Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jwi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N ASN 1.A OD1 no hydrogen 2.827 N/A GLN 5.A N ASN 1.A O no hydrogen 3.246 N/A ARG 6.A N LEU 2.A O no hydrogen 2.793 N/A LEU 7.A N ASN 3.A O no hydrogen 2.937 N/A GLY 8.A N GLN 4.A O no hydrogen 2.632 N/A THR 9.A N GLN 5.A O no hydrogen 2.839 N/A THR 9.A N ARG 6.A O no hydrogen 3.249 N/A THR 9.A OG1 GLN 5.A O no hydrogen 2.611 N/A VAL 10.A N ARG 6.A O no hydrogen 3.226 N/A VAL 11.A N LEU 7.A O no hydrogen 3.183 N/A ALA 12.A N GLY 8.A O no hydrogen 3.150 N/A VAL 13.A N THR 9.A O no hydrogen 2.787 N/A LEU 14.A N VAL 10.A O no hydrogen 2.867 N/A LYS 15.A N VAL 11.A O no hydrogen 2.980 N/A LYS 15.A NZ ASP 39.A OD2 no hydrogen 2.886 N/A SER 16.A N ALA 12.A O no hydrogen 3.016 N/A SER 16.A OG VAL 13.A O no hydrogen 2.485 N/A VAL 17.A N VAL 13.A O no hydrogen 3.228 N/A ASN 18.A N LYS 15.A O no hydrogen 2.784 N/A ALA 19.A N LEU 14.A O no hydrogen 2.985 N/A LYS 20.A N ASP 93.A OD2 no hydrogen 2.816 N/A LYS 21.A N ASP 93.A OD2 no hydrogen 2.823 N/A VAL 22.A N GLN 44.A O no hydrogen 2.885 N/A ILE 23.A N ALA 94.A O no hydrogen 3.076 N/A ASP 24.A N THR 46.A O no hydrogen 2.718 N/A LEU 25.A N THR 96.A O no hydrogen 2.927 N/A GLY 26.A N VAL 48.A O no hydrogen 2.677 N/A CYS 27.A N VAL 48.A O no hydrogen 2.901 N/A CYS 27.A SG GLY 28.A O no hydrogen 3.821 N/A GLY 28.A N ASP 49.A OD1 no hydrogen 3.121 N/A GLY 30.A N CYS 27.A O no hydrogen 2.957 N/A SER 34.A N GLY 30.A O no hydrogen 2.833 N/A LEU 35.A N ASN 31.A O no hydrogen 3.376 N/A LEU 36.A N LEU 32.A O no hydrogen 2.902 N/A LEU 37.A N LEU 33.A O no hydrogen 2.869 N/A LYS 38.A N LEU 35.A O no hydrogen 3.114 N/A ASP 39.A N LEU 36.A O no hydrogen 3.142 N/A LYS 40.A NZ GLN 71.A OE1 no hydrogen 2.584 N/A SER 41.A N ASP 39.A OD1 no hydrogen 3.072 N/A SER 41.A OG ASP 39.A OD1 no hydrogen 2.447 N/A PHE 42.A N ASP 39.A O no hydrogen 3.055 N/A GLU 43.A N LYS 20.A O no hydrogen 2.815 N/A GLN 44.A N LYS 20.A O no hydrogen 3.184 N/A GLN 44.A NE2 ILE 45.A O no hydrogen 3.361 N/A GLN 44.A NE2 THR 46.A OG1 no hydrogen 3.178 N/A ILE 45.A N ARG 74.A O no hydrogen 2.675 N/A THR 46.A N VAL 22.A O no hydrogen 2.905 N/A THR 46.A OG1 TYR 92.A OH no hydrogen 2.662 N/A GLY 47.A N SER 76.A O no hydrogen 2.835 N/A VAL 48.A N ASP 24.A O no hydrogen 3.026 N/A ASP 49.A N PHE 78.A O no hydrogen 3.396 N/A VAL 54.A N SER 51.A OG no hydrogen 3.263 N/A LEU 55.A N SER 51.A O no hydrogen 3.111 N/A GLU 56.A N TYR 52.A O no hydrogen 2.762 N/A ARG 57.A N SER 53.A O no hydrogen 3.201 N/A ARG 57.A NE GLU 29.A OE2 no hydrogen 2.954 N/A ALA 58.A N VAL 54.A O no hydrogen 2.911 N/A LYS 59.A N LEU 55.A O no hydrogen 2.823 N/A LYS 59.A NZ TYR 52.A OH no hydrogen 2.875 N/A ASP 60.A N GLU 56.A O no hydrogen 3.093 N/A ARG 61.A N ARG 57.A O no hydrogen 2.915 N/A ARG 61.A NE ARG 61.A O no hydrogen 2.874 N/A ARG 61.A NH1 ASN 31.A OD1 no hydrogen 2.607 N/A LEU 62.A N ALA 58.A O no hydrogen 3.022 N/A LYS 63.A N ASP 60.A O no hydrogen 3.012 N/A LYS 63.A NZ ARG 61.A O no hydrogen 3.234 N/A ILE 64.A N LYS 59.A O no hydrogen 3.352 N/A ARG 66.A N LYS 63.A O no hydrogen 2.853 N/A LEU 67.A N LYS 63.A O no hydrogen 3.244 N/A GLN 71.A N PRO 68.A O no hydrogen 3.279 N/A ARG 72.A N PRO 68.A O no hydrogen 3.078 N/A LYS 73.A N GLU 69.A O no hydrogen 3.222 N/A SER 76.A N ILE 45.A O no hydrogen 2.854 N/A PHE 78.A N GLY 47.A O no hydrogen 3.157 N/A GLN 79.A NE2 VAL 50.A O no hydrogen 3.182 N/A SER 80.A N ASP 49.A O no hydrogen 3.206 N/A SER 80.A OG ASP 86.A OD2 no hydrogen 2.954 N/A VAL 83.A N SER 81.A OG no hydrogen 3.284 N/A ARG 88.A N ASP 86.A OD1 no hydrogen 2.786 N/A ARG 88.A NE ASP 86.A OD1 no hydrogen 3.254 N/A ARG 88.A NH2 ASP 86.A OD2 no hydrogen 3.143 N/A PHE 89.A N ASP 86.A O no hydrogen 2.839 N/A SER 90.A N LYS 87.A O no hydrogen 3.210 N/A SER 90.A OG LYS 87.A O no hydrogen 2.864 N/A TYR 92.A OH THR 46.A OG1 no hydrogen 2.662 N/A ASP 93.A N LYS 21.A O no hydrogen 2.880 N/A ALA 94.A N LYS 21.A O no hydrogen 3.166 N/A ALA 95.A N THR 124.A O no hydrogen 2.984 N/A THR 96.A N ILE 23.A O no hydrogen 2.983 N/A THR 96.A OG1 ASP 24.A OD1 no hydrogen 2.509 N/A VAL 97.A N ILE 126.A O no hydrogen 2.726 N/A GLU 99.A N SER 128.A O no hydrogen 2.805 N/A GLU 102.A N GLU 102.A OE1 no hydrogen 2.654 N/A HIS 103.A N VAL 100.A O no hydrogen 3.089 N/A LEU 104.A N ILE 101.A O no hydrogen 3.078 N/A ARG 108.A N ASP 105.A OD1 no hydrogen 2.715 N/A LEU 109.A N ASP 105.A O no hydrogen 2.863 N/A GLN 110.A N GLU 106.A O no hydrogen 3.062 N/A ALA 111.A N ASN 107.A O no hydrogen 3.255 N/A PHE 112.A N ARG 108.A O no hydrogen 2.856 N/A GLU 113.A N LEU 109.A O no hydrogen 2.887 N/A LYS 114.A N GLN 110.A O no hydrogen 3.411 N/A LYS 114.A NZ GLU 118.A OE1 no hydrogen 2.891 N/A LYS 114.A NZ GLU 118.A OE2 no hydrogen 3.226 N/A VAL 115.A N ALA 111.A O no hydrogen 3.171 N/A LEU 116.A N PHE 112.A O no hydrogen 2.944 N/A PHE 117.A N GLU 113.A O no hydrogen 2.827 N/A GLU 118.A N LYS 114.A O no hydrogen 2.915 N/A PHE 119.A N LYS 114.A O no hydrogen 3.046 N/A THR 120.A N VAL 115.A O no hydrogen 2.810 N/A THR 120.A OG1 VAL 115.A O no hydrogen 2.761 N/A ARG 121.A N LEU 116.A O no hydrogen 2.905 N/A ARG 121.A NH1 PHE 117.A O no hydrogen 2.776 N/A ARG 121.A NH1 TYR 168.A O no hydrogen 2.899 N/A ARG 121.A NH2 TYR 168.A O no hydrogen 2.940 N/A GLN 123.A NE2 LEU 195.A O no hydrogen 2.919 N/A THR 124.A N ASP 93.A O no hydrogen 3.294 N/A VAL 125.A N PHE 193.A O no hydrogen 2.774 N/A ILE 126.A N ALA 95.A O no hydrogen 2.911 N/A VAL 127.A N GLY 191.A O no hydrogen 3.002 N/A SER 128.A N VAL 97.A O no hydrogen 3.077 N/A SER 128.A OG GLU 99.A OE2 no hydrogen 2.669 N/A THR 129.A N GLN 189.A O no hydrogen 2.996 N/A THR 129.A OG1 GLU 102.A OE1 no hydrogen 2.916 N/A ASN 131.A N PRO 187.A O no hydrogen 2.905 N/A ASN 131.A ND2 PHE 184.A O no hydrogen 2.847 N/A ASN 131.A ND2 SER 186.A O no hydrogen 2.843 N/A LYS 132.A N TRP 152.A O no hydrogen 2.841 N/A ASN 135.A N ASN 131.A O no hydrogen 2.937 N/A ASN 135.A ND2 GLU 151.A OE1 no hydrogen 3.100 N/A ASN 135.A ND2 GLU 151.A OE2 no hydrogen 3.450 N/A PHE 136.A N LYS 132.A O no hydrogen 2.798 N/A HIS 137.A N GLU 133.A O no hydrogen 3.268 N/A HIS 137.A ND1 GLU 133.A O no hydrogen 3.255 N/A TYR 138.A N TYR 134.A O no hydrogen 2.957 N/A TYR 138.A OH ASP 181.A OD1 no hydrogen 2.475 N/A GLN 139.A N ASN 135.A O no hydrogen 2.681 N/A GLN 139.A NE2 GLU 143.A O no hydrogen 3.211 N/A GLU 143.A N ASN 140.A O no hydrogen 2.876 N/A HIS 148.A NE2 HIS 137.A O no hydrogen 2.419 N/A THR 153.A N GLU 156.A OE1 no hydrogen 2.928 N/A THR 153.A OG1 GLU 156.A OE1 no hydrogen 3.238 N/A ARG 154.A N GLU 133.A OE1 no hydrogen 3.104 N/A ARG 154.A NE GLU 133.A OE1 no hydrogen 2.967 N/A ARG 154.A NH1 GLU 183.A O no hydrogen 3.174 N/A ARG 154.A NH2 GLU 133.A OE2 no hydrogen 2.991 N/A ARG 154.A NH2 GLU 183.A O no hydrogen 2.889 N/A GLU 156.A N THR 153.A OG1 no hydrogen 3.093 N/A PHE 157.A N THR 153.A O no hydrogen 3.013 N/A GLU 158.A N ARG 154.A O no hydrogen 2.787 N/A THR 159.A N LYS 155.A O no hydrogen 2.836 N/A THR 159.A OG1 LYS 155.A O no hydrogen 2.870 N/A TRP 160.A N GLU 156.A O no hydrogen 3.013 N/A TRP 160.A NE1 GLU 113.A OE2 no hydrogen 2.905 N/A ALA 161.A N PHE 157.A O no hydrogen 2.818 N/A VAL 162.A N GLU 158.A O no hydrogen 2.990 N/A LYS 163.A N THR 159.A O no hydrogen 3.014 N/A VAL 164.A N TRP 160.A O no hydrogen 2.955 N/A ALA 165.A N ALA 161.A O no hydrogen 2.979 N/A GLU 166.A N VAL 162.A O no hydrogen 2.896 N/A LYS 167.A N LYS 163.A O no hydrogen 2.948 N/A TYR 168.A N VAL 164.A O no hydrogen 2.863 N/A TYR 170.A N ALA 165.A O no hydrogen 2.908 N/A TYR 170.A OH PRO 122.A O no hydrogen 2.727 N/A SER 171.A N THR 194.A O no hydrogen 2.847 N/A ARG 173.A N VAL 192.A O no hydrogen 2.986 N/A LEU 175.A N MET 190.A O no hydrogen 2.829 N/A ILE 177.A N THR 188.A O no hydrogen 3.102 N/A ASP 181.A N GLY 185.A O no hydrogen 2.529 N/A GLU 183.A N ASP 181.A OD2 no hydrogen 2.724 N/A PHE 184.A N ASP 181.A OD2 no hydrogen 2.844 N/A GLY 185.A N ASP 181.A O no hydrogen 2.721 N/A SER 186.A OG ILE 177.A O no hydrogen 3.461 N/A SER 186.A OG THR 188.A O no hydrogen 3.025 N/A THR 188.A N ILE 177.A O no hydrogen 3.280 N/A GLN 189.A N THR 129.A O no hydrogen 2.926 N/A MET 190.A N LEU 175.A O no hydrogen 3.038 N/A GLY 191.A N VAL 127.A O no hydrogen 2.790 N/A VAL 192.A N ARG 173.A O no hydrogen 2.731 N/A PHE 193.A N VAL 125.A O no hydrogen 2.774 N/A THR 194.A N SER 171.A O no hydrogen 2.925 N/A LEU 195.A N GLN 123.A O no hydrogen 2.956 N/A