Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bsw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH1 TYR 24.A OH no hydrogen 2.965 N/A ARG 1.A NH1 ASN 73.A O no hydrogen 2.871 N/A ARG 1.A NH2 ASN 73.A O no hydrogen 2.836 N/A THR 2.A N ASP 46.A OD2 no hydrogen 2.923 N/A THR 2.A OG1 LYS 4.A O no hydrogen 2.475 N/A ILE 5.A N GLU 26.A O no hydrogen 3.034 N/A TYR 6.A N ASP 46.A O no hydrogen 2.915 N/A TYR 6.A OH PRO 43.A O no hydrogen 2.773 N/A ILE 7.A N ILE 28.A O no hydrogen 2.832 N/A TYR 8.A N PHE 48.A O no hydrogen 2.910 N/A CYS 15.A N HIS 11.A O no hydrogen 2.962 N/A CYS 15.A SG HIS 11.A O no hydrogen 3.599 N/A GLU 16.A N GLY 12.A O no hydrogen 2.848 N/A ASP 17.A N LEU 13.A O no hydrogen 2.945 N/A VAL 18.A N VAL 14.A O no hydrogen 3.111 N/A ALA 19.A N CYS 15.A O no hydrogen 2.842 N/A LYS 20.A N GLU 16.A O no hydrogen 2.896 N/A LYS 20.A NZ GLU 16.A OE2 no hydrogen 3.029 N/A ASN 21.A N ASP 17.A O no hydrogen 2.942 N/A MET 22.A N VAL 18.A O no hydrogen 3.042 N/A GLY 23.A N ALA 19.A O no hydrogen 3.190 N/A GLY 23.A N LYS 20.A O no hydrogen 3.041 N/A TYR 24.A N ALA 19.A O no hydrogen 3.086 N/A TYR 24.A OH ASP 46.A OD2 no hydrogen 2.535 N/A LYS 25.A N GLU 3.A O no hydrogen 2.705 N/A LYS 25.A NZ GLY 23.A O no hydrogen 2.813 N/A GLU 26.A N GLU 3.A O no hydrogen 3.445 N/A ILE 28.A N ILE 5.A O no hydrogen 2.857 N/A LEU 30.A N ILE 7.A O no hydrogen 2.947 N/A PHE 38.A N GLY 35.A O no hydrogen 3.088 N/A GLU 39.A N MET 36.A O no hydrogen 2.915 N/A SER 40.A N LYS 37.A O no hydrogen 3.301 N/A SER 40.A OG LYS 37.A O no hydrogen 2.671 N/A THR 41.A N PHE 38.A O no hydrogen 3.033 N/A THR 41.A OG1 PHE 38.A O no hydrogen 2.692 N/A LEU 42.A N GLU 39.A O no hydrogen 2.901 N/A LYS 44.A NZ SER 40.A O no hydrogen 2.558 N/A LYS 44.A NZ LEU 42.A O no hydrogen 2.668 N/A TYR 45.A N PRO 43.A O no hydrogen 2.920 N/A ASP 46.A N THR 2.A OG1 no hydrogen 2.974 N/A PHE 47.A N LYS 70.A O no hydrogen 2.865 N/A PHE 48.A N TYR 6.A O no hydrogen 2.831 N/A ALA 50.A N TYR 8.A O no hydrogen 2.657 N/A ASN 54.A ND2 CYS 147.A O no hydrogen 3.230 N/A ILE 56.A N ASN 53.A OD1 no hydrogen 3.100 N/A ARG 57.A N ASN 53.A O no hydrogen 3.037 N/A ARG 57.A NE GLY 110.A O no hydrogen 2.826 N/A ARG 57.A NH1 ASN 54.A OD1 no hydrogen 2.801 N/A ARG 57.A NH1 GLY 110.A O no hydrogen 2.891 N/A ARG 57.A NH2 ILE 51.A O no hydrogen 2.793 N/A ARG 57.A NH2 GLY 52.A O no hydrogen 3.037 N/A ARG 57.A NH2 ASN 54.A OD1 no hydrogen 3.217 N/A LYS 58.A N ASN 54.A O no hydrogen 3.191 N/A LYS 58.A NZ GLU 127.A OE2 no hydrogen 3.150 N/A LYS 59.A N GLU 55.A O no hydrogen 3.198 N/A ILE 60.A N ILE 56.A O no hydrogen 2.902 N/A TYR 61.A N ARG 57.A O no hydrogen 2.804 N/A GLN 62.A N LYS 58.A O no hydrogen 2.947 N/A LYS 63.A N LYS 59.A O no hydrogen 3.055 N/A ILE 64.A N ILE 60.A O no hydrogen 2.756 N/A SER 65.A N TYR 61.A O no hydrogen 3.017 N/A SER 65.A OG TYR 61.A O no hydrogen 2.760 N/A GLU 66.A N GLN 62.A O no hydrogen 3.214 N/A ASN 67.A N ILE 64.A O no hydrogen 3.046 N/A GLY 68.A N SER 65.A O no hydrogen 3.308 N/A VAL 72.A N PHE 47.A O no hydrogen 2.965 N/A ASN 73.A ND2 GLU 88.A O no hydrogen 2.835 N/A LEU 74.A N ILE 93.A O no hydrogen 2.901 N/A HIS 76.A N ILE 95.A O no hydrogen 2.911 N/A HIS 76.A ND1 SER 78.A OG no hydrogen 2.809 N/A LYS 77.A N ASN 21.A OD1 no hydrogen 2.798 N/A SER 78.A N HIS 76.A ND1 no hydrogen 3.095 N/A SER 78.A OG HIS 76.A ND1 no hydrogen 2.809 N/A ALA 79.A N HIS 76.A O no hydrogen 3.018 N/A LEU 80.A N VAL 99.A O no hydrogen 2.863 N/A SER 82.A N ILE 101.A O no hydrogen 2.924 N/A SER 82.A OG SER 84.A OG no hydrogen 3.236 N/A SER 84.A N SER 82.A OG no hydrogen 3.240 N/A SER 84.A OG SER 82.A OG no hydrogen 3.236 N/A ALA 85.A N SER 82.A O no hydrogen 2.916 N/A ILE 86.A N ALA 105.A O no hydrogen 2.841 N/A GLU 88.A N ILE 107.A O no hydrogen 3.165 N/A ALA 91.A N ASN 73.A OD1 no hydrogen 2.970 N/A ILE 93.A N ASN 73.A OD1 no hydrogen 3.003 N/A LEU 94.A N VAL 111.A O no hydrogen 2.977 N/A ILE 95.A N LEU 74.A O no hydrogen 2.801 N/A MET 96.A N LEU 113.A O no hydrogen 2.996 N/A TYR 98.A N SER 78.A OG no hydrogen 2.945 N/A VAL 100.A N SER 117.A O no hydrogen 3.272 N/A ILE 101.A N LEU 80.A O no hydrogen 2.794 N/A ASN 102.A N ILE 119.A O no hydrogen 2.883 N/A LYS 104.A N SER 84.A OG no hydrogen 3.110 N/A ALA 105.A N ASN 102.A O no hydrogen 3.217 N/A LYS 106.A N CYS 123.A O no hydrogen 2.796 N/A ILE 107.A N ILE 86.A O no hydrogen 2.817 N/A GLU 108.A N ILE 125.A O no hydrogen 3.062 N/A GLY 110.A N ALA 91.A O no hydrogen 2.787 N/A VAL 111.A N GLU 108.A O no hydrogen 3.404 N/A ILE 112.A N SER 129.A O no hydrogen 2.904 N/A LEU 113.A N LEU 94.A O no hydrogen 2.861 N/A ASN 114.A N VAL 131.A O no hydrogen 2.849 N/A THR 115.A N ASN 114.A OD1 no hydrogen 2.795 N/A THR 115.A OG1 ASN 114.A OD1 no hydrogen 3.468 N/A SER 116.A N PRO 97.A O no hydrogen 3.087 N/A SER 117.A N ASN 114.A O no hydrogen 3.061 N/A SER 117.A OG ASN 114.A O no hydrogen 2.752 N/A VAL 118.A N ALA 135.A O no hydrogen 3.154 N/A ILE 119.A N VAL 100.A O no hydrogen 2.840 N/A GLU 120.A N CYS 137.A O no hydrogen 3.014 N/A HIS 121.A ND1 GLU 122.A OE1 no hydrogen 2.735 N/A GLU 122.A N ALA 103.A O no hydrogen 2.962 N/A CYS 123.A SG GLU 120.A O no hydrogen 3.397 N/A CYS 123.A SG CYS 137.A O no hydrogen 3.984 N/A CYS 123.A SG ALA 138.A O no hydrogen 2.975 N/A VAL 124.A N VAL 141.A O no hydrogen 2.935 N/A ILE 125.A N LYS 106.A O no hydrogen 2.841 N/A GLY 126.A N ILE 143.A O no hydrogen 2.788 N/A GLU 127.A N GLU 108.A OE1 no hydrogen 3.050 N/A PHE 128.A N LYS 109.A O no hydrogen 2.807 N/A SER 129.A N GLY 126.A O no hydrogen 3.211 N/A SER 129.A OG GLY 126.A O no hydrogen 3.214 N/A SER 129.A OG GLY 144.A O no hydrogen 2.710 N/A SER 129.A OG CYS 147.A O no hydrogen 3.568 N/A HIS 130.A N CYS 147.A O no hydrogen 2.870 N/A HIS 130.A ND1 GLY 52.A O no hydrogen 3.071 N/A VAL 131.A N ILE 112.A O no hydrogen 2.814 N/A SER 132.A N LEU 149.A O no hydrogen 2.947 N/A SER 132.A OG LEU 149.A O no hydrogen 2.777 N/A GLY 134.A N THR 115.A O no hydrogen 2.985 N/A ALA 135.A N SER 132.A O no hydrogen 3.094 N/A LYS 136.A N SER 153.A O no hydrogen 2.942 N/A LYS 136.A NZ GLY 134.A O no hydrogen 2.778 N/A CYS 137.A N VAL 118.A O no hydrogen 2.891 N/A ALA 138.A N VAL 155.A O no hydrogen 3.010 N/A ASN 140.A N HIS 121.A O no hydrogen 2.884 N/A LYS 142.A N LEU 159.A O no hydrogen 2.929 N/A LYS 142.A NZ GLU 122.A O no hydrogen 2.779 N/A LYS 142.A NZ ASN 140.A OD1.B no hydrogen 3.136 N/A ILE 143.A N VAL 124.A O no hydrogen 2.797 N/A GLY 144.A N LEU 161.A O no hydrogen 2.838 N/A LYS 145.A N ASP 163.A OD1 no hydrogen 2.890 N/A ASN 146.A N GLU 127.A O no hydrogen 2.901 N/A ASN 146.A ND2 ASP 164.A OD1 no hydrogen 3.403 N/A CYS 147.A N SER 129.A OG no hydrogen 2.884 N/A CYS 147.A SG GLY 144.A O no hydrogen 3.583 N/A CYS 147.A SG LYS 145.A O no hydrogen 3.857 N/A CYS 147.A SG ALA 162.A O no hydrogen 3.181 N/A PHE 148.A N SER 165.A O no hydrogen 2.976 N/A LEU 149.A N HIS 130.A O no hydrogen 2.893 N/A GLY 150.A N LEU 167.A O no hydrogen 2.751 N/A ASN 152.A N VAL 133.A O no hydrogen 3.022 N/A SER 153.A N GLY 150.A O no hydrogen 3.103 N/A SER 153.A OG GLY 150.A O no hydrogen 2.718 N/A CYS 154.A N ALA 171.A O no hydrogen 2.921 N/A CYS 154.A SG THR 172.A OG1 no hydrogen 3.503 N/A VAL 155.A N LYS 136.A O no hydrogen 3.035 N/A LEU 156.A N LEU 173.A O no hydrogen 3.140 N/A ASN 158.A N GLY 139.A O no hydrogen 2.911 N/A LEU 161.A N LYS 142.A O no hydrogen 2.800 N/A ASP 164.A N LYS 145.A O no hydrogen 2.926 N/A SER 165.A OG ALA 162.A O no hydrogen 2.813 N/A ILE 166.A N GLY 181.A O no hydrogen 3.018 N/A LEU 167.A N PHE 148.A O no hydrogen 2.797 N/A GLY 168.A N PHE 183.A O no hydrogen 2.787 N/A GLY 170.A N ILE 151.A O no hydrogen 2.768 N/A ALA 171.A N GLY 168.A O no hydrogen 3.198 N/A LEU 173.A N CYS 154.A O no hydrogen 2.839 N/A GLN 177.A N SER 160.A O no hydrogen 2.855 N/A GLN 177.A NE2 LYS 175.A O no hydrogen 3.402 N/A GLY 181.A N SER 165.A OG no hydrogen 3.152 N/A PHE 183.A N ILE 166.A O no hydrogen 2.817 N/A