Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fi9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A OH GLU 59.A O no hydrogen 2.773 N/A LEU 5.A N ARG 31.A O no hydrogen 2.944 N/A THR 6.A N LEU 32.A O no hydrogen 2.948 N/A GLU 8.A N THR 6.A OG1 no hydrogen 3.182 N/A LYS 9.A NZ GLU 71.A O no hydrogen 2.952 N/A LYS 9.A NZ ALA 72.A O no hydrogen 3.071 N/A LYS 9.A NZ THR 74.A O no hydrogen 3.055 N/A LEU 10.A N ASN 35.A O no hydrogen 3.046 N/A THR 11.A N TYR 78.A O no hydrogen 2.949 N/A THR 11.A OG1 ALA 72.A O no hydrogen 2.874 N/A ILE 12.A N CYS 37.A O no hydrogen 2.834 N/A VAL 13.A N VAL 80.A O no hydrogen 2.865 N/A GLY 14.A N TYR 39.A O no hydrogen 2.937 N/A ALA 15.A N TYR 39.A O no hydrogen 3.115 N/A ALA 16.A N ASP 40.A OD2 no hydrogen 2.920 N/A GLY 17.A N GLY 14.A O no hydrogen 3.449 N/A SER 21.A N GLY 17.A O no hydrogen 2.786 N/A SER 21.A OG GLY 17.A O no hydrogen 2.891 N/A SER 21.A OG MET 18.A O no hydrogen 3.333 N/A ASN 22.A N MET 18.A O no hydrogen 3.352 N/A MET 23.A N ILE 19.A O no hydrogen 2.872 N/A ALA 24.A N GLY 20.A O no hydrogen 2.969 N/A GLN 25.A N SER 21.A O no hydrogen 3.126 N/A THR 26.A N ASN 22.A O no hydrogen 2.892 N/A THR 26.A OG1 ASN 22.A O no hydrogen 2.932 N/A THR 26.A OG1 ASN 22.A OD1 no hydrogen 3.286 N/A ALA 27.A N MET 23.A O no hydrogen 2.773 N/A ALA 28.A N ALA 24.A O no hydrogen 3.087 N/A MET 29.A N GLN 25.A O no hydrogen 2.928 N/A MET 30.A N THR 26.A O no hydrogen 2.946 N/A ARG 31.A N ALA 28.A O no hydrogen 3.043 N/A ARG 31.A NE LEU 2.A O no hydrogen 2.857 N/A ARG 31.A NH1 GLU 59.A O no hydrogen 2.997 N/A LEU 32.A N ALA 27.A O no hydrogen 3.401 N/A THR 33.A OG1 GLU 8.A O no hydrogen 2.670 N/A ASN 35.A N THR 33.A OG1 no hydrogen 2.933 N/A ASN 35.A ND2 GLU 7.A O no hydrogen 2.840 N/A CYS 37.A N LEU 10.A O no hydrogen 2.740 N/A LEU 38.A N THR 64.A O no hydrogen 2.868 N/A TYR 39.A N ILE 12.A O no hydrogen 2.925 N/A ASP 40.A N THR 66.A O no hydrogen 3.333 N/A PHE 42.A N ASP 40.A OD1 no hydrogen 2.863 N/A LEU 46.A N PHE 42.A O no hydrogen 2.963 N/A GLU 47.A N ALA 43.A O no hydrogen 2.974 N/A GLY 48.A N VAL 44.A O no hydrogen 3.213 N/A VAL 49.A N GLY 45.A O no hydrogen 3.167 N/A ALA 50.A N LEU 46.A O no hydrogen 2.972 N/A GLU 51.A N GLU 47.A O no hydrogen 3.005 N/A GLU 52.A N GLY 48.A O no hydrogen 3.110 N/A ILE 53.A N VAL 49.A O no hydrogen 3.068 N/A ARG 54.A N ALA 50.A O no hydrogen 2.898 N/A ARG 54.A NH1 GLU 51.A OE1 no hydrogen 3.088 N/A HIS 55.A N GLU 51.A O no hydrogen 3.007 N/A CYS 56.A N ILE 53.A O no hydrogen 3.014 N/A CYS 56.A SG GLU 52.A O no hydrogen 3.529 N/A GLY 57.A N ARG 54.A O no hydrogen 3.256 N/A LEU 61.A N PHE 58.A O no hydrogen 3.283 N/A ASN 62.A N PRO 34.A O no hydrogen 2.647 N/A ASN 62.A ND2 ASN 35.A OD1 no hydrogen 3.444 N/A THR 64.A N LEU 36.A O no hydrogen 3.060 N/A THR 66.A N LEU 38.A O no hydrogen 2.882 N/A THR 66.A OG1 GLU 71.A OE1 no hydrogen 2.759 N/A SER 67.A OG ASP 40.A O no hydrogen 2.609 N/A ASP 68.A N THR 66.A OG1 no hydrogen 3.019 N/A GLU 71.A N ASP 68.A OD2 no hydrogen 2.874 N/A ALA 72.A N ASP 68.A O no hydrogen 3.083 N/A LEU 73.A N ILE 69.A O no hydrogen 2.946 N/A THR 74.A N LYS 70.A O no hydrogen 2.976 N/A THR 74.A OG1 LYS 70.A O no hydrogen 2.489 N/A ALA 76.A N LEU 73.A O no hydrogen 2.866 N/A LYS 77.A N LYS 9.A O no hydrogen 2.960 N/A LYS 77.A NZ ASP 110.A OD2 no hydrogen 3.273 N/A TYR 78.A N LYS 9.A O no hydrogen 3.174 N/A ILE 79.A N HIS 113.A O no hydrogen 3.111 N/A VAL 80.A N THR 11.A O no hydrogen 3.029 N/A SER 81.A N ILE 115.A O no hydrogen 2.836 N/A SER 82.A N VAL 13.A O no hydrogen 2.939 N/A SER 82.A OG VAL 13.A O no hydrogen 3.472 N/A GLY 83.A N SER 81.A OG no hydrogen 2.809 N/A THR 85.A OG1 ASP 88.A OD2 no hydrogen 2.671 N/A ASP 88.A N THR 85.A O no hydrogen 3.048 N/A ASP 88.A N THR 85.A OG1 no hydrogen 2.895 N/A LEU 89.A N THR 85.A O no hydrogen 3.143 N/A LEU 90.A N ARG 86.A O no hydrogen 3.129 N/A LYS 91.A N GLU 87.A O no hydrogen 2.939 N/A LYS 91.A NZ GLU 95.A OE2 no hydrogen 2.819 N/A GLY 92.A N ASP 88.A O no hydrogen 2.776 N/A ASN 93.A N LEU 89.A O no hydrogen 2.834 N/A ASN 93.A ND2 LEU 89.A O no hydrogen 2.792 N/A ALA 94.A N LEU 90.A O no hydrogen 2.850 N/A GLU 95.A N LYS 91.A O no hydrogen 2.844 N/A ILE 96.A N GLY 92.A O no hydrogen 3.062 N/A ALA 97.A N ASN 93.A O no hydrogen 2.950 N/A ALA 98.A N ALA 94.A O no hydrogen 2.836 N/A GLN 99.A N GLU 95.A O no hydrogen 3.065 N/A GLN 99.A NE2 ASP 103.A OD1 no hydrogen 2.958 N/A LEU 100.A N ILE 96.A O no hydrogen 2.926 N/A GLY 101.A N ALA 97.A O no hydrogen 3.084 N/A LYS 102.A N ALA 98.A O no hydrogen 2.837 N/A ASP 103.A N GLN 99.A O no hydrogen 3.027 N/A ILE 104.A N LEU 100.A O no hydrogen 2.945 N/A LYS 105.A N GLY 101.A O no hydrogen 2.927 N/A SER 106.A N LYS 102.A O no hydrogen 2.919 N/A SER 106.A OG LYS 102.A O no hydrogen 3.060 N/A TYR 107.A N ASP 103.A O no hydrogen 2.867 N/A CYS 108.A N ILE 104.A O no hydrogen 2.857 N/A CYS 108.A SG ILE 104.A O no hydrogen 3.945 N/A CYS 111.A N CYS 108.A O no hydrogen 2.734 N/A CYS 111.A SG HIS 113.A O no hydrogen 3.787 N/A LYS 112.A N LYS 77.A O no hydrogen 2.742 N/A LYS 112.A NZ GLU 8.A OE2 no hydrogen 3.154 N/A HIS 113.A N LYS 77.A O no hydrogen 3.328 N/A HIS 113.A NE2 THR 140.A OG1 no hydrogen 2.912 N/A VAL 114.A N GLN 138.A O no hydrogen 2.841 N/A ILE 115.A N ILE 79.A O no hydrogen 2.938 N/A ILE 116.A N THR 140.A O no hydrogen 3.017 N/A ILE 117.A N SER 81.A O no hydrogen 2.998 N/A ALA 121.A N ASN 119.A OD1 no hydrogen 2.808 N/A ILE 123.A N PRO 120.A O no hydrogen 2.887 N/A THR 124.A N PRO 120.A O no hydrogen 2.942 N/A THR 124.A OG1 PHE 118.A O no hydrogen 2.683 N/A THR 124.A OG1 PRO 120.A O no hydrogen 3.321 N/A GLY 125.A N ALA 121.A O no hydrogen 2.857 N/A VAL 127.A N ILE 123.A O no hydrogen 2.820 N/A THR 128.A N THR 124.A O no hydrogen 2.919 N/A THR 128.A OG1 ALA 97.A O no hydrogen 3.275 N/A THR 128.A OG1 THR 124.A O no hydrogen 3.089 N/A LEU 129.A N GLY 125.A O no hydrogen 3.053 N/A ILE 130.A N LEU 126.A O no hydrogen 2.973 N/A TYR 131.A N VAL 127.A O no hydrogen 3.003 N/A TYR 131.A OH ILE 314.A O no hydrogen 2.377 N/A SER 132.A N THR 128.A O no hydrogen 2.884 N/A SER 132.A OG LEU 129.A O no hydrogen 2.937 N/A LEU 134.A N SER 132.A OG no hydrogen 2.992 N/A LYS 135.A N GLN 138.A OE1 no hydrogen 2.774 N/A LYS 135.A NZ GLN 138.A OE1 no hydrogen 2.646 N/A GLN 138.A N LYS 135.A O no hydrogen 2.967 N/A GLN 138.A NE2 LYS 112.A O no hydrogen 3.284 N/A VAL 139.A N PRO 136.A O no hydrogen 3.511 N/A THR 140.A N VAL 114.A O no hydrogen 3.025 N/A THR 140.A OG1 HIS 113.A NE2 no hydrogen 2.912 N/A THR 141.A N GLY 254.A O no hydrogen 2.990 N/A THR 148.A N GLY 144.A O no hydrogen 3.012 N/A THR 148.A OG1 LEU 145.A O no hydrogen 3.284 N/A ARG 149.A N LEU 145.A O no hydrogen 2.917 N/A LEU 150.A N ASP 146.A O no hydrogen 2.918 N/A GLN 151.A N SER 147.A O no hydrogen 2.981 N/A GLN 151.A NE2 VAL 165.A O no hydrogen 2.805 N/A SER 152.A N THR 148.A O no hydrogen 2.852 N/A GLU 153.A N ARG 149.A O no hydrogen 2.859 N/A LEU 154.A N LEU 150.A O no hydrogen 2.969 N/A ALA 155.A N GLN 151.A O no hydrogen 2.932 N/A LYS 156.A N SER 152.A O no hydrogen 2.873 N/A LYS 156.A NZ GLU 153.A OE1 no hydrogen 3.409 N/A LYS 156.A NZ GLU 153.A OE2 no hydrogen 3.135 N/A HIS 157.A N GLU 153.A O no hydrogen 3.041 N/A HIS 157.A NE2 LYS 200.A O no hydrogen 2.603 N/A PHE 158.A N LEU 154.A O no hydrogen 3.062 N/A GLY 159.A N LYS 156.A O no hydrogen 3.220 N/A ILE 160.A N ALA 155.A O no hydrogen 3.014 N/A GLN 162.A NE2 GLN 151.A OE1 no hydrogen 2.925 N/A LEU 164.A N LYS 161.A O no hydrogen 2.880 N/A VAL 165.A N GLN 162.A O no hydrogen 3.029 N/A THR 166.A N LYS 186.A O no hydrogen 2.866 N/A ASN 167.A ND2 THR 184.A O no hydrogen 2.930 N/A THR 168.A OG1 SER 147.A O no hydrogen 3.197 N/A ARG 169.A NE GLU 270.A OE1 no hydrogen 2.939 N/A ARG 169.A NH1 THR 168.A O no hydrogen 2.972 N/A THR 170.A N SER 147.A OG no hydrogen 3.055 N/A TYR 171.A N ALA 179.A O no hydrogen 2.805 N/A TYR 171.A OH GLU 270.A OE1 no hydrogen 2.565 N/A GLY 172.A N ALA 268.A O no hydrogen 2.900 N/A GLY 173.A N GLN 177.A O no hydrogen 3.265 N/A GLY 173.A N SER 298.A OG no hydrogen 2.791 N/A GLY 175.A N ASP 146.A OD2 no hydrogen 3.109 N/A GLN 177.A N HIS 174.A O no hydrogen 2.835 N/A MET 178.A N GLY 175.A O no hydrogen 2.930 N/A ALA 179.A N TYR 171.A O no hydrogen 2.802 N/A PHE 181.A N ARG 169.A O no hydrogen 3.064 N/A SER 183.A N GLU 291.A OE2 no hydrogen 2.886 N/A SER 183.A OG GLU 291.A OE1 no hydrogen 2.683 N/A SER 183.A OG GLU 291.A OE2 no hydrogen 3.214 N/A THR 184.A N PHE 181.A O no hydrogen 2.998 N/A THR 184.A OG1 ASN 167.A O no hydrogen 2.492 N/A THR 184.A OG1 PHE 181.A O no hydrogen 3.126 N/A ALA 185.A N ALA 182.A O no hydrogen 3.139 N/A LYS 186.A N THR 166.A O no hydrogen 3.132 N/A VAL 187.A N THR 190.A O no hydrogen 2.661 N/A ASN 188.A N LEU 164.A O no hydrogen 2.742 N/A THR 190.A N VAL 187.A O no hydrogen 3.270 N/A LEU 192.A N ALA 185.A O no hydrogen 2.810 N/A ASP 194.A N PRO 191.A O no hydrogen 3.051 N/A LEU 195.A N LEU 192.A O no hydrogen 2.889 N/A ILE 196.A N LEU 192.A O no hydrogen 3.054 N/A GLY 197.A N LEU 201.A O no hydrogen 2.733 N/A THR 198.A N LEU 195.A O no hydrogen 3.145 N/A THR 198.A OG1 LEU 195.A O no hydrogen 2.467 N/A LYS 200.A N THR 198.A OG1 no hydrogen 3.404 N/A LEU 201.A N THR 198.A O no hydrogen 3.049 N/A THR 202.A N GLN 205.A OE1 no hydrogen 2.951 N/A GLN 205.A N THR 202.A OG1 no hydrogen 3.146 N/A TRP 206.A N THR 202.A O no hydrogen 2.926 N/A ALA 207.A N ASN 203.A O no hydrogen 3.115 N/A GLU 208.A N GLU 204.A O no hydrogen 2.985 N/A LEU 209.A N GLN 205.A O no hydrogen 2.724 N/A LYS 210.A N TRP 206.A O no hydrogen 2.805 N/A GLN 211.A N ALA 207.A O no hydrogen 2.997 N/A ARG 212.A N GLU 208.A O no hydrogen 2.982 N/A ARG 212.A NE GLU 153.A OE1 no hydrogen 2.847 N/A VAL 213.A N LEU 209.A O no hydrogen 3.203 N/A VAL 214.A N LYS 210.A O no hydrogen 2.929 N/A LYS 215.A N GLN 211.A O no hydrogen 2.974 N/A GLY 216.A N VAL 213.A O no hydrogen 2.921 N/A ASN 219.A N LYS 215.A O no hydrogen 2.962 N/A ILE 220.A N GLY 216.A O no hydrogen 3.108 N/A ILE 221.A N GLY 217.A O no hydrogen 3.109 N/A LYS 222.A N ALA 218.A O no hydrogen 2.934 N/A LYS 222.A NZ ASN 219.A OD1 no hydrogen 3.488 N/A LEU 223.A N ASN 219.A O no hydrogen 2.899 N/A LEU 223.A N ILE 220.A O no hydrogen 3.045 N/A ARG 224.A N ILE 220.A O no hydrogen 2.658 N/A ARG 224.A NH1 GLN 230.A OE1 no hydrogen 2.810 N/A ARG 224.A NH2 GLN 230.A OE1 no hydrogen 3.378 N/A GLY 225.A N ILE 221.A O no hydrogen 2.839 N/A SER 233.A N PHE 229.A O no hydrogen 3.332 N/A SER 233.A OG ASN 22.A OD1 no hydrogen 2.658 N/A TYR 234.A N GLN 230.A O no hydrogen 2.871 N/A TYR 234.A OH GLU 238.A OE1 no hydrogen 3.394 N/A VAL 235.A N SER 231.A O no hydrogen 2.998 N/A SER 236.A N PRO 232.A O no hydrogen 3.188 N/A SER 236.A OG PRO 232.A O no hydrogen 2.733 N/A ILE 237.A N SER 233.A O no hydrogen 2.964 N/A GLU 238.A N TYR 234.A O no hydrogen 2.920 N/A MET 239.A N VAL 235.A O no hydrogen 2.867 N/A ILE 240.A N SER 236.A O no hydrogen 3.038 N/A ARG 241.A N ILE 237.A O no hydrogen 2.910 N/A ALA 242.A N GLU 238.A O no hydrogen 3.173 N/A ALA 243.A N MET 239.A O no hydrogen 3.088 N/A MET 244.A N ILE 240.A O no hydrogen 2.924 N/A MET 244.A N ARG 241.A O no hydrogen 3.147 N/A GLY 245.A N ALA 242.A O no hydrogen 3.079 N/A GLY 246.A N ARG 241.A O no hydrogen 2.931 N/A ALA 253.A N THR 271.A OG1 no hydrogen 2.858 N/A GLY 254.A N THR 141.A O no hydrogen 2.878 N/A CYS 255.A N MET 267.A O no hydrogen 3.060 N/A CYS 255.A SG TYR 256.A O no hydrogen 3.784 N/A VAL 257.A N ILE 265.A O no hydrogen 2.847 N/A VAL 259.A N PHE 262.A O no hydrogen 3.162 N/A GLY 261.A N GLU 263.A OE2 no hydrogen 2.813 N/A PHE 262.A N VAL 259.A O no hydrogen 2.895 N/A GLU 263.A N GLU 263.A OE1 no hydrogen 2.765 N/A HIS 264.A N ASN 258.A OD1 no hydrogen 2.828 N/A ILE 265.A N VAL 257.A O no hydrogen 3.102 N/A MET 267.A N CYS 255.A O no hydrogen 3.085 N/A ALA 268.A N GLY 172.A O no hydrogen 2.860 N/A MET 269.A N ALA 253.A O no hydrogen 3.096 N/A THR 271.A OG1 MET 269.A O no hydrogen 3.332 N/A THR 272.A N LYS 279.A O no hydrogen 3.066 N/A THR 274.A N GLY 277.A O no hydrogen 2.889 N/A ASP 276.A N THR 274.A OG1 no hydrogen 2.989 N/A GLY 277.A N THR 274.A O no hydrogen 2.811 N/A VAL 278.A N SER 137.A O no hydrogen 2.946 N/A LYS 279.A N THR 272.A O no hydrogen 3.127 N/A HIS 280.A ND1 SER 281.A O no hydrogen 2.769 N/A SER 281.A N GLU 270.A O no hydrogen 2.980 N/A ASN 284.A N ASP 282.A OD1 no hydrogen 2.872 N/A GLN 285.A N ASP 282.A O no hydrogen 2.942 N/A LEU 286.A N ILE 283.A O no hydrogen 2.988 N/A ASN 288.A N GLU 291.A OE1 no hydrogen 3.032 N/A GLU 291.A N ASN 288.A OD1 no hydrogen 2.831 N/A ARG 292.A N ASN 288.A O no hydrogen 2.995 N/A ARG 292.A NH1 LEU 286.A O no hydrogen 2.792 N/A ARG 292.A NH1 GLY 287.A O no hydrogen 2.969 N/A ALA 293.A N GLU 289.A O no hydrogen 3.040 N/A ALA 294.A N ALA 290.A O no hydrogen 3.100 N/A LEU 295.A N GLU 291.A O no hydrogen 2.880 N/A LYS 296.A N ARG 292.A O no hydrogen 2.844 N/A LYS 296.A NZ GLY 261.A O no hydrogen 2.740 N/A GLU 297.A N ALA 293.A O no hydrogen 3.040 N/A SER 298.A N ALA 294.A O no hydrogen 3.041 N/A SER 298.A OG GLN 177.A O no hydrogen 2.612 N/A TYR 299.A N LEU 295.A O no hydrogen 2.760 N/A TYR 299.A OH GLU 263.A O no hydrogen 2.728 N/A SER 300.A N LYS 296.A O no hydrogen 2.850 N/A SER 300.A OG LYS 296.A O no hydrogen 3.054 N/A HIS 301.A N GLU 297.A O no hydrogen 3.330 N/A LEU 302.A N SER 298.A O no hydrogen 3.018 N/A ALA 303.A N TYR 299.A O no hydrogen 2.888 N/A LYS 304.A N SER 300.A O no hydrogen 3.114 N/A LEU 305.A N HIS 301.A O no hydrogen 3.180 N/A ARG 306.A N LEU 302.A O no hydrogen 2.895 N/A ARG 306.A NE ASP 307.A OD1 no hydrogen 3.005 N/A ARG 306.A NH1 HIS 264.A O no hydrogen 2.910 N/A ARG 306.A NH2 ASP 307.A OD1 no hydrogen 3.111 N/A ARG 306.A NH2 ASP 307.A OD2 no hydrogen 3.542 N/A ASP 307.A N ALA 303.A O no hydrogen 3.037 N/A GLU 308.A N LYS 304.A O no hydrogen 3.137 N/A VAL 309.A N LEU 305.A O no hydrogen 3.224 N/A ILE 310.A N ARG 306.A O no hydrogen 2.990 N/A ALA 311.A N ASP 307.A O no hydrogen 2.913 N/A MET 312.A N GLU 308.A O no hydrogen 3.051 N/A GLY 313.A N ILE 310.A O no hydrogen 2.774 N/A ILE 314.A N VAL 309.A O no hydrogen 3.234 N/A ILE 315.A N VAL 309.A O no hydrogen 3.362 N/A ASP 320.A N ALA 317.A O no hydrogen 2.807 N/A TRP 321.A N ILE 318.A O no hydrogen 2.991 N/A TRP 321.A NE1 PRO 316.A O no hydrogen 2.933 N/A