Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ks6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 VAL 218.A O no hydrogen 2.748 N/A ARG 3.A N LYS 219.A O no hydrogen 2.888 N/A ARG 3.A NH2 GLU 31.A OE2 no hydrogen 3.063 N/A ILE 4.A N GLU 30.A OE1 no hydrogen 2.865 N/A ALA 5.A N PHE 221.A O no hydrogen 2.936 N/A SER 6.A N GLU 31.A O no hydrogen 2.859 N/A SER 6.A OG THR 25.A OG1 no hydrogen 2.793 N/A HIS 7.A N THR 223.A O no hydrogen 2.808 N/A HIS 7.A ND1 ASP 224.A OD1 no hydrogen 2.653 N/A ARG 8.A N GLU 33.A O no hydrogen 2.895 N/A ARG 8.A NH1 ASP 16.A OD2 no hydrogen 2.806 N/A GLY 9.A N SER 6.A O no hydrogen 3.375 N/A GLY 10.A N HIS 7.A O no hydrogen 2.839 N/A THR 11.A N HIS 7.A O no hydrogen 3.236 N/A THR 11.A OG1 HIS 7.A O no hydrogen 3.170 N/A THR 11.A OG1 ASP 224.A OD1 no hydrogen 2.855 N/A LEU 12.A N ASP 224.A O no hydrogen 3.196 N/A GLU 13.A N GLY 10.A O no hydrogen 2.917 N/A PHE 14.A N GLY 10.A O no hydrogen 2.978 N/A GLY 15.A N THR 11.A O no hydrogen 2.904 N/A SER 17.A N ARG 8.A O no hydrogen 3.045 N/A SER 17.A OG ASP 16.A OD1 no hydrogen 2.784 N/A THR 18.A OG1 PHE 14.A O no hydrogen 2.798 N/A GLY 21.A N THR 18.A OG1 no hydrogen 3.016 N/A PHE 22.A N THR 18.A O no hydrogen 2.932 N/A THR 23.A N PRO 19.A O no hydrogen 2.917 N/A THR 23.A OG1 PRO 19.A O no hydrogen 2.666 N/A ALA 24.A N HIS 20.A O no hydrogen 2.854 N/A THR 25.A N GLY 21.A O no hydrogen 2.821 N/A THR 25.A OG1 SER 6.A OG no hydrogen 2.793 N/A THR 25.A OG1 GLY 9.A O no hydrogen 2.930 N/A THR 25.A OG1 GLY 21.A O no hydrogen 2.986 N/A ALA 26.A N PHE 22.A O no hydrogen 3.157 N/A ALA 27.A N ALA 24.A O no hydrogen 3.138 N/A GLU 30.A N ILE 4.A O no hydrogen 3.195 N/A GLU 31.A N ILE 4.A O no hydrogen 3.156 N/A VAL 32.A N ASN 96.A O no hydrogen 2.931 N/A GLU 33.A N SER 6.A O no hydrogen 2.829 N/A PHE 34.A N ARG 98.A O no hydrogen 3.102 N/A HIS 37.A N VAL 45.A O.A no hydrogen 2.959 N/A HIS 37.A N VAL 45.A O.B no hydrogen 2.975 N/A HIS 37.A ND1 TYR 110.A OH no hydrogen 2.634 N/A HIS 37.A NE2 HIS 48.A O no hydrogen 2.800 N/A THR 39.A N ALA 43.A O no hydrogen 2.970 N/A THR 39.A OG1 ASP 41.A OD1 no hydrogen 2.651 N/A GLY 42.A N THR 39.A O no hydrogen 3.472 N/A ALA 43.A N THR 39.A OG1 no hydrogen 2.969 N/A VAL 45.A N.A HIS 37.A O no hydrogen 2.960 N/A VAL 45.A N.B HIS 37.A O no hydrogen 2.903 N/A HIS 47.A N ASP 35.A O no hydrogen 3.168 N/A LEU 52.A N GLY 59.A O no hydrogen 2.953 N/A THR 56.A N LEU 52.A O no hydrogen 3.259 N/A THR 56.A OG1 LEU 52.A O no hydrogen 2.812 N/A ASP 57.A N THR 72.A O.A no hydrogen 3.248 N/A ASP 57.A N THR 72.A O.B no hydrogen 3.267 N/A THR 58.A OG1 ASP 53.A OD1 no hydrogen 3.385 N/A THR 58.A OG1 ASP 53.A OD2 no hydrogen 2.877 N/A GLY 59.A N ASP 53.A OD1 no hydrogen 2.999 N/A ILE 61.A N PRO 50.A O no hydrogen 2.914 N/A ASP 63.A N ALA 60.A O no hydrogen 2.979 N/A LEU 65.A N ASP 41.A OD1 no hydrogen 2.970 N/A LYS 67.A N THR 64.A OG1 no hydrogen 3.191 N/A VAL 68.A N THR 64.A O no hydrogen 3.099 N/A LYS 69.A N LEU 65.A O no hydrogen 2.859 N/A LYS 69.A NZ PRO 81.A O no hydrogen 2.810 N/A LYS 69.A NZ GLU 85.A OE1 no hydrogen 2.720 N/A LYS 69.A NZ GLU 85.A OE2 no hydrogen 3.387 N/A THR 70.A N LYS 67.A O no hydrogen 2.930 N/A THR 70.A OG1 LYS 67.A O no hydrogen 2.647 N/A ALA 71.A N VAL 68.A O no hydrogen 3.035 N/A THR 72.A N.A ASP 57.A OD1 no hydrogen 2.832 N/A THR 72.A N.B ASP 57.A OD1 no hydrogen 2.875 N/A THR 72.A OG1.A ASP 57.A OD2 no hydrogen 3.554 N/A THR 72.A OG1.B ASP 57.A OD2 no hydrogen 3.232 N/A ILE 73.A N SER 79.A O.A no hydrogen 2.986 N/A ILE 73.A N SER 79.A O.B no hydrogen 2.994 N/A ARG 74.A N.A THR 55.A O no hydrogen 2.742 N/A ARG 74.A N.B THR 55.A O no hydrogen 2.759 N/A ARG 74.A NE.A THR 56.A O no hydrogen 3.275 N/A ARG 74.A NH2.A THR 56.A O no hydrogen 3.338 N/A GLY 76.A N ILE 73.A O no hydrogen 2.956 N/A SER 79.A N.A GLY 76.A O no hydrogen 2.928 N/A SER 79.A N.B GLY 76.A O no hydrogen 2.924 N/A SER 79.A OG.A GLY 76.A O no hydrogen 2.764 N/A SER 79.A OG.B GLY 76.A O no hydrogen 2.917 N/A HIS 80.A ND1 ALA 71.A O no hydrogen 2.608 N/A LEU 83.A N ILE 44.A O no hydrogen 3.041 N/A GLU 85.A N THR 82.A OG1 no hydrogen 3.174 N/A LEU 86.A N THR 82.A O no hydrogen 3.065 N/A CYS 87.A N LEU 83.A O no hydrogen 2.780 N/A CYS 87.A SG LEU 83.A O no hydrogen 3.403 N/A ALA 88.A N GLU 84.A O no hydrogen 2.969 N/A LEU 89.A N GLU 85.A O no hydrogen 3.355 N/A LEU 89.A N LEU 86.A O no hydrogen 3.015 N/A TYR 90.A N CYS 87.A O no hydrogen 2.947 N/A TYR 90.A OH PHE 22.A O no hydrogen 2.697 N/A SER 93.A N TYR 90.A O no hydrogen 3.111 N/A SER 93.A OG ALA 26.A O no hydrogen 2.705 N/A VAL 95.A N SER 93.A OG no hydrogen 2.945 N/A ASN 96.A N GLU 30.A O no hydrogen 3.037 N/A PHE 97.A N ARG 128.A O no hydrogen 2.910 N/A ARG 98.A N VAL 32.A O no hydrogen 2.889 N/A CYS 99.A N THR 130.A O no hydrogen 2.827 N/A GLU 100.A N PHE 34.A O no hydrogen 2.793 N/A ILE 101.A N SER 132.A O no hydrogen 2.986 N/A LYS 102.A NZ.A HIS 48.A O no hydrogen 2.922 N/A GLY 104.A N LEU 108.A O no hydrogen 3.036 N/A GLY 107.A N GLY 104.A O no hydrogen 2.879 N/A LEU 108.A N ASP 106.A OD1 no hydrogen 2.892 N/A TYR 110.A OH HIS 37.A ND1 no hydrogen 2.634 N/A PHE 113.A N TYR 110.A O no hydrogen 3.286 N/A LEU 116.A N GLY 112.A O no hydrogen 3.258 N/A VAL 117.A N PHE 113.A O no hydrogen 2.859 N/A ILE 118.A N VAL 114.A O no hydrogen 2.969 N/A ALA 119.A N ALA 115.A O no hydrogen 2.985 N/A GLY 120.A N LEU 116.A O no hydrogen 2.921 N/A LEU 121.A N VAL 117.A O no hydrogen 2.880 N/A GLU 122.A N ILE 118.A O no hydrogen 2.925 N/A ARG 123.A N ALA 119.A O no hydrogen 2.942 N/A HIS 124.A N GLY 120.A O no hydrogen 3.335 N/A HIS 124.A N LEU 121.A O no hydrogen 3.307 N/A SER 125.A N GLU 122.A O no hydrogen 3.077 N/A ARG 128.A NE ASN 96.A OD1 no hydrogen 2.863 N/A ARG 128.A NH1 TYR 90.A O no hydrogen 3.013 N/A ARG 128.A NH1 VAL 91.A O no hydrogen 3.379 N/A ARG 128.A NH2 TYR 90.A O no hydrogen 2.882 N/A ARG 128.A NH2 VAL 95.A O no hydrogen 2.898 N/A ARG 128.A NH2 ASN 96.A OD1 no hydrogen 3.568 N/A THR 129.A N LEU 126.A O no hydrogen 3.038 N/A THR 130.A N PHE 97.A O no hydrogen 2.887 N/A PHE 131.A N PRO 148.A O no hydrogen 2.942 N/A SER 132.A N CYS 99.A O no hydrogen 2.879 N/A SER 132.A OG CYS 99.A O no hydrogen 3.459 N/A SER 133.A N LEU 150.A O no hydrogen 3.385 N/A SER 133.A OG ILE 101.A O no hydrogen 2.880 N/A LEU 135.A N SER 133.A OG no hydrogen 3.050 N/A GLU 140.A N ALA 137.A O no hydrogen 3.084 N/A LEU 141.A N SER 138.A O no hydrogen 2.995 N/A LYS 143.A N ASP 139.A O no hydrogen 3.343 N/A ALA 144.A N GLU 140.A O no hydrogen 2.999 N/A THR 145.A N LEU 141.A O no hydrogen 2.926 N/A ARG 147.A N THR 145.A OG1 no hydrogen 3.086 N/A ARG 147.A NE THR 129.A O no hydrogen 2.859 N/A ARG 147.A NH2 THR 129.A O no hydrogen 3.255 N/A ARG 149.A NH1 SER 174.A O no hydrogen 3.069 N/A ARG 149.A NH2 SER 174.A O no hydrogen 3.315 N/A LEU 150.A N PHE 131.A O no hydrogen 2.873 N/A TRP 151.A N GLU 177.A O no hydrogen 3.023 N/A TRP 151.A NE1 PHE 134.A O no hydrogen 3.077 N/A LEU 152.A N SER 133.A O no hydrogen 2.924 N/A VAL 153.A N GLY 179.A O no hydrogen 2.855 N/A VAL 157.A N SER 154.A OG no hydrogen 3.200 N/A LEU 158.A N SER 154.A O no hydrogen 2.921 N/A GLN 159.A N.A PRO 155.A O no hydrogen 2.882 N/A GLN 159.A N.B PRO 155.A O no hydrogen 2.899 N/A GLN 160.A N SER 156.A O no hydrogen 2.914 N/A LEU 161.A N VAL 157.A O no hydrogen 2.840 N/A VAL 166.A N GLY 162.A O no hydrogen 2.986 N/A ILE 167.A N PRO 163.A O no hydrogen 2.982 N/A GLU 168.A N.A GLY 164.A O no hydrogen 2.911 N/A GLU 168.A N.B GLY 164.A O no hydrogen 2.949 N/A THR 169.A N ALA 165.A O no hydrogen 2.969 N/A THR 169.A OG1 ALA 165.A O no hydrogen 2.590 N/A ALA 170.A N VAL 166.A O no hydrogen 3.013 N/A ILE 171.A N ILE 167.A O no hydrogen 3.055 N/A ALA 172.A N GLU 168.A O.A no hydrogen 2.915 N/A ALA 172.A N GLU 168.A O.B no hydrogen 2.957 N/A HIS 173.A N THR 169.A O no hydrogen 3.042 N/A HIS 173.A N ALA 170.A O no hydrogen 3.168 N/A HIS 173.A ND1 ASP 139.A OD1 no hydrogen 2.734 N/A SER 174.A N ILE 171.A O no hydrogen 3.055 N/A ILE 175.A N ALA 170.A O no hydrogen 2.922 N/A ILE 178.A N ASP 198.A O no hydrogen 3.214 N/A GLY 179.A N TRP 151.A O no hydrogen 2.810 N/A VAL 180.A N GLY 200.A O no hydrogen 3.045 N/A ILE 182.A N TRP 202.A O no hydrogen 2.839 N/A ASP 183.A N HIS 181.A ND1 no hydrogen 2.998 N/A THR 184.A N HIS 181.A O no hydrogen 2.862 N/A THR 184.A OG1 HIS 181.A O no hydrogen 2.791 N/A ALA 185.A N ILE 182.A O no hydrogen 3.138 N/A LEU 189.A N ASP 186.A OD1 no hydrogen 2.869 N/A GLN 191.A N GLY 188.A O no hydrogen 2.985 N/A VAL 192.A N LEU 189.A O no hydrogen 2.961 N/A ALA 194.A N ALA 190.A O no hydrogen 2.851 N/A ALA 195.A N GLN 191.A O no hydrogen 3.328 N/A ALA 195.A N VAL 192.A O no hydrogen 3.161 N/A GLY 196.A N GLN 193.A O no hydrogen 2.956 N/A LEU 197.A N VAL 192.A O no hydrogen 3.293 N/A ASP 198.A N HIS 176.A O no hydrogen 2.802 N/A GLY 200.A N ILE 178.A O no hydrogen 3.180 N/A CYS 201.A N VAL 220.A O no hydrogen 2.840 N/A TRP 202.A N VAL 180.A O no hydrogen 2.974 N/A TRP 202.A NE1 GLY 179.A O no hydrogen 2.998 N/A ALA 204.A N THR 222.A O no hydrogen 3.200 N/A HIS 205.A N GLN 209.A OE1 no hydrogen 2.978 N/A THR 206.A N GLN 209.A OE1 no hydrogen 3.126 N/A THR 206.A OG1 SER 208.A OG no hydrogen 3.104 N/A THR 206.A OG1 GLN 209.A OE1 no hydrogen 3.253 N/A SER 208.A OG THR 206.A OG1 no hydrogen 3.104 N/A GLN 209.A N THR 206.A OG1 no hydrogen 3.220 N/A GLN 209.A NE2 ASP 183.A OD1 no hydrogen 2.933 N/A ILE 210.A N THR 206.A O no hydrogen 2.858 N/A THR 211.A N PRO 207.A O no hydrogen 2.856 N/A THR 211.A OG1 PRO 207.A O no hydrogen 2.931 N/A LYS 212.A N SER 208.A O no hydrogen 2.866 N/A LYS 212.A NZ ILE 182.A O no hydrogen 2.899 N/A LYS 212.A NZ ALA 185.A O no hydrogen 2.893 N/A ALA 213.A N GLN 209.A O no hydrogen 3.040 N/A LEU 214.A N ILE 210.A O no hydrogen 3.001 N/A ASP 215.A N THR 211.A O no hydrogen 2.781 N/A LEU 216.A N LYS 212.A O no hydrogen 2.768 N/A GLY 217.A N ALA 213.A O no hydrogen 3.060 N/A GLY 217.A N LEU 214.A O no hydrogen 3.180 N/A VAL 218.A N ALA 213.A O no hydrogen 3.342 N/A LYS 219.A N PHE 199.A O no hydrogen 2.890 N/A LYS 219.A NZ GLU 177.A OE1 no hydrogen 2.801 N/A LYS 219.A NZ ASP 198.A OD2 no hydrogen 2.785 N/A PHE 221.A N ARG 3.A O no hydrogen 3.101 N/A THR 222.A N CYS 201.A O no hydrogen 3.198 N/A THR 223.A N ALA 5.A O no hydrogen 3.026 N/A THR 223.A OG1 ALA 204.A O no hydrogen 2.725 N/A ASP 224.A N HIS 205.A ND1 no hydrogen 2.913 N/A ARG 225.A N THR 223.A OG1 no hydrogen 2.964 N/A ARG 225.A NH1 HIS 205.A O no hydrogen 2.840 N/A THR 227.A N GLU 13.A OE2 no hydrogen 2.852 N/A THR 227.A OG1 GLU 13.A OE1 no hydrogen 2.586 N/A THR 227.A OG1 GLU 13.A OE2 no hydrogen 3.394 N/A ALA 229.A N ARG 225.A O no hydrogen 2.903 N/A ILE 230.A N PRO 226.A O no hydrogen 2.895 N/A ALA 231.A N THR 227.A O no hydrogen 3.188 N/A LEU 232.A N LEU 228.A O no hydrogen 2.871 N/A ARG 233.A N ALA 229.A O no hydrogen 2.907 N/A ARG 233.A NH1 THR 2.A O no hydrogen 2.908 N/A ARG 233.A NH1 GLU 30.A OE1 no hydrogen 2.878 N/A ARG 233.A NH1 GLU 30.A OE2 no hydrogen 3.399 N/A ARG 233.A NH2 GLU 30.A OE2 no hydrogen 3.014 N/A THR 234.A N ILE 230.A O no hydrogen 2.977 N/A THR 234.A OG1 ILE 230.A O no hydrogen 3.207 N/A GLU 235.A N ALA 231.A O no hydrogen 3.113 N/A HIS 236.A N LEU 232.A O no hydrogen 2.844 N/A HIS 236.A NE2 ASP 215.A OD1 no hydrogen 2.733 N/A ARG 237.A N ARG 233.A O no hydrogen 2.860 N/A ALA 239.A N HIS 236.A O no hydrogen 2.928 N/A SER 240.A N ARG 237.A O no hydrogen 3.171 N/A