Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6r8j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N ILE 12.A O no hydrogen 3.112 N/A ASP 4.A N GLN 1.A O no hydrogen 2.959 N/A LEU 6.A N TYR 10.A O no hydrogen 2.943 N/A ARG 9.A N LEU 6.A O no hydrogen 2.969 N/A ARG 9.A NE ASP 29.A OD1 no hydrogen 2.841 N/A ARG 9.A NE ASP 29.A OD2 no hydrogen 3.318 N/A ARG 9.A NH2 ASP 29.A OD1 no hydrogen 3.306 N/A ARG 9.A NH2 ASP 29.A OD2 no hydrogen 2.814 N/A TYR 10.A N LEU 6.A O no hydrogen 3.141 N/A TYR 10.A OH GLU 78.A OE2 no hydrogen 2.514 N/A GLU 11.A N ILE 28.A O no hydrogen 2.814 N/A ILE 12.A N ASP 4.A O no hydrogen 3.090 N/A VAL 13.A N GLU 26.A O no hydrogen 2.908 N/A THR 15.A N ASP 14.A OD1 no hydrogen 2.759 N/A LEU 16.A N VAL 24.A O no hydrogen 2.798 N/A GLY 17.A N VAL 24.A O no hydrogen 3.177 N/A GLY 19.A N GLY 22.A O no hydrogen 3.131 N/A GLY 22.A N GLY 19.A O no hydrogen 3.145 N/A LYS 23.A N ILE 41.A O no hydrogen 3.166 N/A VAL 24.A N GLY 17.A O no hydrogen 2.949 N/A VAL 25.A N VAL 39.A O no hydrogen 2.869 N/A GLU 26.A N ASP 14.A O no hydrogen 2.939 N/A CYS 27.A N VAL 37.A O no hydrogen 2.854 N/A ILE 28.A N GLU 11.A O no hydrogen 2.716 N/A ASP 29.A N ARG 35.A O no hydrogen 3.105 N/A HIS 30.A N ARG 9.A O no hydrogen 2.842 N/A HIS 30.A NE2 GLU 11.A OE1 no hydrogen 2.866 N/A LYS 31.A N ASP 29.A OD1 no hydrogen 2.985 N/A LYS 31.A NZ ALA 8.A O no hydrogen 2.998 N/A ALA 32.A N ASP 29.A O no hydrogen 3.092 N/A GLY 34.A N ASP 29.A O no hydrogen 3.148 N/A ARG 35.A N ALA 32.A O no hydrogen 3.251 N/A HIS 36.A ND1 GLU 26.A OE2 no hydrogen 2.710 N/A VAL 37.A N CYS 27.A O no hydrogen 3.005 N/A ALA 38.A N PHE 90.A O no hydrogen 3.070 N/A VAL 39.A N VAL 25.A O no hydrogen 2.747 N/A LYS 40.A N ILE 88.A O no hydrogen 2.759 N/A LYS 40.A NZ GLU 55.A OE1 no hydrogen 2.894 N/A ILE 41.A N LYS 23.A O no hydrogen 2.776 N/A VAL 42.A N ILE 86.A O no hydrogen 2.978 N/A LYS 43.A N PHE 21.A O no hydrogen 2.794 N/A LYS 43.A NZ ALA 20.A O no hydrogen 2.718 N/A VAL 45.A N LYS 43.A O no hydrogen 2.921 N/A TYR 48.A N VAL 45.A O no hydrogen 3.084 N/A CYS 49.A N VAL 45.A O no hydrogen 2.875 N/A CYS 49.A SG LYS 43.A O no hydrogen 3.988 N/A CYS 49.A SG ASN 44.A OD1 no hydrogen 3.825 N/A CYS 49.A SG VAL 45.A O no hydrogen 3.396 N/A GLU 50.A N ASP 46.A O no hydrogen 2.897 N/A ALA 51.A N ARG 47.A O no hydrogen 3.138 N/A ALA 52.A N TYR 48.A O no hydrogen 2.866 N/A ARG 53.A N CYS 49.A O no hydrogen 2.904 N/A ARG 53.A NH2 GLU 81.A OE1 no hydrogen 3.097 N/A SER 54.A N GLU 50.A O no hydrogen 2.995 N/A GLU 55.A N ALA 51.A O no hydrogen 2.775 N/A ILE 56.A N ALA 52.A O no hydrogen 2.930 N/A GLN 57.A N ARG 53.A O no hydrogen 3.032 N/A VAL 58.A N SER 54.A O no hydrogen 2.987 N/A LEU 59.A N GLU 55.A O no hydrogen 2.832 N/A GLU 60.A N ILE 56.A O no hydrogen 2.861 N/A HIS 61.A N GLN 57.A O no hydrogen 3.063 N/A HIS 61.A ND1 TYR 180.A OH no hydrogen 2.761 N/A LEU 62.A N VAL 58.A O no hydrogen 2.740 N/A ASN 63.A N LEU 59.A O no hydrogen 2.743 N/A THR 64.A N GLU 60.A O no hydrogen 3.036 N/A THR 64.A OG1 GLU 60.A O no hydrogen 2.911 N/A THR 65.A N HIS 61.A O no hydrogen 2.945 N/A THR 65.A OG1 HIS 61.A O no hydrogen 3.102 N/A ASP 66.A N LEU 62.A O no hydrogen 2.782 N/A SER 69.A N ASP 66.A O no hydrogen 3.040 N/A SER 69.A OG CYS 73.A O no hydrogen 2.847 N/A THR 70.A N ASP 66.A OD1 no hydrogen 2.818 N/A THR 70.A OG1 ASP 66.A OD1 no hydrogen 3.309 N/A PHE 71.A N ASP 66.A OD2 no hydrogen 2.764 N/A ARG 72.A N SER 69.A O no hydrogen 3.157 N/A ARG 72.A NH1 ILE 170.A O no hydrogen 3.006 N/A CYS 73.A SG PHE 71.A O no hydrogen 3.929 N/A CYS 73.A SG SER 124.A OG no hydrogen 3.579 N/A VAL 74.A N VAL 172.A O no hydrogen 3.023 N/A GLN 75.A N GLU 91.A OE2 no hydrogen 3.068 N/A LEU 77.A N VAL 89.A O no hydrogen 2.682 N/A PHE 80.A N CYS 87.A O no hydrogen 2.897 N/A HIS 82.A N HIS 85.A O no hydrogen 3.002 N/A HIS 85.A N HIS 82.A O no hydrogen 3.252 N/A HIS 85.A ND1 VAL 42.A O no hydrogen 2.821 N/A CYS 87.A N PHE 80.A O no hydrogen 2.726 N/A CYS 87.A SG HIS 85.A O no hydrogen 3.756 N/A ILE 88.A N LYS 40.A O no hydrogen 2.909 N/A VAL 89.A N GLU 78.A O no hydrogen 2.935 N/A PHE 90.A N ALA 38.A O no hydrogen 2.762 N/A GLU 91.A N GLN 75.A O no hydrogen 3.291 N/A GLY 94.A N PHE 145.A O no hydrogen 2.722 N/A LEU 95.A N SER 148.A OG no hydrogen 3.018 N/A THR 97.A N ILE 143.A O no hydrogen 2.807 N/A THR 97.A OG1 PRO 140.A O no hydrogen 2.849 N/A THR 97.A OG1 ILE 143.A O no hydrogen 3.481 N/A THR 97.A OG1 TYR 221.A OH no hydrogen 2.808 N/A TYR 98.A N PRO 140.A O no hydrogen 3.471 N/A ASP 99.A N SER 96.A OG no hydrogen 2.930 N/A PHE 100.A N SER 96.A O no hydrogen 2.988 N/A ILE 101.A N THR 97.A O no hydrogen 2.977 N/A LYS 102.A N TYR 98.A O no hydrogen 2.916 N/A GLU 103.A N ASP 99.A O no hydrogen 2.904 N/A ASN 104.A N PHE 100.A O no hydrogen 3.072 N/A ASN 104.A N ILE 101.A O no hydrogen 3.049 N/A ASN 104.A ND2 ARG 163.A O no hydrogen 3.620 N/A GLY 105.A N LYS 102.A O no hydrogen 3.018 N/A PHE 106.A N ILE 101.A O no hydrogen 2.933 N/A PHE 109.A N TYR 221.A O no hydrogen 2.929 N/A ILE 114.A N ARG 110.A O no hydrogen 2.987 N/A ARG 115.A N LEU 111.A O no hydrogen 2.906 N/A ARG 115.A NE PHE 325.A O no hydrogen 3.027 N/A ARG 115.A NH2 GLU 295.A OE1 no hydrogen 2.839 N/A LYS 116.A N ASP 112.A O no hydrogen 3.326 N/A MET 117.A N HIS 113.A O no hydrogen 2.966 N/A ALA 118.A N ILE 114.A O no hydrogen 2.850 N/A TYR 119.A N ARG 115.A O no hydrogen 3.082 N/A GLN 120.A N LYS 116.A O no hydrogen 3.175 N/A GLN 120.A NE2 ASP 169.A OD1 no hydrogen 2.878 N/A ILE 121.A N MET 117.A O no hydrogen 2.819 N/A CYS 122.A N ALA 118.A O no hydrogen 2.923 N/A CYS 122.A SG ALA 118.A O no hydrogen 3.434 N/A LYS 123.A N TYR 119.A O no hydrogen 2.802 N/A LYS 123.A NZ THR 70.A O no hydrogen 3.556 N/A SER 124.A N GLN 120.A O no hydrogen 2.958 N/A SER 124.A OG PHE 71.A O no hydrogen 2.811 N/A VAL 125.A N ILE 121.A O no hydrogen 2.920 N/A ASN 126.A N CYS 122.A O no hydrogen 2.814 N/A PHE 127.A N LYS 123.A O no hydrogen 3.080 N/A LEU 128.A N SER 124.A O no hydrogen 3.252 N/A HIS 129.A N VAL 125.A O no hydrogen 2.860 N/A HIS 129.A NE2 ASP 210.A OD2 no hydrogen 2.677 N/A SER 130.A N ASN 126.A O no hydrogen 2.781 N/A SER 130.A OG ASN 126.A O no hydrogen 2.982 N/A ASN 131.A N LEU 128.A O no hydrogen 2.938 N/A ASN 131.A ND2 PHE 127.A O no hydrogen 2.961 N/A LYS 132.A N HIS 129.A O no hydrogen 3.211 N/A LEU 133.A N LEU 128.A O no hydrogen 2.998 N/A THR 134.A N THR 179.A O no hydrogen 2.914 N/A HIS 135.A N ASP 210.A OD2 no hydrogen 2.902 N/A HIS 135.A NE2 VAL 173.A O no hydrogen 3.023 N/A THR 136.A N ASP 210.A OD1 no hydrogen 2.859 N/A THR 136.A OG1 HIS 135.A O no hydrogen 2.706 N/A THR 136.A OG1 SER 177.A O no hydrogen 3.383 N/A ASP 137.A N HIS 135.A ND1 no hydrogen 3.148 N/A LYS 139.A NZ THR 191.A OG1 no hydrogen 3.014 N/A GLU 141.A N GLU 141.A OE1 no hydrogen 2.712 N/A ASN 142.A N LYS 139.A O no hydrogen 2.861 N/A ASN 142.A ND2 ASP 137.A O no hydrogen 2.890 N/A ILE 143.A N PRO 140.A O no hydrogen 3.351 N/A LEU 144.A N LYS 171.A O no hydrogen 2.949 N/A PHE 145.A N LEU 95.A O no hydrogen 2.975 N/A VAL 146.A N ASP 169.A O no hydrogen 3.115 N/A THR 151.A N THR 164.A O no hydrogen 2.899 N/A ALA 153.A N GLU 162.A O no hydrogen 3.281 N/A ASN 155.A N ARG 160.A O no hydrogen 3.111 N/A LYS 159.A N ASN 155.A O no hydrogen 2.713 N/A GLU 162.A N ALA 153.A O no hydrogen 3.046 N/A ARG 163.A N ASN 104.A OD1 no hydrogen 3.130 N/A THR 164.A N THR 151.A O no hydrogen 2.842 N/A ILE 166.A N ASP 149.A O no hydrogen 3.028 N/A ILE 170.A N GLN 120.A OE1 no hydrogen 2.851 N/A LYS 171.A N LEU 144.A O no hydrogen 2.732 N/A LYS 171.A NZ SER 69.A OG no hydrogen 3.043 N/A LYS 171.A NZ GLU 91.A OE1 no hydrogen 3.291 N/A LYS 171.A NZ GLU 91.A OE2 no hydrogen 2.783 N/A VAL 172.A N ARG 72.A O no hydrogen 2.949 N/A VAL 173.A N ASN 142.A O no hydrogen 3.010 N/A PHE 175.A N GLU 55.A OE2 no hydrogen 2.902 N/A GLY 176.A N ASP 174.A OD1 no hydrogen 3.145 N/A ALA 178.A N PHE 175.A O no hydrogen 3.232 N/A THR 179.A N THR 134.A O no hydrogen 2.873 N/A THR 179.A OG1 SER 177.A O no hydrogen 2.974 N/A TYR 180.A N GLU 183.A OE1 no hydrogen 3.021 N/A TYR 180.A OH HIS 61.A ND1 no hydrogen 2.761 N/A ASP 181.A N LYS 132.A O no hydrogen 2.928 N/A GLU 183.A N TYR 180.A O no hydrogen 3.066 N/A HIS 185.A ND1 GLU 183.A O no hydrogen 2.779 N/A SER 190.A OG THR 136.A O no hydrogen 2.635 N/A THR 191.A OG1 ASP 137.A OD1 no hydrogen 2.769 N/A ARG 192.A NH1 SER 233.A OG no hydrogen 3.115 N/A HIS 193.A NE2 THR 230.A O no hydrogen 2.860 N/A TYR 194.A N THR 191.A O no hydrogen 2.882 N/A TYR 194.A OH GLU 220.A OE1 no hydrogen 2.538 N/A TYR 194.A OH GLU 220.A OE2 no hydrogen 2.933 N/A ARG 195.A N ARG 192.A O no hydrogen 3.089 N/A ARG 195.A NE VAL 189.A O no hydrogen 3.001 N/A ARG 195.A NH1 SER 190.A O no hydrogen 2.830 N/A GLU 198.A N GLU 198.A OE1 no hydrogen 2.778 N/A VAL 199.A N ALA 196.A O no hydrogen 3.001 N/A ILE 200.A N ALA 196.A O no hydrogen 3.094 N/A LEU 201.A N PRO 197.A O no hydrogen 2.884 N/A ALA 202.A N VAL 199.A O no hydrogen 3.048 N/A LEU 203.A N GLU 198.A O no hydrogen 2.959 N/A TRP 205.A NE1 SER 186.A O no hydrogen 2.874 N/A GLN 207.A N GLN 207.A OE1 no hydrogen 2.928 N/A GLN 207.A NE2 LEU 133.A O no hydrogen 3.231 N/A GLN 207.A NE2 ASP 181.A OD1 no hydrogen 2.725 N/A CYS 209.A N SER 206.A O no hydrogen 2.989 N/A CYS 209.A SG SER 206.A O no hydrogen 3.321 N/A ASP 210.A N GLN 207.A O no hydrogen 3.004 N/A TRP 212.A N PRO 208.A O no hydrogen 3.191 N/A SER 213.A N CYS 209.A O no hydrogen 3.142 N/A SER 213.A OG TYR 194.A O no hydrogen 2.685 N/A SER 213.A OG CYS 209.A O no hydrogen 3.111 N/A ILE 214.A N ASP 210.A O no hydrogen 3.029 N/A GLY 215.A N VAL 211.A O no hydrogen 3.062 N/A CYS 216.A N TRP 212.A O no hydrogen 3.055 N/A CYS 216.A SG HIS 193.A O no hydrogen 3.655 N/A CYS 216.A SG TRP 212.A O no hydrogen 3.535 N/A ILE 217.A N SER 213.A O no hydrogen 2.898 N/A LEU 218.A N ILE 214.A O no hydrogen 2.857 N/A ILE 219.A N GLY 215.A O no hydrogen 3.105 N/A GLU 220.A N CYS 216.A O no hydrogen 3.132 N/A TYR 221.A N ILE 217.A O no hydrogen 2.917 N/A TYR 221.A OH THR 97.A OG1 no hydrogen 2.808 N/A TYR 222.A N LEU 218.A O no hydrogen 3.062 N/A TYR 222.A OH HIS 296.A ND1 no hydrogen 2.686 N/A LEU 223.A N ILE 219.A O no hydrogen 2.871 N/A GLY 224.A N GLU 220.A O no hydrogen 2.760 N/A THR 226.A OG1 GLU 220.A OE2 no hydrogen 3.359 N/A PHE 228.A N THR 226.A OG1 no hydrogen 2.880 N/A THR 230.A OG1 ASP 232.A O no hydrogen 3.283 N/A THR 230.A OG1 GLU 235.A OE1 no hydrogen 2.697 N/A ASP 232.A N THR 230.A OG1 no hydrogen 3.276 N/A LYS 234.A NZ ASP 267.A O no hydrogen 2.920 N/A GLU 235.A N ASP 232.A OD2 no hydrogen 2.951 N/A HIS 236.A N ASP 232.A O no hydrogen 2.864 N/A LEU 237.A N SER 233.A O no hydrogen 3.070 N/A ALA 238.A N LYS 234.A O no hydrogen 2.925 N/A MET 239.A N GLU 235.A O no hydrogen 2.793 N/A MET 240.A N HIS 236.A O no hydrogen 2.975 N/A GLU 241.A N LEU 237.A O no hydrogen 2.918 N/A ARG 242.A N ALA 238.A O no hydrogen 3.020 N/A ARG 242.A NH2 SER 279.A O no hydrogen 2.942 N/A ILE 243.A N MET 239.A O no hydrogen 2.950 N/A LEU 244.A N MET 240.A O no hydrogen 2.746 N/A GLY 245.A N GLU 241.A O no hydrogen 2.859 N/A LEU 247.A N GLU 241.A OE2 no hydrogen 2.993 N/A ILE 252.A N PRO 248.A O no hydrogen 3.299 N/A GLN 253.A N LYS 249.A O no hydrogen 2.900 N/A LYS 254.A N HIS 250.A O no hydrogen 3.130 N/A THR 255.A N MET 251.A O no hydrogen 3.132 N/A THR 255.A OG1 LEU 201.A O no hydrogen 2.672 N/A LYS 257.A N THR 255.A OG1 no hydrogen 3.109 N/A ARG 258.A NH1 ILE 252.A O no hydrogen 2.725 N/A ARG 258.A NH1 THR 255.A O no hydrogen 2.999 N/A TYR 260.A N LYS 257.A O no hydrogen 3.086 N/A PHE 261.A N ARG 258.A O no hydrogen 2.891 N/A HIS 262.A N ARG 265.A O no hydrogen 2.829 N/A ARG 265.A N HIS 262.A O no hydrogen 3.136 N/A ASP 267.A N TYR 260.A O no hydrogen 2.893 N/A HIS 271.A N ASP 269.A OD1 no hydrogen 2.974 N/A SER 272.A N ASP 269.A O no hydrogen 3.087 N/A SER 272.A OG ASP 269.A O no hydrogen 2.696 N/A GLY 275.A N SER 272.A OG no hydrogen 3.154 N/A ARG 276.A N SER 272.A O no hydrogen 2.871 N/A TYR 277.A N SER 273.A O no hydrogen 2.984 N/A TYR 277.A OH PRO 229.A O no hydrogen 2.687 N/A VAL 278.A N ALA 274.A O no hydrogen 2.881 N/A SER 279.A N GLY 275.A O no hydrogen 2.912 N/A SER 279.A OG GLY 275.A O no hydrogen 3.140 N/A ARG 280.A N ARG 276.A O no hydrogen 2.819 N/A ARG 281.A N TYR 277.A O no hydrogen 3.035 N/A ARG 281.A N VAL 278.A O no hydrogen 3.224 N/A CYS 282.A N VAL 278.A O no hydrogen 2.911 N/A CYS 282.A SG VAL 227.A O no hydrogen 3.471 N/A LEU 285.A N ILE 243.A O no hydrogen 2.936 N/A GLU 287.A N PRO 284.A O no hydrogen 2.962 N/A PHE 288.A N LEU 285.A O no hydrogen 3.031 N/A MET 289.A N LYS 286.A O no hydrogen 3.088 N/A LEU 290.A N TYR 222.A OH no hydrogen 2.882 N/A SER 291.A OG ASP 293.A OD2 no hydrogen 3.047 N/A ASP 293.A N SER 291.A OG no hydrogen 3.103 N/A GLU 295.A N ASP 293.A OD1 no hydrogen 3.259 N/A HIS 296.A ND1 TYR 222.A OH no hydrogen 2.686 N/A GLU 297.A N ASP 293.A O no hydrogen 3.163 N/A ARG 298.A N VAL 294.A O no hydrogen 2.885 N/A ARG 298.A N GLU 295.A O no hydrogen 3.273 N/A LEU 299.A N GLU 295.A O no hydrogen 3.067 N/A PHE 300.A N HIS 296.A O no hydrogen 3.005 N/A ASP 301.A N GLU 297.A O no hydrogen 2.871 N/A LEU 302.A N ARG 298.A O no hydrogen 3.021 N/A ILE 303.A N LEU 299.A O no hydrogen 2.870 N/A GLN 304.A N PHE 300.A O no hydrogen 2.980 N/A LYS 305.A N ASP 301.A O no hydrogen 3.002 N/A LYS 305.A NZ ASP 301.A OD1 no hydrogen 3.093 N/A LYS 305.A NZ ASP 301.A OD2 no hydrogen 3.093 N/A MET 306.A N LEU 302.A O no hydrogen 2.811 N/A LEU 307.A N ILE 303.A O no hydrogen 2.889 N/A TYR 309.A OH GLY 245.A O no hydrogen 2.787 N/A ASP 310.A N GLU 308.A OE2 no hydrogen 2.952 N/A ALA 312.A N ASP 310.A OD1 no hydrogen 2.946 N/A LYS 313.A N ASP 310.A O no hydrogen 2.869 N/A LYS 313.A NZ ASP 310.A OD2 no hydrogen 2.799 N/A ARG 314.A N PRO 311.A O no hydrogen 3.371 N/A ARG 314.A NE GLU 308.A O no hydrogen 2.940 N/A ARG 314.A NH1 GLU 198.A OE1 no hydrogen 3.516 N/A ARG 314.A NH1 GLU 198.A OE2 no hydrogen 2.807 N/A ARG 314.A NH1 PRO 208.A O no hydrogen 2.851 N/A ARG 314.A NH2 GLU 198.A OE1 no hydrogen 2.988 N/A ARG 314.A NH2 GLU 308.A O no hydrogen 2.950 N/A ILE 315.A N LYS 305.A O no hydrogen 3.410 N/A THR 316.A N GLU 319.A OE1 no hydrogen 3.034 N/A GLU 319.A N THR 316.A OG1 no hydrogen 3.242 N/A ALA 320.A N THR 316.A O no hydrogen 2.839 N/A LEU 321.A N LEU 317.A O no hydrogen 2.975 N/A LYS 322.A N GLU 319.A O no hydrogen 3.093 N/A HIS 323.A N ALA 320.A O no hydrogen 2.987 N/A HIS 323.A NE2 ASP 301.A OD2 no hydrogen 2.582 N/A PHE 325.A N HIS 323.A ND1 no hydrogen 3.414 N/A PHE 326.A N HIS 323.A O no hydrogen 2.854 N/A ASP 327.A N PRO 324.A O no hydrogen 2.952 N/A LEU 329.A N PHE 326.A O no hydrogen 3.251 N/A LYS 330.A N ASP 327.A O no hydrogen 2.702 N/A