Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bqy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N LYS 125.A O no hydrogen 2.836 N/A VAL 1.A N ASP 179.A OD2 no hydrogen 2.844 N/A PHE 2.A N ASP 174.A O no hydrogen 2.932 N/A ASP 5.A N CYS 139.A O no hydrogen 3.094 N/A CYS 7.A N PRO 137.A O no hydrogen 2.832 N/A CYS 7.A SG PRO 137.A O no hydrogen 3.393 N/A ASN 8.A N GLU 11.A OE2 no hydrogen 2.945 N/A ASN 10.A N ASN 8.A OD1 no hydrogen 2.809 N/A ASN 10.A ND2 ASN 8.A OD1 no hydrogen 3.098 N/A GLU 11.A N ASN 8.A O no hydrogen 3.228 N/A HIS 12.A ND1 HIS 12.A O no hydrogen 2.895 N/A LEU 15.A N HIS 12.A O no hydrogen 3.025 N/A VAL 16.A N GLY 28.A O no hydrogen 2.874 N/A VAL 17.A N LEU 50.A O no hydrogen 2.974 N/A LEU 18.A N CYS 26.A O no hydrogen 2.770 N/A PHE 19.A N GLN 48.A O no hydrogen 3.080 N/A ASN 20.A N GLY 23.A O no hydrogen 2.823 N/A ASN 20.A ND2 ASN 46.A O no hydrogen 3.561 N/A ASN 22.A N ASN 20.A OD1 no hydrogen 2.888 N/A GLY 23.A N ASN 20.A O no hydrogen 2.894 N/A LEU 25.A N LEU 18.A O no hydrogen 2.850 N/A CYS 26.A N LEU 18.A O no hydrogen 3.332 N/A CYS 26.A SG LEU 25.A O no hydrogen 2.973 N/A GLY 27.A N SER 180.A O no hydrogen 2.907 N/A THR 29.A N VAL 37.A O no hydrogen 2.725 N/A LEU 30.A N SER 14.A O no hydrogen 3.143 N/A ILE 31.A N TRP 35.A O no hydrogen 3.263 N/A ASP 34.A N ASN 32.A OD1 no hydrogen 2.777 N/A VAL 36.A N ILE 90.A O no hydrogen 2.848 N/A VAL 37.A N THR 29.A O no hydrogen 2.791 N/A THR 38.A N MET 88.A O no hydrogen 3.112 N/A THR 38.A OG1 GLY 27.A O no hydrogen 2.817 N/A ALA 39.A N THR 38.A OG1 no hydrogen 2.722 N/A HIS 41.A N ASP 86.A OD1 no hydrogen 2.914 N/A HIS 41.A ND1 ASP 86.A OD2 no hydrogen 2.757 N/A CYS 42.A N ALA 39.A O no hydrogen 3.121 N/A ASP 43.A N ALA 40.A O no hydrogen 3.283 N/A GLN 48.A N PHE 19.A O no hydrogen 2.841 N/A GLN 48.A NE2 ASP 67.A OD1 no hydrogen 3.010 N/A LEU 49.A N ARG 66.A O no hydrogen 2.967 N/A LEU 50.A N VAL 17.A O no hydrogen 2.827 N/A PHE 51.A N GLN 64.A O no hydrogen 2.858 N/A HIS 54.A NE2 CYS 7.A O no hydrogen 3.165 N/A SER 55.A OG ASP 135.A OD2 no hydrogen 2.750 N/A LYS 56.A N ASP 135.A O no hydrogen 3.174 N/A LYS 56.A N ASP 135.A OD2 no hydrogen 3.378 N/A LYS 57.A N SER 55.A OG no hydrogen 3.316 N/A LYS 57.A N ASP 135.A OD2 no hydrogen 3.322 N/A LYS 57.A NZ ASP 135.A OD1 no hydrogen 2.954 N/A ILE 58.A N SER 55.A OG no hydrogen 3.300 N/A ASN 60.A N GLU 63.A OE2 no hydrogen 3.223 N/A GLN 64.A N PHE 51.A O no hydrogen 3.113 N/A ARG 66.A N LEU 49.A O no hydrogen 3.032 N/A ARG 66.A NE SER 94.A O no hydrogen 3.026 N/A ARG 66.A NH1 GLN 64.A OE1 no hydrogen 2.829 N/A ARG 66.A NH1 THR 65.A O no hydrogen 2.859 N/A ARG 66.A NH2 GLN 64.A OE1 no hydrogen 3.260 N/A ARG 66.A NH2 SER 95.A O no hydrogen 3.027 N/A ASP 67.A N ASP 93.A OD1 no hydrogen 3.324 N/A LYS 69.A N LYS 91.A O no hydrogen 2.788 N/A GLU 70.A N LYS 91.A O no hydrogen 3.111 N/A LYS 71.A NZ ASP 43.A OD1 no hydrogen 2.874 N/A LYS 71.A NZ SER 44.A O no hydrogen 3.180 N/A PHE 72.A N LEU 89.A O no hydrogen 2.878 N/A ASN 76.A ND2 CYS 232E.A O no hydrogen 3.219 N/A ARG 77.A N CYS 74.A O no hydrogen 3.442 N/A ARG 77.A NE ASP 84.A O no hydrogen 2.945 N/A ARG 77.A NH2 GLU 82.A O no hydrogen 3.243 N/A LYS 78.A N ASP 84.A OD2 no hydrogen 2.787 N/A ASP 84.A N ASP 81.A O no hydrogen 2.935 N/A ILE 87.A N LYS 85.A O no hydrogen 2.784 N/A MET 88.A N THR 38.A O no hydrogen 2.965 N/A LEU 89.A N PHE 72.A O no hydrogen 2.991 N/A ILE 90.A N VAL 36.A O no hydrogen 2.703 N/A LYS 91.A N GLU 70.A O no hydrogen 2.767 N/A LEU 92.A N ASP 34.A O no hydrogen 2.937 N/A ASP 93.A N ASP 67.A O no hydrogen 3.120 N/A SER 95.A OG ASP 34.A OD1 no hydrogen 2.841 N/A SER 95.A OG ASP 34.A OD2 no hydrogen 3.453 N/A VAL 96.A N GLN 33.A O no hydrogen 2.889 N/A SER 99.A N ILE 102.A O no hydrogen 3.057 N/A SER 99.A OG ASP 62.A OD2 no hydrogen 2.551 N/A HIS 101.A N ASP 62.A OD2 no hydrogen 2.983 N/A HIS 101.A ND1 ASP 62.A OD1 no hydrogen 2.807 N/A ILE 102.A N SER 99.A O no hydrogen 3.263 N/A ALA 103.A N ARG 13.A O no hydrogen 2.807 N/A LEU 105.A N LEU 30.A O no hydrogen 2.791 N/A SER 113.A OG SER 116.A OG no hydrogen 3.020 N/A GLY 115.A N ILE 144.A O no hydrogen 2.617 N/A SER 116.A N SER 113.A O no hydrogen 3.068 N/A SER 116.A OG SER 113.A O no hydrogen 3.244 N/A SER 116.A OG SER 113.A OG no hydrogen 3.020 N/A CYS 118.A N ILE 142.A O no hydrogen 2.820 N/A CYS 118.A SG SER 116.A O no hydrogen 4.001 N/A ARG 119.A N ILE 185.A O no hydrogen 2.718 N/A ARG 119.A NE GLU 11.A OE1 no hydrogen 3.239 N/A ARG 119.A NH2 GLU 11.A OE1 no hydrogen 3.392 N/A ARG 119.A NH2 GLU 11.A OE2 no hydrogen 3.403 N/A ILE 120.A N ALA 140.A O no hydrogen 2.937 N/A GLY 122.A N HIS 138.A O no hydrogen 3.296 N/A GLY 124.A N ASP 179.A OD1 no hydrogen 2.831 N/A LYS 125.A N HIS 177.A O no hydrogen 3.125 N/A LYS 125.A NZ PRO 128.A O no hydrogen 3.266 N/A LYS 125.A NZ GLU 131.A OE2 no hydrogen 3.099 N/A THR 126.A OG1 ILE 132.A O no hydrogen 3.567 N/A TYR 133.A OH GLU 131.A OE1 no hydrogen 2.827 N/A HIS 138.A N GLY 122.A O no hydrogen 2.915 N/A CYS 139.A N ASP 5.A O no hydrogen 2.705 N/A CYS 139.A SG GLU 11.A OE1 no hydrogen 3.562 N/A ALA 140.A N ILE 120.A O no hydrogen 3.175 N/A ILE 142.A N CYS 118.A O no hydrogen 2.814 N/A ASN 143.A N GLY 167.A O no hydrogen 3.048 N/A ILE 144.A N SER 116.A O no hydrogen 2.935 N/A LEU 145.A N CYS 165.A O no hydrogen 2.753 N/A HIS 147.A NE2 THR 163.A OG1 no hydrogen 3.003 N/A ALA 148.A N ASP 146.A OD2 no hydrogen 3.150 N/A VAL 149.A N ASP 146.A O no hydrogen 3.068 N/A CYS 150.A SG GLY 208.A O no hydrogen 4.035 N/A ARG 151.A N HIS 147.A O no hydrogen 3.091 N/A THR 152.A N ALA 148.A O no hydrogen 2.848 N/A THR 152.A OG1 ALA 148.A O no hydrogen 3.041 N/A THR 152.A OG1 VAL 149.A O no hydrogen 3.193 N/A ALA 153.A N VAL 149.A O no hydrogen 2.873 N/A TYR 154.A N CYS 150.A O no hydrogen 2.948 N/A TYR 154.A OH PRO 207.A O no hydrogen 2.685 N/A ARG 157.A N TYR 154.A O no hydrogen 3.216 N/A ARG 157.A NH1 ASP 81.A OD2 no hydrogen 3.531 N/A ARG 157.A NH1 GLN 158.A O no hydrogen 3.087 N/A ARG 157.A NH2 ASP 81.A OD1 no hydrogen 3.064 N/A THR 163.A OG1 HIS 147.A NE2 no hydrogen 3.003 N/A THR 163.A OG1 ALA 160.A O no hydrogen 2.704 N/A LEU 164.A N TYR 210.A O no hydrogen 2.706 N/A CYS 165.A SG ASP 146.A O no hydrogen 3.793 N/A ALA 166.A N GLY 208.A O no hydrogen 2.961 N/A GLY 167.A N ASN 143.A O no hydrogen 2.951 N/A GLY 172.A N GLY 202.A O no hydrogen 2.820 N/A ARG 173.A NH2 ASN 141.A O no hydrogen 3.031 N/A ASP 174.A N PHE 2.A O no hydrogen 3.136 N/A THR 175.A OG1 TYR 210.A OH no hydrogen 3.189 N/A CYS 176.A N ASP 179.A OD2 no hydrogen 2.871 N/A CYS 176.A SG LYS 125.A O no hydrogen 3.746 N/A CYS 176.A SG ASP 174.A O no hydrogen 3.762 N/A ASP 179.A N CYS 176.A O no hydrogen 2.886 N/A SER 180.A OG HIS 41.A NE2 no hydrogen 3.055 N/A GLY 181.A N VAL 194.A O no hydrogen 3.076 N/A GLY 182.A N ASP 179.A O no hydrogen 3.297 N/A LEU 184.A N GLY 192.A O no hydrogen 2.921 N/A ILE 185.A N ARG 119.A O no hydrogen 2.924 N/A CYS 186.A N ILE 189.A O no hydrogen 3.116 N/A ILE 189.A N CYS 186.A O no hydrogen 3.063 N/A PHE 190.A N SER 106.A O no hydrogen 3.392 N/A GLN 191.A N LEU 184.A O no hydrogen 3.096 N/A GLN 191.A NE2 GLN 191.A O no hydrogen 3.448 N/A GLY 192.A N LEU 184.A O no hydrogen 3.313 N/A ILE 193.A N THR 211.A O no hydrogen 3.069 N/A VAL 194.A N GLY 182.A O no hydrogen 2.894 N/A SER 195.A N VAL 209.A O no hydrogen 3.330 N/A SER 195.A OG ASP 86.A OD2 no hydrogen 2.652 N/A TRP 196.A N VAL 209.A O no hydrogen 3.182 N/A GLY 202.A N ASP 174.A OD2 no hydrogen 2.941 N/A GLY 205.A N LEU 169.A O no hydrogen 2.794 N/A GLY 208.A N ALA 166.A O no hydrogen 2.857 N/A VAL 209.A N TRP 196.A O no hydrogen 2.931 N/A TYR 210.A N LEU 164.A O no hydrogen 2.866 N/A THR 211.A N ILE 193.A O no hydrogen 2.970 N/A THR 211.A OG1 ASP 86.A O no hydrogen 2.879 N/A LYS 212.A N THR 162.A O no hydrogen 2.922 N/A VAL 213.A N GLN 191.A O no hydrogen 3.127 N/A ASP 215.A N LYS 212.A O no hydrogen 3.057 N/A TYR 216.A N VAL 213.A O no hydrogen 2.921 N/A LEU 217.A N PHE 214.A O no hydrogen 2.923 N/A TRP 219.A NE1 ALA 230C.A O no hydrogen 3.012 N/A ILE 220.A N TYR 216.A O no hydrogen 2.896 N/A LYS 221.A N LEU 217.A O no hydrogen 3.028 N/A SER 222.A N ASP 218.A O no hydrogen 2.962 N/A SER 222.A OG ASP 218.A O no hydrogen 2.963 N/A ILE 223.A N TRP 219.A O no hydrogen 2.927 N/A ILE 224.A N ILE 220.A O no hydrogen 2.926 N/A ALA 225.A N LYS 221.A O no hydrogen 2.784 N/A GLY 226.A N SER 222.A O no hydrogen 3.234 N/A GLY 226.A N ILE 223.A O no hydrogen 3.151 N/A ASN 227.A N SER 222.A O no hydrogen 2.874 N/A GLN 170A.A N GLN 170A.A OE1 no hydrogen 2.653 N/A GLY 171B.A N ILE 168.A O no hydrogen 2.928 N/A THR 231D.A OG1 ASN 76.A OD1 no hydrogen 3.216 N/A CYS 232E.A N ASN 76.A OD1 no hydrogen 3.235 N/A