Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3big_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 ASP 78.A OD2 no hydrogen 2.989 N/A ARG 2.A NH2 ASP 108.A OD1 no hydrogen 2.905 N/A GLU 4.A N MET 1.A O no hydrogen 3.231 N/A LEU 5.A N ARG 2.A O no hydrogen 2.933 N/A ALA 6.A N ARG 3.A O no hydrogen 3.166 N/A PHE 9.A N LEU 5.A O no hydrogen 2.889 N/A SER 10.A N ALA 6.A O no hydrogen 3.037 N/A SER 10.A OG ILE 7.A O no hydrogen 2.788 N/A ARG 11.A N ILE 7.A O no hydrogen 3.108 N/A VAL 12.A N GLU 8.A O no hydrogen 3.204 N/A THR 13.A N PHE 9.A O no hydrogen 3.302 N/A THR 13.A OG1 SER 10.A O no hydrogen 3.194 N/A THR 13.A OG1 SER 279.A OG no hydrogen 2.793 N/A THR 13.A OG1 THR 281.A OG1 no hydrogen 2.711 N/A GLU 14.A N SER 10.A O no hydrogen 2.948 N/A SER 15.A N ARG 11.A O no hydrogen 2.978 N/A SER 15.A OG ARG 11.A O no hydrogen 3.102 N/A ALA 16.A N VAL 12.A O no hydrogen 3.135 N/A ALA 17.A N THR 13.A O no hydrogen 2.886 N/A LEU 18.A N GLU 14.A O no hydrogen 2.967 N/A ALA 19.A N SER 15.A O no hydrogen 2.944 N/A GLY 20.A N ALA 16.A O no hydrogen 2.950 N/A TYR 21.A N ALA 17.A O no hydrogen 2.797 N/A LYS 22.A N LEU 18.A O no hydrogen 3.155 N/A LYS 22.A N ALA 19.A O no hydrogen 3.242 N/A TRP 23.A N GLY 20.A O no hydrogen 2.972 N/A LEU 24.A N TYR 21.A O no hydrogen 3.023 N/A GLY 25.A N THR 93.A O no hydrogen 2.904 N/A ARG 26.A N.A TRP 23.A O no hydrogen 3.195 N/A ARG 26.A N.B TRP 23.A O no hydrogen 3.169 N/A GLY 27.A N ALA 94.A O no hydrogen 2.976 N/A THR 31.A N ASP 28.A OD2 no hydrogen 3.030 N/A THR 31.A OG1 ASP 28.A OD1 no hydrogen 2.578 N/A ALA 32.A N ASP 28.A O no hydrogen 3.210 N/A ASP 33.A N LYS 29.A O no hydrogen 2.833 N/A GLY 34.A N ASN 30.A O no hydrogen 2.844 N/A ALA 35.A N THR 31.A O no hydrogen 2.936 N/A ALA 36.A N ALA 32.A O no hydrogen 3.179 N/A VAL 37.A N ASP 33.A O no hydrogen 2.838 N/A ASN 38.A N.A GLY 34.A O no hydrogen 2.990 N/A ASN 38.A N.B GLY 34.A O no hydrogen 3.003 N/A ALA 39.A N ALA 35.A O no hydrogen 2.969 N/A MET 40.A N ALA 36.A O no hydrogen 2.792 N/A ARG 41.A N VAL 37.A O no hydrogen 2.922 N/A ARG 41.A NE GLU 70.A OE1 no hydrogen 2.694 N/A ARG 41.A NH1 GLU 70.A OE1 no hydrogen 3.218 N/A ILE 42.A N ASN 38.A O.A no hydrogen 2.934 N/A ILE 42.A N ASN 38.A O.B no hydrogen 2.937 N/A MET 43.A N ALA 39.A O no hydrogen 3.081 N/A LEU 44.A N MET 40.A O no hydrogen 2.832 N/A ASN 45.A N ARG 41.A O no hydrogen 2.923 N/A GLN 46.A N MET 43.A O no hydrogen 3.042 N/A VAL 47.A N LEU 44.A O no hydrogen 2.979 N/A ASN 48.A ND2 THR 74.A OG1 no hydrogen 2.687 N/A ILE 49.A N VAL 47.A O no hydrogen 2.912 N/A ASP 50.A N ASP 78.A O no hydrogen 2.831 N/A GLY 51.A N VAL 72.A O no hydrogen 2.823 N/A THR 52.A N VAL 80.A O no hydrogen 2.967 N/A ILE 53.A N GLU 70.A O no hydrogen 2.924 N/A VAL 54.A N ILE 82.A O no hydrogen 2.723 N/A ILE 55.A N ILE 82.A O no hydrogen 3.288 N/A GLU 57.A N LEU 66.A O no hydrogen 2.885 N/A GLU 62.A N GLU 59.A O no hydrogen 2.944 N/A ALA 63.A N GLU 59.A O no hydrogen 2.846 N/A LEU 66.A N GLU 70.A OE2 no hydrogen 2.607 N/A ILE 68.A N GLY 58.A O no hydrogen 2.874 N/A GLY 69.A N ILE 53.A O no hydrogen 2.794 N/A GLU 70.A N TYR 67.A O no hydrogen 2.995 N/A LYS 71.A NZ ASP 50.A OD1 no hydrogen 2.785 N/A VAL 72.A N GLY 51.A O no hydrogen 2.858 N/A GLY 73.A N ASN 45.A OD1 no hydrogen 2.853 N/A THR 74.A N VAL 47.A O no hydrogen 2.844 N/A THR 74.A OG1 VAL 47.A O no hydrogen 3.441 N/A GLY 75.A N ILE 49.A O no hydrogen 2.886 N/A ARG 76.A N THR 74.A OG1 no hydrogen 3.191 N/A VAL 80.A N ASP 50.A O no hydrogen 3.113 N/A ASP 81.A N GLY 107.A O no hydrogen 2.904 N/A ILE 82.A N THR 52.A O no hydrogen 2.818 N/A ALA 83.A N ALA 105.A O no hydrogen 2.843 N/A VAL 84.A N ILE 55.A O no hydrogen 2.872 N/A ASP 85.A N VAL 103.A O no hydrogen 2.770 N/A GLU 88.A N LEU 101.A O no hydrogen 2.758 N/A THR 90.A OG1.A ASP 33.A OD1 no hydrogen 2.676 N/A THR 90.A OG1.A ILE 87.A O no hydrogen 3.523 N/A ARG 91.A NH1 GLN 97.A OE1 no hydrogen 2.902 N/A THR 93.A N GLY 89.A O no hydrogen 2.914 N/A THR 93.A OG1 GLY 89.A O no hydrogen 2.994 N/A ALA 94.A N THR 90.A O.A no hydrogen 2.906 N/A ALA 94.A N THR 90.A O.B no hydrogen 2.938 N/A MET 95.A N.A ARG 91.A O no hydrogen 2.934 N/A MET 95.A N.B ARG 91.A O no hydrogen 2.907 N/A GLY 96.A N THR 93.A O no hydrogen 3.298 N/A GLN 97.A N MET 92.A O no hydrogen 2.730 N/A ASN 99.A N LYS 285.A O no hydrogen 2.931 N/A ALA 100.A N THR 284.A OG1 no hydrogen 3.005 N/A LEU 101.A N GLU 88.A O no hydrogen 2.977 N/A ALA 102.A N THR 281.A O no hydrogen 2.937 N/A VAL 103.A N ASP 85.A O no hydrogen 2.815 N/A LEU 104.A N SER 279.A O no hydrogen 2.914 N/A ALA 105.A N ALA 83.A O no hydrogen 2.874 N/A VAL 106.A N ILE 277.A O no hydrogen 2.834 N/A GLY 107.A N ASP 81.A O no hydrogen 2.996 N/A GLY 110.A N ASP 81.A OD1 no hydrogen 2.967 N/A CYS 111.A N ASP 108.A O no hydrogen 2.888 N/A CYS 111.A SG SER 273.A O no hydrogen 3.771 N/A PHE 112.A N ASP 81.A OD2 no hydrogen 3.042 N/A LEU 113.A N MET 270.A O no hydrogen 2.920 N/A MET 118.A N PRO 116.A O no hydrogen 2.925 N/A MET 120.A N GLY 209.A O no hydrogen 2.772 N/A GLU 121.A N ARG 231.A O no hydrogen 2.791 N/A LYS 122.A N GLY 207.A O no hydrogen 2.838 N/A LYS 122.A NZ ASP 188.A OD1 no hydrogen 3.283 N/A LYS 122.A NZ ASP 188.A OD2 no hydrogen 2.716 N/A LYS 122.A NZ GLY 210.A O no hydrogen 2.692 N/A LEU 123.A N ASN 229.A O no hydrogen 2.933 N/A ILE 124.A N LEU 205.A O no hydrogen 2.890 N/A VAL 125.A N ASP 227.A O no hydrogen 2.971 N/A ALA 129.A N GLY 126.A O no hydrogen 3.032 N/A LYS 130.A N PRO 127.A O no hydrogen 3.228 N/A LYS 130.A NZ ASP 225.A OD1 no hydrogen 2.936 N/A LYS 130.A NZ GLY 226.A O no hydrogen 2.713 N/A GLY 131.A N ASP 227.A OD2 no hydrogen 3.116 N/A THR 132.A N ALA 129.A O no hydrogen 3.208 N/A THR 132.A OG1 ALA 129.A O no hydrogen 2.610 N/A ASP 134.A N ASN 142.A OD1 no hydrogen 2.857 N/A LEU 135.A N ASN 229.A OD1 no hydrogen 2.955 N/A ASN 136.A N ASP 134.A OD1 no hydrogen 2.980 N/A LEU 137.A N ASP 134.A O no hydrogen 2.766 N/A ASN 142.A N PRO 138.A O no hydrogen 3.019 N/A ASN 142.A ND2 ASP 134.A O no hydrogen 2.971 N/A ASN 142.A ND2 PRO 138.A O no hydrogen 3.400 N/A LEU 143.A N LEU 139.A O no hydrogen 2.864 N/A ARG 144.A N ALA 140.A O no hydrogen 3.012 N/A ASN 145.A N ASP 141.A O no hydrogen 2.942 N/A VAL 146.A N ASN 142.A O no hydrogen 2.933 N/A ALA 147.A N LEU 143.A O no hydrogen 2.922 N/A ALA 148.A N ARG 144.A O no hydrogen 2.996 N/A ALA 149.A N ASN 145.A O no hydrogen 3.022 N/A LEU 150.A N VAL 146.A O no hydrogen 2.840 N/A GLY 151.A N ALA 148.A O no hydrogen 3.057 N/A LYS 152.A N ALA 147.A O no hydrogen 3.001 N/A LYS 152.A NZ ASP 203.A OD1 no hydrogen 3.087 N/A LYS 152.A NZ ASP 203.A OD2 no hydrogen 2.925 N/A GLU 156.A N.A PRO 153.A O no hydrogen 3.019 N/A GLU 156.A N.B PRO 153.A O no hydrogen 3.023 N/A LEU 157.A N LEU 154.A O no hydrogen 3.029 N/A THR 158.A N ASP 203.A OD2 no hydrogen 2.852 N/A THR 158.A OG1 GLU 156.A O.A no hydrogen 3.311 N/A VAL 159.A N ARG 180.A O no hydrogen 2.794 N/A THR 160.A N VAL 204.A O no hydrogen 2.778 N/A THR 160.A OG1 PHE 182.A O no hydrogen 2.775 N/A ILE 161.A N PHE 182.A O no hydrogen 3.071 N/A ALA 163.A N ILE 184.A O no hydrogen 2.813 N/A ARG 166.A NE ILE 208.A O no hydrogen 2.782 N/A ARG 166.A NH1 ILE 208.A O no hydrogen 2.723 N/A HIS 167.A N LYS 164.A O no hydrogen 2.889 N/A HIS 167.A ND1 LEU 162.A O no hydrogen 2.717 N/A ASP 168.A N PRO 165.A O no hydrogen 3.048 N/A ILE 171.A N HIS 167.A O no hydrogen 2.954 N/A ALA 172.A N ASP 168.A O no hydrogen 3.144 N/A GLU 173.A N ALA 169.A O no hydrogen 2.900 N/A MET 174.A N VAL 170.A O no hydrogen 2.881 N/A GLN 175.A N ILE 171.A O no hydrogen 2.906 N/A GLN 176.A N ALA 172.A O no hydrogen 2.832 N/A LEU 177.A N GLU 173.A O no hydrogen 2.998 N/A LEU 177.A N MET 174.A O no hydrogen 3.103 N/A GLY 178.A N GLN 175.A O no hydrogen 2.877 N/A VAL 179.A N MET 174.A O no hydrogen 3.077 N/A ARG 180.A N LEU 157.A O no hydrogen 2.908 N/A ARG 180.A NH1 THR 158.A OG1 no hydrogen 2.762 N/A ARG 180.A NH1 GLU 201.A OE1 no hydrogen 2.981 N/A ARG 180.A NH2 GLU 201.A OE1 no hydrogen 2.885 N/A PHE 182.A N VAL 159.A O no hydrogen 2.804 N/A ILE 184.A N ILE 161.A O no hydrogen 2.873 N/A SER 192.A N ASP 188.A O no hydrogen 2.952 N/A SER 192.A OG VAL 189.A O no hydrogen 2.664 N/A SER 192.A OG SER 217.A OG no hydrogen 2.919 N/A ILE 193.A N VAL 189.A O no hydrogen 3.431 N/A ILE 193.A N ALA 190.A O no hydrogen 3.066 N/A LEU 194.A N ALA 191.A O no hydrogen 3.063 N/A THR 195.A N SER 192.A O no hydrogen 3.376 N/A THR 195.A OG1 SER 192.A O no hydrogen 2.869 N/A CYS 196.A N ILE 193.A O no hydrogen 2.859 N/A CYS 196.A SG THR 195.A OG1 no hydrogen 3.715 N/A MET 197.A N LEU 194.A O no hydrogen 2.912 N/A SER 200.A N MET 197.A O no hydrogen 2.920 N/A VAL 202.A N SER 200.A OG no hydrogen 3.026 N/A ASP 203.A N THR 158.A O no hydrogen 2.903 N/A VAL 204.A N THR 158.A O no hydrogen 3.085 N/A LEU 205.A N ILE 124.A O no hydrogen 2.896 N/A TYR 206.A N THR 160.A O no hydrogen 3.023 N/A TYR 206.A OH GLU 121.A OE2 no hydrogen 2.638 N/A GLY 207.A N LYS 122.A O no hydrogen 2.929 N/A ILE 208.A N HIS 167.A NE2 no hydrogen 2.824 N/A GLY 209.A N MET 120.A O no hydrogen 3.005 N/A ALA 211.A N MET 118.A O no hydrogen 2.814 N/A GLU 213.A N GLU 213.A OE1 no hydrogen 2.785 N/A GLY 214.A N GLY 210.A O no hydrogen 2.991 N/A VAL 215.A N ALA 211.A O no hydrogen 3.134 N/A VAL 216.A N PRO 212.A O no hydrogen 3.232 N/A SER 217.A N GLU 213.A O no hydrogen 2.909 N/A SER 217.A OG SER 192.A OG no hydrogen 2.919 N/A SER 217.A OG GLU 213.A O no hydrogen 3.465 N/A ALA 218.A N GLY 214.A O no hydrogen 2.765 N/A ALA 219.A N VAL 215.A O no hydrogen 3.006 N/A VAL 220.A N VAL 216.A O no hydrogen 3.132 N/A ILE 221.A N SER 217.A O no hydrogen 2.805 N/A ARG 222.A N ALA 218.A O no hydrogen 2.864 N/A ARG 222.A NE ASP 274.A OD1 no hydrogen 2.632 N/A ARG 222.A NH1 ALA 271.A O no hydrogen 2.805 N/A ARG 222.A NH2 ASP 274.A OD1 no hydrogen 3.176 N/A ALA 223.A N ALA 219.A O no hydrogen 3.024 N/A LEU 224.A N VAL 220.A O no hydrogen 2.868 N/A ASP 225.A N ARG 222.A O no hydrogen 3.057 N/A GLY 226.A N ILE 221.A O no hydrogen 2.969 N/A ASP 227.A N VAL 125.A O no hydrogen 3.014 N/A MET 228.A N ASP 227.A OD1 no hydrogen 2.817 N/A ASN 229.A N LEU 123.A O no hydrogen 2.928 N/A ASN 229.A ND2 MET 228.A O no hydrogen 2.843 N/A GLY 230.A N LEU 265.A O no hydrogen 2.881 N/A ARG 231.A N GLU 121.A O no hydrogen 2.853 N/A ARG 231.A NE GLU 121.A OE1 no hydrogen 2.863 N/A ARG 231.A NH2 GLY 262.A O no hydrogen 2.684 N/A LEU 233.A N TYR 119.A O no hydrogen 2.992 N/A ARG 235.A N GLU 250.A OE1 no hydrogen 2.990 N/A HIS 236.A ND1 ASN 243.A O no hydrogen 3.107 N/A ASP 237.A N ALA 234.A O no hydrogen 3.046 N/A VAL 238.A N ARG 235.A O no hydrogen 2.837 N/A LYS 239.A N ARG 235.A O no hydrogen 2.656 N/A ARG 244.A NH1 ASN 240.A O no hydrogen 3.004 N/A ARG 245.A N GLU 241.A O no hydrogen 3.202 N/A ILE 246.A N GLU 242.A O no hydrogen 3.343 N/A GLY 247.A N ASN 243.A O no hydrogen 3.020 N/A GLU 248.A N ARG 244.A O no hydrogen 2.861 N/A GLN 249.A N ARG 245.A O no hydrogen 3.390 N/A GLU 250.A N ILE 246.A O no hydrogen 3.000 N/A LEU 251.A N GLY 247.A O no hydrogen 3.264 N/A ALA 252.A N GLU 248.A O no hydrogen 3.101 N/A ARG 253.A N GLN 249.A O no hydrogen 2.989 N/A ARG 253.A NH1 GLN 249.A O no hydrogen 3.090 N/A CYS 254.A N GLU 250.A O no hydrogen 3.020 N/A CYS 254.A SG GLU 250.A O no hydrogen 3.462 N/A LYS 255.A N LEU 251.A O no hydrogen 2.989 N/A ALA 256.A N ALA 252.A O no hydrogen 2.939 N/A MET 257.A N CYS 254.A O no hydrogen 2.906 N/A GLY 258.A N LYS 255.A O no hydrogen 3.343 N/A ILE 259.A N CYS 254.A O no hydrogen 3.097 N/A GLY 262.A N LEU 232.A O no hydrogen 2.816 N/A LYS 263.A NZ VAL 264.A O no hydrogen 3.097 N/A LEU 265.A N GLY 230.A O no hydrogen 2.721 N/A ARG 266.A N ASP 269.A OD2 no hydrogen 2.833 N/A ARG 266.A NH1 ASP 134.A OD1 no hydrogen 2.788 N/A ARG 266.A NH2 ASP 134.A OD1 no hydrogen 3.546 N/A ARG 266.A NH2 ASN 136.A OD1 no hydrogen 3.151 N/A ASP 269.A N ARG 266.A O no hydrogen 2.943 N/A MET 270.A N LEU 267.A O no hydrogen 3.111 N/A ALA 271.A N LEU 267.A O no hydrogen 3.098 N/A ARG 272.A N CYS 111.A O no hydrogen 2.831 N/A ARG 272.A NH2 GLY 110.A O no hydrogen 2.878 N/A SER 273.A OG ASP 108.A OD2 no hydrogen 2.727 N/A ASN 275.A N SER 273.A OG no hydrogen 3.307 N/A VAL 276.A N ASP 274.A O no hydrogen 2.876 N/A ILE 277.A N VAL 106.A O no hydrogen 2.815 N/A PHE 278.A N ILE 306.A O no hydrogen 2.898 N/A SER 279.A N LEU 104.A O no hydrogen 2.826 N/A SER 279.A OG THR 13.A OG1 no hydrogen 2.793 N/A ALA 280.A N LEU 304.A O no hydrogen 2.923 N/A THR 281.A N ALA 102.A O no hydrogen 2.961 N/A THR 281.A OG1 THR 13.A OG1 no hydrogen 2.711 N/A THR 281.A OG1 THR 303.A OG1 no hydrogen 2.607 N/A GLY 282.A N GLU 302.A O no hydrogen 3.098 N/A ILE 283.A N ALA 100.A O no hydrogen 2.857 N/A THR 284.A N ALA 100.A O no hydrogen 3.208 N/A THR 284.A OG1 GLN 97.A O no hydrogen 2.678 N/A GLY 286.A N LEU 289.A O no hydrogen 2.943 N/A ASP 287.A N ASN 99.A OD1 no hydrogen 3.242 N/A GLU 290.A N GLU 302.A OE1 no hydrogen 2.826 N/A ILE 292.A N ILE 283.A O no hydrogen 2.959 N/A SER 293.A N THR 300.A O no hydrogen 3.391 N/A SER 293.A OG THR 300.A OG1 no hydrogen 2.665 N/A LYS 295.A N ILE 298.A O no hydrogen 2.953 N/A ILE 298.A N LYS 295.A O no hydrogen 3.193 N/A ALA 299.A N HIS 319.A O no hydrogen 2.936 N/A THR 300.A N SER 293.A O no hydrogen 2.900 N/A THR 300.A OG1 SER 293.A OG no hydrogen 2.665 N/A THR 301.A N SER 317.A O no hydrogen 3.039 N/A THR 301.A OG1 HIS 319.A NE2 no hydrogen 2.791 N/A THR 303.A N ILE 315.A O no hydrogen 2.927 N/A THR 303.A OG1 THR 281.A OG1 no hydrogen 2.607 N/A LEU 304.A N ALA 280.A O no hydrogen 2.778 N/A LEU 305.A N ARG 313.A O no hydrogen 2.889 N/A ILE 306.A N PHE 278.A O no hydrogen 2.925 N/A GLY 308.A N VAL 276.A O no hydrogen 2.779 N/A SER 310.A N ARG 307.A O no hydrogen 3.146 N/A SER 310.A OG ARG 307.A O no hydrogen 3.177 N/A SER 310.A OG THR 311.A O no hydrogen 3.331 N/A ARG 313.A N LEU 305.A O no hydrogen 3.064 N/A ARG 314.A NH1 LEU 288.A O no hydrogen 2.945 N/A ARG 314.A NH1 GLU 302.A OE2 no hydrogen 3.027 N/A ARG 314.A NH2 LEU 288.A O no hydrogen 2.882 N/A ILE 315.A N THR 303.A O no hydrogen 2.731 N/A GLN 316.A NE2 GLU 302.A OE2 no hydrogen 2.969 N/A SER 317.A N THR 301.A O no hydrogen 3.002 N/A SER 317.A OG GLU 14.A OE1 no hydrogen 2.850 N/A HIS 319.A N ALA 299.A O no hydrogen 2.688 N/A HIS 319.A NE2 THR 301.A OG1 no hydrogen 2.791 N/A LEU 321.A N ASN 297.A O no hydrogen 2.955 N/A