Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3k89_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N ARG 86.A O no hydrogen 2.723 N/A THR 5.A N GLU 3.A OE2 no hydrogen 3.248 N/A THR 5.A OG1 GLU 3.A OE2 no hydrogen 2.900 N/A LEU 6.A N GLU 3.A O no hydrogen 3.209 N/A ALA 7.A N ARG 273.A O no hydrogen 2.876 N/A PHE 8.A N LEU 89.A O no hydrogen 3.212 N/A VAL 9.A N ALA 275.A O no hydrogen 2.869 N/A PHE 10.A N ALA 91.A O no hydrogen 3.018 N/A GLN 13.A NE2 ASN 59.A O no hydrogen 3.380 N/A GLN 13.A NE2 THR 64.A OG1 no hydrogen 3.110 N/A GLY 14.A N GLN 16.A OE1 no hydrogen 2.804 N/A SER 15.A N GLY 12.A O no hydrogen 3.029 N/A SER 15.A OG GLY 12.A O no hydrogen 3.513 N/A GLN 16.A N GLN 16.A OE1 no hydrogen 2.801 N/A GLN 16.A NE2 ASN 59.A OD1 no hydrogen 2.862 N/A GLY 19.A N SER 50.A O no hydrogen 2.782 N/A MET 20.A N SER 17.A O no hydrogen 3.082 N/A ALA 22.A N GLY 19.A O no hydrogen 3.016 N/A SER 25.A N LEU 21.A O no hydrogen 2.905 N/A GLU 26.A N ALA 22.A O no hydrogen 3.151 N/A LEU 27.A N LEU 24.A O no hydrogen 3.066 N/A HIS 28.A N SER 25.A O no hydrogen 3.141 N/A GLN 30.A NE2 THR 34.A OG1 no hydrogen 2.567 N/A GLN 30.A NE2 ALA 74.A O no hydrogen 3.242 N/A ILE 31.A N HIS 28.A O no hydrogen 3.083 N/A GLU 33.A N PRO 29.A O no hydrogen 3.436 N/A THR 34.A N GLN 30.A O no hydrogen 2.906 N/A THR 34.A OG1 GLN 30.A O no hydrogen 3.143 N/A PHE 35.A N ILE 31.A O no hydrogen 3.063 N/A ALA 36.A N ARG 32.A O no hydrogen 2.930 N/A GLU 37.A N GLU 33.A O no hydrogen 3.056 N/A ALA 38.A N THR 34.A O no hydrogen 2.973 N/A SER 39.A N PHE 35.A O no hydrogen 2.768 N/A SER 39.A OG PHE 35.A O no hydrogen 2.827 N/A SER 39.A OG VAL 44.A O no hydrogen 3.108 N/A GLU 40.A N ALA 36.A O no hydrogen 3.166 N/A ALA 42.A N ALA 38.A O no hydrogen 2.897 N/A GLY 43.A N SER 39.A O no hydrogen 2.836 N/A LEU 46.A N SER 39.A OG no hydrogen 2.783 N/A ALA 48.A N ASP 45.A OD1 no hydrogen 3.010 N/A LEU 49.A N ASP 45.A O no hydrogen 3.110 N/A SER 50.A N LEU 46.A O no hydrogen 2.959 N/A SER 50.A OG LEU 46.A O no hydrogen 3.022 N/A SER 50.A OG TRP 47.A O no hydrogen 3.062 N/A GLN 51.A N TRP 47.A O no hydrogen 2.953 N/A GLN 51.A NE2 MET 20.A O no hydrogen 2.920 N/A GLN 51.A NE2 SER 50.A OG no hydrogen 3.104 N/A GLY 52.A N ALA 48.A O no hydrogen 2.940 N/A GLY 53.A N LEU 49.A O no hydrogen 2.905 N/A MET 57.A N PRO 54.A O no hydrogen 3.082 N/A LEU 58.A N PRO 54.A O no hydrogen 3.105 N/A ASN 59.A N GLU 55.A O no hydrogen 2.882 N/A ARG 60.A N MET 57.A O no hydrogen 2.967 N/A THR 61.A OG1 GLN 13.A OE1 no hydrogen 2.699 N/A TYR 63.A N ARG 60.A O no hydrogen 2.836 N/A THR 64.A N ARG 60.A O no hydrogen 2.914 N/A THR 64.A OG1 LEU 58.A O no hydrogen 2.666 N/A THR 64.A OG1 ARG 60.A O no hydrogen 3.008 N/A GLN 65.A N THR 61.A O no hydrogen 3.019 N/A GLN 65.A NE2 THR 61.A OG1 no hydrogen 2.950 N/A ALA 67.A N TYR 63.A O no hydrogen 3.132 N/A LEU 68.A N THR 64.A O no hydrogen 2.812 N/A LEU 69.A N GLN 65.A O no hydrogen 2.901 N/A ALA 70.A N PRO 66.A O no hydrogen 2.894 N/A ALA 71.A N ALA 67.A O no hydrogen 2.966 N/A GLY 72.A N LEU 68.A O no hydrogen 2.951 N/A VAL 73.A N LEU 69.A O no hydrogen 2.987 N/A ALA 74.A N ALA 70.A O no hydrogen 2.778 N/A VAL 75.A N ALA 71.A O no hydrogen 3.163 N/A TRP 76.A N GLY 72.A O no hydrogen 2.946 N/A ARG 77.A N VAL 73.A O no hydrogen 2.893 N/A ARG 77.A NH1 GLU 37.A OE1 no hydrogen 2.899 N/A ARG 77.A NH2 GLU 37.A OE2 no hydrogen 3.090 N/A LEU 78.A N ALA 74.A O no hydrogen 3.087 N/A TRP 79.A N VAL 75.A O no hydrogen 2.944 N/A TRP 79.A NE1 GLN 85.A O no hydrogen 2.832 N/A THR 80.A N TRP 76.A O no hydrogen 2.941 N/A THR 80.A OG1 TRP 76.A O no hydrogen 2.848 N/A THR 80.A OG1 ARG 77.A O no hydrogen 3.256 N/A ALA 81.A N ARG 77.A O no hydrogen 2.915 N/A GLN 82.A N LEU 78.A O no hydrogen 2.882 N/A ARG 83.A NH2 THR 80.A O no hydrogen 2.773 N/A GLY 84.A N TRP 79.A O no hydrogen 3.001 N/A ALA 88.A N LEU 6.A O no hydrogen 2.851 N/A LEU 90.A N PRO 229.A O no hydrogen 2.973 N/A ALA 91.A N PHE 8.A O no hydrogen 3.125 N/A HIS 93.A N PHE 10.A O no hydrogen 3.001 N/A HIS 93.A NE2 ASN 164.A OD1 no hydrogen 2.759 N/A SER 94.A N ASN 233.A OD1 no hydrogen 2.785 N/A SER 94.A OG HIS 203.A NE2 no hydrogen 2.657 N/A GLY 96.A N HIS 93.A O no hydrogen 2.891 N/A GLU 97.A N SER 94.A O no hydrogen 3.119 N/A TYR 98.A N LEU 95.A O no hydrogen 2.847 N/A THR 99.A N LEU 95.A O no hydrogen 3.373 N/A ALA 100.A N GLY 96.A O no hydrogen 2.907 N/A LEU 101.A N GLU 97.A O no hydrogen 3.049 N/A VAL 102.A N TYR 98.A O no hydrogen 2.977 N/A ALA 103.A N THR 99.A O no hydrogen 2.894 N/A ALA 104.A N ALA 100.A O no hydrogen 2.824 N/A GLY 105.A N VAL 102.A O no hydrogen 2.880 N/A VAL 106.A N LEU 101.A O no hydrogen 2.860 N/A ASP 111.A N SER 108.A OG no hydrogen 3.020 N/A GLY 112.A N SER 108.A O no hydrogen 2.873 N/A ALA 113.A N LEU 109.A O no hydrogen 2.893 N/A HIS 114.A N HIS 110.A O no hydrogen 3.003 N/A LEU 115.A N ASP 111.A O no hydrogen 2.807 N/A VAL 116.A N GLY 112.A O no hydrogen 2.968 N/A ARG 117.A N ALA 113.A O no hydrogen 3.138 N/A ARG 117.A NE GLU 62.A OE2 no hydrogen 2.823 N/A ARG 117.A NH1 ALA 42.A O no hydrogen 2.797 N/A ARG 117.A NH2 GLU 62.A OE2 no hydrogen 3.021 N/A LEU 118.A N HIS 114.A O no hydrogen 3.069 N/A ARG 119.A N LEU 115.A O no hydrogen 2.779 N/A ARG 119.A NH1 GLN 65.A OE1 no hydrogen 2.791 N/A ARG 119.A NH2 SER 94.A OG no hydrogen 2.914 N/A ARG 119.A NH2 GLN 252.A OE1 no hydrogen 2.881 N/A GLY 120.A N VAL 116.A O no hydrogen 2.951 N/A GLN 121.A N ARG 117.A O no hydrogen 2.971 N/A GLN 121.A NE2 GLU 62.A OE2 no hydrogen 2.967 N/A PHE 122.A N LEU 118.A O no hydrogen 2.864 N/A MET 123.A N ARG 119.A O no hydrogen 2.977 N/A GLN 124.A N GLY 120.A O no hydrogen 2.907 N/A GLN 124.A NE2 SER 199.A OG no hydrogen 3.051 N/A ALA 125.A N GLN 121.A O no hydrogen 3.024 N/A ALA 126.A N PHE 122.A O no hydrogen 3.132 N/A ALA 126.A N MET 123.A O no hydrogen 3.233 N/A ALA 127.A N GLN 124.A O no hydrogen 3.227 N/A VAL 131.A N PRO 128.A O no hydrogen 2.971 N/A ALA 133.A N GLY 173.A O no hydrogen 2.986 N/A ALA 135.A N ILE 171.A O no hydrogen 2.872 N/A ALA 136.A N VAL 194.A O no hydrogen 2.952 N/A VAL 137.A N ILE 169.A O no hydrogen 2.778 N/A LEU 138.A N LYS 192.A O no hydrogen 2.797 N/A GLY 139.A N GLY 167.A O no hydrogen 2.776 N/A VAL 145.A N GLU 141.A O no hydrogen 3.303 N/A LEU 146.A N ASP 142.A O no hydrogen 2.850 N/A GLU 147.A N ALA 143.A O no hydrogen 3.028 N/A VAL 148.A N VAL 144.A O no hydrogen 2.962 N/A CYS 149.A N VAL 145.A O no hydrogen 2.940 N/A CYS 149.A SG VAL 145.A O no hydrogen 3.406 N/A ALA 150.A N LEU 146.A O no hydrogen 3.344 N/A GLU 151.A N GLU 147.A O no hydrogen 3.026 N/A ALA 152.A N VAL 148.A O no hydrogen 2.873 N/A ALA 153.A N CYS 149.A O no hydrogen 3.132 N/A GLN 156.A N ALA 153.A O no hydrogen 2.876 N/A VAL 157.A N ASP 174.A OD2 no hydrogen 2.818 N/A VAL 159.A N GLY 172.A O no hydrogen 2.985 N/A ALA 161.A N VAL 170.A O no hydrogen 2.657 N/A ASN 162.A N VAL 170.A O no hydrogen 3.024 N/A PHE 163.A N VAL 257.A O no hydrogen 2.868 N/A ASN 164.A N GLN 168.A O no hydrogen 3.054 N/A SER 165.A N GLN 168.A O no hydrogen 3.248 N/A SER 165.A OG PRO 166.A O no hydrogen 2.994 N/A GLN 168.A N SER 165.A O no hydrogen 2.937 N/A ILE 169.A N VAL 137.A O no hydrogen 3.117 N/A VAL 170.A N ASN 162.A O no hydrogen 2.959 N/A ILE 171.A N ALA 135.A O no hydrogen 2.847 N/A GLY 172.A N VAL 159.A O no hydrogen 2.901 N/A GLY 173.A N ALA 133.A O no hydrogen 3.089 N/A ASP 174.A N VAL 157.A O no hydrogen 2.823 N/A ALA 175.A N VAL 131.A O no hydrogen 2.916 N/A VAL 178.A N ASP 174.A O no hydrogen 2.960 N/A ASP 179.A N ALA 175.A O no hydrogen 2.949 N/A ARG 180.A N ALA 176.A O no hydrogen 2.895 N/A ARG 180.A NE ALA 152.A O no hydrogen 2.803 N/A ARG 180.A NH1 GLN 156.A OE1 no hydrogen 2.937 N/A ARG 180.A NH2 ALA 152.A O no hydrogen 3.199 N/A ARG 180.A NH2 ALA 153.A O no hydrogen 2.897 N/A ARG 180.A NH2 GLN 156.A OE1 no hydrogen 2.887 N/A ALA 181.A N ALA 177.A O no hydrogen 2.907 N/A LEU 182.A N VAL 178.A O no hydrogen 2.899 N/A ALA 183.A N ASP 179.A O no hydrogen 2.967 N/A LEU 184.A N ARG 180.A O no hydrogen 2.987 N/A LEU 185.A N ALA 181.A O no hydrogen 2.924 N/A ALA 186.A N LEU 182.A O no hydrogen 2.973 N/A GLU 187.A N ALA 183.A O no hydrogen 2.979 N/A ARG 188.A N LEU 185.A O no hydrogen 3.115 N/A GLY 189.A N ALA 186.A O no hydrogen 3.292 N/A VAL 190.A N LEU 185.A O no hydrogen 2.818 N/A ALA 193.A N ARG 191.A O no hydrogen 2.774 N/A VAL 194.A N ALA 136.A O no hydrogen 2.949 N/A LYS 195.A NZ ASP 179.A OD1 no hydrogen 3.374 N/A LYS 195.A NZ ASP 179.A OD2 no hydrogen 3.474 N/A LEU 196.A N MET 134.A O no hydrogen 2.783 N/A HIS 203.A N LEU 253.A O no hydrogen 2.895 N/A HIS 203.A ND1 GLN 252.A O no hydrogen 2.681 N/A HIS 203.A NE2 SER 94.A OG no hydrogen 2.657 N/A THR 204.A OG1 PRO 201.A O no hydrogen 2.833 N/A LEU 206.A N THR 204.A OG1 no hydrogen 3.203 N/A MET 207.A N THR 204.A O no hydrogen 2.958 N/A ARG 208.A N PRO 205.A O no hydrogen 3.069 N/A ARG 208.A NH1 ARG 208.A O no hydrogen 2.956 N/A ARG 208.A NH1 ASN 212.A OD1 no hydrogen 2.816 N/A ALA 211.A N MET 207.A O no hydrogen 2.926 N/A ASN 212.A N ARG 208.A O no hydrogen 3.418 N/A GLN 213.A N ASP 209.A O no hydrogen 3.156 N/A LEU 214.A N ALA 210.A O no hydrogen 2.830 N/A GLY 215.A N ALA 211.A O no hydrogen 2.900 N/A GLU 216.A N ASN 212.A O no hydrogen 3.059 N/A ALA 217.A N GLN 213.A O no hydrogen 3.014 N/A MET 218.A N LEU 214.A O no hydrogen 2.915 N/A ALA 219.A N GLY 215.A O no hydrogen 3.179 N/A GLY 220.A N ALA 217.A O no hydrogen 3.462 N/A LEU 221.A N MET 218.A O no hydrogen 3.098 N/A TRP 223.A NE1 MET 218.A O no hydrogen 2.815 N/A HIS 224.A N VAL 106.A O no hydrogen 2.838 N/A GLN 227.A N ALA 104.A O no hydrogen 2.805 N/A VAL 231.A N LEU 90.A O no hydrogen 2.859 N/A GLN 232.A N ARG 237.A O no hydrogen 2.866 N/A ASN 233.A N GLU 97.A OE1 no hydrogen 2.705 N/A ASN 233.A ND2 GLY 92.A O no hydrogen 2.861 N/A ARG 237.A N ASP 235.A OD2 no hydrogen 3.339 N/A ARG 237.A NH2 ASP 235.A OD1 no hydrogen 3.061 N/A ILE 245.A N GLY 241.A O no hydrogen 3.022 N/A ARG 246.A N SER 242.A O no hydrogen 2.920 N/A ARG 246.A NE SER 242.A O no hydrogen 3.288 N/A ARG 246.A NE SER 242.A OG no hydrogen 2.942 N/A ARG 246.A NH2 SER 242.A OG no hydrogen 3.230 N/A GLN 247.A N ALA 243.A O no hydrogen 2.878 N/A GLN 247.A NE2 GLU 251.A OE2 no hydrogen 2.942 N/A ALA 248.A N ALA 244.A O no hydrogen 2.971 N/A LEU 249.A N ILE 245.A O no hydrogen 3.031 N/A VAL 250.A N ARG 246.A O no hydrogen 2.903 N/A GLU 251.A N GLN 247.A O no hydrogen 2.919 N/A GLN 252.A N ALA 248.A O no hydrogen 2.877 N/A GLN 252.A NE2 SER 94.A O no hydrogen 3.086 N/A GLN 252.A NE2 ASN 233.A OD1 no hydrogen 3.077 N/A LEU 253.A N VAL 250.A O no hydrogen 3.144 N/A TYR 254.A N GLU 251.A O no hydrogen 3.304 N/A LEU 255.A N GLU 251.A O no hydrogen 3.162 N/A VAL 257.A N ALA 161.A O no hydrogen 2.949 N/A GLN 258.A N ASN 233.A O no hydrogen 3.008 N/A THR 260.A N PHE 163.A O no hydrogen 3.024 N/A THR 260.A OG1 PHE 163.A O no hydrogen 3.554 N/A CYS 262.A N GLN 258.A O no hydrogen 2.880 N/A CYS 262.A SG GLN 232.A O no hydrogen 3.497 N/A CYS 262.A SG GLN 258.A O no hydrogen 3.343 N/A VAL 263.A N TRP 259.A O no hydrogen 3.018 N/A GLN 264.A N THR 260.A O no hydrogen 2.909 N/A ALA 265.A N GLY 261.A O no hydrogen 2.827 N/A LEU 266.A N CYS 262.A O no hydrogen 2.964 N/A ALA 267.A N VAL 263.A O no hydrogen 3.003 N/A SER 268.A N GLN 264.A O no hydrogen 2.853 N/A SER 268.A OG GLN 264.A O no hydrogen 3.511 N/A SER 268.A OG ALA 265.A O no hydrogen 2.839 N/A GLN 269.A N LEU 266.A O no hydrogen 3.003 N/A GLY 270.A N ALA 267.A O no hydrogen 3.159 N/A ILE 271.A N LEU 266.A O no hydrogen 3.178 N/A THR 272.A N THR 5.A O no hydrogen 2.884 N/A ARG 273.A N THR 5.A O no hydrogen 3.013 N/A ILE 274.A N ASP 295.A O no hydrogen 2.869 N/A ALA 275.A N ALA 7.A O no hydrogen 2.941 N/A GLU 276.A N ARG 297.A O no hydrogen 2.856 N/A CYS 277.A N VAL 9.A O no hydrogen 2.818 N/A CYS 277.A SG GLY 72.A O no hydrogen 3.529 N/A LEU 283.A N GLU 276.A OE2 no hydrogen 2.855 N/A SER 284.A N GLU 276.A OE1 no hydrogen 2.816 N/A SER 284.A OG GLU 276.A OE1 no hydrogen 2.794 N/A GLY 285.A N LYS 281.A O no hydrogen 3.079 N/A LEU 286.A N VAL 282.A O no hydrogen 3.106 N/A ILE 287.A N LEU 283.A O no hydrogen 2.850 N/A LYS 288.A N SER 284.A O no hydrogen 3.081 N/A LYS 288.A NZ SER 284.A O no hydrogen 3.389 N/A LYS 288.A NZ ALA 296.A O no hydrogen 3.092 N/A ARG 289.A N GLY 285.A O no hydrogen 3.315 N/A ARG 289.A N LEU 286.A O no hydrogen 3.047 N/A ARG 289.A NH1 ARG 289.A O no hydrogen 2.894 N/A ILE 290.A N LEU 286.A O no hydrogen 2.914 N/A ASP 291.A N ILE 287.A O no hydrogen 2.937 N/A SER 293.A N ASP 291.A OD1 no hydrogen 3.059 N/A SER 293.A OG ASP 291.A OD1 no hydrogen 2.711 N/A LEU 294.A N ASP 291.A O no hydrogen 3.212 N/A ASP 295.A N THR 272.A O no hydrogen 2.839 N/A ARG 297.A N ILE 274.A O no hydrogen 2.881 N/A ARG 297.A NE ASP 295.A OD1 no hydrogen 3.425 N/A LEU 299.A N GLU 276.A O no hydrogen 3.018 N/A THR 301.A OG1 ASP 304.A OD2 no hydrogen 2.891 N/A ASP 304.A N THR 301.A OG1 no hydrogen 3.301 N/A TYR 305.A N THR 301.A O no hydrogen 2.831 N/A TYR 305.A OH GLN 82.A OE1 no hydrogen 2.999 N/A ALA 306.A N PRO 302.A O no hydrogen 2.920 N/A GLY 307.A N ALA 303.A O no hydrogen 2.983 N/A ALA 308.A N ASP 304.A O no hydrogen 3.026 N/A LEU 309.A N TYR 305.A O no hydrogen 2.898 N/A ASP 310.A N ALA 306.A O no hydrogen 2.961 N/A ALA 311.A N GLY 307.A O no hydrogen 2.979 N/A TRP 312.A N ALA 308.A O no hydrogen 3.047 N/A TRP 312.A NE1 ASP 295.A OD2 no hydrogen 3.140 N/A HIS 314.A ND1 GLN 85.A OE1 no hydrogen 2.948 N/A