Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ia4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 6.A N ALA 3.A O no hydrogen 3.109 N/A SER 6.A OG ALA 3.A O no hydrogen 2.609 N/A THR 7.A N ASP 212.A OD2 no hydrogen 2.668 N/A THR 7.A OG1 ASP 212.A OD2 no hydrogen 2.641 N/A ASP 9.A N SER 6.A OG no hydrogen 3.393 N/A LYS 10.A N SER 6.A O no hydrogen 2.995 N/A LYS 10.A NZ GLY 80.A O no hydrogen 3.255 N/A LYS 10.A NZ ASP 83.A OD1 no hydrogen 2.767 N/A ILE 11.A N THR 7.A O no hydrogen 2.871 N/A ALA 12.A N LEU 8.A O no hydrogen 3.046 N/A LYS 13.A N ASP 9.A O no hydrogen 2.927 N/A LYS 13.A NZ ASP 9.A OD1 no hydrogen 2.641 N/A ASN 14.A N LYS 10.A O no hydrogen 2.926 N/A ASN 14.A ND2 LYS 10.A O no hydrogen 3.079 N/A GLY 15.A N ILE 11.A O no hydrogen 2.761 N/A VAL 16.A N ILE 11.A O no hydrogen 3.285 N/A ILE 17.A N GLN 62.A O no hydrogen 2.690 N/A VAL 18.A N ASP 83.A OD2 no hydrogen 2.892 N/A VAL 19.A N LYS 64.A O no hydrogen 2.766 N/A GLY 20.A N PHE 84.A O no hydrogen 2.948 N/A HIS 21.A N ILE 66.A O no hydrogen 2.996 N/A HIS 21.A ND1 ARG 22.A O no hydrogen 2.882 N/A ARG 22.A N SER 29.A OG no hydrogen 3.006 N/A ARG 22.A NH2 SER 70.A OG no hydrogen 2.813 N/A ARG 22.A NH2 ASP 159.A OD2 no hydrogen 3.379 N/A SER 24.A OG GLU 183.A OE2 no hydrogen 2.724 N/A SER 25.A N SER 29.A O no hydrogen 3.241 N/A SER 25.A OG SER 88.A OG no hydrogen 2.806 N/A PHE 28.A N SER 25.A O no hydrogen 2.721 N/A SER 29.A N SER 25.A O no hydrogen 2.848 N/A SER 29.A OG GLN 42.A OE1 no hydrogen 2.797 N/A TYR 30.A N VAL 38.A O no hydrogen 2.874 N/A TYR 30.A OH PRO 244.A O no hydrogen 2.904 N/A TYR 31.A OH GLU 23.A OE2 no hydrogen 2.586 N/A ASP 32.A N LYS 36.A O no hydrogen 3.198 N/A GLN 34.A N ASP 32.A OD1 no hydrogen 2.710 N/A LYS 36.A N ASP 32.A OD1 no hydrogen 2.999 N/A VAL 38.A N TYR 30.A O no hydrogen 2.871 N/A TYR 40.A N PRO 27.A O no hydrogen 2.904 N/A TYR 40.A OH ILE 105.A O no hydrogen 2.647 N/A SER 41.A OG GLY 87.A O no hydrogen 2.725 N/A GLN 42.A N PHE 28.A O no hydrogen 3.010 N/A ASP 43.A N GLY 39.A O no hydrogen 2.994 N/A TYR 44.A N SER 41.A O no hydrogen 2.949 N/A TYR 44.A OH TYR 40.A OH no hydrogen 2.869 N/A SER 45.A N SER 41.A O no hydrogen 3.250 N/A ASN 46.A N GLN 42.A O no hydrogen 2.954 N/A ALA 47.A N ASP 43.A O no hydrogen 3.170 N/A ILE 48.A N TYR 44.A O no hydrogen 2.820 N/A VAL 49.A N SER 45.A O no hydrogen 2.871 N/A GLU 50.A N ASN 46.A O no hydrogen 3.064 N/A ALA 51.A N ALA 47.A O no hydrogen 3.049 N/A VAL 52.A N ILE 48.A O no hydrogen 2.947 N/A LYS 53.A N VAL 49.A O no hydrogen 3.010 N/A LYS 54.A N GLU 50.A O no hydrogen 3.083 N/A LYS 55.A N ALA 51.A O no hydrogen 2.892 N/A LEU 56.A N VAL 52.A O no hydrogen 2.955 N/A ASN 57.A N LYS 54.A O no hydrogen 3.027 N/A LYS 58.A N LYS 53.A O no hydrogen 2.919 N/A LEU 61.A N LYS 58.A O no hydrogen 3.117 N/A LYS 64.A N ILE 17.A O no hydrogen 3.028 N/A ILE 66.A N VAL 19.A O no hydrogen 2.921 N/A ILE 68.A N HIS 21.A O no hydrogen 2.922 N/A THR 69.A N ASN 72.A OD1 no hydrogen 2.832 N/A GLN 71.A NE2 GLN 71.A O no hydrogen 3.236 N/A ASN 72.A N THR 69.A OG1 no hydrogen 2.967 N/A ARG 73.A N THR 69.A O no hydrogen 3.019 N/A ARG 73.A NH2 GLY 136.A O no hydrogen 3.150 N/A LEU 76.A N ASN 72.A O no hydrogen 3.082 N/A LEU 77.A N ARG 73.A O no hydrogen 2.961 N/A GLN 78.A N ILE 74.A O no hydrogen 2.950 N/A GLN 78.A NE2 GLN 98.A O no hydrogen 3.165 N/A GLN 78.A NE2 GLN 98.A OE1 no hydrogen 2.677 N/A ASN 79.A N PRO 75.A O no hydrogen 3.406 N/A GLY 80.A N LEU 77.A O no hydrogen 3.087 N/A THR 81.A N LEU 76.A O no hydrogen 2.760 N/A THR 81.A N ASN 79.A OD1 no hydrogen 3.175 N/A THR 81.A OG1 ASN 79.A OD1 no hydrogen 2.678 N/A ASP 83.A N VAL 18.A O no hydrogen 2.745 N/A SER 88.A OG SER 25.A OG no hydrogen 2.806 N/A THR 89.A OG1 GLU 85.A OE1 no hydrogen 2.596 N/A THR 90.A OG1 GLU 203.A OE1 no hydrogen 2.608 N/A ASN 91.A N ALA 204.A O no hydrogen 2.839 N/A ASN 91.A ND2 ASP 265.A O no hydrogen 3.117 N/A ARG 95.A N ASN 92.A OD1 no hydrogen 2.799 N/A ARG 95.A NH1 THR 90.A O no hydrogen 3.009 N/A GLN 96.A N ASN 92.A O no hydrogen 3.120 N/A GLN 96.A N VAL 93.A O no hydrogen 3.085 N/A GLN 96.A NE2 ASN 91.A OD1 no hydrogen 2.888 N/A LYS 97.A N GLU 94.A O no hydrogen 3.241 N/A GLN 98.A N ARG 95.A O no hydrogen 2.909 N/A GLN 98.A NE2 LYS 97.A O no hydrogen 3.371 N/A ALA 99.A N ARG 95.A O no hydrogen 2.850 N/A ALA 100.A N LEU 208.A O no hydrogen 2.872 N/A SER 102.A N CYS 207.A O no hydrogen 2.902 N/A SER 102.A OG ASP 103.A O no hydrogen 2.890 N/A ASP 103.A N ASP 219.A OD1 no hydrogen 2.905 N/A THR 104.A N ASN 264.A O no hydrogen 2.828 N/A THR 104.A OG1 ASN 264.A O no hydrogen 3.495 N/A ILE 105.A N TYR 205.A O no hydrogen 2.898 N/A VAL 108.A N GLU 203.A O no hydrogen 2.899 N/A GLY 109.A N ASP 177.A OD1 no hydrogen 3.201 N/A THR 110.A N SER 201.A O no hydrogen 3.219 N/A THR 110.A OG1 SER 201.A OG no hydrogen 2.762 N/A ARG 111.A NE GLY 197.A O no hydrogen 2.805 N/A ARG 111.A NH2 GLY 197.A O no hydrogen 3.048 N/A LEU 112.A N VAL 196.A O no hydrogen 2.995 N/A LEU 113.A N PHE 175.A O no hydrogen 2.868 N/A THR 114.A N ASP 194.A O no hydrogen 2.944 N/A THR 114.A OG1 VAL 173.A O no hydrogen 2.757 N/A LYS 116.A N ASN 192.A O no hydrogen 2.929 N/A GLY 118.A N LYS 115.A O no hydrogen 3.003 N/A LYS 121.A N ASP 125.A OD2 no hydrogen 2.921 N/A LYS 121.A NZ GLY 118.A O no hydrogen 3.144 N/A ASP 122.A N ASP 125.A OD2 no hydrogen 3.080 N/A ALA 124.A N ASP 122.A OD2 no hydrogen 3.195 N/A ASP 125.A N ASP 122.A O no hydrogen 3.161 N/A LEU 126.A N PHE 123.A O no hydrogen 2.976 N/A LYS 127.A N ALA 124.A O no hydrogen 3.373 N/A LYS 129.A N LEU 126.A O no hydrogen 2.951 N/A VAL 131.A N ARG 153.A O no hydrogen 2.912 N/A VAL 132.A N ALA 174.A O no hydrogen 2.948 N/A VAL 133.A N ILE 155.A O no hydrogen 2.872 N/A THR 134.A OG1 HIS 160.A ND1 no hydrogen 2.872 N/A THR 134.A OG1 SER 163.A OG no hydrogen 2.933 N/A SER 135.A N ALA 157.A O no hydrogen 2.783 N/A SER 135.A OG ALA 157.A O no hydrogen 3.261 N/A GLY 136.A N GLU 140.A OE1 no hydrogen 2.816 N/A THR 137.A OG1 THR 134.A O no hydrogen 2.773 N/A THR 138.A OG1 GLU 203.A OE1 no hydrogen 2.633 N/A THR 138.A OG1 GLU 203.A OE2 no hydrogen 3.206 N/A GLU 140.A N THR 137.A OG1 no hydrogen 3.173 N/A VAL 141.A N THR 137.A O no hydrogen 3.318 N/A LEU 142.A N THR 138.A O no hydrogen 2.912 N/A LEU 143.A N SER 139.A O no hydrogen 2.746 N/A ASN 144.A N GLU 140.A O no hydrogen 3.021 N/A ASN 144.A ND2 GLU 140.A O no hydrogen 2.975 N/A LYS 145.A N VAL 141.A O no hydrogen 3.005 N/A LEU 146.A N LEU 142.A O no hydrogen 2.853 N/A ASN 147.A N LEU 143.A O no hydrogen 2.902 N/A GLU 148.A N ASN 144.A O no hydrogen 3.051 N/A GLU 149.A N LYS 145.A O no hydrogen 2.780 N/A GLN 150.A N LEU 146.A O no hydrogen 2.893 N/A LYS 151.A N GLU 148.A O no hydrogen 3.427 N/A ARG 153.A N LYS 129.A O no hydrogen 2.859 N/A ILE 155.A N VAL 131.A O no hydrogen 2.851 N/A SER 156.A OG GLU 140.A OE2 no hydrogen 2.828 N/A ALA 157.A N VAL 133.A O no hydrogen 2.949 N/A HIS 160.A N ASP 159.A OD2 no hydrogen 2.910 N/A HIS 160.A ND1 THR 134.A OG1 no hydrogen 2.872 N/A SER 163.A N ASP 159.A O no hydrogen 3.034 N/A SER 163.A OG THR 134.A OG1 no hydrogen 2.933 N/A SER 163.A OG ASP 159.A O no hydrogen 3.347 N/A PHE 164.A N HIS 160.A O no hydrogen 2.891 N/A ARG 165.A N GLY 161.A O no hydrogen 2.908 N/A THR 166.A N ASP 162.A O no hydrogen 3.041 N/A THR 166.A N SER 163.A O no hydrogen 3.047 N/A THR 166.A OG1 ASP 162.A O no hydrogen 2.794 N/A LEU 167.A N SER 163.A O no hydrogen 3.241 N/A GLU 168.A N PHE 164.A O no hydrogen 2.821 N/A SER 169.A N ARG 165.A O no hydrogen 2.981 N/A SER 169.A OG ARG 165.A O no hydrogen 2.702 N/A SER 169.A OG THR 166.A O no hydrogen 3.275 N/A GLY 170.A N LEU 167.A O no hydrogen 3.030 N/A ARG 171.A N THR 166.A O no hydrogen 2.865 N/A ARG 171.A NE SER 169.A OG no hydrogen 2.786 N/A ARG 171.A NH1 ARG 165.A O no hydrogen 3.457 N/A ARG 171.A NH1 SER 169.A OG no hydrogen 3.289 N/A VAL 173.A N ALA 130.A O no hydrogen 2.895 N/A PHE 175.A N LEU 113.A O no hydrogen 2.942 N/A ASP 177.A N GLY 109.A O no hydrogen 2.715 N/A LEU 180.A N ASP 176.A O no hydrogen 3.044 N/A ALA 181.A N ASP 177.A O no hydrogen 3.030 N/A GLY 182.A N ALA 178.A O no hydrogen 2.958 N/A GLU 183.A N LEU 179.A O no hydrogen 2.925 N/A ARG 184.A N LEU 180.A O no hydrogen 2.955 N/A ARG 184.A NH1 TRP 193.A O no hydrogen 3.148 N/A ALA 185.A N ALA 181.A O no hydrogen 3.040 N/A LYS 186.A N GLU 183.A O no hydrogen 2.977 N/A LYS 186.A NZ SER 24.A OG no hydrogen 3.096 N/A LYS 186.A NZ GLU 183.A OE1 no hydrogen 2.817 N/A LYS 186.A NZ GLU 183.A OE2 no hydrogen 3.324 N/A ALA 187.A N ARG 184.A O no hydrogen 3.079 N/A LYS 188.A N GLU 168.A OE2 no hydrogen 3.160 N/A ASN 192.A N LYS 189.A O no hydrogen 3.033 N/A TRP 193.A N PRO 190.A O no hydrogen 3.118 N/A ASP 194.A N THR 114.A O no hydrogen 2.832 N/A VAL 196.A N LEU 112.A O no hydrogen 2.743 N/A GLN 200.A N THR 110.A O no hydrogen 3.005 N/A SER 201.A OG THR 110.A OG1 no hydrogen 2.762 N/A SER 201.A OG GLU 203.A OE2 no hydrogen 2.623 N/A GLU 203.A N VAL 108.A O no hydrogen 2.842 N/A TYR 205.A N PHE 106.A O no hydrogen 2.773 N/A TYR 205.A OH ASP 176.A OD2 no hydrogen 2.623 N/A GLY 206.A N THR 89.A O no hydrogen 3.160 N/A CYS 207.A N SER 102.A OG no hydrogen 2.906 N/A ARG 209.A NH1 LEU 77.A O no hydrogen 2.953 N/A ARG 209.A NH1 PHE 82.A O no hydrogen 2.857 N/A ARG 209.A NH2 ASP 83.A OD1 no hydrogen 2.871 N/A LYS 210.A NZ LYS 97.A O no hydrogen 2.838 N/A PHE 215.A N ASP 212.A OD1 no hydrogen 3.221 N/A LYS 216.A N ASP 212.A O no hydrogen 3.162 N/A LYS 216.A NZ PHE 101.A O no hydrogen 2.706 N/A LYS 216.A NZ ASP 219.A OD1 no hydrogen 3.563 N/A LYS 216.A NZ ASP 219.A OD2 no hydrogen 2.734 N/A LYS 216.A NZ ASP 265.A OD1 no hydrogen 2.776 N/A LYS 217.A N PRO 213.A O no hydrogen 2.853 N/A LYS 217.A NZ ASP 220.A OD2 no hydrogen 3.018 N/A LEU 218.A N GLN 214.A O no hydrogen 3.118 N/A ASP 220.A N LYS 217.A O no hydrogen 2.799 N/A THR 221.A N LEU 218.A O no hydrogen 3.120 N/A THR 221.A OG1 LEU 218.A O no hydrogen 2.767 N/A ALA 223.A N ASP 219.A O no hydrogen 2.783 N/A GLN 224.A N ASP 220.A O no hydrogen 3.262 N/A VAL 225.A N THR 221.A O no hydrogen 3.173 N/A GLN 226.A N ILE 222.A O no hydrogen 2.887 N/A GLN 226.A NE2 TYR 44.A OH no hydrogen 3.112 N/A GLN 226.A NE2 THR 104.A O no hydrogen 3.091 N/A THR 227.A N ALA 223.A O no hydrogen 2.877 N/A THR 227.A OG1 ALA 223.A O no hydrogen 2.700 N/A SER 228.A N GLN 224.A O no hydrogen 3.184 N/A SER 228.A OG GLN 224.A O no hydrogen 2.761 N/A SER 228.A OG VAL 225.A O no hydrogen 3.170 N/A GLY 229.A N GLN 226.A O no hydrogen 3.310 N/A GLU 230.A N SER 228.A OG no hydrogen 3.349 N/A ALA 231.A N VAL 225.A O no hydrogen 2.938 N/A LYS 233.A N GLY 229.A O no hydrogen 3.380 N/A TRP 234.A N GLU 230.A O no hydrogen 2.956 N/A PHE 235.A N ALA 231.A O no hydrogen 2.863 N/A ASP 236.A N GLU 232.A O no hydrogen 2.928 N/A LYS 237.A N LYS 233.A O no hydrogen 3.114 N/A TRP 238.A N TRP 234.A O no hydrogen 3.040 N/A TRP 238.A NE1 ASP 43.A OD2 no hydrogen 2.796 N/A PHE 239.A N PHE 235.A O no hydrogen 2.703 N/A LYS 240.A N ASP 236.A O no hydrogen 2.956 N/A ASN 241.A ND2 ASP 236.A O no hydrogen 2.890 N/A ILE 243.A N LEU 248.A O no hydrogen 2.902 N/A LYS 246.A NZ LYS 186.A O no hydrogen 3.097 N/A LYS 246.A NZ ALA 187.A O no hydrogen 3.209 N/A ASN 249.A ND2 LYS 240.A O no hydrogen 2.907 N/A ASN 250.A N PHE 239.A O no hydrogen 3.119 N/A PHE 251.A N PHE 239.A O no hydrogen 2.860 N/A ALA 258.A N ASP 255.A O no hydrogen 2.897 N/A LEU 259.A N GLU 256.A O no hydrogen 3.075 N/A LYS 261.A N LYS 257.A O no hydrogen 3.285 N/A LYS 261.A N ALA 258.A O no hydrogen 3.172 N/A GLU 262.A N ALA 258.A O no hydrogen 3.250 N/A ASN 269.A ND2 GLN 202.A O no hydrogen 3.571 N/A