Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ipi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N ASN 1.A O no hydrogen 3.100 N/A TRP 5.A N ILE 2.A O no hydrogen 2.857 N/A GLU 7.A N GLU 7.A OE1 no hydrogen 2.776 N/A ARG 9.A N TRP 5.A O no hydrogen 3.101 N/A ARG 9.A NH1 GLU 4.A O no hydrogen 2.801 N/A TYR 10.A N GLU 6.A O no hydrogen 2.954 N/A TYR 10.A OH SER 58.A O no hydrogen 2.905 N/A VAL 11.A N GLU 7.A O no hydrogen 3.149 N/A GLU 12.A N TYR 8.A O no hydrogen 2.935 N/A ALA 13.A N ARG 9.A O no hydrogen 2.928 N/A GLY 14.A N TYR 10.A O no hydrogen 2.937 N/A ILE 15.A N VAL 11.A O no hydrogen 2.858 N/A LYS 16.A N GLU 12.A O no hydrogen 2.920 N/A GLU 17.A N ALA 13.A O no hydrogen 2.915 N/A SER 18.A N GLY 14.A O no hydrogen 2.859 N/A ILE 19.A N ILE 15.A O no hydrogen 2.964 N/A THR 20.A N LYS 16.A O no hydrogen 3.174 N/A THR 20.A OG1 GLU 17.A O no hydrogen 2.471 N/A LEU 21.A N SER 18.A O no hydrogen 3.141 N/A ILE 22.A N ILE 19.A O no hydrogen 3.168 N/A LEU 27.A N ASP 24.A OD1 no hydrogen 2.843 N/A LYS 28.A N ASP 24.A O no hydrogen 2.890 N/A LYS 29.A N PRO 25.A O no hydrogen 2.944 N/A GLU 31.A N LYS 28.A O no hydrogen 2.908 N/A HIS 32.A N LYS 29.A O no hydrogen 3.098 N/A CYS 34.A N VAL 30.A O no hydrogen 3.064 N/A CYS 34.A SG VAL 30.A O no hydrogen 3.317 N/A HIS 35.A N GLU 31.A O no hydrogen 2.995 N/A HIS 35.A N HIS 32.A O no hydrogen 3.154 N/A SER 36.A OG VAL 33.A O no hydrogen 2.784 N/A LYS 39.A NZ GLU 3.A OE1 no hydrogen 2.701 N/A ARG 40.A NH2 GLU 12.A OE1 no hydrogen 3.205 N/A ARG 40.A NH2 CYS 34.A O no hydrogen 2.902 N/A ILE 44.A N ARG 40.A O no hydrogen 3.128 N/A ILE 45.A N ILE 41.A O no hydrogen 2.876 N/A LEU 46.A N ARG 42.A O no hydrogen 3.097 N/A LEU 47.A N PRO 43.A O no hydrogen 3.051 N/A LEU 48.A N ILE 44.A O no hydrogen 2.823 N/A VAL 49.A N ILE 45.A O no hydrogen 2.949 N/A SER 50.A N LEU 46.A O no hydrogen 3.134 N/A SER 50.A OG SER 56.A O no hydrogen 2.855 N/A SER 50.A OG SER 60.A OG no hydrogen 3.067 N/A GLU 51.A N LEU 47.A O no hydrogen 2.986 N/A ILE 52.A N LEU 48.A O no hydrogen 2.958 N/A CYS 53.A N VAL 49.A O no hydrogen 3.040 N/A CYS 53.A SG VAL 49.A O no hydrogen 3.433 N/A SER 54.A N SER 50.A O no hydrogen 2.839 N/A SER 54.A OG SER 50.A O no hydrogen 2.879 N/A GLY 55.A N GLU 51.A O no hydrogen 2.599 N/A SER 56.A N SER 54.A OG no hydrogen 3.212 N/A TYR 57.A OH GLU 6.A OE1 no hydrogen 2.854 N/A ARG 59.A NH1 SER 56.A OG no hydrogen 2.896 N/A SER 60.A N TYR 57.A O no hydrogen 2.966 N/A SER 60.A OG SER 50.A OG no hydrogen 3.067 N/A SER 60.A OG THR 166.A OG1 no hydrogen 2.636 N/A LEU 61.A N SER 58.A O no hydrogen 3.473 N/A ALA 63.A N TYR 118.A OH no hydrogen 3.210 N/A ALA 64.A N SER 60.A O no hydrogen 3.029 N/A LEU 65.A N LEU 61.A O no hydrogen 2.885 N/A ALA 66.A N ASN 62.A O no hydrogen 2.910 N/A VAL 67.A N ALA 63.A O no hydrogen 3.080 N/A GLU 68.A N ALA 64.A O no hydrogen 3.078 N/A SER 70.A N GLU 68.A O no hydrogen 2.836 N/A SER 70.A OG GLU 68.A O no hydrogen 3.245 N/A SER 72.A OG HIS 69.A O no hydrogen 2.642 N/A LEU 73.A N HIS 69.A O no hydrogen 3.016 N/A ILE 74.A N SER 70.A O no hydrogen 3.026 N/A HIS 75.A N ALA 71.A O no hydrogen 2.974 N/A HIS 75.A NE2 ASP 105.A OD1 no hydrogen 3.173 N/A ASP 76.A N SER 72.A O no hydrogen 2.870 N/A ASP 77.A N LEU 73.A O no hydrogen 2.971 N/A LEU 78.A N ILE 74.A O no hydrogen 2.987 N/A LEU 79.A N HIS 75.A O no hydrogen 2.854 N/A ASP 80.A N ASP 76.A O no hydrogen 2.889 N/A GLN 81.A N ASP 77.A O no hydrogen 2.874 N/A GLY 82.A N LEU 78.A O no hydrogen 3.007 N/A LEU 83.A N LEU 79.A O no hydrogen 3.208 N/A ARG 85.A NE ASP 80.A O no hydrogen 3.185 N/A LEU 88.A N ARG 85.A O no hydrogen 3.138 N/A LYS 94.A NZ GLN 81.A OE1 no hydrogen 2.935 N/A ALA 100.A N GLY 96.A O no hydrogen 2.957 N/A LEU 101.A N PRO 97.A O no hydrogen 3.108 N/A LEU 102.A N SER 98.A O no hydrogen 3.040 N/A CYS 103.A N GLY 99.A O no hydrogen 2.869 N/A GLY 104.A N ALA 100.A O no hydrogen 3.126 N/A ASP 105.A N LEU 101.A O no hydrogen 3.057 N/A TYR 106.A N LEU 102.A O no hydrogen 2.849 N/A LEU 107.A N CYS 103.A O no hydrogen 2.976 N/A ILE 108.A N GLY 104.A O no hydrogen 3.007 N/A ALA 109.A N ASP 105.A O no hydrogen 3.087 N/A LYS 110.A N TYR 106.A O no hydrogen 2.864 N/A LYS 110.A NZ SER 18.A O no hydrogen 2.929 N/A LYS 110.A NZ TYR 106.A OH no hydrogen 3.276 N/A SER 111.A N LEU 107.A O no hydrogen 2.893 N/A SER 111.A OG ILE 108.A O no hydrogen 2.545 N/A ILE 112.A N ILE 108.A O no hydrogen 3.189 N/A ILE 112.A N ALA 109.A O no hydrogen 3.009 N/A ALA 113.A N ALA 109.A O no hydrogen 3.217 N/A PHE 114.A N LYS 110.A O no hydrogen 2.988 N/A ILE 115.A N SER 111.A O no hydrogen 2.855 N/A SER 116.A OG ALA 113.A O no hydrogen 2.714 N/A TYR 118.A N ILE 115.A O no hydrogen 3.161 N/A TYR 118.A OH ARG 59.A O no hydrogen 2.706 N/A ILE 123.A N GLY 119.A O no hydrogen 3.027 N/A GLN 124.A N GLU 120.A O no hydrogen 2.816 N/A ASP 125.A N LYS 121.A O no hydrogen 3.001 N/A PHE 126.A N VAL 122.A O no hydrogen 2.918 N/A GLY 127.A N ILE 123.A O no hydrogen 2.930 N/A LYS 128.A N GLN 124.A O no hydrogen 2.910 N/A ALA 129.A N ASP 125.A O no hydrogen 2.979 N/A GLY 130.A N PHE 126.A O no hydrogen 3.109 N/A GLY 134.A N ASP 131.A O no hydrogen 2.679 N/A VAL 136.A N ALA 132.A O no hydrogen 3.015 N/A LEU 137.A N GLU 133.A O no hydrogen 3.018 N/A ASP 138.A N GLY 134.A O no hydrogen 2.837 N/A LEU 139.A N GLU 135.A O no hydrogen 3.070 N/A LYS 140.A N VAL 136.A O no hydrogen 3.179 N/A LYS 140.A N LEU 137.A O no hydrogen 3.005 N/A TYR 144.A OH ASP 193.A OD2 no hydrogen 2.578 N/A PHE 145.A N GLU 141.A O no hydrogen 3.326 N/A LYS 146.A N ASN 142.A O no hydrogen 2.861 N/A CYS 147.A N ASP 143.A O no hydrogen 2.786 N/A CYS 147.A SG GLY 134.A O no hydrogen 3.654 N/A CYS 147.A SG ASP 138.A OD1 no hydrogen 3.666 N/A ILE 148.A N TYR 144.A O no hydrogen 3.015 N/A TYR 149.A N PHE 145.A O no hydrogen 3.040 N/A LYS 150.A N LYS 146.A O no hydrogen 2.986 N/A LYS 151.A N CYS 147.A O no hydrogen 2.824 N/A THR 152.A N ILE 148.A O no hydrogen 2.883 N/A ALA 153.A N ILE 148.A O no hydrogen 2.946 N/A SER 154.A N TYR 149.A O no hydrogen 2.774 N/A SER 154.A OG LYS 150.A O no hydrogen 2.700 N/A LEU 155.A N THR 152.A O no hydrogen 3.302 N/A ALA 157.A N ALA 153.A O no hydrogen 2.816 N/A ILE 158.A N SER 154.A O no hydrogen 3.057 N/A SER 159.A N LEU 155.A O no hydrogen 2.889 N/A SER 159.A OG LEU 155.A O no hydrogen 2.726 N/A ALA 160.A N PHE 156.A O no hydrogen 3.179 N/A SER 161.A N ALA 157.A O no hydrogen 2.973 N/A SER 161.A OG ALA 157.A O no hydrogen 3.374 N/A SER 161.A OG ILE 158.A O no hydrogen 3.521 N/A ILE 162.A N ILE 158.A O no hydrogen 2.859 N/A GLY 163.A N SER 159.A O no hydrogen 3.223 N/A ALA 164.A N ALA 160.A O no hydrogen 2.976 N/A TYR 165.A N SER 161.A O no hydrogen 2.863 N/A THR 166.A N ILE 162.A O no hydrogen 2.800 N/A THR 166.A OG1 SER 60.A OG no hydrogen 2.636 N/A THR 166.A OG1 ILE 162.A O no hydrogen 3.249 N/A THR 166.A OG1 GLY 163.A O no hydrogen 2.753 N/A GLY 167.A N ALA 164.A O no hydrogen 2.869 N/A GLY 168.A N TYR 165.A O no hydrogen 3.020 N/A ALA 169.A N ALA 164.A O no hydrogen 2.976 N/A ALA 174.A N GLU 170.A O no hydrogen 2.979 N/A GLU 175.A N GLU 171.A O no hydrogen 2.899 N/A ARG 176.A N GLU 172.A O no hydrogen 3.412 N/A ARG 176.A NH2 THR 239.A O no hydrogen 3.021 N/A ARG 176.A NH2 THR 239.A OG1 no hydrogen 2.828 N/A PHE 177.A N LEU 173.A O no hydrogen 3.180 N/A SER 178.A N ALA 174.A O no hydrogen 2.936 N/A HIS 179.A N GLU 175.A O no hydrogen 3.023 N/A PHE 180.A N ARG 176.A O no hydrogen 3.120 N/A GLY 181.A N PHE 177.A O no hydrogen 2.888 N/A ASN 182.A N SER 178.A O no hydrogen 2.859 N/A ALA 183.A N HIS 179.A O no hydrogen 3.001 N/A LEU 184.A N PHE 180.A O no hydrogen 2.925 N/A GLY 185.A N GLY 181.A O no hydrogen 2.837 N/A THR 186.A N ASN 182.A O no hydrogen 2.992 N/A THR 186.A OG1 ASN 182.A O no hydrogen 2.730 N/A ALA 187.A N ALA 183.A O no hydrogen 3.085 N/A TYR 188.A N LEU 184.A O no hydrogen 2.754 N/A GLN 189.A N GLY 185.A O no hydrogen 2.994 N/A ILE 190.A N THR 186.A O no hydrogen 3.065 N/A VAL 191.A N ALA 187.A O no hydrogen 2.979 N/A ASP 192.A N TYR 188.A O no hydrogen 3.064 N/A ASP 193.A N GLN 189.A O no hydrogen 2.795 N/A ILE 194.A N ILE 190.A O no hydrogen 2.815 N/A LEU 195.A N VAL 191.A O no hydrogen 3.016 N/A GLU 196.A N ASP 192.A O no hydrogen 3.009 N/A PHE 197.A N ASP 193.A O no hydrogen 2.864 N/A LEU 198.A N ILE 194.A O no hydrogen 2.999 N/A GLU 199.A N LEU 195.A O no hydrogen 3.106 N/A GLU 199.A N GLU 196.A O no hydrogen 3.123 N/A VAL 200.A N GLU 196.A O no hydrogen 3.193 N/A VAL 201.A N PHE 197.A O no hydrogen 3.135 N/A GLU 202.A N LEU 198.A O no hydrogen 2.996 N/A GLY 203.A N GLU 199.A O no hydrogen 2.983 N/A GLY 203.A N VAL 200.A O no hydrogen 3.141 N/A ILE 209.A N THR 205.A O no hydrogen 2.984 N/A TYR 210.A N LEU 206.A O no hydrogen 2.998 N/A LYS 211.A NZ GLU 141.A OE2 no hydrogen 3.039 N/A SER 212.A N TYR 210.A O no hydrogen 2.995 N/A SER 212.A OG TYR 210.A O no hydrogen 3.382 N/A THR 213.A N TYR 210.A O no hydrogen 3.018 N/A ALA 218.A N SER 214.A O no hydrogen 2.896 N/A LEU 219.A N LYS 215.A O no hydrogen 3.000 N/A LYS 220.A N GLU 216.A O no hydrogen 2.695 N/A LYS 220.A NZ ASP 224.A OD2 no hydrogen 3.439 N/A LYS 221.A N GLU 217.A O no hydrogen 2.947 N/A SER 222.A N ALA 218.A O no hydrogen 3.125 N/A SER 222.A OG ALA 218.A O no hydrogen 2.694 N/A ILE 223.A N LEU 219.A O no hydrogen 2.873 N/A ASP 224.A N LYS 220.A O no hydrogen 2.951 N/A CYS 225.A N LYS 221.A O no hydrogen 3.090 N/A CYS 225.A SG HIS 229.A NE2 no hydrogen 3.786 N/A VAL 226.A N SER 222.A O no hydrogen 3.101 N/A LYS 227.A N ILE 223.A O no hydrogen 2.969 N/A LYS 227.A NZ ASP 224.A OD1 no hydrogen 3.304 N/A LEU 228.A N ASP 224.A O no hydrogen 2.964 N/A HIS 229.A N CYS 225.A O no hydrogen 3.224 N/A VAL 230.A N VAL 226.A O no hydrogen 2.895 N/A ALA 231.A N LYS 227.A O no hydrogen 2.885 N/A ALA 232.A N LEU 228.A O no hydrogen 2.973 N/A ALA 233.A N HIS 229.A O no hydrogen 2.906 N/A LYS 234.A N VAL 230.A O no hydrogen 2.947 N/A LYS 234.A NZ ASP 254.A OD1 no hydrogen 2.708 N/A LYS 234.A NZ ASP 254.A OD2 no hydrogen 3.502 N/A GLU 235.A N ALA 231.A O no hydrogen 2.894 N/A THR 236.A N ALA 232.A O no hydrogen 3.225 N/A THR 236.A OG1 ALA 232.A O no hydrogen 3.270 N/A LEU 237.A N ALA 233.A O no hydrogen 2.957 N/A GLU 238.A N LYS 234.A O no hydrogen 2.903 N/A THR 239.A N THR 236.A O no hydrogen 2.877 N/A THR 239.A OG1 THR 236.A O no hydrogen 2.643 N/A PHE 240.A N LEU 237.A O no hydrogen 3.009 N/A ARG 241.A NE ILE 52.A O no hydrogen 2.784 N/A ARG 241.A NH2 ILE 52.A O no hydrogen 2.773 N/A CYS 243.A SG ARG 241.A O no hydrogen 3.571 N/A ARG 246.A NH1 PHE 240.A O no hydrogen 2.877 N/A ASP 247.A N CYS 243.A O no hydrogen 2.989 N/A LYS 248.A N PRO 244.A O no hydrogen 2.841 N/A LYS 248.A NZ GLU 7.A OE1 no hydrogen 2.807 N/A LEU 249.A N ALA 245.A O no hydrogen 3.010 N/A PHE 250.A N ARG 246.A O no hydrogen 3.058 N/A GLN 251.A N ASP 247.A O no hydrogen 3.005 N/A GLN 251.A NE2 ASP 247.A O no hydrogen 3.534 N/A ILE 252.A N LYS 248.A O no hydrogen 2.868 N/A THR 253.A N LEU 249.A O no hydrogen 2.965 N/A THR 253.A OG1 LEU 249.A O no hydrogen 2.891 N/A ASP 254.A N PHE 250.A O no hydrogen 3.178 N/A TYR 255.A N GLN 251.A O no hydrogen 2.853 N/A ILE 256.A N ILE 252.A O no hydrogen 3.037 N/A THR 257.A N ASP 254.A O no hydrogen 3.290 N/A THR 257.A OG1 THR 253.A O no hydrogen 2.515 N/A ASP 259.A N ASP 254.A O no hydrogen 3.000 N/A