Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4irx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N GLN 40.A OE1 no hydrogen 2.783 N/A ARG 5.A NH1 GLU 9.A O no hydrogen 3.564 N/A GLY 6.A N GLU 9.A OE2 no hydrogen 2.856 N/A VAL 10.A N LYS 38.A O no hydrogen 2.857 N/A VAL 11.A N VAL 65.A O no hydrogen 3.462 N/A VAL 12.A N GLN 40.A O no hydrogen 2.910 N/A SER 13.A N ILE 67.A O no hydrogen 2.910 N/A PHE 14.A N LEU 42.A O no hydrogen 2.830 N/A LEU 17.A N ASP 43.A OD1 no hydrogen 2.929 N/A SER 18.A N ASP 16.A OD1 no hydrogen 2.935 N/A SER 18.A OG ASP 16.A OD1 no hydrogen 2.625 N/A SER 18.A OG ASP 16.A OD2 no hydrogen 3.215 N/A GLN 19.A N ASP 16.A O no hydrogen 3.270 N/A GLN 19.A NE2 ASP 137.A OD2 no hydrogen 2.996 N/A PHE 22.A N GLN 19.A O no hydrogen 2.964 N/A VAL 23.A N GLN 19.A O no hydrogen 3.014 N/A ALA 24.A N PRO 20.A O no hydrogen 3.092 N/A ARG 25.A NE GLU 29.A OE2 no hydrogen 3.136 N/A ARG 26.A N VAL 23.A O no hydrogen 3.235 N/A GLU 27.A N ALA 24.A O no hydrogen 3.389 N/A GLU 29.A N ARG 25.A O no hydrogen 2.964 N/A ASP 30.A N ARG 26.A O no hydrogen 3.228 N/A GLU 31.A N GLU 27.A O no hydrogen 3.033 N/A ALA 32.A N LEU 28.A O no hydrogen 2.855 N/A ALA 33.A N GLU 29.A O no hydrogen 3.143 N/A LYS 34.A N ASP 30.A O no hydrogen 3.032 N/A LYS 34.A NZ ASP 30.A OD1 no hydrogen 3.435 N/A LYS 34.A NZ ASP 30.A OD2 no hydrogen 2.837 N/A LEU 35.A N GLU 31.A O no hydrogen 2.904 N/A GLY 36.A N ALA 33.A O no hydrogen 2.986 N/A VAL 37.A N ALA 32.A O no hydrogen 2.987 N/A GLN 40.A N VAL 10.A O no hydrogen 2.909 N/A GLN 40.A NE2 VAL 3.A O no hydrogen 2.837 N/A GLN 40.A NE2 GLU 9.A OE1 no hydrogen 3.323 N/A LEU 42.A N VAL 12.A O no hydrogen 2.862 N/A ALA 44.A N PHE 14.A O no hydrogen 2.888 N/A GLN 45.A N ASP 43.A OD1 no hydrogen 2.951 N/A ASN 46.A N ASN 15.A O no hydrogen 2.785 N/A ASN 47.A N ALA 44.A O no hydrogen 2.901 N/A SER 48.A OG.B THR 71.A OG1 no hydrogen 2.452 N/A LYS 50.A N ASN 47.A OD1 no hydrogen 3.056 N/A LYS 50.A NZ ASP 43.A O no hydrogen 2.799 N/A LYS 50.A NZ ASP 54.A OD1 no hydrogen 3.535 N/A LYS 50.A NZ ASP 54.A OD2 no hydrogen 2.985 N/A GLN 51.A N ASN 47.A O no hydrogen 3.051 N/A GLN 51.A NE2 SER 13.A O no hydrogen 3.657 N/A GLN 51.A NE2 SER 13.A OG no hydrogen 2.984 N/A GLN 51.A NE2 ALA 69.A O no hydrogen 3.000 N/A ILE 52.A N SER 48.A O no hydrogen 2.929 N/A SER 53.A N SER 49.A O no hydrogen 3.000 N/A SER 53.A OG SER 49.A O no hydrogen 3.474 N/A SER 53.A OG LYS 50.A O no hydrogen 3.039 N/A ASP 54.A N LYS 50.A O no hydrogen 2.760 N/A LEU 55.A N GLN 51.A O no hydrogen 2.922 N/A GLN 56.A N ILE 52.A O no hydrogen 2.935 N/A ALA 57.A N SER 53.A O no hydrogen 2.941 N/A ALA 58.A N ASP 54.A O no hydrogen 2.970 N/A ALA 59.A N LEU 55.A O no hydrogen 3.095 N/A VAL 60.A N GLN 56.A O no hydrogen 2.974 N/A GLN 61.A N ALA 57.A O no hydrogen 2.965 N/A GLY 62.A N ALA 59.A O no hydrogen 3.080 N/A ALA 63.A N ALA 58.A O no hydrogen 2.966 N/A LYS 64.A NZ GLY 87.A O no hydrogen 3.328 N/A VAL 66.A N ALA 89.A O no hydrogen 2.894 N/A ILE 67.A N VAL 11.A O no hydrogen 2.884 N/A VAL 68.A N ILE 91.A O no hydrogen 2.889 N/A ALA 69.A N SER 13.A O no hydrogen 2.941 N/A THR 71.A N GLN 51.A OE1 no hydrogen 2.793 N/A THR 71.A OG1 SER 48.A OG.B no hydrogen 2.452 N/A THR 71.A OG1 GLN 51.A OE1 no hydrogen 3.562 N/A SER 73.A N GLY 139.A O no hydrogen 3.049 N/A SER 73.A OG ASN 96.A O no hydrogen 2.630 N/A LYS 74.A N ASP 72.A OD1 no hydrogen 3.146 N/A ALA 75.A N ASP 72.A OD1 no hydrogen 2.966 N/A LEU 76.A N ASP 72.A O no hydrogen 3.302 N/A ALA 77.A N LYS 74.A O no hydrogen 3.182 N/A ALA 80.A N LEU 76.A O no hydrogen 3.021 N/A ASP 81.A N ALA 77.A O no hydrogen 2.966 N/A ASP 82.A N GLY 78.A O no hydrogen 2.978 N/A LEU 83.A N ALA 79.A O no hydrogen 2.887 N/A VAL 84.A N ALA 80.A O no hydrogen 2.948 N/A GLU 85.A N ASP 81.A O no hydrogen 2.987 N/A GLN 86.A N ASP 82.A O no hydrogen 3.114 N/A GLN 86.A N LEU 83.A O no hydrogen 3.085 N/A GLN 86.A NE2 ASP 82.A O no hydrogen 3.615 N/A GLN 86.A NE2 ASP 82.A OD2 no hydrogen 3.436 N/A GLY 87.A N VAL 84.A O no hydrogen 2.825 N/A VAL 88.A N LEU 83.A O no hydrogen 2.849 N/A ALA 89.A N LYS 64.A O no hydrogen 2.842 N/A ILE 91.A N VAL 66.A O no hydrogen 3.067 N/A SER 92.A N PRO 105.A O no hydrogen 2.930 N/A SER 92.A OG PRO 105.A O no hydrogen 3.390 N/A SER 92.A OG HIS 106.A ND1 no hydrogen 2.680 N/A VAL 93.A N VAL 68.A O no hydrogen 2.910 N/A ASP 94.A N VAL 107.A O no hydrogen 2.964 N/A ARG 95.A N VAL 93.A O no hydrogen 2.827 N/A ARG 95.A NE ASP 94.A OD2 no hydrogen 2.897 N/A ARG 95.A NH1 PRO 70.A O no hydrogen 2.784 N/A ARG 95.A NH2 ASP 137.A OD2 no hydrogen 2.975 N/A ASN 96.A N SER 141.A OG no hydrogen 2.816 N/A ALA 98.A N SER 73.A O no hydrogen 3.039 N/A LYS 101.A N ASP 81.A OD2 no hydrogen 2.757 N/A THR 102.A N ASP 81.A OD1 no hydrogen 2.985 N/A HIS 106.A N SER 267.A OG no hydrogen 3.020 N/A HIS 106.A ND1 SER 92.A OG no hydrogen 2.680 N/A VAL 107.A N SER 92.A O no hydrogen 2.910 N/A GLY 108.A N VAL 268.A O no hydrogen 3.112 N/A ASP 110.A N LEU 270.A O no hydrogen 2.877 N/A ALA 113.A N ASP 110.A OD1 no hydrogen 3.075 N/A GLY 114.A N ASP 110.A O no hydrogen 2.991 N/A GLY 115.A N ASN 111.A O no hydrogen 2.884 N/A ARG 116.A N VAL 112.A O no hydrogen 2.885 N/A ARG 116.A NE ASP 119.A OD1 no hydrogen 2.822 N/A ALA 117.A N ALA 113.A O no hydrogen 2.913 N/A ASP 119.A N ARG 116.A O no hydrogen 2.785 N/A TRP 120.A N ALA 117.A O no hydrogen 2.997 N/A VAL 122.A N ALA 118.A O no hydrogen 2.952 N/A LYS 123.A N ASP 119.A O no hydrogen 2.911 N/A THR 124.A N TRP 120.A O no hydrogen 2.910 N/A THR 124.A OG1 TRP 120.A O no hydrogen 2.744 N/A TYR 125.A N VAL 121.A O no hydrogen 2.818 N/A GLY 128.A N TYR 125.A O no hydrogen 2.949 N/A ALA 129.A N ALA 160.A O no hydrogen 3.011 N/A ARG 130.A N ASP 192.A OD2 no hydrogen 2.872 N/A ARG 130.A NE THR 189.A O no hydrogen 3.190 N/A ARG 130.A NH2 THR 189.A O no hydrogen 3.220 N/A VAL 131.A N LYS 162.A O no hydrogen 2.771 N/A VAL 132.A N VAL 193.A O no hydrogen 2.910 N/A VAL 133.A N THR 165.A O no hydrogen 3.048 N/A ILE 134.A N LEU 195.A O no hydrogen 2.866 N/A THR 135.A N GLN 167.A O no hydrogen 2.841 N/A ASN 136.A ND2 SER 142.A OG no hydrogen 3.276 N/A ASP 137.A N SER 171.A OG no hydrogen 2.966 N/A SER 140.A N ASP 137.A O no hydrogen 2.971 N/A SER 140.A OG.A SER 142.A OG no hydrogen 2.622 N/A SER 140.A OG.B ASP 137.A O no hydrogen 2.747 N/A SER 140.A OG.B SER 142.A OG no hydrogen 2.921 N/A SER 141.A N SER 73.A OG no hydrogen 2.845 N/A SER 142.A N SER 140.A OG.A no hydrogen 3.133 N/A SER 142.A OG SER 140.A OG.A no hydrogen 2.622 N/A SER 142.A OG SER 140.A OG.B no hydrogen 2.921 N/A SER 143.A N SER 140.A OG.B no hydrogen 3.159 N/A SER 143.A OG.A ASN 136.A O no hydrogen 2.815 N/A SER 143.A OG.A ASN 136.A OD1 no hydrogen 3.336 N/A SER 143.A OG.B ASP 137.A O no hydrogen 2.844 N/A SER 143.A OG.B PRO 138.A O no hydrogen 3.129 N/A SER 143.A OG.B SER 140.A O no hydrogen 2.722 N/A ILE 144.A N SER 140.A O no hydrogen 3.175 N/A GLU 145.A N SER 141.A O no hydrogen 2.825 N/A ARG 146.A N SER 142.A O no hydrogen 2.935 N/A ARG 146.A NE ASN 111.A OD1 no hydrogen 2.917 N/A ARG 146.A NH1 LEU 197.A O no hydrogen 2.769 N/A ARG 146.A NH2 ASN 111.A OD1 no hydrogen 2.987 N/A VAL 147.A N SER 143.A O no hydrogen 2.923 N/A LYS 148.A N ILE 144.A O no hydrogen 3.040 N/A LYS 148.A NZ ASP 152.A OD1 no hydrogen 3.556 N/A LYS 148.A NZ ASP 152.A OD2 no hydrogen 2.889 N/A GLY 149.A N GLU 145.A O no hydrogen 3.002 N/A VAL 150.A N ARG 146.A O no hydrogen 3.052 N/A HIS 151.A N VAL 147.A O no hydrogen 2.886 N/A HIS 151.A NE2 GLU 166.A OE1 no hydrogen 2.558 N/A ASP 152.A N LYS 148.A O no hydrogen 2.817 N/A GLY 153.A N GLY 149.A O no hydrogen 3.076 N/A LEU 154.A N VAL 150.A O no hydrogen 2.996 N/A ALA 155.A N HIS 151.A O no hydrogen 2.827 N/A ALA 156.A N ASP 152.A O no hydrogen 2.972 N/A GLY 157.A N GLY 153.A O no hydrogen 3.085 N/A GLY 158.A N LEU 154.A O no hydrogen 3.038 N/A PHE 161.A N GLY 158.A O no hydrogen 2.916 N/A LYS 162.A N ALA 129.A O no hydrogen 2.854 N/A LYS 162.A NZ PRO 159.A O no hydrogen 2.716 N/A VAL 164.A N VAL 131.A O no hydrogen 2.869 N/A GLN 167.A N VAL 133.A O no hydrogen 2.937 N/A GLN 167.A NE2 THR 165.A OG1.A no hydrogen 3.026 N/A THR 168.A OG1 THR 135.A O no hydrogen 3.009 N/A THR 168.A OG1 THR 135.A OG1 no hydrogen 3.042 N/A ALA 169.A N THR 135.A O no hydrogen 3.139 N/A ASN 170.A N THR 168.A OG1 no hydrogen 3.023 N/A ASN 170.A ND2 GLN 175.A OE1 no hydrogen 2.846 N/A LYS 172.A N ALA 169.A O no hydrogen 2.975 N/A LYS 172.A NZ ASP 16.A OD2 no hydrogen 3.206 N/A ARG 173.A NE ASP 200.A O no hydrogen 3.162 N/A ARG 173.A NE ASP 200.A OD1 no hydrogen 2.799 N/A ARG 173.A NH1 GLU 227.A OE1 no hydrogen 3.507 N/A ARG 173.A NH1 GLU 227.A OE2 no hydrogen 2.856 N/A ARG 173.A NH2 ASP 200.A OD1 no hydrogen 2.851 N/A ARG 173.A NH2 GLU 227.A OE1 no hydrogen 2.827 N/A ALA 176.A N LYS 172.A O no hydrogen 2.918 N/A LEU 177.A N ARG 173.A O no hydrogen 3.007 N/A THR 178.A N ASP 174.A O no hydrogen 3.422 N/A THR 178.A OG1 ASP 174.A O no hydrogen 3.520 N/A THR 178.A OG1 GLN 175.A O no hydrogen 3.351 N/A VAL 179.A N GLN 175.A O no hydrogen 2.769 N/A THR 180.A N ALA 176.A O no hydrogen 2.977 N/A THR 180.A OG1 ALA 176.A O no hydrogen 2.755 N/A GLN 181.A N LEU 177.A O no hydrogen 2.864 N/A ASN 182.A N THR 178.A O no hydrogen 2.980 N/A ILE 183.A N VAL 179.A O no hydrogen 3.085 N/A LEU 184.A N THR 180.A O no hydrogen 2.835 N/A THR 185.A N GLN 181.A O no hydrogen 2.888 N/A THR 185.A OG1 GLN 181.A O no hydrogen 3.088 N/A SER 186.A N ASN 182.A O no hydrogen 2.973 N/A SER 186.A OG ILE 183.A O no hydrogen 2.731 N/A THR 189.A OG1 THR 189.A O no hydrogen 2.609 N/A ASP 192.A N ARG 130.A O no hydrogen 2.778 N/A VAL 193.A N ARG 130.A O no hydrogen 3.234 N/A ILE 194.A N LYS 218.A O no hydrogen 2.719 N/A LEU 195.A N VAL 132.A O no hydrogen 2.811 N/A CYS 196.A N ILE 220.A O no hydrogen 2.766 N/A LEU 197.A N ILE 134.A O no hydrogen 2.939 N/A LEU 204.A N ALA 201.A O no hydrogen 2.832 N/A ALA 206.A N GLY 202.A O no hydrogen 2.881 N/A VAL 207.A N ALA 203.A O no hydrogen 2.945 N/A ARG 208.A N LEU 204.A O no hydrogen 3.023 N/A ALA 209.A N GLU 205.A O no hydrogen 2.724 N/A ALA 210.A N ALA 206.A O no hydrogen 2.951 N/A ALA 210.A N VAL 207.A O no hydrogen 3.313 N/A GLY 211.A N ARG 208.A O no hydrogen 2.957 N/A LEU 212.A N VAL 207.A O no hydrogen 3.010 N/A ALA 215.A N ASP 213.A OD1 no hydrogen 3.289 N/A LYS 216.A N ASP 213.A O no hydrogen 2.818 N/A VAL 217.A N ASP 213.A O no hydrogen 2.904 N/A LYS 218.A N ASP 192.A O no hydrogen 2.848 N/A LYS 218.A NZ ALA 215.A O no hydrogen 2.850 N/A ILE 220.A N ILE 194.A O no hydrogen 3.024 N/A GLY 221.A N ALA 238.A O no hydrogen 3.009 N/A ASP 223.A N VAL 240.A O no hydrogen 2.832 N/A ALA 224.A N THR 239.A OG1 no hydrogen 3.109 N/A ILE 225.A N ASP 199.A OD2 no hydrogen 2.854 N/A LEU 229.A N ILE 225.A O no hydrogen 3.034 N/A ALA 230.A N PRO 226.A O no hydrogen 2.989 N/A ARG 231.A N GLU 227.A O no hydrogen 3.238 N/A ARG 231.A NH1 GLU 236.A OE1 no hydrogen 2.190 N/A ILE 232.A N ALA 228.A O no hydrogen 2.954 N/A LYS 233.A N LEU 229.A O no hydrogen 2.880 N/A ALA 234.A N ALA 230.A O no hydrogen 2.901 N/A GLY 235.A N ILE 232.A O no hydrogen 3.055 N/A GLU 236.A N ARG 231.A O no hydrogen 2.872 N/A VAL 237.A N VAL 219.A O no hydrogen 3.229 N/A THR 239.A N ILE 275.A O no hydrogen 2.910 N/A THR 239.A OG1 ASP 199.A OD1 no hydrogen 2.711 N/A THR 239.A OG1 ASP 199.A OD2 no hydrogen 3.141 N/A VAL 240.A N THR 239.A OG1 no hydrogen 2.743 N/A GLU 241.A N VAL 273.A O no hydrogen 2.809 N/A GLN 242.A NE2 ASP 223.A OD1 no hydrogen 2.908 N/A ASN 243.A N GLU 241.A OE2 no hydrogen 2.758 N/A GLN 247.A N ASN 243.A O no hydrogen 3.012 N/A GLN 247.A NE2 GLN 242.A O no hydrogen 2.903 N/A GLN 247.A NE2 GLN 242.A OE1 no hydrogen 3.001 N/A ILE 248.A N PRO 244.A O no hydrogen 3.091 N/A ARG 249.A N GLY 245.A O no hydrogen 2.933 N/A ARG 249.A NH1 ASP 30.A OD2 no hydrogen 2.741 N/A ARG 249.A NH1 GLU 31.A OE1 no hydrogen 2.779 N/A ARG 249.A NH2 GLU 27.A OE1 no hydrogen 2.675 N/A ARG 249.A NH2 ASP 30.A OD2 no hydrogen 2.865 N/A THR 250.A N LEU 246.A O no hydrogen 2.894 N/A THR 250.A OG1 LEU 246.A O no hydrogen 2.711 N/A ALA 251.A N GLN 247.A O no hydrogen 3.022 N/A LEU 252.A N ILE 248.A O no hydrogen 3.019 N/A ARG 253.A N ARG 249.A O no hydrogen 2.872 N/A ARG 253.A NE GLU 31.A OE2 no hydrogen 2.776 N/A ARG 253.A NH2 GLU 31.A OE1 no hydrogen 3.086 N/A ARG 253.A NH2 GLU 31.A OE2 no hydrogen 3.302 N/A GLN 254.A N THR 250.A O no hydrogen 3.009 N/A GLN 254.A NE2 LYS 266.A O no hydrogen 2.851 N/A ALA 255.A N ALA 251.A O no hydrogen 2.941 N/A VAL 256.A N LEU 252.A O no hydrogen 2.943 N/A ASP 257.A N ARG 253.A O no hydrogen 3.090 N/A LYS 258.A N GLN 254.A O no hydrogen 2.863 N/A ILE 259.A N ALA 255.A O no hydrogen 2.977 N/A LYS 260.A N VAL 256.A O no hydrogen 2.862 N/A SER 261.A N ASP 257.A O no hydrogen 2.986 N/A SER 261.A OG ASP 257.A O no hydrogen 3.119 N/A GLY 262.A N LYS 258.A O no hydrogen 2.873 N/A LYS 266.A N GLN 254.A OE1 no hydrogen 2.676 N/A VAL 268.A N HIS 106.A O no hydrogen 2.875 N/A LEU 270.A N GLY 108.A O no hydrogen 2.851 N/A VAL 273.A N GLU 241.A O no hydrogen 3.021 N/A ILE 275.A N THR 239.A O no hydrogen 2.819 N/A THR 276.A N ASN 279.A OD1 no hydrogen 2.799 N/A THR 276.A OG1 ASN 279.A OD1 no hydrogen 3.383 N/A ASN 279.A N THR 276.A O no hydrogen 3.144 N/A ASN 279.A ND2 LEU 274.A O no hydrogen 3.084 N/A ASN 279.A ND2 GLU 282.A OE1 no hydrogen 2.910 N/A GLU 282.A N ASN 279.A O no hydrogen 2.911 N/A ALA 283.A N LEU 280.A O no hydrogen 3.037 N/A SER 284.A N GLU 241.A OE1 no hydrogen 2.911 N/A SER 284.A OG GLU 241.A OE1 no hydrogen 3.381 N/A SER 284.A OG GLU 241.A OE2 no hydrogen 2.786 N/A ARG 285.A NE GLU 288.A OE2 no hydrogen 2.987 N/A ARG 285.A NH2 GLU 288.A OE1 no hydrogen 2.995 N/A ILE 286.A N ALA 283.A O no hydrogen 3.256 N/A GLU 288.A N ARG 285.A O no hydrogen 2.933 N/A