Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4i43_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N ILE 35.A O no hydrogen 3.394 N/A VAL 3.A N ILE 32.A O no hydrogen 2.685 N/A PHE 5.A N HIS 30.A O no hydrogen 3.071 N/A THR 6.A N ILE 68.A O no hydrogen 2.985 N/A THR 6.A OG1 ILE 68.A O no hydrogen 3.567 N/A THR 6.A OG1 GLN 69.A OE1 no hydrogen 3.550 N/A ILE 10.A N TYR 77.A OH no hydrogen 3.249 N/A VAL 12.A N VAL 23.A O no hydrogen 2.977 N/A THR 13.A N GLN 46.A O no hydrogen 2.939 N/A THR 13.A OG1 ASN 22.A OD1 no hydrogen 2.400 N/A ILE 14.A N PHE 21.A O no hydrogen 2.640 N/A GLY 15.A N HIS 44.A O no hydrogen 2.743 N/A ILE 16.A N TYR 19.A O no hydrogen 2.715 N/A ASP 17.A N VAL 42.A O no hydrogen 2.658 N/A GLN 18.A N GLN 18.A OE1 no hydrogen 2.551 N/A TYR 19.A N ILE 16.A O no hydrogen 2.719 N/A PHE 21.A N ILE 14.A O no hydrogen 2.741 N/A VAL 23.A N VAL 12.A O no hydrogen 2.821 N/A LYS 24.A N GLN 27.A OE1 no hydrogen 3.120 N/A LYS 24.A NZ GLU 11.A OE1 no hydrogen 3.110 N/A ASN 26.A N ALA 8.A O no hydrogen 2.778 N/A GLN 27.A N LYS 24.A O no hydrogen 2.769 N/A HIS 30.A N MET 94.A O no hydrogen 3.174 N/A ILE 32.A N VAL 3.A O no hydrogen 2.846 N/A LYS 33.A N VAL 96.A O no hydrogen 2.736 N/A ILE 35.A N ASN 1.A O no hydrogen 2.802 N/A HIS 41.A N PHE 59.A O no hydrogen 2.919 N/A HIS 41.A ND1 ASP 17.A OD2 no hydrogen 2.569 N/A HIS 41.A NE2 PRO 36.A O no hydrogen 2.745 N/A VAL 42.A N ASP 17.A OD1 no hydrogen 2.894 N/A ILE 43.A N TYR 57.A O no hydrogen 3.105 N/A HIS 44.A N GLY 15.A O no hydrogen 2.723 N/A PHE 45.A N TYR 55.A O no hydrogen 2.693 N/A GLN 46.A N THR 13.A O no hydrogen 3.122 N/A HIS 47.A NE2 TYR 55.A OH no hydrogen 2.705 N/A ALA 48.A N GLU 11.A O no hydrogen 3.026 N/A SER 51.A N ASP 49.A O no hydrogen 2.409 N/A SER 51.A OG ASP 49.A OD1 no hydrogen 2.508 N/A SER 51.A OG ASP 49.A OD2 no hydrogen 3.423 N/A SER 52.A N ASP 49.A O no hydrogen 3.338 N/A SER 52.A OG HIS 47.A ND1 no hydrogen 2.795 N/A ARG 54.A NH1 MET 218.A O no hydrogen 3.343 N/A ARG 54.A NH1 PHE 219.A O no hydrogen 2.855 N/A TYR 55.A N PHE 45.A O no hydrogen 3.095 N/A TYR 55.A OH HIS 47.A NE2 no hydrogen 2.705 N/A GLY 56.A N VAL 133.A O no hydrogen 2.852 N/A TYR 57.A N ILE 43.A O no hydrogen 2.955 N/A TYR 57.A OH TYR 77.A O no hydrogen 2.646 N/A TRP 58.A N SER 131.A O no hydrogen 2.746 N/A TRP 58.A NE1 ASN 216.A OD1 no hydrogen 2.920 N/A PHE 59.A N HIS 41.A O no hydrogen 2.949 N/A ARG 62.A N ASP 60.A OD1 no hydrogen 3.279 N/A ARG 62.A NE ASP 60.A OD1 no hydrogen 3.186 N/A ARG 62.A NE ASP 60.A OD2 no hydrogen 3.468 N/A ARG 62.A NH2 ASP 60.A OD2 no hydrogen 2.973 N/A MET 63.A N ASP 60.A O no hydrogen 2.913 N/A GLY 64.A N CYS 61.A O no hydrogen 3.512 N/A TYR 67.A N MET 80.A O no hydrogen 2.654 N/A ILE 68.A N PRO 4.A O no hydrogen 2.859 N/A GLN 69.A N LYS 78.A O no hydrogen 2.783 N/A ASP 71.A N LEU 76.A O no hydrogen 2.915 N/A LYS 73.A N ASP 71.A OD1 no hydrogen 3.224 N/A ASP 74.A N ASP 71.A OD2 no hydrogen 3.342 N/A GLY 75.A N ASP 71.A O no hydrogen 2.539 N/A TYR 77.A N TYR 55.A OH no hydrogen 2.832 N/A TYR 77.A OH ILE 10.A O no hydrogen 2.785 N/A LYS 78.A N GLN 69.A O no hydrogen 2.886 N/A LYS 78.A NZ ASP 71.A OD2 no hydrogen 3.091 N/A LYS 78.A NZ ASP 74.A OD2 no hydrogen 2.540 N/A MET 80.A N TYR 67.A O no hydrogen 2.653 N/A GLU 82.A N ASN 65.A O no hydrogen 2.784 N/A LYS 87.A N ASP 84.A OD1 no hydrogen 2.808 N/A PHE 88.A N ASP 84.A O no hydrogen 3.025 N/A GLU 89.A N GLY 85.A O no hydrogen 3.006 N/A ASN 90.A N ALA 86.A O no hydrogen 3.048 N/A ILE 91.A N LYS 87.A O no hydrogen 3.419 N/A MET 95.A N ARG 92.A O no hydrogen 3.140 N/A VAL 96.A N GLY 31.A O no hydrogen 3.142 N/A SER 97.A OG ASP 34.A OD2 no hydrogen 2.616 N/A SER 97.A OG TYR 98.A O no hydrogen 3.563 N/A TYR 98.A N LYS 33.A O no hydrogen 2.649 N/A TYR 98.A OH ASP 17.A OD2 no hydrogen 2.674 N/A ASP 105.A N ASP 102.A O no hydrogen 3.174 N/A THR 106.A N ASP 102.A OD1 no hydrogen 3.028 N/A THR 106.A OG1 ASP 102.A OD2 no hydrogen 2.291 N/A THR 106.A OG1 ASP 104.A OD2 no hydrogen 2.909 N/A TRP 107.A NE1 VAL 40.A O no hydrogen 2.779 N/A ASN 109.A N ASP 105.A O no hydrogen 3.225 N/A ASN 109.A ND2 ASP 104.A OD1 no hydrogen 3.332 N/A LEU 110.A N THR 106.A O no hydrogen 2.922 N/A THR 111.A N TYR 108.A O no hydrogen 2.939 N/A THR 111.A OG1 TRP 107.A O no hydrogen 2.426 N/A THR 111.A OG1 TYR 108.A O no hydrogen 3.566 N/A PHE 113.A N GLN 211.A OE1 no hydrogen 2.903 N/A VAL 114.A N THR 111.A O no hydrogen 2.733 N/A LYS 118.A NZ GLN 115.A OE1 no hydrogen 3.034 N/A ILE 119.A N GLN 115.A O no hydrogen 2.932 N/A ARG 120.A N MET 116.A O no hydrogen 3.013 N/A ARG 120.A NE ASN 128.A O no hydrogen 3.111 N/A LYS 121.A N LYS 118.A O no hydrogen 2.947 N/A LYS 121.A NZ ASP 117.A OD2 no hydrogen 3.152 N/A ILE 122.A N LYS 118.A O no hydrogen 3.310 N/A VAL 123.A N ILE 119.A O no hydrogen 2.811 N/A ARG 124.A NH2 PRO 158.A O no hydrogen 3.136 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.336 N/A ASN 128.A N LYS 125.A O no hydrogen 3.123 N/A SER 131.A N TRP 58.A O no hydrogen 2.759 N/A TYR 132.A OH ASP 134.A OD2 no hydrogen 2.506 N/A VAL 133.A N GLY 56.A O no hydrogen 2.809 N/A SER 135.A N ARG 54.A O no hydrogen 3.082 N/A SER 135.A OG ARG 54.A O no hydrogen 3.332 N/A SER 135.A OG PHE 220.A O no hydrogen 2.503 N/A SER 136.A N ASP 134.A OD1 no hydrogen 2.907 N/A SER 136.A OG ASP 134.A OD1 no hydrogen 3.256 N/A MET 137.A N ASP 134.A O no hydrogen 3.416 N/A THR 138.A OG1 ASN 143.A OD1 no hydrogen 2.898 N/A VAL 140.A N LEU 162.A O no hydrogen 2.932 N/A GLN 141.A NE2 ILE 167.A O no hydrogen 3.012 N/A GLU 142.A N THR 139.A OG1 no hydrogen 2.767 N/A ASN 143.A N THR 139.A O no hydrogen 2.953 N/A GLU 144.A N VAL 140.A O no hydrogen 2.807 N/A LEU 145.A N GLN 141.A O no hydrogen 2.906 N/A LEU 146.A N GLU 142.A O no hydrogen 3.020 N/A LYS 147.A N ASN 143.A O no hydrogen 3.526 N/A SER 148.A N GLU 144.A O no hydrogen 2.968 N/A SER 149.A N LEU 145.A O no hydrogen 2.698 N/A LEU 150.A N LEU 146.A O no hydrogen 2.711 N/A ALA 159.A N ASP 157.A OD1 no hydrogen 3.074 N/A HIS 160.A N ASP 157.A O no hydrogen 2.783 N/A SER 161.A N PRO 158.A O no hydrogen 3.187 N/A LEU 162.A N THR 138.A O no hydrogen 2.852 N/A ASN 163.A N ILE 122.A O no hydrogen 2.848 N/A ASN 163.A ND2 LYS 121.A O no hydrogen 3.194 N/A TYR 164.A OH SER 225.A OG no hydrogen 2.603 N/A THR 165.A N GLU 209.A OE2 no hydrogen 2.770 N/A THR 165.A OG1 GLU 209.A OE1 no hydrogen 2.947 N/A THR 165.A OG1 GLU 209.A OE2 no hydrogen 3.551 N/A ASN 168.A N TYR 190.A OH no hydrogen 2.822 N/A LYS 170.A N ASN 168.A OD1 no hydrogen 3.011 N/A SER 171.A OG ASN 168.A O no hydrogen 2.573 N/A SER 171.A OG GLU 173.A OE1 no hydrogen 3.299 N/A ARG 172.A NH1 ILE 175.A O no hydrogen 2.741 N/A ALA 174.A N SER 171.A O no hydrogen 3.012 N/A ILE 175.A N ARG 172.A O no hydrogen 3.289 N/A ARG 176.A N ASP 183.A OD2 no hydrogen 3.047 N/A ARG 176.A NE ASP 183.A OD2 no hydrogen 2.733 N/A ARG 176.A NH2 GLU 182.A OE2 no hydrogen 3.030 N/A ARG 176.A NH2 ASP 183.A OD1 no hydrogen 2.793 N/A ARG 176.A NH2 ASP 183.A OD2 no hydrogen 3.472 N/A GLY 178.A N GLU 180.A OE2 no hydrogen 3.224 N/A HIS 179.A N ARG 176.A O no hydrogen 2.721 N/A HIS 179.A ND1 GLU 182.A OE1 no hydrogen 2.945 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.859 N/A ASP 183.A N HIS 179.A O no hydrogen 2.726 N/A PHE 184.A N GLU 180.A O no hydrogen 2.992 N/A LEU 185.A N MET 181.A O no hydrogen 2.974 N/A ASP 186.A N GLU 182.A O no hydrogen 2.896 N/A LYS 187.A N SER 238.A O no hydrogen 2.949 N/A LYS 187.A NZ PHE 184.A O no hydrogen 2.942 N/A SER 188.A N ASP 186.A OD1 no hydrogen 3.024 N/A SER 188.A OG ASP 186.A OD1 no hydrogen 2.716 N/A SER 188.A OG THR 241.A O no hydrogen 3.473 N/A LEU 191.A N LYS 187.A O no hydrogen 2.894 N/A ASN 192.A N SER 188.A O no hydrogen 2.805 N/A ASN 192.A ND2 SER 188.A O no hydrogen 2.981 N/A ASN 192.A ND2 THR 241.A O no hydrogen 2.695 N/A THR 193.A N TYR 189.A O no hydrogen 2.880 N/A VAL 194.A N TYR 189.A O no hydrogen 3.187 N/A MET 195.A N TYR 190.A O no hydrogen 2.906 N/A LEU 196.A N LEU 191.A O no hydrogen 2.792 N/A GLN 197.A N ASN 192.A O no hydrogen 2.898 N/A ILE 199.A N MET 195.A O no hydrogen 2.898 N/A PHE 200.A N MET 195.A O no hydrogen 2.776 N/A LYS 201.A NZ GLN 197.A O no hydrogen 3.530 N/A LYS 201.A NZ GLY 198.A O no hydrogen 2.707 N/A ASN 202.A N PHE 200.A O no hydrogen 2.614 N/A SER 203.A OG HIS 245.A NE2 no hydrogen 2.854 N/A ASN 205.A N ASN 202.A OD1 no hydrogen 2.924 N/A ASN 205.A ND2 PHE 200.A O no hydrogen 3.075 N/A TYR 206.A N ASN 202.A O no hydrogen 3.339 N/A TYR 206.A OH MET 232.A O no hydrogen 2.659 N/A PHE 207.A N SER 203.A O no hydrogen 2.897 N/A GLY 208.A N SER 204.A O no hydrogen 2.993 N/A GLU 209.A N ASN 205.A O no hydrogen 3.299 N/A LEU 210.A N TYR 206.A O no hydrogen 3.024 N/A GLN 211.A N PHE 207.A O no hydrogen 2.841 N/A PHE 212.A N GLY 208.A O no hydrogen 2.971 N/A ALA 213.A N GLU 209.A O no hydrogen 2.852 N/A PHE 214.A N LEU 210.A O no hydrogen 3.059 N/A LEU 215.A N GLN 211.A O no hydrogen 3.174 N/A ASN 216.A N PHE 212.A O no hydrogen 3.038 N/A ASN 216.A ND2 TYR 164.A OH no hydrogen 3.227 N/A ALA 217.A N ALA 213.A O no hydrogen 2.936 N/A MET 218.A N PHE 214.A O no hydrogen 2.905 N/A PHE 219.A N LEU 215.A O no hydrogen 2.897 N/A PHE 220.A N ASN 216.A O no hydrogen 2.920 N/A GLY 221.A N ALA 217.A O no hydrogen 2.849 N/A ASN 222.A ND2 ASP 134.A O no hydrogen 3.216 N/A ASN 222.A ND2 SER 135.A O no hydrogen 3.237 N/A ASN 222.A ND2 MET 137.A O no hydrogen 2.869 N/A SER 225.A N ASN 222.A OD1 no hydrogen 2.965 N/A SER 225.A OG TYR 164.A OH no hydrogen 2.603 N/A SER 225.A OG ASN 222.A OD1 no hydrogen 2.837 N/A SER 226.A N ASN 222.A O no hydrogen 3.219 N/A SER 226.A OG LEU 269.A O no hydrogen 3.027 N/A LEU 227.A N TYR 223.A O no hydrogen 3.068 N/A GLN 228.A N GLY 224.A O no hydrogen 2.942 N/A GLN 228.A NE2 THR 165.A O no hydrogen 2.968 N/A TRP 229.A N SER 225.A O no hydrogen 3.000 N/A TRP 229.A NE1 GLN 257.A OE1 no hydrogen 2.883 N/A HIS 230.A N SER 226.A O no hydrogen 3.057 N/A HIS 230.A ND1 SER 226.A O no hydrogen 2.765 N/A ALA 231.A N LEU 227.A O no hydrogen 2.859 N/A MET 232.A N GLN 228.A O no hydrogen 2.922 N/A ILE 233.A N TRP 229.A O no hydrogen 3.160 N/A GLU 234.A N HIS 230.A O no hydrogen 2.879 N/A LEU 235.A N ALA 231.A O no hydrogen 2.964 N/A CYS 237.A N ILE 233.A O no hydrogen 3.100 N/A CYS 237.A SG ILE 233.A O no hydrogen 3.415 N/A SER 238.A N GLU 234.A O no hydrogen 2.911 N/A SER 238.A OG GLU 234.A O no hydrogen 2.812 N/A SER 239.A N ILE 236.A O no hydrogen 2.978 N/A SER 239.A OG LEU 235.A O no hydrogen 3.026 N/A ALA 240.A N ASP 186.A OD1 no hydrogen 3.041 N/A THR 241.A N SER 188.A OG no hydrogen 2.749 N/A HIS 245.A NE2 SER 203.A OG no hydrogen 2.854 N/A LEU 247.A N PRO 243.A O no hydrogen 3.387 N/A ASP 248.A N LYS 244.A O no hydrogen 3.177 N/A LYS 249.A N HIS 245.A O no hydrogen 2.900 N/A LYS 249.A NZ GLU 112.A OE1 no hydrogen 3.407 N/A LYS 249.A NZ GLU 112.A OE2 no hydrogen 2.887 N/A LEU 250.A N MET 246.A O no hydrogen 2.734 N/A ASP 251.A N LEU 247.A O no hydrogen 3.205 N/A ILE 253.A N LYS 249.A O no hydrogen 2.917 N/A LEU 254.A N LEU 250.A O no hydrogen 2.866 N/A TYR 255.A N ASP 251.A O no hydrogen 3.083 N/A TYR 256.A N GLU 252.A O no hydrogen 3.089 N/A GLN 257.A N ILE 253.A O no hydrogen 3.086 N/A ILE 258.A N LEU 254.A O no hydrogen 2.842 N/A LYS 259.A N TYR 255.A O no hydrogen 2.895 N/A THR 260.A N TYR 256.A O no hydrogen 3.072 N/A THR 260.A N GLN 257.A O no hydrogen 3.190 N/A LEU 261.A N GLN 257.A O no hydrogen 2.912 N/A TYR 265.A N PRO 262.A O no hydrogen 3.137 N/A SER 266.A N GLU 263.A O no hydrogen 2.974 N/A SER 266.A OG GLU 263.A O no hydrogen 2.719 N/A LEU 269.A N TYR 265.A O no hydrogen 2.957 N/A LEU 270.A N SER 266.A O no hydrogen 2.896 N/A ASN 271.A N HIS 230.A NE2 no hydrogen 3.089 N/A ARG 273.A NH1 GLU 234.A OE2 no hydrogen 3.025 N/A ARG 273.A NH2 GLU 234.A OE1 no hydrogen 2.982 N/A VAL 274.A N ASN 271.A OD1 no hydrogen 3.002 N/A TRP 275.A N ASN 271.A O no hydrogen 3.072 N/A ASN 276.A N GLU 272.A O no hydrogen 3.119 N/A ASN 276.A ND2 GLU 272.A O no hydrogen 2.666 N/A ASN 276.A ND2 LEU 302.A O no hydrogen 2.969 N/A ILE 277.A N ARG 273.A O no hydrogen 3.068 N/A CYS 278.A N VAL 274.A O no hydrogen 2.881 N/A CYS 278.A SG VAL 274.A O no hydrogen 3.234 N/A LEU 279.A N TRP 275.A O no hydrogen 3.182 N/A TYR 280.A N ASN 276.A O no hydrogen 2.990 N/A TYR 280.A OH GLU 296.A OE1 no hydrogen 2.494 N/A SER 281.A N ILE 277.A O no hydrogen 2.955 N/A SER 281.A OG ILE 277.A O no hydrogen 3.214 N/A SER 282.A N ILE 277.A O no hydrogen 2.881 N/A SER 282.A OG CYS 237.A O no hydrogen 3.408 N/A SER 282.A OG CYS 278.A O no hydrogen 2.590 N/A GLN 284.A N CYS 237.A O no hydrogen 3.203 N/A GLN 284.A N SER 282.A OG no hydrogen 3.236 N/A GLN 284.A NE2 SER 239.A O no hydrogen 2.963 N/A LYS 285.A N SER 282.A O no hydrogen 3.225 N/A SER 287.A N GLN 284.A O no hydrogen 2.910 N/A SER 287.A OG GLN 284.A O no hydrogen 3.530 N/A SER 287.A OG GLN 284.A OE1 no hydrogen 2.526 N/A ASN 290.A N ASP 251.A OD2 no hydrogen 2.856 N/A THR 291.A N ASP 251.A OD1 no hydrogen 2.858 N/A THR 291.A OG1 ASP 251.A O no hydrogen 2.902 N/A THR 291.A OG1 ASP 251.A OD1 no hydrogen 2.875 N/A GLU 292.A N LEU 288.A O no hydrogen 2.859 N/A LYS 293.A N HIS 289.A O no hydrogen 3.259 N/A ILE 294.A N ASN 290.A O no hydrogen 3.149 N/A MET 295.A N THR 291.A O no hydrogen 2.912 N/A GLU 296.A N GLU 292.A O no hydrogen 2.925 N/A ASN 297.A N LYS 293.A O no hydrogen 3.100 N/A LYS 298.A N ILE 294.A O no hydrogen 2.808 N/A LYS 298.A NZ ILE 258.A O no hydrogen 3.048 N/A LYS 298.A NZ LYS 259.A O no hydrogen 3.543 N/A LYS 298.A NZ LEU 261.A O no hydrogen 3.446 N/A TYR 299.A N MET 295.A O no hydrogen 2.769 N/A LEU 303.A N PRO 300.A O no hydrogen 2.716 N/A GLY 304.A N GLU 301.A O no hydrogen 3.265 N/A LYS 305.A N PRO 300.A O no hydrogen 2.931 N/A ASP 319.A N ASP 318.A OD1 no hydrogen 2.774 N/A HIS 321.A N ASP 319.A OD2 no hydrogen 2.998 N/A