Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cij_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N ASN 28.A O no hydrogen 2.920 N/A LEU 3.A N GLU 30.A O no hydrogen 2.961 N/A LYS 4.A N ASP 53.A OD2 no hydrogen 2.850 N/A LYS 4.A NZ GLU 262.A OE1 no hydrogen 2.498 N/A VAL 5.A N GLN 32.A O no hydrogen 2.886 N/A PHE 6.A N VAL 54.A O no hydrogen 2.970 N/A HIS 7.A N GLU 34.A O no hydrogen 2.945 N/A HIS 7.A ND1 ALA 8.A O no hydrogen 2.763 N/A ALA 8.A N ALA 56.A O no hydrogen 2.908 N/A SER 10.A OG TYR 253.A OH no hydrogen 2.663 N/A LEU 11.A N ALA 8.A O no hydrogen 2.942 N/A THR 12.A N GLY 9.A O no hydrogen 2.958 N/A THR 12.A OG1 GLY 9.A O no hydrogen 2.693 N/A MET 15.A N LEU 11.A O no hydrogen 2.848 N/A LYS 16.A N THR 12.A O no hydrogen 3.231 N/A LYS 16.A N GLU 13.A O no hydrogen 3.107 N/A LYS 16.A NZ GLU 13.A OE1 no hydrogen 2.982 N/A LYS 16.A NZ GLU 13.A OE2 no hydrogen 2.959 N/A PHE 18.A N PRO 14.A O no hydrogen 2.833 N/A LYS 19.A N MET 15.A O no hydrogen 2.826 N/A LYS 19.A NZ GLU 23.A OE2 no hydrogen 2.621 N/A LYS 19.A NZ VAL 31.A O no hydrogen 2.803 N/A ARG 20.A N LYS 16.A O no hydrogen 3.090 N/A ALA 21.A N ALA 17.A O no hydrogen 2.933 N/A PHE 22.A N PHE 18.A O no hydrogen 2.853 N/A GLU 23.A N LYS 19.A O no hydrogen 2.947 N/A GLU 24.A N ARG 20.A O no hydrogen 3.104 N/A LYS 25.A N ALA 21.A O no hydrogen 3.317 N/A HIS 26.A N PHE 22.A O no hydrogen 2.895 N/A VAL 29.A N HIS 26.A O no hydrogen 3.132 N/A GLU 30.A N VAL 1.A O no hydrogen 2.803 N/A VAL 31.A N GLU 23.A OE2 no hydrogen 2.807 N/A GLN 32.A N LEU 3.A O no hydrogen 2.743 N/A GLN 32.A NE2 GLU 30.A OE2 no hydrogen 3.568 N/A GLU 34.A N VAL 5.A O no hydrogen 2.997 N/A ALA 36.A N HIS 7.A O no hydrogen 3.016 N/A SER 38.A OG THR 57.A OG1.B no hydrogen 3.282 N/A ALA 39.A N ASP 120.A O no hydrogen 2.912 N/A ALA 40.A N ASP 120.A O no hydrogen 3.269 N/A THR 41.A N GLY 37.A O no hydrogen 2.735 N/A THR 41.A OG1 HIS 7.A O no hydrogen 3.420 N/A THR 41.A OG1 ALA 36.A O no hydrogen 2.890 N/A THR 41.A OG1 GLY 37.A O no hydrogen 3.334 N/A ILE 42.A N SER 38.A O no hydrogen 3.012 N/A ARG 43.A N ALA 39.A O no hydrogen 2.972 N/A ARG 43.A NH2 ASN 119.A O no hydrogen 2.876 N/A LYS 44.A N ALA 40.A O no hydrogen 3.154 N/A LYS 44.A N THR 41.A O no hydrogen 3.133 N/A LYS 44.A NZ GLU 34.A OE1 no hydrogen 2.800 N/A VAL 45.A N ILE 42.A O no hydrogen 2.917 N/A THR 46.A N ILE 42.A O no hydrogen 2.940 N/A THR 46.A OG1 ILE 42.A O no hydrogen 3.384 N/A GLU 47.A N ARG 43.A O no hydrogen 2.799 N/A LEU 48.A N ARG 43.A O no hydrogen 2.993 N/A ARG 50.A N LYS 44.A O no hydrogen 2.946 N/A ARG 50.A NH2 GLU 34.A OE1 no hydrogen 2.486 N/A ARG 50.A NH2 GLU 34.A OE2 no hydrogen 3.124 N/A ASP 53.A N LYS 4.A O no hydrogen 2.826 N/A VAL 54.A N LYS 4.A O no hydrogen 3.140 N/A ILE 55.A N THR 256.A O no hydrogen 2.971 N/A ALA 56.A N PHE 6.A O no hydrogen 3.025 N/A THR 57.A N.A GLY 254.A O no hydrogen 2.842 N/A THR 57.A N.B GLY 254.A O no hydrogen 2.821 N/A THR 57.A OG1.A ASP 59.A O no hydrogen 2.907 N/A THR 57.A OG1.B ASP 59.A O no hydrogen 2.818 N/A ALA 58.A N SER 38.A OG no hydrogen 2.836 N/A ASP 59.A N THR 57.A OG1.B no hydrogen 3.095 N/A TYR 60.A N VAL 252.A O no hydrogen 2.987 N/A THR 61.A N ASP 59.A OD1 no hydrogen 2.994 N/A THR 61.A OG1 ASP 59.A OD1 no hydrogen 2.882 N/A THR 61.A OG1 ASP 59.A OD2 no hydrogen 3.542 N/A LEU 62.A N ASP 59.A O no hydrogen 3.086 N/A ILE 63.A N TYR 60.A O no hydrogen 3.261 N/A LYS 65.A N THR 61.A O no hydrogen 3.033 N/A LYS 65.A NZ GLU 245.A O no hydrogen 2.935 N/A MET 66.A N LEU 62.A O no hydrogen 2.905 N/A MET 67.A N ILE 63.A O no hydrogen 2.790 N/A TYR 68.A N GLN 64.A O no hydrogen 3.348 N/A TYR 68.A OH THR 75.A OG1 no hydrogen 2.839 N/A PHE 71.A N MET 67.A O no hydrogen 2.864 N/A ALA 72.A N MET 67.A O no hydrogen 3.227 N/A THR 75.A OG1 TYR 68.A OH no hydrogen 2.839 N/A ILE 76.A N ILE 255.A O no hydrogen 2.930 N/A PHE 78.A N TYR 253.A O no hydrogen 2.917 N/A LYS 80.A N GLU 289.A O no hydrogen 2.956 N/A LYS 80.A NZ PRO 290.A O no hydrogen 3.473 N/A ASN 81.A ND2 SER 206.A OG no hydrogen 2.864 N/A ASN 81.A ND2 TYR 253.A OH no hydrogen 2.960 N/A GLN 82.A N ASN 81.A OD1 no hydrogen 3.013 N/A GLN 82.A NE2 GLU 217.A OE2 no hydrogen 2.895 N/A ILE 83.A N ASP 223.A O no hydrogen 3.025 N/A VAL 84.A N ILE 203.A O no hydrogen 2.857 N/A LEU 85.A N VAL 216.A O no hydrogen 3.157 N/A ALA 86.A N PHE 201.A O no hydrogen 2.835 N/A TYR 87.A N ASN 214.A O no hydrogen 2.917 N/A ARG 88.A N SER 91.A OG no hydrogen 2.947 N/A ARG 88.A NH1 VAL 193.A O no hydrogen 2.991 N/A ARG 88.A NH1 LEU 198.A O no hydrogen 2.923 N/A SER 91.A N ARG 88.A O no hydrogen 3.044 N/A SER 91.A OG ARG 88.A O no hydrogen 3.376 N/A SER 91.A OG ASP 199.A O no hydrogen 2.622 N/A ARG 92.A N ASP 199.A OD1 no hydrogen 2.931 N/A ARG 92.A NE ASP 110.A O no hydrogen 3.181 N/A TYR 93.A OH ASP 110.A OD2 no hydrogen 2.599 N/A ALA 94.A N SER 91.A O no hydrogen 3.007 N/A GLU 96.A N TYR 93.A O no hydrogen 2.897 N/A ILE 97.A N TYR 93.A O no hydrogen 3.047 N/A ASN 98.A N ASN 101.A OD1 no hydrogen 2.779 N/A SER 99.A OG GLU 217.A O no hydrogen 2.740 N/A GLN 100.A N ASN 98.A OD1 no hydrogen 2.765 N/A ASN 101.A N ASN 98.A OD1 no hydrogen 2.972 N/A ASN 101.A ND2 GLU 96.A O no hydrogen 3.059 N/A TRP 102.A NE1 TYR 138.A OH no hydrogen 2.950 N/A ILE 105.A N ASN 101.A O no hydrogen 2.972 N/A LEU 106.A N TRP 102.A O no hydrogen 3.039 N/A LYS 107.A N TYR 103.A O no hydrogen 3.160 N/A LYS 107.A N GLU 104.A O no hydrogen 3.275 N/A LYS 107.A NZ GLU 104.A OE2 no hydrogen 3.029 N/A ARG 108.A N ILE 105.A O no hydrogen 3.011 N/A ARG 108.A NH1 GLU 96.A OE1 no hydrogen 2.954 N/A ARG 108.A NH2 GLU 96.A OE2 no hydrogen 2.915 N/A VAL 111.A N ARG 108.A O no hydrogen 3.079 N/A ARG 112.A N ASP 199.A OD2 no hydrogen 3.017 N/A ARG 112.A NE GLU 197.A O no hydrogen 2.847 N/A ARG 112.A NH1 LYS 177.A O no hydrogen 2.773 N/A ARG 112.A NH2 GLU 197.A O no hydrogen 3.082 N/A PHE 113.A N LYS 179.A O.A no hydrogen 2.974 N/A PHE 113.A N LYS 179.A O.B no hydrogen 3.044 N/A GLY 114.A N TYR 200.A O no hydrogen 3.014 N/A PHE 115.A N MET 181.A O no hydrogen 3.422 N/A SER 116.A OG ASP 121.A OD2 no hydrogen 2.737 N/A ASN 117.A N ARG 183.A O no hydrogen 2.812 N/A ASN 117.A ND2 SER 170.A OG no hydrogen 3.019 N/A ASN 119.A N ASN 117.A OD1 no hydrogen 2.859 N/A ASN 119.A ND2 PRO 168.A O no hydrogen 2.981 N/A ASN 119.A ND2 SER 170.A OG no hydrogen 3.038 N/A ASP 120.A N ASN 117.A O no hydrogen 2.928 N/A ASP 121.A N ASN 117.A O no hydrogen 2.991 N/A GLY 124.A N ASP 121.A O no hydrogen 2.867 N/A TYR 125.A N ASP 121.A O no hydrogen 3.388 N/A TYR 125.A OH ASP 59.A OD2 no hydrogen 2.651 N/A ARG 126.A N PRO 122.A O no hydrogen 2.799 N/A ARG 126.A NH1 ALA 58.A O no hydrogen 2.831 N/A ARG 126.A NH1 TYR 204.A OH no hydrogen 2.829 N/A ARG 126.A NH2 ALA 58.A O no hydrogen 2.882 N/A SER 127.A N CYS 123.A O no hydrogen 2.842 N/A SER 127.A OG CYS 123.A O no hydrogen 2.688 N/A LEU 128.A N GLY 124.A O no hydrogen 3.176 N/A MET 129.A N TYR 125.A O no hydrogen 2.863 N/A ALA 130.A N ARG 126.A O no hydrogen 2.872 N/A ILE 131.A N SER 127.A O no hydrogen 3.088 N/A GLN 132.A N LEU 128.A O no hydrogen 3.005 N/A GLN 132.A NE2 GLN 132.A O no hydrogen 3.034 N/A GLN 132.A NE2 GLU 135.A OE2 no hydrogen 2.954 N/A LEU 133.A N MET 129.A O no hydrogen 2.799 N/A ALA 134.A N ALA 130.A O no hydrogen 2.923 N/A GLU 135.A N GLN 132.A O no hydrogen 2.966 N/A LEU 136.A N LEU 133.A O no hydrogen 3.021 N/A TYR 137.A N LEU 133.A O no hydrogen 2.971 N/A TYR 138.A N ALA 134.A O no hydrogen 2.880 N/A ASN 139.A N LEU 136.A O no hydrogen 3.188 N/A ASP 140.A N GLU 135.A O no hydrogen 2.892 N/A THR 142.A N ASP 140.A OD1 no hydrogen 3.046 N/A THR 142.A OG1 ASP 140.A OD1 no hydrogen 2.776 N/A PHE 144.A N GLU 135.A OE1 no hydrogen 2.772 N/A GLU 146.A N THR 142.A O no hydrogen 2.817 N/A LEU 147.A N ILE 143.A O no hydrogen 2.999 N/A VAL 148.A N PHE 144.A O no hydrogen 2.856 N/A ALA 149.A N PHE 144.A O no hydrogen 2.992 N/A LYS 150.A N ASP 145.A O.A no hydrogen 2.892 N/A LYS 150.A N ASP 145.A O.B no hydrogen 2.817 N/A LYS 150.A NZ ASP 145.A OD1.A no hydrogen 2.685 N/A LYS 150.A NZ ASP 145.A OD2.A no hydrogen 3.119 N/A ASN 151.A N VAL 148.A O no hydrogen 2.930 N/A ASN 151.A ND2 LEU 147.A O no hydrogen 2.965 N/A SER 152.A OG VAL 148.A O no hydrogen 2.792 N/A ASN 153.A N GLU 174.A O no hydrogen 3.074 N/A ASN 153.A ND2 ARG 172.A O no hydrogen 2.899 N/A LEU 154.A N SER 152.A OG no hydrogen 2.951 N/A SER 157.A N.A VAL 164.A O no hydrogen 2.857 N/A SER 157.A N.B VAL 164.A O no hydrogen 2.849 N/A SER 157.A OG.A VAL 164.A O no hydrogen 3.210 N/A ASP 159.A N SER 162.A O no hydrogen 2.844 N/A GLY 161.A N GLU 158.A OE2 no hydrogen 2.968 N/A SER 162.A N ASP 159.A O no hydrogen 2.999 N/A TYR 163.A N LYS 235.A O no hydrogen 2.820 N/A VAL 164.A N SER 157.A O.A no hydrogen 2.952 N/A VAL 164.A N SER 157.A O.B no hydrogen 2.939 N/A LEU 165.A N LYS 237.A O no hydrogen 2.934 N/A MET 167.A N VAL 239.A O no hydrogen 2.849 N/A GLU 171.A N GLU 171.A OE1 no hydrogen 2.769 N/A ARG 172.A N SER 169.A O no hydrogen 2.883 N/A ILE 173.A N SER 170.A O no hydrogen 3.192 N/A GLU 174.A N ASN 153.A OD1 no hydrogen 2.880 N/A ASN 176.A N ASN 151.A O no hydrogen 2.823 N/A ASN 176.A ND2 ASN 151.A OD1 no hydrogen 3.082 N/A SER 178.A N ASN 176.A OD1 no hydrogen 3.020 N/A SER 178.A OG ASN 176.A OD1 no hydrogen 2.716 N/A LYS 179.A N.A ASN 176.A O no hydrogen 3.009 N/A LYS 179.A N.B ASN 176.A O no hydrogen 2.948 N/A LYS 179.A NZ.A LEU 106.A O no hydrogen 2.813 N/A LYS 179.A NZ.A ARG 108.A O no hydrogen 2.780 N/A LYS 179.A NZ.A VAL 111.A O no hydrogen 2.769 N/A LYS 179.A NZ.B LEU 106.A O no hydrogen 2.712 N/A LYS 179.A NZ.B VAL 111.A O no hydrogen 2.858 N/A ILE 180.A N ASN 176.A O no hydrogen 3.018 N/A MET 181.A N PHE 113.A O no hydrogen 3.240 N/A ARG 183.A NH1 ILE 182.A O no hydrogen 2.878 N/A SER 184.A OG.A ASP 120.A OD2 no hydrogen 2.751 N/A SER 184.A OG.B GLU 188.A OE1 no hydrogen 2.939 N/A MET 185.A N GLU 188.A OE1 no hydrogen 3.410 N/A GLU 186.A N ASP 121.A OD2 no hydrogen 2.820 N/A MET 187.A N GLU 186.A OE1 no hydrogen 2.966 N/A GLU 188.A N MET 185.A O no hydrogen 2.973 N/A LEU 189.A N GLU 186.A O no hydrogen 2.926 N/A ILE 190.A N MET 187.A O no hydrogen 3.261 N/A VAL 193.A N LEU 189.A O no hydrogen 3.010 N/A GLU 194.A N ILE 190.A O no hydrogen 2.926 N/A SER 195.A N HIS 191.A O no hydrogen 2.924 N/A SER 195.A OG HIS 191.A O no hydrogen 3.282 N/A SER 195.A OG LEU 192.A O no hydrogen 3.115 N/A SER 195.A OG GLU 197.A OE2 no hydrogen 2.811 N/A GLY 196.A N VAL 193.A O no hydrogen 3.045 N/A GLU 197.A N SER 195.A OG no hydrogen 3.404 N/A LEU 198.A N LEU 192.A O no hydrogen 3.171 N/A ASP 199.A N ARG 112.A O no hydrogen 2.927 N/A TYR 200.A N ARG 112.A O no hydrogen 3.218 N/A TYR 200.A OH ARG 92.A O no hydrogen 2.711 N/A PHE 201.A N ALA 86.A O no hydrogen 2.965 N/A PHE 202.A N GLY 114.A O no hydrogen 3.076 N/A ILE 203.A N VAL 84.A O no hydrogen 3.059 N/A LYS 205.A N GLN 82.A O no hydrogen 2.822 N/A LYS 205.A NZ GLU 217.A OE2 no hydrogen 3.340 N/A SER 206.A N ASN 81.A OD1 no hydrogen 3.385 N/A ALA 208.A N TYR 204.A O no hydrogen 3.052 N/A LYS 209.A N LYS 205.A O no hydrogen 2.992 N/A GLN 210.A N SER 206.A O no hydrogen 2.896 N/A GLN 210.A NE2 LEU 286.A O no hydrogen 2.883 N/A HIS 211.A N VAL 207.A O no hydrogen 3.034 N/A GLY 212.A N LYS 209.A O no hydrogen 3.219 N/A PHE 213.A N ALA 208.A O no hydrogen 2.947 N/A ASN 214.A ND2 ASN 89.A OD1 no hydrogen 2.821 N/A VAL 216.A N LEU 85.A O no hydrogen 2.814 N/A GLU 221.A N GLU 221.A OE1 no hydrogen 2.787 N/A ILE 222.A N PRO 219.A O no hydrogen 2.857 N/A SER 225.A N ASP 223.A OD1 no hydrogen 3.077 N/A SER 225.A OG ASP 223.A OD1 no hydrogen 2.626 N/A SER 226.A N TYR 233.A OH no hydrogen 3.086 N/A ASP 228.A N SER 226.A OG no hydrogen 3.021 N/A TYR 229.A N SER 226.A O no hydrogen 3.143 N/A ALA 230.A N PRO 227.A O no hydrogen 3.389 N/A TYR 233.A N TYR 229.A O no hydrogen 3.053 N/A TYR 233.A OH VAL 220.A O no hydrogen 2.649 N/A SER 234.A N ALA 230.A O no hydrogen 3.047 N/A SER 234.A OG GLU 231.A O no hydrogen 2.849 N/A LYS 235.A N LEU 232.A O no hydrogen 3.238 N/A LYS 235.A NZ GLU 231.A O no hydrogen 2.838 N/A LYS 235.A NZ SER 234.A OG no hydrogen 3.263 N/A VAL 236.A N TYR 233.A O no hydrogen 3.423 N/A LYS 237.A N TYR 163.A O no hydrogen 2.923 N/A VAL 238.A N VAL 246.A O no hydrogen 2.821 N/A VAL 239.A N LEU 165.A O no hydrogen 2.787 N/A LEU 240.A N LYS 244.A O no hydrogen 2.830 N/A ALA 241.A N ASN 119.A OD1 no hydrogen 2.856 N/A GLY 243.A N LEU 240.A O no hydrogen 2.844 N/A LYS 244.A N ASN 242.A OD1 no hydrogen 2.996 N/A LYS 244.A NZ LYS 65.A O no hydrogen 2.855 N/A VAL 246.A N VAL 238.A O no hydrogen 2.854 N/A GLY 248.A N VAL 236.A O no hydrogen 2.801 N/A ILE 251.A N LEU 224.A O no hydrogen 2.810 N/A TYR 253.A N ALA 79.A O no hydrogen 3.152 N/A TYR 253.A OH SER 10.A OG no hydrogen 2.663 N/A GLY 254.A N THR 57.A O.A no hydrogen 2.991 N/A GLY 254.A N THR 57.A O.B no hydrogen 2.884 N/A ILE 255.A N ILE 76.A O no hydrogen 2.912 N/A THR 256.A N ILE 55.A O no hydrogen 2.939 N/A THR 256.A OG1 TRP 74.A O no hydrogen 2.716 N/A THR 256.A OG1 ILE 257.A O no hydrogen 3.529 N/A LYS 259.A N PHE 71.A O no hydrogen 2.876 N/A ASN 260.A ND2 ARG 50.A O no hydrogen 3.661 N/A ALA 261.A N PRO 258.A O no hydrogen 3.108 N/A ASN 263.A N ASP 53.A OD1 no hydrogen 2.827 N/A ASN 263.A ND2 ASP 53.A OD1 no hydrogen 3.462 N/A ASN 263.A ND2 ASP 53.A OD2 no hydrogen 2.876 N/A GLU 265.A N GLU 265.A OE1 no hydrogen 2.904 N/A ALA 267.A N ASN 263.A O no hydrogen 2.915 N/A VAL 268.A N ARG 264.A O no hydrogen 2.883 N/A GLU 269.A N GLU 265.A O no hydrogen 3.288 N/A PHE 270.A N LEU 266.A O no hydrogen 2.865 N/A VAL 271.A N ALA 267.A O no hydrogen 2.904 N/A LYS 272.A N VAL 268.A O no hydrogen 2.953 N/A LYS 272.A NZ GLU 269.A OE2 no hydrogen 2.811 N/A LEU 273.A N GLU 269.A O no hydrogen 3.064 N/A VAL 274.A N PHE 270.A O no hydrogen 2.995 N/A ILE 275.A N VAL 271.A O no hydrogen 3.105 N/A SER 276.A N LYS 272.A O no hydrogen 2.970 N/A SER 276.A N LEU 273.A O no hydrogen 3.326 N/A SER 276.A OG LEU 273.A O no hydrogen 2.685 N/A GLY 279.A N SER 276.A OG no hydrogen 3.044 N/A GLN 280.A N SER 276.A O no hydrogen 2.854 N/A GLN 280.A NE2 ILE 275.A O no hydrogen 3.457 N/A GLU 281.A N GLU 277.A O no hydrogen 3.011 N/A ILE 282.A N GLU 278.A O no hydrogen 3.009 N/A LEU 283.A N GLY 279.A O no hydrogen 3.032 N/A ARG 284.A N.A GLN 280.A O no hydrogen 2.815 N/A ARG 284.A N.B GLN 280.A O no hydrogen 2.812 N/A ARG 284.A NE.A GLU 281.A OE2 no hydrogen 2.600 N/A ARG 284.A NE.B GLU 281.A OE1 no hydrogen 2.575 N/A ARG 284.A NE.B GLU 281.A OE2 no hydrogen 3.554 N/A ARG 284.A NH1.B GLU 289.A OE1 no hydrogen 3.012 N/A ARG 284.A NH2.B GLU 281.A OE1 no hydrogen 2.917 N/A GLU 285.A N GLU 281.A O no hydrogen 2.944 N/A LEU 286.A N ILE 282.A O no hydrogen 3.289 N/A LEU 286.A N LEU 283.A O no hydrogen 3.095 N/A GLY 287.A N ARG 284.A O.A no hydrogen 2.994 N/A GLY 287.A N ARG 284.A O.B no hydrogen 2.971 N/A GLN 288.A N LEU 283.A O no hydrogen 2.954 N/A