Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xq5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 7.A ND1 HIS 8.A O no hydrogen 3.105 N/A VAL 10.A N ASN 315.A OD1 no hydrogen 2.695 N/A THR 14.A N VAL 26.A O no hydrogen 2.911 N/A VAL 16.A N GLU 24.A O no hydrogen 2.910 N/A THR 18.A N ASN 21.A O no hydrogen 2.720 N/A THR 18.A OG1 ASN 21.A O no hydrogen 3.412 N/A THR 20.A N THR 18.A OG1 no hydrogen 3.090 N/A ASN 21.A ND2 GLU 24.A OE1 no hydrogen 2.819 N/A GLN 23.A N ASN 21.A OD1 no hydrogen 3.025 N/A GLU 24.A N VAL 16.A O no hydrogen 3.064 N/A VAL 26.A N THR 14.A O no hydrogen 2.695 N/A THR 27.A N MET 313.A O no hydrogen 2.765 N/A ALA 29.A N ASN 28.A OD1 no hydrogen 2.774 N/A THR 30.A N LEU 309.A O no hydrogen 2.922 N/A THR 32.A N GLU 31.A OE1 no hydrogen 3.182 N/A THR 32.A N LEU 307.A O no hydrogen 3.143 N/A THR 32.A OG1 LEU 307.A O no hydrogen 3.100 N/A VAL 33.A N GLU 31.A OE1 no hydrogen 3.346 N/A GLU 34.A N PHE 287.A O no hydrogen 2.762 N/A THR 36.A N GLU 34.A OE2 no hydrogen 2.853 N/A THR 36.A OG1 GLU 34.A OE2 no hydrogen 2.579 N/A ILE 38.A N SER 280.A O no hydrogen 2.938 N/A ASN 39.A ND2 GLY 278.A O no hydrogen 3.660 N/A ARG 40.A NH2 ASN 39.A O no hydrogen 3.155 N/A LEU 41.A N PRO 265.A O no hydrogen 2.718 N/A CYS 42.A N SER 280.A OG no hydrogen 3.119 N/A CYS 42.A SG ARG 40.A O no hydrogen 4.003 N/A MET 43.A N ASP 267.A O no hydrogen 2.994 N/A LYS 44.A N CYS 270.A O no hydrogen 2.780 N/A LYS 44.A NZ ASN 269A.A OD1 no hydrogen 3.195 N/A ARG 46.A N MET 43.A O no hydrogen 3.094 N/A ARG 46.A NH1 THR 76.A OG1 no hydrogen 2.864 N/A LYS 47.A N ASP 75.A OD2 no hydrogen 3.203 N/A LYS 49.A N THR 76.A O no hydrogen 2.983 N/A LEU 51.A N ILE 78.A O no hydrogen 3.114 N/A GLY 52.A N ASP 50.A OD1 no hydrogen 2.943 N/A CYS 54.A N LEU 51.A O no hydrogen 3.168 N/A CYS 54.A SG HIS 55.A O no hydrogen 3.366 N/A HIS 55.A N ILE 84.A O no hydrogen 2.819 N/A ILE 57.A N HIS 55.A ND1 no hydrogen 3.083 N/A MET 59.A N HIS 55.A O no hydrogen 3.368 N/A MET 59.A N PRO 56.A O no hydrogen 3.061 N/A LEU 60.A N ILE 57.A O no hydrogen 2.792 N/A ILE 61.A N ILE 57.A O no hydrogen 3.341 N/A GLY 62.A N GLY 58.A O no hydrogen 2.755 N/A THR 63.A N GLY 58.A O no hydrogen 3.124 N/A THR 63.A OG1 ALA 85.A O no hydrogen 2.646 N/A CYS 66.A N THR 63.A O no hydrogen 2.726 N/A CYS 66.A SG HIS 55.A O no hydrogen 3.608 N/A ASP 67.A N PRO 64.A O no hydrogen 2.984 N/A HIS 69.A N CYS 66.A O no hydrogen 2.807 N/A GLY 72.A N ILE 108.A O no hydrogen 3.081 N/A TRP 74.A N GLY 106.A O no hydrogen 2.807 N/A ASP 75.A N LYS 47.A O no hydrogen 2.851 N/A THR 76.A OG1 ASP 75.A OD1 no hydrogen 2.915 N/A LEU 77.A N LEU 258.A O no hydrogen 2.943 N/A ILE 78.A N LYS 49.A O no hydrogen 2.958 N/A GLU 79.A N ILE 260.A O no hydrogen 2.723 N/A ARG 80.A NE ASP 50.A OD1 no hydrogen 2.903 N/A ARG 80.A NE ASP 50.A OD2 no hydrogen 3.436 N/A ARG 80.A NH1 SER 262.A O no hydrogen 2.997 N/A ARG 80.A NH1 ALA 264.A O no hydrogen 2.731 N/A ARG 80.A NH2 ASP 50.A OD2 no hydrogen 3.009 N/A ARG 80.A NH2 ALA 264.A O no hydrogen 3.156 N/A ILE 84.A N ASN 53.A O no hydrogen 2.563 N/A TYR 86.A OH THR 92.A OG1 no hydrogen 2.703 N/A CYS 87.A N TYR 139.A OH no hydrogen 3.293 N/A TYR 88.A OH HIS 176.A NE2 no hydrogen 3.116 N/A ALA 91.A N ILE 223.A O no hydrogen 3.397 N/A THR 92.A OG1 TYR 86.A OH no hydrogen 2.703 N/A VAL 93.A N PHE 225.A O no hydrogen 3.060 N/A LEU 98.A N ASN 94.A O no hydrogen 3.169 N/A ARG 99.A N VAL 95.A O no hydrogen 2.865 N/A ARG 99.A NE GLU 96.A OE1 no hydrogen 2.976 N/A ARG 99.A NH1 GLU 79.A OE2 no hydrogen 2.648 N/A ARG 99.A NH2 GLU 96.A OE2 no hydrogen 2.614 N/A GLN 100.A N GLU 96.A O no hydrogen 2.930 N/A GLN 100.A NE2 GLU 96.A OE2 no hydrogen 2.823 N/A LYS 101.A N ALA 97.A O no hydrogen 2.903 N/A ILE 102.A N LEU 98.A O no hydrogen 2.952 N/A MET 103.A N ARG 99.A O no hydrogen 2.871 N/A GLU 104.A N GLN 100.A O no hydrogen 2.939 N/A SER 105.A N ILE 102.A O no hydrogen 3.021 N/A SER 105.A OG ILE 102.A O no hydrogen 2.403 N/A GLY 106.A N ILE 254.A O no hydrogen 2.641 N/A ILE 108.A N GLY 72.A O no hydrogen 2.884 N/A ASN 109.A N LYS 252.A O no hydrogen 2.781 N/A LYS 110.A NZ MET 59.A O no hydrogen 2.845 N/A LYS 110.A NZ LEU 70.A O no hydrogen 2.881 N/A LYS 110.A NZ GLU 141.A OE2 no hydrogen 2.925 N/A ILE 111.A N VAL 250.A O no hydrogen 3.064 N/A THR 113.A N SER 248.A O no hydrogen 2.862 N/A THR 113.A OG1 PRO 247.A O no hydrogen 2.686 N/A ILE 121.A N GLY 118.A O no hydrogen 3.107 N/A ASN 122.A N VAL 146.A O no hydrogen 2.763 N/A ALA 124.A N ASN 122.A OD1 no hydrogen 2.654 N/A THR 127.A N SER 137.A O no hydrogen 2.853 N/A ALA 129.A N THR 127.A OG1 no hydrogen 3.265 N/A CYS 130.A N THR 127.A O no hydrogen 3.359 N/A ARG 132.A N GLY 135.A O no hydrogen 2.998 N/A ARG 132.A NE ASP 67.A OD1 no hydrogen 3.425 N/A ARG 132.A NE ASP 67.A OD2 no hydrogen 2.717 N/A ARG 132.A NH1 SER 137.A OG no hydrogen 3.126 N/A ARG 132.A NH1 PHE 138.A O no hydrogen 2.666 N/A ARG 132.A NH2 GLY 62.A O no hydrogen 2.970 N/A ARG 132.A NH2 ASP 67.A OD1 no hydrogen 2.889 N/A SER 137.A N CYS 130.A O no hydrogen 2.625 N/A TYR 139.A OH TYR 88.A O no hydrogen 2.732 N/A ALA 140.A N GLY 62.A O no hydrogen 2.798 N/A GLU 141.A N ILE 61.A O no hydrogen 3.111 N/A LYS 143.A N ALA 246.A O no hydrogen 2.865 N/A TRP 144.A NE1 TYR 188.A OH no hydrogen 3.120 N/A VAL 146.A N ASN 122.A O no hydrogen 3.031 N/A SER 147.A N LEU 187.A O no hydrogen 2.933 N/A SER 147.A OG GLN 152.A O no hydrogen 2.553 N/A LYS 148.A N SER 120A.A O no hydrogen 2.761 N/A LYS 148.A NZ ILE 121.A O no hydrogen 3.118 N/A GLN 152.A N SER 149.A O no hydrogen 3.366 N/A PHE 154.A N TYR 188.A O no hydrogen 2.855 N/A THR 157.A N HIS 240.A O no hydrogen 2.904 N/A THR 157.A OG1 PRO 155.A O no hydrogen 2.846 N/A ASN 159.A N PHE 238.A O no hydrogen 3.100 N/A ASN 159.A ND2 THR 116.A O no hydrogen 3.628 N/A THR 160.A OG1 THR 237.A OG1 no hydrogen 2.683 N/A TYR 161.A N ILE 236.A O no hydrogen 2.841 N/A TYR 161.A OH HIS 169.A ND1 no hydrogen 2.506 N/A ASN 163.A N ASP 234.A O no hydrogen 3.080 N/A ASN 163.A ND2 ALA 167.A O no hydrogen 3.226 N/A ASN 163.A ND2 VAL 230.A O no hydrogen 2.804 N/A ASP 165.A N ASN 163.A OD1 no hydrogen 3.066 N/A THR 166.A N ASP 165.A OD1 no hydrogen 2.676 N/A HIS 169.A N VAL 230.A O no hydrogen 2.827 N/A HIS 169.A ND1 TYR 161.A OH no hydrogen 2.506 N/A HIS 169.A NE2 ASP 165.A OD2 no hydrogen 2.942 N/A LEU 170.A N SER 251.A O no hydrogen 2.703 N/A ILE 171.A N THR 228.A O no hydrogen 3.034 N/A TRP 173.A N HIS 226.A O no hydrogen 2.993 N/A GLY 174.A N ILE 245.A O no hydrogen 2.855 N/A ILE 175.A N ASP 224.A O no hydrogen 2.848 N/A HIS 176.A N GLY 243.A O no hydrogen 2.816 N/A HIS 176.A NE2 TYR 88.A OH no hydrogen 3.116 N/A HIS 177.A N ARG 222.A O no hydrogen 2.832 N/A SER 179.A N GLU 183.A OE1 no hydrogen 2.907 N/A SER 179.A OG GLU 183.A OE1 no hydrogen 3.071 N/A GLN 182.A NE2 GLN 182.A O no hydrogen 3.629 N/A GLU 183.A N SER 180.A OG no hydrogen 2.941 N/A LYS 184.A N SER 180.A O no hydrogen 2.862 N/A LYS 184.A NZ GLY 189.A O no hydrogen 3.297 N/A LYS 184.A NZ GLN 191.A O no hydrogen 2.652 N/A ASN 185.A N THR 181.A O no hydrogen 2.797 N/A ASP 186.A N GLN 182.A O no hydrogen 2.979 N/A LEU 187.A N GLU 183.A O no hydrogen 3.193 N/A LEU 187.A N LYS 184.A O no hydrogen 3.101 N/A TYR 188.A N LYS 184.A O no hydrogen 3.043 N/A TYR 188.A OH HIS 176.A ND1 no hydrogen 2.770 N/A GLY 189.A N ASN 185.A O no hydrogen 2.765 N/A GLN 191.A N ASN 153.A OD1 no hydrogen 3.308 N/A GLN 191.A NE2 PHE 154.A O no hydrogen 2.664 N/A GLN 191.A NE2 TYR 188.A O no hydrogen 3.225 N/A ILE 195.A N PHE 206.A O no hydrogen 2.839 N/A SER 196.A N SER 239.A O no hydrogen 2.747 N/A VAL 197.A N ASN 204.A O no hydrogen 3.018 N/A GLY 198.A N THR 237.A O no hydrogen 3.125 N/A SER 199.A N TYR 202.A O no hydrogen 2.820 N/A SER 200.A N ASP 234.A OD2 no hydrogen 3.194 N/A SER 200.A OG ASP 234.A OD1 no hydrogen 2.757 N/A THR 201.A N SER 199.A OG no hydrogen 3.401 N/A ASN 204.A N VAL 197.A O no hydrogen 3.076 N/A ASN 204.A ND2 TYR 202.A OH no hydrogen 2.810 N/A ASN 205.A N ASN 204.A OD1 no hydrogen 2.878 N/A PHE 206.A N ILE 195.A O no hydrogen 2.815 N/A VAL 209.A N HIS 177.A ND1 no hydrogen 2.905 N/A GLY 211.A N PRO 178.A O no hydrogen 3.250 N/A ARG 213.A NH1 HIS 177.A O no hydrogen 2.933 N/A ARG 213.A NH1 PRO 178.A O no hydrogen 3.461 N/A ARG 213.A NH1 SER 220.A O no hydrogen 3.037 N/A ARG 213.A NH2 HIS 177.A O no hydrogen 3.498 N/A ARG 213.A NH2 PRO 178.A O no hydrogen 3.033 N/A VAL 216.A N GLN 219.A O no hydrogen 2.840 N/A ASN 217.A ND2 CYS 87.A O no hydrogen 2.597 N/A GLN 219.A N VAL 216.A O no hydrogen 2.864 N/A ARG 222.A N HIS 177.A O no hydrogen 3.104 N/A ARG 222.A NE GLY 221.A O no hydrogen 2.913 N/A ARG 222.A NH1 PRO 214.A O no hydrogen 3.521 N/A ARG 222.A NH2 PRO 214.A O no hydrogen 2.569 N/A ARG 222.A NH2 GLN 219.A O no hydrogen 2.917 N/A ILE 223.A N PRO 89.A O no hydrogen 3.020 N/A ASP 224.A N ILE 175.A O no hydrogen 3.101 N/A PHE 225.A N ALA 91.A O no hydrogen 2.600 N/A HIS 226.A N TRP 173.A O no hydrogen 2.914 N/A TRP 227.A NE1 VAL 93.A O no hydrogen 2.978 N/A THR 228.A N ILE 171.A O no hydrogen 3.209 N/A VAL 230.A N HIS 169.A O no hydrogen 2.707 N/A GLN 231.A NE2 GLU 168.A OE1 no hydrogen 3.280 N/A GLY 233.A N ASN 163.A O no hydrogen 2.853 N/A ASP 234.A N GLN 231.A O no hydrogen 3.090 N/A ILE 236.A N TYR 161.A O no hydrogen 2.948 N/A THR 237.A N GLY 198.A O no hydrogen 2.785 N/A THR 237.A OG1 THR 160.A OG1 no hydrogen 2.683 N/A PHE 238.A N ASN 159.A O no hydrogen 2.743 N/A SER 239.A N SER 196.A O no hydrogen 2.907 N/A HIS 240.A N THR 157.A O no hydrogen 2.953 N/A HIS 240.A NE2 ASN 159.A OD1 no hydrogen 2.860 N/A ASN 241.A ND2 GLN 191.A OE1 no hydrogen 3.074 N/A ASN 241.A ND2 SER 192.A O no hydrogen 2.714 N/A ILE 245.A N GLY 174.A O no hydrogen 2.570 N/A ALA 246.A N LYS 143.A O no hydrogen 3.036 N/A SER 248.A N GLU 141.A O no hydrogen 2.826 N/A ARG 249.A N GLU 141.A O no hydrogen 3.231 N/A ARG 249.A NE GLU 141.A OE1 no hydrogen 2.767 N/A ARG 249.A NH2 GLU 141.A OE1 no hydrogen 3.074 N/A ARG 249.A NH2 GLU 141.A OE2 no hydrogen 2.859 N/A VAL 250.A N ILE 111.A O no hydrogen 2.773 N/A SER 251.A N LEU 170.A O no hydrogen 2.866 N/A LYS 252.A N ASN 109.A O no hydrogen 2.951 N/A LYS 252.A NZ ASP 165.A OD2 no hydrogen 2.876 N/A ILE 254.A N GLY 107.A O no hydrogen 2.812 N/A GLY 257.A N GLU 104.A O no hydrogen 2.923 N/A LEU 258.A N ASP 75.A O no hydrogen 2.793 N/A ILE 260.A N LEU 77.A O no hydrogen 2.593 N/A GLN 261.A NE2 GLU 79.A OE1 no hydrogen 3.254 N/A GLN 261.A NE2 GLU 79.A OE2 no hydrogen 3.374 N/A SER 262.A N GLU 79.A O no hydrogen 3.171 N/A SER 262.A OG TRP 276.A O no hydrogen 3.305 N/A SER 262.A OG ARG 277.A O no hydrogen 2.937 N/A ASP 263.A N ARG 277.A O no hydrogen 2.917 N/A ALA 264.A N SER 262.A OG no hydrogen 3.168 N/A ASP 267.A N LEU 41.A O no hydrogen 2.932 N/A SER 272.A OG CYS 274.A O no hydrogen 3.450 N/A SER 272.A OG ASN 282.A OD1 no hydrogen 2.707 N/A PHE 275.A N VAL 295.A O no hydrogen 2.964 N/A TRP 276.A N GLY 279.A O no hydrogen 3.161 N/A GLY 279.A N TRP 276.A O no hydrogen 3.315 N/A SER 280.A N ILE 38.A O no hydrogen 2.858 N/A SER 280.A OG ARG 40.A O no hydrogen 3.048 N/A ILE 281.A N CYS 274.A O no hydrogen 2.859 N/A ASN 282.A ND2 GLU 271.A O no hydrogen 2.879 N/A THR 283.A OG1 GLU 34.A OE1 no hydrogen 3.360 N/A LEU 285.A N THR 283.A OG1 no hydrogen 3.063 N/A PHE 287.A N THR 32.A O no hydrogen 3.330 N/A GLN 288.A N LYS 300.A O no hydrogen 2.917 N/A GLN 288.A NE2 SER 291.A O no hydrogen 2.924 N/A ASN 289.A N GLU 34.A O no hydrogen 2.988 N/A ASN 289.A ND2 ARG 304.A O no hydrogen 3.092 N/A SER 291.A OG ARG 293.A O no hydrogen 2.999 N/A ARG 293.A N SER 291.A OG no hydrogen 2.960 N/A VAL 295.A N PHE 275.A O no hydrogen 2.928 N/A GLN 297.A N LYS 273.A O no hydrogen 2.752 N/A CYS 298.A SG THR 294.A OG1 no hydrogen 3.440 N/A CYS 298.A SG VAL 295.A O no hydrogen 3.449 N/A LYS 300.A N PRO 286.A O no hydrogen 3.109 N/A VAL 302.A N GLN 288.A O no hydrogen 2.902 N/A ARG 304.A NH1 ASN 303.A O no hydrogen 2.767 N/A SER 306.A OG GLU 31.A OE2 no hydrogen 1.998 N/A LEU 307.A N GLU 31.A OE1 no hydrogen 3.097 N/A LEU 309.A N THR 30.A O no hydrogen 2.700 N/A THR 311.A N ASN 28.A O no hydrogen 2.641 N/A ARG 314.A NE GLU 24.A OE2 no hydrogen 3.010 N/A ARG 314.A NH2 GLU 24.A OE1 no hydrogen 3.268 N/A ASN 315.A N GLU 25.A O no hydrogen 2.892 N/A ASN 315.A ND2 VAL 10.A O no hydrogen 3.024 N/A ASN 315.A ND2 GLU 25.A OE2 no hydrogen 3.076 N/A ASN 269A.A N ASP 267.A OD1 no hydrogen 3.220 N/A