydrogen 3.138 N/A ILE 311.A N GLY 307.A O no hydrogen 3.068 N/A ARG 312.A N ALA 308.A O no hydrogen 3.266 N/A ARG 312.A NH1 ASP 12.A O no hydrogen 3.310 N/A ARG 312.A NH1 TYR 15.A OH no hydrogen 2.815 N/A LYS 313.A N PHE 310.A O no hydrogen 2.999 N/A LYS 313.A NZ THR 269.A O no hydrogen 2.663 N/A PHE 314.A N PHE 310.A O no hydrogen 3.200 N/A THR 316.A N PHE 155.A O no hydrogen 3.193 N/A THR 316.A OG1 PHE 314.A O no hydrogen 3.054 N/A GLU 317.A N GLY 326.A O no hydrogen 2.947 N/A PHE 318.A N PHE 153.A O no hydrogen 2.743 N/A ARG 320.A N ASP 151.A O no hydrogen 2.926 N/A ARG 320.A NH1 ASP 140.A OD1 no hydrogen 2.782 N/A ARG 320.A NH1 ASP 140.A OD2 no hydrogen 3.469 N/A ARG 320.A NH2 ASP 140.A OD2 no hydrogen 3.149 N/A ARG 321.A N ASP 319.A OD1 no hydrogen 3.394 N/A ILE 325.A N ILE 184.A O no hydrogen 3.069 N/A GLY 326.A N GLU 317.A O no hydrogen 2.973 N/A PHE 327.A N HIS 182.A O no hydrogen 3.150 N/A ALA 328.A N TYR 315.A O no hydrogen 3.176 N/A ALA 330.A N LYS 313.A O no hydrogen 2.826 N/A ARG 331.A N HIS 176.A O no hydrogen 3.055 N/A ARG 48A.A NE CYS 46.A O no hydrogen 2.780 N/A ARG 48A.A NH2 SER 44.A O no hydrogen 2.962 N/A LEU 49B.A N SER 47.A OG no hydrogen 3.104 N/A