Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bbj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N ASP 177.A O no hydrogen 2.820 N/A ARG 2.A NE ASP 22.A OD2 no hydrogen 2.884 N/A ARG 2.A NH1 ASP 137.A OD2 no hydrogen 3.140 N/A ARG 2.A NH2 ASP 22.A OD1 no hydrogen 3.016 N/A ARG 2.A NH2 ASP 22.A OD2 no hydrogen 3.306 N/A ARG 2.A NH2 ASP 137.A OD2 no hydrogen 3.060 N/A ASP 4.A N THR 1.A OG1 no hydrogen 3.314 N/A SER 5.A N THR 1.A O no hydrogen 3.431 N/A ALA 6.A N ARG 2.A O no hydrogen 2.750 N/A THR 7.A N PHE 3.A O no hydrogen 2.925 N/A THR 7.A OG1 PHE 3.A O no hydrogen 2.625 N/A GLU 8.A N SER 5.A O no hydrogen 3.531 N/A VAL 10.A N ALA 18.A O no hydrogen 2.884 N/A VAL 12.A N ARG 16.A O no hydrogen 2.885 N/A GLY 13.A N ARG 16.A O no hydrogen 3.160 N/A ARG 16.A N GLY 13.A O no hydrogen 3.113 N/A TYR 17.A N ILE 69.A O no hydrogen 2.796 N/A TYR 17.A OH GLU 45.A OE2 no hydrogen 2.608 N/A ALA 18.A N VAL 10.A O no hydrogen 2.741 N/A VAL 19.A N ALA 67.A O no hydrogen 3.016 N/A LEU 21.A N GLY 65.A O no hydrogen 2.649 N/A ASP 22.A N TYR 34.A OH no hydrogen 2.999 N/A GLY 24.A N ASP 22.A OD1 no hydrogen 2.866 N/A TYR 25.A N ASP 22.A O no hydrogen 2.998 N/A LEU 26.A N PRO 23.A O no hydrogen 3.154 N/A ILE 27.A N ALA 30.A O no hydrogen 2.983 N/A ASN 31.A ND2 ASP 193.A O no hydrogen 3.112 N/A GLY 33.A N ASP 193.A OD2 no hydrogen 3.027 N/A TYR 34.A N ASN 31.A OD1 no hydrogen 2.992 N/A TYR 34.A OH ALA 6.A O no hydrogen 2.523 N/A TYR 34.A OH GLU 20.A O no hydrogen 3.114 N/A THR 36.A OG1 GLY 33.A O no hydrogen 3.060 N/A VAL 37.A N TYR 34.A O no hydrogen 3.330 N/A LEU 38.A N LEU 35.A O no hydrogen 3.123 N/A GLN 39.A NE2 LEU 185.A O no hydrogen 3.134 N/A ARG 40.A N THR 36.A O no hydrogen 3.178 N/A SER 41.A N VAL 37.A O no hydrogen 3.262 N/A SER 41.A OG LEU 38.A O no hydrogen 2.373 N/A SER 41.A OG THR 85.A OG1 no hydrogen 2.683 N/A ALA 42.A N LEU 38.A O no hydrogen 3.113 N/A LEU 43.A N GLN 39.A O no hydrogen 3.105 N/A ALA 44.A N ARG 40.A O no hydrogen 3.127 N/A GLU 45.A N ALA 42.A O no hydrogen 3.165 N/A SER 46.A N LEU 43.A O no hydrogen 3.297 N/A SER 46.A OG HIS 48.A O no hydrogen 3.383 N/A SER 46.A OG THR 101.A OG1 no hydrogen 2.637 N/A ASP 47.A N ASP 47.A OD1 no hydrogen 2.476 N/A HIS 48.A N SER 46.A OG no hydrogen 2.953 N/A HIS 48.A NE2 GLY 77.A O no hydrogen 2.776 N/A LEU 49.A N THR 103.A OG1 no hydrogen 3.142 N/A HIS 50.A N ALA 102.A O no hydrogen 2.792 N/A VAL 52.A N ALA 100.A O no hydrogen 2.782 N/A SER 53.A N ALA 100.A O no hydrogen 3.174 N/A SER 53.A OG HIS 216.A ND1 no hydrogen 3.023 N/A SER 54.A N TRP 215.A O no hydrogen 3.055 N/A SER 55.A N THR 98.A O no hydrogen 2.972 N/A SER 55.A OG THR 98.A O no hydrogen 3.352 N/A TYR 56.A N LEU 213.A O no hydrogen 2.739 N/A HIS 57.A N THR 96.A O no hydrogen 2.757 N/A PHE 58.A N VAL 211.A O no hydrogen 3.185 N/A HIS 59.A N ILE 94.A O no hydrogen 2.674 N/A ARG 60.A N ILE 94.A O no hydrogen 3.026 N/A ARG 60.A NH1 THR 93.A O no hydrogen 2.694 N/A ARG 60.A NH1 THR 93.A OG1 no hydrogen 3.190 N/A SER 63.A N GLN 89.A OE1 no hydrogen 2.941 N/A GLY 65.A N LEU 21.A O no hydrogen 3.023 N/A ALA 67.A N VAL 19.A O no hydrogen 2.898 N/A GLU 68.A N PHE 88.A O no hydrogen 2.833 N/A ILE 69.A N TYR 17.A O no hydrogen 2.795 N/A GLU 70.A N THR 86.A O no hydrogen 3.007 N/A THR 71.A N ASN 15.A O no hydrogen 2.827 N/A ARG 72.A N GLN 84.A O no hydrogen 2.679 N/A LEU 74.A N THR 82.A O no hydrogen 2.583 N/A LYS 75.A N THR 82.A O no hydrogen 3.359 N/A LYS 75.A NZ ARG 76.A O no hydrogen 3.119 N/A GLY 77.A N THR 81.A OG1 no hydrogen 3.332 N/A THR 81.A N THR 101.A O no hydrogen 2.784 N/A THR 81.A OG1 ASP 47.A OD1 no hydrogen 2.771 N/A THR 82.A N LYS 75.A O no hydrogen 2.752 N/A VAL 83.A N LEU 99.A O no hydrogen 3.051 N/A GLN 84.A N ARG 72.A O no hydrogen 2.623 N/A THR 85.A N GLY 97.A O no hydrogen 2.958 N/A THR 85.A OG1 SER 41.A OG no hydrogen 2.683 N/A THR 86.A N GLU 70.A O no hydrogen 3.072 N/A THR 86.A OG1 THR 96.A OG1 no hydrogen 3.291 N/A LEU 87.A N LEU 95.A O no hydrogen 2.894 N/A PHE 88.A N GLU 68.A O no hydrogen 2.743 N/A GLN 89.A N ARG 92.A O no hydrogen 2.932 N/A GLN 89.A NE2 SER 63.A O no hydrogen 2.724 N/A GLN 89.A NE2 PRO 66.A O no hydrogen 3.199 N/A ARG 92.A N GLN 89.A O no hydrogen 3.250 N/A ILE 94.A N LEU 87.A O no hydrogen 2.795 N/A THR 96.A N HIS 57.A O no hydrogen 2.966 N/A THR 96.A OG1 THR 85.A O no hydrogen 3.426 N/A THR 96.A OG1 THR 86.A OG1 no hydrogen 3.291 N/A GLY 97.A N THR 85.A O no hydrogen 2.851 N/A THR 98.A N SER 55.A O no hydrogen 2.859 N/A LEU 99.A N VAL 83.A O no hydrogen 2.954 N/A ALA 100.A N SER 53.A O no hydrogen 2.662 N/A THR 101.A N THR 81.A O no hydrogen 2.908 N/A THR 101.A OG1 SER 46.A OG no hydrogen 2.637 N/A THR 101.A OG1 THR 81.A O no hydrogen 2.843 N/A ALA 102.A N HIS 50.A O no hydrogen 2.867 N/A LEU 104.A N HIS 50.A ND1 no hydrogen 2.960 N/A HIS 107.A N ASP 105.A OD1 no hydrogen 2.830 N/A ALA 108.A N ASP 105.A O no hydrogen 3.305 N/A GLN 116.A NE2 PRO 117.A O no hydrogen 3.011 N/A GLN 122.A NE2 ASP 147.A OD2 no hydrogen 3.044 N/A GLN 124.A N PRO 121.A O no hydrogen 2.958 N/A CYS 125.A N GLN 122.A O no hydrogen 3.093 N/A CYS 125.A SG PRO 120.A O no hydrogen 3.787 N/A CYS 125.A SG PRO 121.A O no hydrogen 3.404 N/A ARG 126.A N PHE 148.A O no hydrogen 2.783 N/A ARG 127.A NE ASP 147.A OD1 no hydrogen 2.991 N/A ARG 127.A NH2 ASP 147.A OD1 no hydrogen 3.163 N/A ARG 127.A NH2 ASP 147.A OD2 no hydrogen 3.268 N/A SER 133.A N ASP 138.A OD1 no hydrogen 3.014 N/A LEU 135.A N SER 133.A OG no hydrogen 2.877 N/A ASP 138.A N LEU 135.A O no hydrogen 2.815 N/A GLY 139.A N PRO 136.A O no hydrogen 3.049 N/A PHE 140.A N LEU 26.A O no hydrogen 2.855 N/A ALA 142.A N GLY 139.A O no hydrogen 3.007 N/A ARG 143.A N PHE 140.A O no hydrogen 2.815 N/A ARG 143.A NE ASP 177.A OD2 no hydrogen 2.652 N/A ARG 143.A NH1 GLY 24.A O no hydrogen 3.062 N/A ARG 143.A NH1 ASP 137.A O no hydrogen 3.072 N/A ARG 143.A NH2 ASP 137.A O no hydrogen 3.030 N/A ARG 143.A NH2 ASP 177.A OD1 no hydrogen 3.221 N/A ASP 145.A N ASP 172.A O no hydrogen 2.918 N/A ASP 147.A N TYR 170.A O no hydrogen 2.809 N/A PHE 148.A N ARG 126.A O no hydrogen 2.911 N/A SER 149.A N CYS 168.A O no hydrogen 2.955 N/A SER 149.A OG SER 152.A OG no hydrogen 2.673 N/A SER 152.A N SER 149.A OG no hydrogen 3.173 N/A SER 152.A OG SER 149.A OG no hydrogen 2.673 N/A SER 152.A OG CYS 168.A O no hydrogen 3.392 N/A TYR 153.A N SER 149.A O no hydrogen 2.913 N/A ALA 154.A N PRO 150.A O no hydrogen 2.854 N/A ALA 155.A N ASP 151.A O no hydrogen 2.982 N/A LEU 156.A N SER 152.A O no hydrogen 2.947 N/A ALA 157.A N TYR 153.A O no hydrogen 2.799 N/A ARG 158.A N ALA 155.A O no hydrogen 3.172 N/A ARG 158.A NE LEU 156.A O no hydrogen 3.294 N/A ARG 158.A NH1 SER 200.A O no hydrogen 3.197 N/A ARG 158.A NH2 SER 200.A O no hydrogen 3.143 N/A GLU 159.A N ALA 154.A O no hydrogen 3.039 N/A LEU 167.A N SER 230.A O no hydrogen 2.940 N/A CYS 168.A N SER 152.A OG no hydrogen 2.975 N/A CYS 168.A SG SER 149.A OG no hydrogen 3.457 N/A GLY 169.A N PHE 228.A O no hydrogen 3.242 N/A TYR 170.A N ASP 147.A O no hydrogen 2.830 N/A TYR 170.A OH PRO 120.A O no hydrogen 2.659 N/A VAL 171.A N LEU 226.A O no hydrogen 2.754 N/A ASP 172.A N ASP 145.A O no hydrogen 3.166 N/A LEU 173.A N ASP 172.A OD1 no hydrogen 2.789 N/A SER 174.A N ARG 143.A O no hydrogen 2.965 N/A SER 174.A OG ALA 142.A O no hydrogen 2.860 N/A ALA 175.A N ASP 145.A OD2 no hydrogen 2.979 N/A ARG 176.A NH1 ASP 138.A OD2 no hydrogen 2.985 N/A ASP 177.A N SER 174.A O no hydrogen 3.269 N/A ASP 177.A N SER 174.A OG no hydrogen 3.113 N/A GLY 178.A N ALA 175.A O no hydrogen 2.959 N/A GLY 179.A N SER 174.A O no hydrogen 3.056 N/A SER 180.A OG ASP 172.A OD1 no hydrogen 3.478 N/A SER 180.A OG ASP 172.A OD2 no hydrogen 2.720 N/A ALA 181.A N ASP 172.A OD1 no hydrogen 3.306 N/A ALA 186.A N ASP 183.A O no hydrogen 2.968 N/A PHE 187.A N PRO 184.A O no hydrogen 2.981 N/A LEU 188.A N PRO 184.A O no hydrogen 3.028 N/A ALA 191.A N PHE 187.A O no hydrogen 2.821 N/A VAL 192.A N LEU 188.A O no hydrogen 2.965 N/A ASP 193.A N LEU 190.A O no hydrogen 2.944 N/A ALA 194.A N ALA 191.A O no hydrogen 3.058 N/A ILE 198.A N GLU 242.A OE1 no hydrogen 3.108 N/A SER 200.A N PRO 197.A O no hydrogen 3.150 N/A SER 200.A OG PRO 197.A O no hydrogen 2.726 N/A LEU 201.A N ILE 198.A O no hydrogen 3.113 N/A LEU 202.A N VAL 199.A O no hydrogen 2.957 N/A VAL 203.A N VAL 199.A O no hydrogen 3.141 N/A THR 210.A OG1 GLN 259.A OE1 no hydrogen 2.624 N/A VAL 211.A N LEU 260.A O no hydrogen 2.880 N/A GLU 212.A N LEU 260.A O no hydrogen 3.139 N/A LEU 213.A N TYR 56.A O no hydrogen 3.036 N/A THR 214.A N ARG 258.A O no hydrogen 3.150 N/A THR 214.A OG1 GLU 212.A OE2 no hydrogen 2.548 N/A TRP 215.A N SER 54.A O no hydrogen 2.931 N/A HIS 216.A N GLN 256.A O no hydrogen 2.810 N/A HIS 216.A ND1 SER 53.A OG no hydrogen 3.023 N/A LEU 217.A N VAL 52.A O no hydrogen 2.973 N/A ARG 218.A N VAL 254.A O no hydrogen 2.880 N/A ARG 218.A NH1 GLN 256.A OE1 no hydrogen 2.938 N/A LEU 226.A N VAL 171.A O no hydrogen 2.825 N/A ALA 227.A N TRP 247.A O no hydrogen 2.900 N/A PHE 228.A N GLY 169.A O no hydrogen 2.821 N/A ARG 229.A N ASP 245.A O no hydrogen 3.123 N/A SER 230.A N LEU 167.A O no hydrogen 2.754 N/A THR 231.A N ASN 243.A O no hydrogen 2.981 N/A CYS 232.A SG LEU 234.A O no hydrogen 3.720 N/A CYS 232.A SG ASP 241.A O no hydrogen 3.258 N/A CYS 232.A SG ASP 241.A OD1 no hydrogen 3.711 N/A ALA 233.A N ASP 241.A OD1 no hydrogen 3.229 N/A ALA 233.A N ASP 241.A OD2 no hydrogen 2.992 N/A LEU 234.A N ASP 241.A OD1 no hydrogen 2.897 N/A SER 236.A N TRP 239.A O no hydrogen 2.922 N/A TRP 239.A N SER 236.A O no hydrogen 3.099 N/A PHE 240.A N ALA 261.A O no hydrogen 2.975 N/A GLU 242.A N GLN 259.A O no hydrogen 2.987 N/A ASN 243.A N THR 231.A O no hydrogen 2.858 N/A ASN 243.A ND2 ASP 241.A OD2 no hydrogen 2.868 N/A VAL 244.A N SER 257.A O no hydrogen 2.852 N/A ASP 245.A N ARG 229.A O no hydrogen 3.015 N/A LEU 246.A N ALA 255.A O no hydrogen 2.928 N/A TRP 247.A N ALA 227.A O no hydrogen 2.841 N/A ASP 248.A N ARG 252.A O no hydrogen 3.033 N/A GLY 251.A N ASP 248.A O no hydrogen 2.844 N/A ARG 252.A N ASP 248.A OD1 no hydrogen 2.702 N/A ARG 252.A NH1 ILE 220.A O no hydrogen 3.159 N/A ARG 252.A NH1 ASP 248.A OD2 no hydrogen 2.783 N/A ARG 252.A NH2 ILE 220.A O no hydrogen 3.337 N/A VAL 254.A N LEU 246.A O no hydrogen 2.883 N/A ALA 255.A N LEU 246.A O no hydrogen 3.235 N/A GLN 256.A N HIS 216.A O no hydrogen 3.105 N/A SER 257.A N VAL 244.A O no hydrogen 2.830 N/A ARG 258.A N THR 214.A O no hydrogen 3.060 N/A ARG 258.A NE ASN 243.A OD1 no hydrogen 3.018 N/A GLN 259.A N GLU 242.A O no hydrogen 2.975 N/A GLN 259.A NE2 ASP 193.A OD1 no hydrogen 2.970 N/A LEU 260.A N GLU 212.A O no hydrogen 2.832 N/A ALA 261.A N PHE 240.A O no hydrogen 3.222 N/A ARG 262.A NE ASP 237.A O no hydrogen 2.833 N/A ARG 262.A NH2 ASP 237.A O no hydrogen 3.025 N/A VAL 263.A N GLY 238.A O no hydrogen 2.826 N/A