Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hxf_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLU 226.A O no hydrogen 2.842 N/A VAL 4.A N ASP 3.A OD1 no hydrogen 2.719 N/A ALA 10.A N LYS 7.A O no hydrogen 3.089 N/A LYS 18.A NZ GLU 265.A O no hydrogen 3.536 N/A LYS 18.A NZ GLU 266.A O no hydrogen 2.832 N/A HIS 19.A N LEU 15.A O no hydrogen 3.102 N/A ALA 20.A N LEU 16.A O no hydrogen 3.004 N/A ASP 21.A N GLU 17.A O no hydrogen 3.106 N/A TYR 22.A N LYS 18.A O no hydrogen 2.927 N/A ILE 23.A N HIS 19.A O no hydrogen 3.002 N/A ALA 24.A N ALA 20.A O no hydrogen 2.885 N/A SER 25.A N ASP 21.A O no hydrogen 3.073 N/A SER 25.A OG ASP 21.A O no hydrogen 3.297 N/A TYR 26.A N ILE 23.A O no hydrogen 3.027 N/A SER 28.A OG SER 25.A O no hydrogen 2.571 N/A MET 33.A N TYR 29.A O no hydrogen 2.799 N/A SER 34.A N TYR 31.A O no hydrogen 3.318 N/A SER 34.A OG GLU 30.A O no hydrogen 2.427 N/A SER 34.A OG TYR 31.A O no hydrogen 2.902 N/A GLU 35.A N CYS 32.A O no hydrogen 3.376 N/A LEU 37.A N SER 34.A O no hydrogen 2.815 N/A ARG 38.A N GLU 35.A O no hydrogen 3.033 N/A ARG 38.A NH1 TYR 31.A O no hydrogen 3.288 N/A ARG 38.A NH1 SER 34.A OG no hydrogen 3.412 N/A ARG 38.A NH2 TYR 31.A O no hydrogen 2.595 N/A MET 39.A N ALA 79.A O no hydrogen 2.796 N/A SER 40.A OG SER 92.A OG no hydrogen 2.714 N/A GLY 41.A N LEU 37.A O no hydrogen 3.090 N/A VAL 42.A N ARG 38.A O no hydrogen 2.865 N/A TYR 43.A N MET 39.A O no hydrogen 3.051 N/A TYR 43.A OH CYS 306.A O no hydrogen 2.821 N/A TRP 44.A N SER 40.A O no hydrogen 2.813 N/A GLY 45.A N GLY 41.A O no hydrogen 3.068 N/A LEU 46.A N VAL 42.A O no hydrogen 2.900 N/A THR 47.A N TYR 43.A O no hydrogen 2.979 N/A THR 47.A OG1 TYR 43.A O no hydrogen 2.837 N/A VAL 48.A N TRP 44.A O no hydrogen 3.012 N/A MET 49.A N GLY 45.A O no hydrogen 3.052 N/A ASP 50.A N LEU 46.A O no hydrogen 2.921 N/A LEU 51.A N THR 47.A O no hydrogen 2.968 N/A MET 52.A N VAL 48.A O no hydrogen 3.012 N/A GLY 53.A N ASP 50.A O no hydrogen 3.011 N/A GLN 54.A N MET 49.A O no hydrogen 2.817 N/A GLN 54.A NE2 MET 52.A O no hydrogen 3.602 N/A ARG 57.A N GLN 54.A O no hydrogen 3.101 N/A ARG 57.A NH1 GLN 54.A OE1 no hydrogen 3.345 N/A ARG 57.A NH2 ASP 21.A OD2 no hydrogen 2.927 N/A MET 58.A N LEU 55.A O no hydrogen 2.967 N/A LYS 60.A NZ TYR 100.A O no hydrogen 3.334 N/A GLU 62.A N ASN 59.A OD1 no hydrogen 3.082 N/A ILE 63.A N ASN 59.A O no hydrogen 3.090 N/A LEU 64.A N LYS 60.A O no hydrogen 2.939 N/A VAL 65.A N GLU 61.A O no hydrogen 3.155 N/A PHE 66.A N GLU 62.A O no hydrogen 3.103 N/A ILE 67.A N ILE 63.A O no hydrogen 2.922 N/A LYS 68.A N LEU 64.A O no hydrogen 3.111 N/A LYS 68.A NZ VAL 105.A O no hydrogen 2.943 N/A SER 69.A N VAL 65.A O no hydrogen 2.989 N/A SER 69.A OG.A PHE 66.A O no hydrogen 2.799 N/A SER 69.A OG.B VAL 65.A O no hydrogen 3.108 N/A CYS 70.A N ILE 67.A O no hydrogen 2.877 N/A CYS 70.A SG PHE 66.A O no hydrogen 3.346 N/A GLN 71.A N LYS 68.A O no hydrogen 3.335 N/A GLN 71.A NE2 GLY 75.A O no hydrogen 2.943 N/A GLN 71.A NE2 ASN 107.A O no hydrogen 3.067 N/A HIS 72.A N GLY 76.A O no hydrogen 2.783 N/A HIS 72.A NE2 SER 78.A OG no hydrogen 3.002 N/A GLY 75.A N HIS 72.A O no hydrogen 3.028 N/A VAL 77.A N THR 90.A OG1 no hydrogen 3.009 N/A SER 78.A N CYS 70.A O no hydrogen 2.911 N/A SER 78.A OG CYS 70.A O no hydrogen 3.219 N/A SER 78.A OG HIS 72.A NE2 no hydrogen 3.002 N/A SER 78.A OG SER 80.A O no hydrogen 2.891 N/A SER 78.A OG HIS 83.A O no hydrogen 3.285 N/A HIS 83.A N SER 80.A O no hydrogen 3.068 N/A HIS 83.A NE2 GLU 35.A OE2 no hydrogen 2.894 N/A HIS 86.A N VAL 77.A O no hydrogen 3.119 N/A LEU 87.A N GLY 127.A O no hydrogen 2.917 N/A THR 90.A N HIS 86.A O no hydrogen 2.939 N/A THR 90.A OG1 VAL 77.A O no hydrogen 3.372 N/A THR 90.A OG1 HIS 86.A O no hydrogen 2.751 N/A LEU 91.A N LEU 87.A O no hydrogen 2.967 N/A SER 92.A N LEU 88.A O no hydrogen 3.137 N/A SER 92.A OG SER 40.A OG no hydrogen 2.714 N/A SER 92.A OG LEU 88.A O no hydrogen 3.282 N/A ALA 93.A N TYR 89.A O no hydrogen 2.946 N/A VAL 94.A N THR 90.A O no hydrogen 3.008 N/A GLN 95.A N LEU 91.A O no hydrogen 2.751 N/A GLN 95.A NE2 PHE 305.A O no hydrogen 3.032 N/A ILE 96.A N SER 92.A O no hydrogen 2.963 N/A LEU 97.A N ALA 93.A O no hydrogen 2.971 N/A THR 98.A N VAL 94.A O no hydrogen 2.937 N/A THR 98.A OG1 VAL 94.A O no hydrogen 2.755 N/A LEU 99.A N GLN 95.A O no hydrogen 2.938 N/A TYR 100.A N ILE 96.A O no hydrogen 3.028 N/A ASP 101.A N THR 98.A O no hydrogen 3.152 N/A SER 102.A N LEU 97.A O no hydrogen 2.752 N/A SER 102.A OG TYR 100.A O no hydrogen 2.833 N/A VAL 105.A N SER 102.A O no hydrogen 3.026 N/A ILE 106.A N ILE 103.A O no hydrogen 3.222 N/A ASN 107.A N GLN 71.A OE1 no hydrogen 2.896 N/A VAL 111.A N ASN 107.A O no hydrogen 3.143 N/A VAL 112.A N VAL 108.A O no hydrogen 2.988 N/A ALA 113.A N ASP 109.A O no hydrogen 3.070 N/A TYR 114.A N LYS 110.A O no hydrogen 2.844 N/A VAL 115.A N VAL 111.A O no hydrogen 2.919 N/A GLN 116.A N VAL 112.A O no hydrogen 2.933 N/A GLN 116.A NE2 ALA 153.A O no hydrogen 2.610 N/A SER 117.A N ALA 113.A O no hydrogen 3.014 N/A SER 117.A OG TYR 114.A O no hydrogen 2.724 N/A LEU 118.A N VAL 115.A O no hydrogen 3.168 N/A GLN 119.A N GLN 116.A O no hydrogen 3.381 N/A GLN 119.A NE2 GLY 123.A O no hydrogen 3.182 N/A GLN 119.A NE2 ASN 155.A O no hydrogen 2.905 N/A LYS 120.A N SER 124.A O no hydrogen 2.640 N/A GLY 123.A N LYS 120.A O no hydrogen 2.892 N/A SER 124.A N ASP 122.A OD1 no hydrogen 3.019 N/A SER 124.A OG ASP 122.A OD1 no hydrogen 2.583 N/A ALA 126.A N LEU 118.A O no hydrogen 3.047 N/A GLY 127.A N GLU 132.A O no hydrogen 2.951 N/A TRP 130.A N ASP 128.A OD1 no hydrogen 2.713 N/A GLY 131.A N ASP 128.A O no hydrogen 3.182 N/A THR 135.A N CYS 175.A O no hydrogen 2.809 N/A THR 135.A OG1 GLY 174.A O no hydrogen 2.944 N/A ARG 136.A N ASP 134.A OD1 no hydrogen 2.844 N/A ARG 136.A NE ASP 134.A OD2 no hydrogen 3.032 N/A ARG 136.A NH2 ASP 134.A OD2 no hydrogen 3.073 N/A PHE 137.A N ASP 134.A O no hydrogen 2.835 N/A PHE 139.A N THR 135.A O no hydrogen 3.128 N/A CYS 140.A N ARG 136.A O no hydrogen 2.888 N/A CYS 140.A SG ARG 136.A O no hydrogen 3.357 N/A ALA 141.A N PHE 137.A O no hydrogen 2.850 N/A VAL 142.A N SER 138.A O no hydrogen 3.138 N/A ALA 143.A N PHE 139.A O no hydrogen 2.843 N/A THR 144.A N CYS 140.A O no hydrogen 3.004 N/A THR 144.A OG1 CYS 140.A O no hydrogen 2.728 N/A LEU 145.A N ALA 141.A O no hydrogen 2.985 N/A ALA 146.A N VAL 142.A O no hydrogen 2.883 N/A LEU 147.A N ALA 143.A O no hydrogen 3.104 N/A LEU 148.A N THR 144.A O no hydrogen 3.301 N/A LEU 148.A N LEU 145.A O no hydrogen 3.146 N/A GLY 149.A N ALA 146.A O no hydrogen 3.146 N/A LYS 150.A N LEU 145.A O no hydrogen 2.805 N/A ALA 153.A N LYS 150.A O no hydrogen 3.013 N/A ILE 154.A N LEU 151.A O no hydrogen 3.349 N/A ASN 155.A N GLN 119.A OE1 no hydrogen 2.842 N/A LYS 158.A N ASN 155.A OD1 no hydrogen 3.177 N/A ALA 159.A N ASN 155.A O no hydrogen 2.983 N/A ILE 160.A N VAL 156.A O no hydrogen 2.948 N/A GLU 161.A N GLU 157.A O no hydrogen 2.891 N/A PHE 162.A N LYS 158.A O no hydrogen 3.040 N/A VAL 163.A N ALA 159.A O no hydrogen 3.113 N/A LEU 164.A N ILE 160.A O no hydrogen 2.838 N/A SER 165.A N GLU 161.A O no hydrogen 3.044 N/A SER 165.A OG PHE 162.A O no hydrogen 2.556 N/A CYS 166.A N VAL 163.A O no hydrogen 2.985 N/A CYS 166.A SG PHE 162.A O no hydrogen 3.481 N/A MET 167.A N LEU 164.A O no hydrogen 3.032 N/A ASN 168.A N GLY 172.A O no hydrogen 2.669 N/A ASN 168.A ND2 SER 179.A O no hydrogen 2.795 N/A ASN 168.A ND2 SER 181.A OG no hydrogen 2.932 N/A GLY 171.A N ASN 168.A O no hydrogen 3.021 N/A GLY 172.A N ASP 170.A OD1 no hydrogen 3.040 N/A GLY 174.A N CYS 166.A O no hydrogen 3.449 N/A CYS 175.A SG ASP 134.A OD2 no hydrogen 3.577 N/A ARG 176.A N SER 179.A OG no hydrogen 3.314 N/A ARG 176.A NH1 ILE 133.A O no hydrogen 2.640 N/A SER 179.A N ARG 176.A O no hydrogen 2.955 N/A SER 179.A OG ARG 176.A O no hydrogen 3.183 N/A SER 181.A OG ASP 170.A OD1 no hydrogen 2.610 N/A SER 181.A OG ASP 170.A OD2 no hydrogen 3.293 N/A HIS 182.A N PHE 173.A O no hydrogen 3.290 N/A ALA 183.A N GLY 223.A O no hydrogen 2.887 N/A GLN 185.A NE2 ASP 134.A OD1 no hydrogen 3.124 N/A ILE 186.A N HIS 182.A O no hydrogen 2.999 N/A TYR 187.A N ALA 183.A O no hydrogen 2.926 N/A CYS 188.A N GLY 184.A O no hydrogen 3.176 N/A CYS 188.A SG GLY 184.A O no hydrogen 3.392 N/A CYS 189.A N GLN 185.A O no hydrogen 2.830 N/A CYS 189.A SG GLN 185.A O no hydrogen 3.373 N/A THR 190.A N ILE 186.A O no hydrogen 2.800 N/A THR 190.A OG1 ILE 186.A O no hydrogen 2.823 N/A THR 190.A OG1 TYR 187.A O no hydrogen 3.335 N/A GLY 191.A N TYR 187.A O no hydrogen 2.767 N/A PHE 192.A N CYS 188.A O no hydrogen 2.888 N/A LEU 193.A N CYS 189.A O no hydrogen 2.952 N/A ALA 194.A N THR 190.A O no hydrogen 2.836 N/A ILE 195.A N GLY 191.A O no hydrogen 2.984 N/A THR 196.A N PHE 192.A O no hydrogen 2.922 N/A THR 196.A OG1 PHE 192.A O no hydrogen 2.853 N/A SER 197.A N ALA 194.A O no hydrogen 3.092 N/A GLN 198.A N LEU 193.A O no hydrogen 2.842 N/A GLN 198.A NE2 THR 196.A O no hydrogen 3.585 N/A GLN 201.A N GLN 198.A O no hydrogen 2.948 N/A GLN 201.A NE2 GLN 198.A OE1 no hydrogen 2.821 N/A VAL 202.A N LEU 199.A O no hydrogen 3.169 N/A LEU 206.A N ASN 203.A OD1 no hydrogen 3.118 N/A LEU 207.A N ASN 203.A O no hydrogen 2.919 N/A GLY 208.A N SER 204.A O no hydrogen 2.810 N/A TRP 209.A N ASP 205.A O no hydrogen 3.092 N/A TRP 209.A NE1 GLU 213.A OE1 no hydrogen 2.898 N/A TRP 210.A N LEU 206.A O no hydrogen 3.082 N/A LEU 211.A N LEU 207.A O no hydrogen 2.851 N/A CYS 212.A N GLY 208.A O no hydrogen 2.915 N/A CYS 212.A SG TRP 209.A O no hydrogen 3.493 N/A GLU 213.A N TRP 209.A O no hydrogen 3.069 N/A ARG 214.A N LEU 211.A O no hydrogen 2.987 N/A ARG 214.A NE TRP 210.A O no hydrogen 2.997 N/A ARG 214.A NH1 ASN 222.A OD1 no hydrogen 3.155 N/A ARG 214.A NH2 TRP 210.A O no hydrogen 3.042 N/A GLN 215.A N CYS 212.A O no hydrogen 3.143 N/A GLN 215.A NE2 GLY 219.A O no hydrogen 3.066 N/A GLN 215.A NE2 ASP 251.A O no hydrogen 3.033 N/A LEU 216.A N GLY 220.A O no hydrogen 2.782 N/A SER 218.A N ASP 3.A OD2 no hydrogen 2.729 N/A SER 218.A OG ASP 3.A OD1 no hydrogen 2.555 N/A SER 218.A OG ASP 3.A OD2 no hydrogen 3.405 N/A GLY 219.A N LEU 216.A O no hydrogen 2.761 N/A GLY 220.A N SER 218.A OG no hydrogen 3.176 N/A ASN 222.A N ARG 214.A O no hydrogen 3.001 N/A ASN 222.A ND2 LYS 227.A O no hydrogen 2.858 N/A ARG 224.A NH1 GLU 180.A OE2 no hydrogen 3.132 N/A LYS 227.A N ARG 224.A O no hydrogen 3.383 N/A ASP 230.A N LEU 221.A O no hydrogen 3.072 N/A VAL 231.A N ASP 272.A O no hydrogen 2.866 N/A CYS 232.A N ASP 230.A OD1 no hydrogen 2.784 N/A CYS 232.A SG ASP 230.A OD1 no hydrogen 3.459 N/A CYS 232.A SG ASP 230.A OD2 no hydrogen 3.525 N/A CYS 232.A SG HIS 282.A NE2 no hydrogen 3.802 N/A TYR 233.A N ASP 230.A O no hydrogen 2.820 N/A SER 234.A N VAL 231.A O no hydrogen 2.900 N/A SER 234.A OG VAL 231.A O no hydrogen 2.747 N/A TRP 235.A N CYS 232.A O no hydrogen 2.855 N/A TRP 236.A N CYS 232.A O no hydrogen 3.175 N/A VAL 237.A N TYR 233.A O no hydrogen 2.915 N/A ALA 239.A N TRP 235.A O no hydrogen 2.798 N/A SER 240.A N TRP 236.A O no hydrogen 3.350 N/A SER 240.A OG TRP 236.A O no hydrogen 2.819 N/A LEU 241.A N VAL 237.A O no hydrogen 2.945 N/A LYS 242.A N LEU 238.A O no hydrogen 2.862 N/A ILE 243.A N ALA 239.A O no hydrogen 2.834 N/A ILE 244.A N SER 240.A O no hydrogen 3.071 N/A GLY 245.A N LYS 242.A O no hydrogen 3.073 N/A ARG 246.A N LEU 241.A O no hydrogen 2.886 N/A ARG 246.A NE ASP 205.A OD2 no hydrogen 3.066 N/A ARG 246.A NH2 ASP 205.A OD2 no hydrogen 2.838 N/A TRP 249.A N ARG 246.A O no hydrogen 2.976 N/A ILE 250.A N LEU 247.A O no hydrogen 3.364 N/A ASP 251.A N GLN 215.A OE1 no hydrogen 2.867 N/A LYS 254.A N ASP 251.A OD1 no hydrogen 3.022 N/A LYS 254.A NZ PRO 217.A O no hydrogen 2.584 N/A LEU 255.A N ASP 251.A O no hydrogen 3.095 N/A ARG 256.A N ARG 252.A O no hydrogen 2.798 N/A ARG 256.A NH1 GLU 295.A OE1 no hydrogen 2.759 N/A SER 257.A N GLU 253.A O no hydrogen 3.005 N/A SER 257.A OG GLU 253.A O no hydrogen 3.075 N/A PHE 258.A N LYS 254.A O no hydrogen 3.012 N/A ILE 259.A N LEU 255.A O no hydrogen 2.946 N/A LEU 260.A N ARG 256.A O no hydrogen 3.004 N/A ALA 261.A N SER 257.A O no hydrogen 3.108 N/A CYS 262.A N ILE 259.A O no hydrogen 3.070 N/A CYS 262.A SG PHE 258.A O no hydrogen 3.435 N/A CYS 262.A SG ASP 272.A O no hydrogen 4.001 N/A GLN 263.A N LEU 260.A O no hydrogen 3.086 N/A GLN 263.A NE2 HIS 19.A NE2 no hydrogen 2.677 N/A ASP 264.A N GLY 269.A O no hydrogen 2.998 N/A GLU 266.A N ASP 264.A OD2 no hydrogen 2.761 N/A THR 267.A N ASP 264.A OD2 no hydrogen 2.951 N/A THR 267.A OG1 GLY 268.A O no hydrogen 2.649 N/A GLY 268.A N ASP 264.A O no hydrogen 2.888 N/A GLY 269.A N HIS 19.A ND1 no hydrogen 2.836 N/A PHE 270.A N THR 283.A OG1 no hydrogen 2.876 N/A ALA 271.A N CYS 262.A O no hydrogen 2.964 N/A ARG 273.A N ASP 272.A OD2 no hydrogen 2.883 N/A ARG 273.A NE PRO 229.A O no hydrogen 2.703 N/A ARG 273.A NH2 PRO 229.A O no hydrogen 3.345 N/A ASP 276.A N ARG 273.A O no hydrogen 2.982 N/A ASP 279.A N PHE 270.A O no hydrogen 3.176 N/A HIS 282.A N ASP 279.A OD1 no hydrogen 2.788 N/A HIS 282.A ND1 ASP 279.A OD1 no hydrogen 2.899 N/A HIS 282.A ND1 ASP 279.A OD2 no hydrogen 3.081 N/A THR 283.A N ASP 279.A O no hydrogen 3.118 N/A THR 283.A OG1 ASP 279.A O no hydrogen 2.767 N/A LEU 284.A N PRO 280.A O no hydrogen 2.976 N/A PHE 285.A N PHE 281.A O no hydrogen 3.186 N/A GLY 286.A N HIS 282.A O no hydrogen 2.884 N/A ILE 287.A N THR 283.A O no hydrogen 3.096 N/A ALA 288.A N LEU 284.A O no hydrogen 2.839 N/A GLY 289.A N PHE 285.A O no hydrogen 2.886 N/A LEU 290.A N GLY 286.A O no hydrogen 3.103 N/A SER 291.A N ILE 287.A O no hydrogen 2.954 N/A SER 291.A OG LYS 299.A O no hydrogen 2.595 N/A LEU 292.A N ALA 288.A O no hydrogen 3.041 N/A LEU 293.A N GLY 289.A O no hydrogen 3.049 N/A GLY 294.A N SER 291.A O no hydrogen 2.893 N/A GLU 295.A N LEU 290.A O no hydrogen 3.049 N/A GLN 297.A N GLU 295.A OE2 no hydrogen 2.851 N/A ILE 298.A N GLU 295.A O no hydrogen 3.152 N/A LYS 299.A N LEU 51.A O no hydrogen 2.987 N/A LYS 299.A NZ ASP 50.A O no hydrogen 3.126 N/A LYS 299.A NZ ASP 50.A OD2 no hydrogen 3.066 N/A LYS 299.A NZ GLU 310.A OE1 no hydrogen 3.093 N/A SER 302.A N MET 307.A O no hydrogen 2.807 N/A VAL 304.A N SER 302.A OG no hydrogen 3.186 N/A PHE 305.A N SER 302.A OG no hydrogen 2.973 N/A CYS 306.A N SER 302.A O no hydrogen 2.898 N/A GLU 309.A N PRO 300.A O no hydrogen 2.950 N/A VAL 311.A N PRO 308.A O no hydrogen 3.016 N/A GLN 313.A N GLU 309.A O no hydrogen 2.801 N/A ARG 314.A N GLU 310.A O no hydrogen 3.169 N/A ARG 314.A NH1 THR 98.A O no hydrogen 2.673 N/A ARG 314.A NH2 THR 98.A O no hydrogen 2.998 N/A ARG 314.A NH2 LEU 99.A O no hydrogen 3.387 N/A VAL 315.A N VAL 311.A O no hydrogen 3.250 N/A ASN 316.A N GLN 313.A O no hydrogen 3.103 N/A VAL 317.A N LEU 312.A O no hydrogen 3.020 N/A GLN 318.A NE2 GLU 309.A OE2 no hydrogen 3.134 N/A VAL 322.A N ILE 243.A O no hydrogen 2.868 N/A