Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ri6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N HIS 332.A O no hydrogen 2.947 N/A LYS 3.A NZ ASP 69.A O no hydrogen 3.110 N/A GLN 4.A NE2 ASP 284.A OD2 no hydrogen 2.793 N/A THR 5.A N ASN 330.A O no hydrogen 2.803 N/A VAL 6.A N TRP 19.A O no hydrogen 2.672 N/A TYR 7.A N VAL 328.A O no hydrogen 2.832 N/A TYR 7.A OH GLY 71.A O no hydrogen 2.673 N/A ILE 8.A N HIS 17.A O no hydrogen 3.019 N/A ALA 9.A N TRP 326.A O no hydrogen 3.011 N/A SER 10.A N GLN 15.A O no hydrogen 2.914 N/A GLN 14.A N PRO 11.A O no hydrogen 2.881 N/A GLN 15.A N SER 10.A O no hydrogen 2.989 N/A ILE 16.A N VAL 33.A O no hydrogen 2.928 N/A HIS 17.A N ILE 8.A O no hydrogen 2.980 N/A VAL 18.A N GLN 31.A O no hydrogen 2.714 N/A TRP 19.A N VAL 6.A O no hydrogen 2.859 N/A ASN 20.A N THR 28.A O no hydrogen 2.976 N/A LEU 21.A N GLN 4.A O no hydrogen 2.966 N/A ASN 22.A N ALA 26.A O no hydrogen 3.102 N/A GLU 24.A N ASN 22.A OD1 no hydrogen 2.734 N/A GLY 25.A N ASN 22.A O no hydrogen 3.020 N/A ALA 26.A N ASN 22.A OD1 no hydrogen 2.984 N/A LEU 27.A N TYR 318.A OH no hydrogen 2.875 N/A THR 28.A N ASN 20.A O no hydrogen 3.109 N/A THR 30.A N VAL 18.A O no hydrogen 2.680 N/A THR 30.A OG1 THR 28.A O no hydrogen 3.554 N/A GLN 31.A N VAL 18.A O no hydrogen 3.227 N/A GLN 31.A NE2 LEU 73.A O no hydrogen 3.141 N/A VAL 33.A N ILE 16.A O no hydrogen 2.744 N/A VAL 35.A N GLN 14.A O no hydrogen 2.974 N/A GLN 38.A N ARG 56.A O no hydrogen 2.814 N/A GLN 40.A N GLY 54.A O no hydrogen 3.027 N/A VAL 43.A N TYR 52.A O no hydrogen 2.942 N/A SER 45.A N TYR 50.A O no hydrogen 2.835 N/A SER 45.A OG ASP 47.A OD1 no hydrogen 2.647 N/A SER 45.A OG TYR 50.A O no hydrogen 3.311 N/A LYS 48.A N SER 45.A O no hydrogen 2.819 N/A LYS 48.A NZ ALA 331.A O no hydrogen 2.772 N/A ARG 49.A N ASP 47.A OD1 no hydrogen 2.876 N/A ARG 49.A NE ASP 47.A OD2 no hydrogen 2.706 N/A ARG 49.A NH2 ASP 114.A OD1 no hydrogen 3.110 N/A TYR 50.A N SER 45.A OG no hydrogen 3.072 N/A LEU 51.A N TYR 64.A O no hydrogen 2.846 N/A TYR 52.A N VAL 43.A O no hydrogen 2.900 N/A TYR 52.A OH GLY 115.A O no hydrogen 2.641 N/A VAL 53.A N LEU 62.A O no hydrogen 2.927 N/A GLY 54.A N PRO 41.A O no hydrogen 3.049 N/A VAL 55.A N ARG 60.A O no hydrogen 3.156 N/A ARG 56.A NH1 GLN 40.A OE1 no hydrogen 3.116 N/A ARG 60.A NE GLU 58.A O no hydrogen 3.015 N/A ARG 60.A NH1 GLU 78.A OE1 no hydrogen 2.697 N/A ARG 60.A NH2 PRO 36.A O no hydrogen 2.847 N/A VAL 61.A N SER 79.A O no hydrogen 2.750 N/A LEU 62.A N VAL 53.A O no hydrogen 2.720 N/A ALA 63.A N ALA 77.A O no hydrogen 2.841 N/A TYR 64.A N LEU 51.A O no hydrogen 2.964 N/A ARG 65.A N THR 74.A O no hydrogen 2.836 N/A ARG 65.A NH1 TYR 50.A OH no hydrogen 2.940 N/A ILE 66.A N ARG 49.A O no hydrogen 2.867 N/A ALA 67.A N ALA 72.A O no hydrogen 2.915 N/A GLY 71.A N ALA 67.A O no hydrogen 2.770 N/A ALA 72.A N ASP 70.A OD1 no hydrogen 2.968 N/A LEU 73.A N GLN 31.A OE1 no hydrogen 2.761 N/A THR 74.A N ARG 65.A O no hydrogen 3.237 N/A ALA 76.A N ALA 63.A O no hydrogen 2.819 N/A ALA 77.A N ALA 63.A O no hydrogen 3.189 N/A SER 79.A N VAL 61.A O no hydrogen 2.956 N/A LEU 81.A N PHE 59.A O no hydrogen 3.085 N/A SER 84.A OG SER 101.A OG no hydrogen 3.319 N/A THR 86.A N GLY 100.A O no hydrogen 2.977 N/A HIS 87.A N GLY 100.A O no hydrogen 3.281 N/A SER 89.A N PHE 98.A O no hydrogen 3.000 N/A SER 89.A OG ALA 133.A O no hydrogen 2.749 N/A THR 90.A OG1 ASP 91.A O no hydrogen 2.917 N/A ASP 91.A N PHE 96.A O no hydrogen 3.226 N/A HIS 92.A N ASN 139.A OD1 no hydrogen 2.608 N/A HIS 92.A NE2 SER 136.A O no hydrogen 3.134 N/A GLN 93.A N ASP 91.A OD2 no hydrogen 2.861 N/A GLY 94.A N ASP 91.A O no hydrogen 3.254 N/A GLN 95.A N ASP 91.A OD1 no hydrogen 2.690 N/A GLN 95.A NE2 GLN 93.A O no hydrogen 3.567 N/A PHE 96.A N ASP 91.A OD1 no hydrogen 2.920 N/A VAL 97.A N THR 110.A O no hydrogen 2.965 N/A PHE 98.A N SER 89.A O no hydrogen 2.652 N/A VAL 99.A N SER 108.A O no hydrogen 2.996 N/A GLY 100.A N HIS 87.A O no hydrogen 3.254 N/A SER 101.A N ASN 106.A O no hydrogen 2.833 N/A SER 101.A OG SER 84.A O no hydrogen 2.745 N/A SER 101.A OG SER 84.A OG no hydrogen 3.319 N/A TYR 102.A N THR 86.A OG1 no hydrogen 2.808 N/A ALA 104.A N SER 101.A OG no hydrogen 3.379 N/A ASN 106.A N SER 101.A O no hydrogen 3.190 N/A ASN 106.A ND2 GLU 125.A OE1 no hydrogen 3.135 N/A VAL 107.A N VAL 124.A O no hydrogen 3.249 N/A SER 108.A N VAL 99.A O no hydrogen 2.945 N/A VAL 109.A N ASP 122.A O no hydrogen 2.884 N/A THR 110.A N VAL 97.A O no hydrogen 2.891 N/A ARG 111.A N GLY 119.A O no hydrogen 2.862 N/A LEU 112.A N GLN 95.A O no hydrogen 2.964 N/A GLU 113.A N LEU 116.A O no hydrogen 2.739 N/A LEU 116.A N GLU 113.A O no hydrogen 3.156 N/A VAL 118.A N ARG 111.A O no hydrogen 2.858 N/A VAL 121.A N VAL 109.A O no hydrogen 2.682 N/A VAL 123.A N ASP 122.A OD1 no hydrogen 2.811 N/A VAL 124.A N VAL 107.A O no hydrogen 2.906 N/A LEU 127.A N GLY 105.A O no hydrogen 2.878 N/A CYS 130.A N LEU 127.A O no hydrogen 2.956 N/A CYS 130.A SG ASN 106.A O no hydrogen 3.377 N/A CYS 130.A SG SER 132.A O no hydrogen 3.927 N/A HIS 131.A N PRO 145.A O no hydrogen 2.935 N/A HIS 131.A ND1 HIS 131.A O no hydrogen 2.879 N/A SER 132.A OG ARG 180.A O no hydrogen 2.834 N/A ASN 134.A N TRP 143.A O no hydrogen 2.839 N/A ASN 134.A ND2 SER 132.A OG no hydrogen 3.148 N/A ASN 134.A ND2 TRP 143.A O no hydrogen 3.185 N/A SER 136.A N THR 141.A O no hydrogen 2.682 N/A SER 136.A OG ASP 138.A OD1 no hydrogen 2.634 N/A SER 136.A OG THR 141.A O no hydrogen 3.043 N/A ASN 139.A N SER 136.A O no hydrogen 2.801 N/A ASN 139.A ND2 ASP 91.A OD2 no hydrogen 3.199 N/A ARG 140.A N ASP 138.A OD1 no hydrogen 2.968 N/A ARG 140.A NH1 VAL 157.A O no hydrogen 2.832 N/A ARG 140.A NH1 ASP 159.A OD1 no hydrogen 3.479 N/A ARG 140.A NH2 ASP 159.A OD1 no hydrogen 2.735 N/A THR 141.A N SER 136.A OG no hydrogen 2.933 N/A LEU 142.A N PHE 155.A O no hydrogen 2.754 N/A TRP 143.A N ASN 134.A O no hydrogen 2.768 N/A VAL 144.A N CYS 153.A O no hydrogen 2.763 N/A ALA 146.A N ARG 151.A O no hydrogen 2.806 N/A LEU 147.A N GLY 129.A O no hydrogen 3.115 N/A LYS 148.A N ASP 128.A O no hydrogen 3.262 N/A GLN 149.A N ALA 146.A O no hydrogen 2.917 N/A GLN 149.A NE2 GLY 126.A O no hydrogen 2.862 N/A ASP 150.A N LEU 147.A O no hydrogen 3.433 N/A ARG 151.A NE GLN 149.A OE1 no hydrogen 2.912 N/A ARG 151.A NH2 GLN 149.A OE1 no hydrogen 2.908 N/A ILE 152.A N VAL 171.A O no hydrogen 2.983 N/A CYS 153.A N VAL 144.A O no hydrogen 2.811 N/A LEU 154.A N ALA 169.A O no hydrogen 2.962 N/A PHE 155.A N LEU 142.A O no hydrogen 3.071 N/A THR 156.A N VAL 164.A O no hydrogen 2.814 N/A VAL 157.A N ARG 140.A O no hydrogen 2.863 N/A SER 158.A N HIS 162.A O no hydrogen 2.866 N/A SER 158.A OG ASP 160.A OD2 no hydrogen 2.652 N/A SER 158.A OG HIS 162.A O no hydrogen 3.276 N/A GLY 161.A N SER 158.A O no hydrogen 3.132 N/A HIS 162.A N SER 158.A OG no hydrogen 2.891 N/A LEU 163.A N ASP 122.A OD2 no hydrogen 2.904 N/A VAL 164.A N THR 156.A O no hydrogen 2.928 N/A GLN 166.A N LEU 154.A O no hydrogen 3.111 N/A GLN 166.A NE2 THR 141.A OG1 no hydrogen 2.917 N/A GLN 166.A NE2 THR 156.A OG1 no hydrogen 2.901 N/A VAL 171.A N ILE 152.A O no hydrogen 3.045 N/A THR 173.A N ASP 150.A O no hydrogen 3.057 N/A THR 173.A OG1 VAL 174.A O no hydrogen 3.157 N/A GLY 176.A N ASP 150.A OD2 no hydrogen 2.801 N/A ALA 177.A N VAL 174.A O no hydrogen 3.023 N/A GLY 178.A N ASP 150.A OD1 no hydrogen 3.077 N/A ARG 180.A N VAL 194.A O no hydrogen 2.955 N/A ARG 180.A NE GLU 196.A OE1 no hydrogen 3.054 N/A ARG 180.A NH1 ALA 233.A O no hydrogen 2.781 N/A HIS 181.A ND1 ASP 234.A OD1 no hydrogen 3.038 N/A VAL 183.A N TYR 192.A O no hydrogen 2.948 N/A HIS 185.A N TYR 190.A O no hydrogen 2.869 N/A HIS 185.A ND1 TYR 192.A OH no hydrogen 2.955 N/A ASN 187.A ND2 ASP 262.A O no hydrogen 2.979 N/A GLU 188.A N HIS 185.A O no hydrogen 2.844 N/A GLN 189.A N ASN 187.A OD1 no hydrogen 2.671 N/A ALA 191.A N TRP 204.A O no hydrogen 2.808 N/A TYR 192.A N VAL 183.A O no hydrogen 2.799 N/A TYR 192.A OH HIS 185.A ND1 no hydrogen 2.955 N/A TYR 192.A OH GLY 263.A O no hydrogen 2.699 N/A CYS 193.A N ASP 202.A O no hydrogen 3.014 N/A CYS 193.A SG HIS 181.A O no hydrogen 3.484 N/A CYS 193.A SG VAL 194.A O no hydrogen 3.808 N/A CYS 193.A SG ASN 195.A OD1 no hydrogen 3.969 N/A VAL 194.A N HIS 181.A O no hydrogen 2.820 N/A ASN 195.A N SER 200.A O no hydrogen 2.729 N/A ASN 195.A ND2 SER 200.A OG no hydrogen 2.922 N/A ASN 195.A ND2 ASP 202.A OD2 no hydrogen 2.839 N/A GLU 196.A N GLY 178.A O no hydrogen 2.759 N/A SER 199.A OG ASP 248.A OD2 no hydrogen 2.731 N/A SER 200.A N ASN 195.A O no hydrogen 3.400 N/A SER 200.A OG ASN 198.A OD1 no hydrogen 2.746 N/A VAL 201.A N LEU 219.A O no hydrogen 2.960 N/A ASP 202.A N CYS 193.A O no hydrogen 2.832 N/A VAL 203.A N GLN 217.A O no hydrogen 2.764 N/A TRP 204.A N ALA 191.A O no hydrogen 2.718 N/A GLU 205.A N GLU 214.A O no hydrogen 2.764 N/A LEU 206.A N GLN 189.A O no hydrogen 3.046 N/A ASP 208.A N ASN 212.A O no hydrogen 2.881 N/A HIS 210.A N ASP 208.A OD1 no hydrogen 2.825 N/A HIS 210.A ND1 ASP 208.A OD2 no hydrogen 3.342 N/A GLY 211.A N ASP 208.A O no hydrogen 2.744 N/A ASN 212.A N ASP 208.A OD1 no hydrogen 2.861 N/A GLU 214.A N GLU 205.A O no hydrogen 3.092 N/A CYS 215.A SG ASP 202.A OD1 no hydrogen 3.516 N/A CYS 215.A SG VAL 203.A O no hydrogen 3.839 N/A CYS 215.A SG GLN 217.A O no hydrogen 3.625 N/A CYS 215.A SG THR 218.A OG1 no hydrogen 3.580 N/A VAL 216.A N VAL 203.A O no hydrogen 2.940 N/A GLN 217.A NE2 LEU 266.A O no hydrogen 3.127 N/A THR 218.A OG1 ASP 202.A OD1 no hydrogen 2.626 N/A LEU 219.A N VAL 201.A O no hydrogen 3.007 N/A MET 221.A N SER 199.A O no hydrogen 3.086 N/A MET 222.A N ASP 220.A OD1 no hydrogen 2.835 N/A PHE 226.A N PRO 223.A O no hydrogen 2.983 N/A THR 229.A N ASP 228.A OD1 no hydrogen 2.463 N/A THR 229.A OG1 ASP 228.A OD1 no hydrogen 3.451 N/A ARG 230.A NH1 ASN 198.A O no hydrogen 2.810 N/A ARG 230.A NH1 ASP 220.A OD1 no hydrogen 2.988 N/A ARG 230.A NH2 ASP 220.A OD1 no hydrogen 3.534 N/A ARG 230.A NH2 ASP 220.A OD2 no hydrogen 2.860 N/A TRP 231.A N ASP 248.A OD2 no hydrogen 2.817 N/A ALA 232.A N GLU 196.A O no hydrogen 3.069 N/A ALA 233.A N CYS 247.A O no hydrogen 2.891 N/A ILE 235.A N ASP 234.A OD1 no hydrogen 2.914 N/A HIS 236.A N TYR 245.A O no hydrogen 2.967 N/A HIS 236.A NE2 ASP 234.A OD2 no hydrogen 2.754 N/A THR 238.A N HIS 243.A O no hydrogen 2.956 N/A THR 238.A OG1 ASP 240.A OD1 no hydrogen 2.746 N/A THR 238.A OG1 HIS 243.A O no hydrogen 3.392 N/A GLY 241.A N THR 238.A O no hydrogen 2.941 N/A ARG 242.A N ASP 240.A OD1 no hydrogen 2.837 N/A HIS 243.A N THR 238.A OG1 no hydrogen 3.229 N/A LEU 244.A N PHE 257.A O no hydrogen 3.023 N/A TYR 245.A N HIS 236.A O no hydrogen 2.787 N/A TYR 245.A OH GLY 310.A O no hydrogen 2.667 N/A ALA 246.A N THR 255.A O no hydrogen 3.260 N/A CYS 247.A N ASP 234.A O no hydrogen 3.093 N/A CYS 247.A SG PRO 278.A O no hydrogen 3.263 N/A ASP 248.A N LEU 253.A O no hydrogen 3.078 N/A ARG 249.A N TRP 231.A O no hydrogen 2.951 N/A ARG 249.A NE TRP 231.A O no hydrogen 3.342 N/A ARG 249.A NH2 ALA 232.A O no hydrogen 2.946 N/A THR 250.A N ASP 248.A OD1 no hydrogen 2.651 N/A THR 250.A OG1 THR 229.A O no hydrogen 2.556 N/A ALA 251.A N ASP 248.A OD1 no hydrogen 2.888 N/A LEU 253.A N ASP 248.A O no hydrogen 3.459 N/A ILE 254.A N GLN 272.A O no hydrogen 2.954 N/A THR 255.A N ALA 246.A O no hydrogen 2.704 N/A THR 255.A OG1 MET 221.A O no hydrogen 2.569 N/A VAL 256.A N GLY 270.A O no hydrogen 2.853 N/A PHE 257.A N LEU 244.A O no hydrogen 2.834 N/A SER 258.A N SER 267.A O no hydrogen 2.797 N/A SER 258.A OG SER 267.A O no hydrogen 3.458 N/A SER 258.A OG GLU 269.A OE2 no hydrogen 2.750 N/A VAL 259.A N ARG 242.A O no hydrogen 2.969 N/A SER 260.A N VAL 265.A O no hydrogen 2.917 N/A SER 260.A OG ASP 262.A OD1 no hydrogen 2.945 N/A SER 260.A OG VAL 265.A O no hydrogen 3.550 N/A GLY 263.A N SER 260.A O no hydrogen 2.883 N/A SER 264.A N ASP 262.A OD1 no hydrogen 2.693 N/A SER 264.A OG ASP 262.A OD1 no hydrogen 2.782 N/A SER 264.A OG ASP 262.A OD2 no hydrogen 3.445 N/A VAL 265.A N SER 260.A OG no hydrogen 2.960 N/A LEU 266.A N GLN 217.A OE1 no hydrogen 2.741 N/A SER 267.A N SER 258.A O no hydrogen 3.013 N/A LYS 268.A NZ ASP 220.A O no hydrogen 2.832 N/A LYS 268.A NZ MET 222.A O no hydrogen 2.855 N/A GLU 269.A N VAL 256.A O no hydrogen 2.861 N/A GLN 272.A N ILE 254.A O no hydrogen 2.819 N/A THR 274.A N SER 252.A O no hydrogen 3.041 N/A THR 274.A OG1 TYR 303.A OH no hydrogen 2.609 N/A GLU 275.A N THR 274.A OG1 no hydrogen 2.727 N/A GLN 277.A N SER 252.A OG no hydrogen 2.804 N/A GLN 277.A NE2 GLN 295.A OE1 no hydrogen 2.986 N/A PHE 281.A N ASP 234.A OD2 no hydrogen 3.278 N/A ASN 282.A N ILE 291.A O no hydrogen 2.955 N/A ASN 282.A ND2 VAL 327.A O no hydrogen 2.806 N/A VAL 283.A N ASN 282.A OD1 no hydrogen 2.857 N/A ASP 284.A N TYR 289.A O no hydrogen 2.995 N/A HIS 285.A N GLN 4.A OE1 no hydrogen 2.814 N/A HIS 285.A NE2 VAL 329.A O no hydrogen 2.782 N/A SER 286.A N ASP 284.A OD2 no hydrogen 2.852 N/A SER 286.A OG ASP 284.A OD1 no hydrogen 3.349 N/A SER 286.A OG ASP 284.A OD2 no hydrogen 2.650 N/A GLY 287.A N ASP 284.A O no hydrogen 3.269 N/A LYS 288.A N ASP 284.A OD1 no hydrogen 2.996 N/A TYR 289.A N ASP 284.A OD1 no hydrogen 2.868 N/A TYR 289.A OH HIS 23.A O no hydrogen 2.673 N/A LEU 290.A N TYR 303.A O no hydrogen 2.757 N/A ILE 291.A N ASN 282.A O no hydrogen 2.890 N/A ALA 292.A N SER 301.A O no hydrogen 2.987 N/A ALA 293.A N GLY 280.A O no hydrogen 3.018 N/A GLY 294.A N HIS 299.A O no hydrogen 2.959 N/A GLN 295.A N GLN 277.A O no hydrogen 2.871 N/A LYS 296.A N THR 276.A O no hydrogen 3.081 N/A SER 297.A N GLY 294.A O no hydrogen 2.991 N/A SER 297.A OG GLU 275.A OE1 no hydrogen 2.671 N/A SER 297.A OG GLY 294.A O no hydrogen 3.364 N/A HIS 298.A N GLY 294.A O no hydrogen 2.866 N/A HIS 299.A N SER 297.A OG no hydrogen 3.276 N/A ILE 300.A N TYR 318.A O no hydrogen 2.849 N/A SER 301.A N ALA 292.A O no hydrogen 2.967 N/A SER 301.A OG GLU 275.A OE2 no hydrogen 2.381 N/A VAL 302.A N GLY 316.A O no hydrogen 2.948 N/A TYR 303.A N LEU 290.A O no hydrogen 2.746 N/A TYR 303.A OH THR 274.A OG1 no hydrogen 2.609 N/A GLU 304.A N HIS 313.A O no hydrogen 2.860 N/A ILE 305.A N LYS 288.A O no hydrogen 2.631 N/A VAL 306.A N LEU 311.A O no hydrogen 2.922 N/A GLN 309.A NE2 GLU 269.A OE1 no hydrogen 2.805 N/A HIS 313.A N GLU 304.A O no hydrogen 3.010 N/A LYS 315.A N VAL 302.A O no hydrogen 2.893 N/A LYS 315.A NZ GLU 24.A O no hydrogen 3.288 N/A GLY 316.A N VAL 302.A O no hydrogen 3.443 N/A ARG 317.A NE GLU 275.A OE1 no hydrogen 3.291 N/A ARG 317.A NE GLU 275.A OE2 no hydrogen 2.644 N/A ARG 317.A NH2 GLU 275.A OE1 no hydrogen 3.038 N/A TYR 318.A N ILE 300.A O no hydrogen 2.832 N/A VAL 320.A N HIS 298.A O no hydrogen 3.263 N/A GLY 321.A N SER 10.A OG no hydrogen 3.168 N/A GLN 322.A N SER 13.A OG no hydrogen 2.870 N/A GLY 323.A N HIS 298.A ND1 no hydrogen 2.878 N/A MET 325.A N ALA 9.A O no hydrogen 3.034 N/A VAL 328.A N TYR 7.A O no hydrogen 3.162 N/A ASN 330.A N THR 5.A O no hydrogen 2.865 N/A HIS 332.A N LYS 3.A O no hydrogen 2.753 N/A