Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5f52_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A N ASP 84.A OD2 no hydrogen 2.801 N/A ILE 4.A N ASN 48.A O no hydrogen 2.909 N/A VAL 5.A N GLY 85.A O no hydrogen 3.178 N/A ILE 6.A N LYS 50.A O no hydrogen 2.838 N/A LEU 7.A N VAL 87.A O no hydrogen 2.742 N/A ALA 8.A N GLU 52.A O no hydrogen 2.874 N/A THR 9.A N THR 89.A O no hydrogen 2.902 N/A THR 9.A OG1 THR 89.A O no hydrogen 2.790 N/A GLY 11.A N ALA 28.A O.A no hydrogen 3.075 N/A GLY 11.A N MET 57.A O no hydrogen 3.000 N/A ALA 14.A N GLY 11.A O no hydrogen 2.908 N/A GLY 15.A N THR 12.A O no hydrogen 2.859 N/A ALA 17.A N THR 122.A OG1 no hydrogen 2.872 N/A ALA 18.A N GLN 22.A OE1 no hydrogen 3.151 N/A THR 21.A N THR 19.A OG1 no hydrogen 3.412 N/A GLN 22.A NE2 THR 24.A O no hydrogen 2.778 N/A LYS 27.A NZ GLY 29.A O no hydrogen 3.346 N/A LYS 27.A NZ ASN 56.A O no hydrogen 3.094 N/A ALA 30.A N ALA 14.A O no hydrogen 2.884 N/A LEU 31.A N ALA 14.A O no hydrogen 2.826 N/A VAL 33.A N GLN 53.A OE1 no hydrogen 2.854 N/A THR 35.A N GLY 32.A O no hydrogen 2.965 N/A LEU 36.A N GLY 32.A O no hydrogen 3.309 N/A ILE 37.A N VAL 33.A O no hydrogen 3.001 N/A ASN 38.A N ASP 34.A O no hydrogen 2.798 N/A ALA 39.A N THR 35.A O no hydrogen 3.163 N/A VAL 40.A N ILE 37.A O no hydrogen 3.011 N/A GLU 42.A N GLU 42.A OE1 no hydrogen 2.842 N/A VAL 43.A N VAL 40.A O no hydrogen 2.864 N/A LYS 44.A N PRO 41.A O no hydrogen 3.005 N/A LYS 45.A N GLU 42.A O no hydrogen 3.126 N/A LEU 46.A N VAL 43.A O no hydrogen 2.926 N/A ALA 47.A N VAL 43.A O no hydrogen 3.040 N/A ASN 48.A N PRO 2.A O no hydrogen 2.879 N/A ASN 48.A ND2 ASN 3.A OD1 no hydrogen 3.265 N/A LYS 50.A N ILE 4.A O no hydrogen 2.987 N/A GLU 52.A N ILE 6.A O no hydrogen 2.853 N/A GLN 53.A NE2 SER 55.A O no hydrogen 2.852 N/A PHE 54.A N ALA 8.A O no hydrogen 2.829 N/A SER 55.A N ALA 8.A O no hydrogen 3.061 N/A SER 55.A OG THR 9.A O no hydrogen 2.811 N/A ASN 56.A ND2 LEU 31.A O no hydrogen 3.134 N/A MET 57.A N THR 9.A O no hydrogen 2.922 N/A GLU 60.A N GLU 60.A OE1 no hydrogen 2.757 N/A ASN 61.A N ALA 58.A O no hydrogen 2.924 N/A MET 62.A N SER 59.A O no hydrogen 3.060 N/A VAL 67.A N THR 63.A O no hydrogen 2.923 N/A LEU 68.A N GLY 64.A O no hydrogen 2.833 N/A LYS 69.A N ASP 65.A O no hydrogen 3.396 N/A LEU 70.A N VAL 66.A O no hydrogen 2.847 N/A SER 71.A N VAL 67.A O no hydrogen 2.865 N/A SER 71.A OG.A THR 105.A OG1 no hydrogen 2.669 N/A SER 71.A OG.B LEU 68.A O no hydrogen 2.696 N/A GLN 72.A N LEU 68.A O no hydrogen 2.996 N/A GLN 72.A NE2 VAL 208.A O no hydrogen 2.961 N/A GLN 72.A NE2 LEU 211.A O no hydrogen 2.878 N/A ARG 73.A N LYS 69.A O no hydrogen 2.879 N/A ARG 73.A NE GLU 52.A OE2 no hydrogen 2.772 N/A ARG 73.A NH1 GLU 76.A OE1 no hydrogen 2.905 N/A ARG 73.A NH2 GLU 52.A OE1 no hydrogen 2.855 N/A ARG 73.A NH2 GLU 52.A OE2 no hydrogen 3.317 N/A VAL 74.A N LEU 70.A O no hydrogen 2.932 N/A ASN 75.A N SER 71.A O no hydrogen 2.963 N/A ASN 75.A ND2 SER 71.A O no hydrogen 3.282 N/A ASN 75.A ND2 THR 105.A O no hydrogen 3.032 N/A GLU 76.A N GLN 72.A O no hydrogen 3.027 N/A LEU 77.A N ARG 73.A O no hydrogen 2.929 N/A LEU 78.A N VAL 74.A O no hydrogen 2.893 N/A ALA 79.A N ASN 75.A O no hydrogen 3.061 N/A ARG 80.A N LEU 77.A O no hydrogen 3.071 N/A ARG 80.A NE ASP 82.A OD1 no hydrogen 2.790 N/A ARG 80.A NH2 ASP 82.A OD2 no hydrogen 2.813 N/A VAL 83.A N ARG 80.A O no hydrogen 3.284 N/A ASP 84.A N ASN 3.A O no hydrogen 2.817 N/A VAL 86.A N PRO 111.A O no hydrogen 2.974 N/A VAL 87.A N VAL 5.A O no hydrogen 2.878 N/A ILE 88.A N VAL 113.A O no hydrogen 2.832 N/A THR 89.A N LEU 7.A O no hydrogen 3.070 N/A HIS 90.A N VAL 115.A O no hydrogen 2.973 N/A HIS 90.A ND1 GLY 91.A O no hydrogen 2.765 N/A HIS 90.A NE2 SER 98.A OG no hydrogen 2.744 N/A THR 92.A OG1 ASP 93.A OD1 no hydrogen 3.531 N/A THR 94.A N SER 59.A OG no hydrogen 2.984 N/A THR 94.A OG1 SER 59.A O no hydrogen 2.750 N/A GLU 97.A N THR 94.A O no hydrogen 3.024 N/A SER 98.A N THR 94.A O no hydrogen 3.219 N/A SER 98.A OG HIS 90.A NE2 no hydrogen 2.744 N/A ALA 99.A N VAL 95.A O no hydrogen 2.822 N/A TYR 100.A N GLU 96.A O no hydrogen 3.065 N/A TYR 100.A OH TYR 324.A OXT no hydrogen 2.635 N/A PHE 101.A N GLU 97.A O no hydrogen 2.991 N/A LEU 102.A N SER 98.A O no hydrogen 3.063 N/A HIS 103.A N ALA 99.A O no hydrogen 2.817 N/A LEU 104.A N TYR 100.A O no hydrogen 3.150 N/A LEU 104.A N PHE 101.A O no hydrogen 3.201 N/A THR 105.A N LEU 102.A O no hydrogen 3.106 N/A THR 105.A OG1 SER 71.A OG.A no hydrogen 2.669 N/A THR 105.A OG1 PHE 101.A O no hydrogen 2.812 N/A VAL 106.A N LEU 102.A O no hydrogen 2.888 N/A LYS 107.A N ASN 75.A OD1 no hydrogen 2.790 N/A LYS 107.A NZ PHE 206.A O no hydrogen 2.767 N/A LYS 110.A N SER 108.A OG no hydrogen 3.001 N/A LYS 110.A NZ LEU 78.A O no hydrogen 2.854 N/A LYS 110.A NZ VAL 83.A O no hydrogen 2.730 N/A VAL 113.A N VAL 86.A O no hydrogen 2.894 N/A PHE 114.A N MET 150.A O no hydrogen 2.773 N/A VAL 115.A N ILE 88.A O no hydrogen 2.863 N/A MET 118.A N ASP 127.A OD2 no hydrogen 2.843 N/A ARG 119.A N ASP 127.A OD1 no hydrogen 2.983 N/A ARG 119.A NH1 SER 125.A O no hydrogen 2.914 N/A ALA 121.A N GLY 15.A O no hydrogen 2.965 N/A ALA 123.A N PRO 120.A O no hydrogen 2.950 N/A ILE 124.A N GLY 20.A O no hydrogen 2.914 N/A ALA 126.A N ALA 123.A O no hydrogen 3.186 N/A ASP 127.A N ASP 127.A OD1 no hydrogen 2.652 N/A ASN 131.A N ASP 127.A O no hydrogen 2.984 N/A ASN 131.A ND2 ALA 116.A O no hydrogen 2.909 N/A LEU 132.A N GLY 128.A O no hydrogen 2.820 N/A LEU 133.A N.A PRO 129.A O no hydrogen 3.027 N/A LEU 133.A N.B PRO 129.A O no hydrogen 3.029 N/A GLU 134.A N MET 130.A O no hydrogen 2.949 N/A ALA 135.A N ASN 131.A O no hydrogen 2.851 N/A VAL 136.A N LEU 132.A O no hydrogen 2.955 N/A ARG 137.A N LEU 133.A O.A no hydrogen 2.969 N/A ARG 137.A N LEU 133.A O.B no hydrogen 2.973 N/A VAL 138.A N GLU 134.A O no hydrogen 2.899 N/A ALA 139.A N ALA 135.A O no hydrogen 2.856 N/A GLY 140.A N VAL 136.A O no hydrogen 2.999 N/A ASP 141.A N VAL 138.A O no hydrogen 3.258 N/A LYS 142.A NZ GLY 140.A O no hydrogen 3.408 N/A GLN 143.A N ASP 141.A OD1 no hydrogen 2.859 N/A SER 144.A N ASP 141.A O no hydrogen 2.957 N/A SER 144.A OG VAL 138.A O no hydrogen 2.656 N/A SER 144.A OG TYR 192.A OH no hydrogen 2.681 N/A ARG 145.A N LYS 142.A O no hydrogen 3.281 N/A GLY 146.A N ASP 109.A O no hydrogen 2.925 N/A ARG 147.A NE GLN 143.A O no hydrogen 2.806 N/A ARG 147.A NH2 GLN 143.A O no hydrogen 3.136 N/A VAL 149.A N HIS 103.A ND1 no hydrogen 3.101 N/A MET 150.A N VAL 112.A O no hydrogen 3.069 N/A VAL 151.A N GLY 158.A O no hydrogen 2.843 N/A VAL 152.A N PHE 114.A O no hydrogen 2.874 N/A LEU 153.A N ARG 156.A O no hydrogen 3.347 N/A ASN 154.A N ASN 131.A OD1 no hydrogen 2.900 N/A ASP 155.A N GLU 134.A OE1 no hydrogen 2.987 N/A ARG 156.A N LEU 153.A O no hydrogen 2.973 N/A ARG 156.A NH1 ASN 154.A O no hydrogen 3.000 N/A ILE 157.A N GLY 183.A O no hydrogen 2.885 N/A GLY 158.A N VAL 151.A O no hydrogen 2.834 N/A ALA 160.A N VAL 149.A O no hydrogen 2.960 N/A ARG 161.A N SER 159.A OG no hydrogen 3.220 N/A ARG 161.A NE TYR 324.A O no hydrogen 2.853 N/A ARG 161.A NH1 ARG 161.A O no hydrogen 3.053 N/A ARG 161.A NH1 SER 294.A OG no hydrogen 3.400 N/A ARG 161.A NH2 SER 294.A OG no hydrogen 2.880 N/A TYR 162.A N SER 159.A O no hydrogen 3.017 N/A ILE 163.A N SER 159.A O no hydrogen 2.879 N/A THR 164.A N LYS 175.A O no hydrogen 3.222 N/A THR 164.A OG1 GLU 96.A OE1 no hydrogen 3.331 N/A THR 164.A OG1 GLU 96.A OE2 no hydrogen 2.724 N/A LYS 165.A N GLU 96.A OE1 no hydrogen 3.114 N/A LYS 165.A NZ THR 92.A OG1 no hydrogen 2.773 N/A LYS 165.A NZ ASP 93.A OD1 no hydrogen 2.752 N/A THR 166.A N THR 173.A O no hydrogen 2.907 N/A THR 166.A OG1 THR 173.A O no hydrogen 2.704 N/A ASN 167.A N THR 173.A OG1 no hydrogen 2.777 N/A SER 169.A N ASN 167.A OD1 no hydrogen 2.918 N/A THR 173.A N THR 170.A O no hydrogen 3.348 N/A THR 173.A OG1 ASN 167.A O no hydrogen 2.611 N/A LYS 175.A N THR 164.A O no hydrogen 3.185 N/A LYS 175.A NZ ASP 172.A O no hydrogen 2.982 N/A LYS 175.A NZ ASP 172.A OD2 no hydrogen 2.931 N/A ASN 177.A ND2 ASN 278.A OD1 no hydrogen 3.099 N/A GLY 180.A N ALA 176.A O no hydrogen 2.840 N/A TYR 181.A OH PHE 174.A O no hydrogen 2.714 N/A LEU 182.A N ILE 157.A O no hydrogen 2.758 N/A GLY 183.A N ILE 157.A O no hydrogen 3.303 N/A VAL 184.A N TYR 191.A O no hydrogen 2.932 N/A ILE 185.A N ASP 155.A O no hydrogen 2.861 N/A ILE 186.A N ARG 189.A O no hydrogen 2.969 N/A ARG 189.A N ILE 186.A O no hydrogen 3.106 N/A TYR 191.A N VAL 184.A O no hydrogen 2.783 N/A TYR 192.A OH SER 144.A OG no hydrogen 2.681 N/A GLN 193.A N LEU 182.A O no hydrogen 2.689 N/A GLN 193.A NE2 TYR 181.A O no hydrogen 3.087 N/A ASN 194.A N LEU 182.A O no hydrogen 3.070 N/A ASN 194.A ND2 TYR 181.A O no hydrogen 3.168 N/A LYS 198.A NZ HIS 322.A O no hydrogen 3.287 N/A LEU 199.A N THR 323.A O no hydrogen 2.929 N/A HIS 200.A ND1 THR 201.A OG1 no hydrogen 2.881 N/A THR 201.A N HIS 103.A O no hydrogen 2.835 N/A THR 201.A OG1 HIS 200.A ND1 no hydrogen 2.881 N/A THR 202.A OG1 ASP 109.A OD1 no hydrogen 2.954 N/A ARG 203.A N HIS 200.A O no hydrogen 2.827 N/A SER 204.A N THR 201.A O no hydrogen 3.135 N/A SER 204.A OG LEU 104.A O no hydrogen 2.621 N/A VAL 205.A N TYR 324.A OH no hydrogen 2.931 N/A PHE 206.A N SER 204.A OG no hydrogen 3.231 N/A ARG 209.A N ASP 207.A OD1 no hydrogen 3.237 N/A ARG 209.A NE ASP 207.A OD1 no hydrogen 2.825 N/A ARG 209.A NH2 ASP 207.A OD1 no hydrogen 3.562 N/A ARG 209.A NH2 ASP 207.A OD2 no hydrogen 2.907 N/A LEU 211.A N VAL 208.A O no hydrogen 3.106 N/A LYS 216.A NZ ASP 218.A OD2 no hydrogen 3.348 N/A ASP 218.A N GLY 241.A O no hydrogen 3.161 N/A LEU 220.A N VAL 243.A O no hydrogen 2.955 N/A GLY 222.A N ALA 245.A O no hydrogen 2.865 N/A ASP 226.A N TYR 223.A O no hydrogen 3.047 N/A ASP 232.A N GLU 228.A O no hydrogen 3.231 N/A ALA 233.A N TYR 229.A O no hydrogen 2.885 N/A ALA 234.A N LEU 230.A O no hydrogen 3.069 N/A ILE 235.A N TYR 231.A O no hydrogen 2.943 N/A GLN 236.A N ASP 232.A O no hydrogen 2.980 N/A HIS 237.A N ALA 233.A O no hydrogen 2.976 N/A HIS 237.A ND1 ALA 233.A O no hydrogen 2.895 N/A GLY 238.A N ILE 235.A O no hydrogen 3.003 N/A VAL 239.A N ALA 234.A O no hydrogen 3.253 N/A LYS 240.A N LYS 216.A O no hydrogen 2.807 N/A GLY 241.A N LYS 216.A O no hydrogen 3.282 N/A ILE 242.A N VAL 269.A O no hydrogen 2.911 N/A VAL 243.A N ASP 218.A O no hydrogen 2.900 N/A TYR 244.A N ILE 271.A O no hydrogen 2.832 N/A TYR 244.A OH SER 251.A O no hydrogen 2.485 N/A ALA 245.A N LEU 220.A O no hydrogen 2.786 N/A GLY 246.A N SER 273.A O no hydrogen 3.118 N/A SER 251.A N MET 247.A O no hydrogen 2.840 N/A SER 251.A OG MET 247.A O no hydrogen 3.529 N/A SER 253.A OG ASP 226.A OD1 no hydrogen 2.704 N/A ARG 255.A NE ASP 226.A O no hydrogen 2.677 N/A ARG 255.A NH2 ASP 226.A OD1 no hydrogen 2.904 N/A GLY 256.A N SER 253.A OG no hydrogen 3.034 N/A ILE 257.A N SER 253.A O no hydrogen 2.927 N/A ALA 258.A N VAL 254.A O no hydrogen 3.153 N/A GLY 259.A N ARG 255.A O no hydrogen 2.997 N/A MET 260.A N GLY 256.A O no hydrogen 2.865 N/A ARG 261.A N ILE 257.A O no hydrogen 2.868 N/A LYS 262.A N ALA 258.A O no hydrogen 3.075 N/A LYS 262.A NZ GLU 228.A OE2 no hydrogen 2.666 N/A LYS 262.A NZ ASP 232.A OD1 no hydrogen 2.710 N/A LYS 262.A NZ ASP 232.A OD2 no hydrogen 3.515 N/A ALA 263.A N GLY 259.A O no hydrogen 2.986 N/A MET 264.A N MET 260.A O no hydrogen 2.909 N/A GLU 265.A N ARG 261.A O no hydrogen 3.038 N/A LYS 266.A N LYS 262.A O no hydrogen 3.274 N/A GLY 267.A N MET 264.A O no hydrogen 2.938 N/A VAL 268.A N ALA 263.A O no hydrogen 3.037 N/A VAL 269.A N LYS 240.A O no hydrogen 3.062 N/A ILE 271.A N ILE 242.A O no hydrogen 2.886 N/A ARG 272.A N LEU 290.A O no hydrogen 2.798 N/A ARG 272.A NE PRO 288.A O no hydrogen 2.846 N/A ARG 272.A NH1 GLY 250.A O no hydrogen 2.848 N/A SER 273.A N TYR 244.A O no hydrogen 2.786 N/A SER 273.A OG SER 292.A OG no hydrogen 3.371 N/A SER 273.A OG LEU 295.A O no hydrogen 2.891 N/A THR 274.A OG1 GLY 248.A O no hydrogen 2.631 N/A THR 274.A OG1 THR 276.A OG1 no hydrogen 2.794 N/A ARG 275.A N GLY 246.A O no hydrogen 2.806 N/A ARG 275.A NH1 GLY 222.A O no hydrogen 2.879 N/A THR 276.A N THR 274.A OG1 no hydrogen 3.047 N/A THR 276.A OG1 THR 274.A OG1 no hydrogen 2.794 N/A THR 276.A OG1 ASN 278.A O no hydrogen 3.165 N/A VAL 281.A N ASP 293.A O no hydrogen 2.993 N/A GLU 286.A N ASP 284.A OD1 no hydrogen 3.035 N/A LEU 287.A N ASP 284.A O no hydrogen 3.049 N/A LEU 290.A N VAL 270.A O no hydrogen 2.828 N/A VAL 291.A N GLN 318.A OE1 no hydrogen 2.892 N/A SER 292.A N ARG 272.A O no hydrogen 2.910 N/A SER 292.A OG ARG 272.A O no hydrogen 3.383 N/A SER 292.A OG SER 273.A OG no hydrogen 3.371 N/A SER 292.A OG ASP 293.A O no hydrogen 3.503 N/A SER 292.A OG LEU 295.A O no hydrogen 3.094 N/A SER 294.A N ASP 293.A OD1 no hydrogen 2.702 N/A SER 294.A OG ASP 293.A OD1 no hydrogen 3.395 N/A LEU 295.A N SER 292.A O no hydrogen 2.954 N/A ASN 296.A ND2 GLU 96.A OE2 no hydrogen 3.191 N/A HIS 299.A N ASN 296.A OD1 no hydrogen 2.936 N/A HIS 299.A ND1.A ASN 296.A OD1 no hydrogen 2.734 N/A HIS 299.A NE2.A ALA 160.A O no hydrogen 2.788 N/A ALA 300.A N ASN 296.A O no hydrogen 2.776 N/A ARG 301.A N PRO 297.A O no hydrogen 2.960 N/A ARG 301.A NE VAL 217.A O no hydrogen 2.900 N/A ILE 302.A N ALA 298.A O no hydrogen 3.349 N/A LEU 303.A N HIS 299.A O no hydrogen 2.985 N/A LEU 304.A N ALA 300.A O no hydrogen 2.925 N/A MET 305.A N ARG 301.A O no hydrogen 2.903 N/A LEU 306.A N ILE 302.A O no hydrogen 3.111 N/A ALA 307.A N LEU 303.A O no hydrogen 2.782 N/A LEU 308.A N LEU 304.A O no hydrogen 2.869 N/A THR 309.A N LEU 306.A O no hydrogen 3.029 N/A THR 309.A OG1 LEU 306.A O no hydrogen 2.565 N/A ARG 310.A N ALA 307.A O no hydrogen 2.951 N/A ARG 310.A NE TYR 320.A OH no hydrogen 3.488 N/A THR 311.A N ALA 307.A O no hydrogen 2.920 N/A ASP 313.A N THR 311.A OG1 no hydrogen 2.858 N/A LYS 315.A N ASP 313.A OD1 no hydrogen 2.983 N/A VAL 316.A N ASP 313.A O no hydrogen 3.074 N/A ILE 317.A N ASP 313.A O no hydrogen 2.948 N/A GLN 318.A N PRO 314.A O no hydrogen 2.869 N/A GLN 318.A NE2 VAL 291.A O no hydrogen 2.939 N/A GLN 318.A NE2 GLN 318.A O no hydrogen 3.055 N/A GLU 319.A N LYS 315.A O no hydrogen 3.091 N/A TYR 320.A N VAL 316.A O no hydrogen 2.947 N/A PHE 321.A N ILE 317.A O no hydrogen 3.082 N/A HIS 322.A N GLN 318.A O no hydrogen 3.216 N/A HIS 322.A N GLU 319.A O no hydrogen 3.095 N/A HIS 322.A ND1 ASP 293.A OD2 no hydrogen 2.760 N/A THR 323.A N TYR 320.A O no hydrogen 3.058 N/A THR 323.A OG1 GLU 319.A O no hydrogen 2.781 N/A THR 323.A OG1 TYR 320.A O no hydrogen 3.503 N/A TYR 324.A N TYR 320.A O no hydrogen 2.915 N/A