Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sia_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 6.A N CYS 3.A O no hydrogen 3.158 N/A MET 15.A N SER 13.A OG no hydrogen 3.413 N/A GLY 16.A N SER 13.A O no hydrogen 2.989 N/A ALA 17.A N TRP 14.A O no hydrogen 3.285 N/A ILE 20.A N GLY 16.A O no hydrogen 3.014 N/A TYR 21.A N ALA 17.A O no hydrogen 2.868 N/A GLN 22.A N ALA 18.A O no hydrogen 3.381 N/A GLN 22.A N CYS 19.A O no hydrogen 3.237 N/A MET 23.A N CYS 19.A O no hydrogen 3.224 N/A MET 23.A N ILE 20.A O no hydrogen 3.274 N/A SER 26.A OG ASP 93.A OD1 no hydrogen 2.816 N/A VAL 27.A N PRO 24.A O no hydrogen 2.959 N/A ARG 28.A N PRO 24.A O no hydrogen 3.162 N/A ARG 28.A NH1 ILE 20.A O no hydrogen 2.570 N/A ARG 28.A NH1 MET 23.A O no hydrogen 2.585 N/A ASN 29.A N PRO 25.A O no hydrogen 2.827 N/A THR 30.A N VAL 27.A O no hydrogen 3.306 N/A TRP 31.A NE1 SER 178.A OG no hydrogen 2.935 N/A TRP 32.A NE1 ILE 89.A O no hydrogen 2.911 N/A PHE 33.A N THR 30.A O no hydrogen 3.298 N/A LEU 35.A N TRP 32.A O no hydrogen 2.903 N/A LEU 36.A N PHE 33.A O no hydrogen 2.826 N/A ASN 37.A N PRO 34.A O no hydrogen 3.181 N/A THR 38.A N LEU 35.A O no hydrogen 3.102 N/A THR 38.A OG1 LEU 35.A O no hydrogen 2.590 N/A ILE 39.A N LEU 36.A O no hydrogen 3.449 N/A GLN 43.A N PRO 40.A O no hydrogen 2.986 N/A GLN 43.A NE2 ASP 42.A OD2 no hydrogen 3.005 N/A TYR 44.A N LEU 41.A O no hydrogen 2.971 N/A ARG 46.A NE TYR 107.A OH no hydrogen 3.516 N/A ILE 47.A N GLN 43.A O no hydrogen 2.845 N/A TYR 48.A N TYR 44.A O no hydrogen 2.879 N/A GLN 49.A N THR 45.A O no hydrogen 2.921 N/A TRP 50.A N ARG 46.A O no hydrogen 3.048 N/A TRP 50.A NE1 GLN 71.A O no hydrogen 2.709 N/A PHE 51.A N ILE 47.A O no hydrogen 2.906 N/A MET 52.A N TYR 48.A O no hydrogen 2.932 N/A GLY 53.A N GLN 49.A O no hydrogen 3.213 N/A VAL 54.A N TRP 50.A O no hydrogen 3.074 N/A ASP 55.A N PHE 51.A O no hydrogen 2.880 N/A ASP 57.A N GLU 66.A OE2 no hydrogen 3.293 N/A ARG 58.A N ASP 55.A O no hydrogen 3.203 N/A SER 59.A N ASP 55.A OD1 no hydrogen 3.175 N/A SER 59.A N ASP 57.A OD1 no hydrogen 3.354 N/A SER 59.A OG ASP 55.A OD1 no hydrogen 3.477 N/A SER 59.A OG ASP 57.A OD1 no hydrogen 3.231 N/A SER 59.A OG THR 61.A OG1 no hydrogen 2.765 N/A SER 59.A OG GLU 63.A OE1 no hydrogen 3.520 N/A GLY 60.A N ASP 55.A OD2 no hydrogen 2.792 N/A THR 61.A N SER 59.A OG no hydrogen 3.198 N/A THR 61.A OG1 SER 59.A OG no hydrogen 2.765 N/A THR 61.A OG1 GLU 63.A OE2 no hydrogen 2.555 N/A LEU 62.A N ILE 98.A O no hydrogen 2.889 N/A GLU 63.A N GLU 66.A OE1 no hydrogen 2.997 N/A LEU 67.A N GLU 63.A O no hydrogen 3.129 N/A MET 68.A N ILE 64.A O no hydrogen 2.898 N/A MET 69.A N ASN 65.A O no hydrogen 2.973 N/A GLY 70.A N LEU 67.A O no hydrogen 3.447 N/A PHE 72.A N ILE 76.A O no hydrogen 3.104 N/A ARG 77.A N ASN 164.A OD1 no hydrogen 2.884 N/A ARG 77.A NH2 MET 68.A O no hydrogen 2.728 N/A SER 79.A OG THR 82.A OG1 no hydrogen 3.250 N/A THR 82.A N SER 79.A OG no hydrogen 3.087 N/A THR 82.A OG1 SER 79.A OG no hydrogen 3.250 N/A ALA 83.A N SER 79.A O no hydrogen 2.942 N/A LEU 84.A N PRO 80.A O no hydrogen 3.073 N/A ARG 85.A N GLN 81.A O no hydrogen 3.056 N/A ARG 85.A NH1 GLN 81.A OE1 no hydrogen 3.422 N/A MET 86.A N THR 82.A O no hydrogen 2.937 N/A MET 87.A N ALA 83.A O no hydrogen 3.019 N/A ARG 88.A N LEU 84.A O no hydrogen 2.943 N/A ILE 89.A N ARG 85.A O no hydrogen 2.904 N/A PHE 90.A N MET 86.A O no hydrogen 3.003 N/A ASP 91.A N MET 87.A O no hydrogen 2.956 N/A THR 92.A OG1 GLU 102.A OE2 no hydrogen 3.062 N/A PHE 94.A N ASP 91.A O no hydrogen 3.059 N/A ASN 95.A N ASP 91.A OD1 no hydrogen 3.083 N/A GLY 96.A N ASP 91.A OD2 no hydrogen 2.642 N/A HIS 97.A N ASN 95.A OD1 no hydrogen 3.091 N/A HIS 97.A ND1 GLU 63.A OE2 no hydrogen 2.581 N/A ILE 98.A N LEU 62.A O no hydrogen 2.806 N/A SER 99.A N GLU 102.A OE1 no hydrogen 3.031 N/A GLU 102.A N SER 99.A OG no hydrogen 3.223 N/A PHE 103.A N SER 99.A O no hydrogen 2.766 N/A MET 104.A N PHE 100.A O no hydrogen 2.795 N/A ALA 105.A N TYR 101.A O no hydrogen 3.314 N/A MET 106.A N GLU 102.A O no hydrogen 3.056 N/A TYR 107.A N PHE 103.A O no hydrogen 2.690 N/A LYS 108.A N MET 104.A O no hydrogen 3.002 N/A PHE 109.A N ALA 105.A O no hydrogen 2.941 N/A MET 110.A N MET 106.A O no hydrogen 2.940 N/A GLU 111.A N TYR 107.A O no hydrogen 2.898 N/A LEU 112.A N LYS 108.A O no hydrogen 2.792 N/A ALA 113.A N PHE 109.A O no hydrogen 2.925 N/A TYR 114.A N MET 110.A O no hydrogen 2.805 N/A ASN 115.A N GLU 111.A O no hydrogen 2.975 N/A LEU 116.A N LEU 112.A O no hydrogen 3.106 N/A PHE 117.A N ALA 113.A O no hydrogen 2.995 N/A VAL 118.A N TYR 114.A O no hydrogen 3.068 N/A MET 119.A N ASN 115.A O no hydrogen 3.013 N/A ASN 120.A N LEU 116.A O no hydrogen 2.945 N/A ASN 120.A N PHE 117.A O no hydrogen 3.101 N/A ASN 120.A ND2 LEU 116.A O no hydrogen 2.855 N/A ASN 120.A ND2 GLN 139.A OE1 no hydrogen 2.983 N/A ALA 121.A N PHE 117.A O no hydrogen 2.848 N/A ARG 122.A N ASN 120.A O no hydrogen 2.923 N/A ARG 122.A N GLU 132.A OE2 no hydrogen 3.080 N/A ALA 123.A N GLU 132.A OE2 no hydrogen 2.897 N/A THR 127.A N ARG 124.A O no hydrogen 3.313 N/A THR 127.A OG1 ARG 124.A O no hydrogen 3.324 N/A LEU 128.A N CYS 161.A O no hydrogen 2.841 N/A GLU 129.A N GLU 132.A OE1 no hydrogen 3.000 N/A GLU 132.A N GLU 129.A O no hydrogen 3.086 N/A ILE 133.A N PRO 130.A O no hydrogen 3.354 N/A ALA 136.A N GLU 132.A O no hydrogen 3.327 N/A LEU 137.A N ILE 133.A O no hydrogen 2.992 N/A GLN 138.A N LEU 134.A O no hydrogen 3.023 N/A GLN 139.A N PRO 135.A O no hydrogen 2.933 N/A GLN 139.A NE2 ASN 120.A OD1 no hydrogen 3.613 N/A LEU 140.A N ALA 136.A O no hydrogen 3.179 N/A GLY 141.A N GLN 138.A O no hydrogen 2.945 N/A PHE 142.A N LEU 137.A O no hydrogen 2.865 N/A ASN 145.A N ASP 205.A OD1 no hydrogen 3.267 N/A THR 148.A N ASN 145.A OD1 no hydrogen 2.914 N/A THR 148.A OG1 ASN 145.A OD1 no hydrogen 2.835 N/A THR 148.A OG1 ASP 205.A OD1 no hydrogen 2.953 N/A SER 149.A N ASN 145.A O no hydrogen 2.988 N/A SER 149.A OG GLN 146.A O no hydrogen 2.871 N/A LEU 150.A N GLN 146.A O no hydrogen 3.019 N/A LEU 151.A N ARG 147.A O no hydrogen 2.963 N/A LEU 152.A N THR 148.A O no hydrogen 2.847 N/A HIS 153.A N SER 149.A O no hydrogen 3.133 N/A HIS 153.A NE2 MET 158.A O no hydrogen 3.160 N/A HIS 153.A NE2 ALA 159.A O no hydrogen 3.133 N/A ARG 154.A N LEU 150.A O no hydrogen 3.085 N/A LEU 155.A N LEU 151.A O no hydrogen 2.901 N/A PHE 156.A N LEU 152.A O no hydrogen 2.965 N/A ALA 157.A N HIS 153.A O no hydrogen 2.828 N/A CYS 161.A N LEU 128.A O no hydrogen 2.823 N/A CYS 161.A SG ASP 162.A O no hydrogen 3.683 N/A CYS 165.A N ASP 162.A OD1 no hydrogen 2.891 N/A CYS 165.A SG PHE 156.A O no hydrogen 3.220 N/A CYS 165.A SG ASP 162.A OD1 no hydrogen 3.292 N/A TRP 166.A N ASP 162.A O no hydrogen 2.925 N/A TRP 166.A NE1 ALA 113.A O no hydrogen 2.823 N/A ILE 167.A N LEU 163.A O no hydrogen 2.950 N/A ALA 168.A N ASN 164.A O no hydrogen 3.011 N/A ILE 169.A N CYS 165.A O no hydrogen 3.019 N/A CYS 170.A N TRP 166.A O no hydrogen 2.889 N/A CYS 170.A SG TRP 166.A O no hydrogen 3.409 N/A ALA 171.A N ILE 167.A O no hydrogen 2.844 N/A PHE 172.A N ALA 168.A O no hydrogen 3.054 N/A ALA 173.A N ILE 169.A O no hydrogen 3.016 N/A ALA 174.A N CYS 170.A O no hydrogen 2.921 N/A GLN 175.A N ALA 171.A O no hydrogen 2.825 N/A THR 176.A N PHE 172.A O no hydrogen 2.934 N/A THR 176.A OG1 PHE 172.A O no hydrogen 2.856 N/A ARG 177.A N ALA 173.A O no hydrogen 3.118 N/A ARG 177.A NH1 ARG 177.A O no hydrogen 2.999 N/A SER 178.A N ALA 174.A O no hydrogen 3.043 N/A SER 178.A OG ALA 174.A O no hydrogen 3.550 N/A ALA 179.A N GLN 175.A O no hydrogen 2.880 N/A TYR 180.A N THR 176.A O no hydrogen 2.852 N/A GLN 181.A N ARG 177.A O no hydrogen 3.036 N/A GLN 181.A NE2 ASN 29.A O no hydrogen 3.033 N/A MET 182.A N SER 178.A O no hydrogen 2.902 N/A ILE 183.A N ALA 179.A O no hydrogen 2.797 N/A PHE 184.A N TYR 180.A O no hydrogen 3.006 N/A MET 185.A N GLN 181.A O no hydrogen 3.127 N/A MET 185.A N MET 182.A O no hydrogen 3.200 N/A ASN 186.A N ILE 183.A O no hydrogen 3.056 N/A TYR 188.A N ASN 186.A OD1 no hydrogen 2.998 N/A TYR 189.A N ASN 186.A O no hydrogen 3.099 N/A GLY 190.A N PRO 187.A O no hydrogen 3.053 N/A GLU 199.A N ASN 196.A OD1 no hydrogen 2.910 N/A PHE 200.A N ASN 196.A O no hydrogen 2.875 N/A GLY 201.A N PRO 197.A O no hydrogen 2.851 N/A LYS 202.A N MET 198.A O no hydrogen 3.232 N/A LYS 202.A NZ GLU 199.A OE1 no hydrogen 3.247 N/A PHE 203.A N GLU 199.A O no hydrogen 3.162 N/A LEU 204.A N PHE 200.A O no hydrogen 2.823 N/A ASP 205.A N GLY 201.A O no hydrogen 2.973 N/A VAL 206.A N LYS 202.A O no hydrogen 3.031 N/A VAL 207.A N PHE 203.A O no hydrogen 2.923 N/A THR 208.A N LEU 204.A O no hydrogen 2.881 N/A THR 208.A OG1 LEU 204.A O no hydrogen 2.772 N/A SER 209.A N ASP 205.A O no hydrogen 3.260 N/A SER 209.A N VAL 206.A O no hydrogen 3.069 N/A SER 209.A OG VAL 206.A O no hydrogen 2.449 N/A LEU 210.A N VAL 207.A O no hydrogen 2.998 N/A LEU 211.A N THR 208.A O no hydrogen 3.014 N/A