Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3baa_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N THR 2.A OG1 no hydrogen 3.077 N/A ALA 6.A N THR 2.A O no hydrogen 2.878 N/A THR 7.A N LEU 3.A O no hydrogen 2.892 N/A THR 7.A OG1 LEU 3.A O no hydrogen 2.608 N/A THR 8.A OG1.A THR 4.A O no hydrogen 3.495 N/A THR 8.A OG1.B ALA 5.A O no hydrogen 3.050 N/A ARG 9.A N ALA 5.A O no hydrogen 3.046 N/A ARG 9.A NE GLU 43.A OE1 no hydrogen 2.859 N/A ARG 9.A NH1 GLU 43.A OE1 no hydrogen 3.455 N/A ARG 9.A NH1 GLU 43.A OE2 no hydrogen 3.057 N/A ARG 9.A NH2 GLU 12.A OE2 no hydrogen 2.914 N/A ALA 10.A N ALA 6.A O no hydrogen 2.809 N/A GLU 12.A N THR 8.A O.A no hydrogen 3.225 N/A GLU 12.A N THR 8.A O.B no hydrogen 3.167 N/A LEU 13.A N ARG 9.A O no hydrogen 2.956 N/A ARG 14.A N ALA 10.A O no hydrogen 2.924 N/A LYS 15.A N GLN 11.A O no hydrogen 2.980 N/A GLN 16.A N GLU 12.A O no hydrogen 2.997 N/A GLN 16.A NE2 TYR 20.A OH no hydrogen 2.933 N/A LEU 17.A N LEU 13.A O no hydrogen 2.712 N/A ASN 18.A N ARG 14.A O no hydrogen 2.787 N/A ASN 18.A ND2 ASP 58.A O no hydrogen 2.932 N/A GLN 19.A N LYS 15.A O no hydrogen 3.162 N/A GLN 19.A NE2 GLU 23.A OE2 no hydrogen 2.887 N/A TYR 20.A N GLN 16.A O no hydrogen 3.125 N/A SER 21.A N.A LEU 17.A O no hydrogen 2.898 N/A SER 21.A N.B LEU 17.A O no hydrogen 2.909 N/A SER 21.A OG.B LEU 17.A O no hydrogen 3.046 N/A HIS 22.A N ASN 18.A O no hydrogen 2.861 N/A GLU 23.A N GLN 19.A O no hydrogen 3.053 N/A TYR 24.A N TYR 20.A O no hydrogen 2.874 N/A TYR 25.A N SER 21.A O.A no hydrogen 2.718 N/A TYR 25.A N SER 21.A O.B no hydrogen 2.685 N/A VAL 26.A N HIS 22.A O no hydrogen 2.906 N/A LYS 27.A N HIS 22.A O no hydrogen 2.947 N/A GLN 29.A N GLU 23.A O no hydrogen 2.765 N/A SER 31.A OG GLU 23.A OE1 no hydrogen 2.639 N/A VAL 36.A N GLU 33.A O.A no hydrogen 2.986 N/A VAL 36.A N GLU 33.A O.B no hydrogen 2.986 N/A ASP 38.A N ASP 34.A O no hydrogen 2.870 N/A ARG 39.A N TYR 35.A O no hydrogen 3.134 N/A LEU 40.A N VAL 36.A O no hydrogen 3.334 N/A TYR 41.A N TYR 37.A O no hydrogen 2.753 N/A LYS 42.A N ASP 38.A O no hydrogen 2.878 N/A GLU 43.A N ARG 39.A O no hydrogen 3.012 N/A LEU 44.A N LEU 40.A O no hydrogen 3.021 N/A VAL 45.A N TYR 41.A O no hydrogen 2.933 N/A ASP 46.A N LYS 42.A O no hydrogen 2.993 N/A ILE 47.A N GLU 43.A O no hydrogen 3.157 N/A GLU 48.A N LEU 44.A O no hydrogen 2.877 N/A THR 49.A N VAL 45.A O no hydrogen 2.809 N/A THR 49.A OG1 VAL 45.A O no hydrogen 2.679 N/A GLU 50.A N ASP 46.A O no hydrogen 3.050 N/A PHE 51.A N ILE 47.A O no hydrogen 2.812 N/A LEU 54.A N PHE 51.A O no hydrogen 2.758 N/A ILE 55.A N PRO 52.A O no hydrogen 3.121 N/A THR 56.A OG1 ASP 58.A OD1 no hydrogen 2.729 N/A SER 59.A N THR 56.A O no hydrogen 3.057 N/A SER 59.A OG GLU 48.A OE1 no hydrogen 2.586 N/A SER 59.A OG THR 61.A OG1 no hydrogen 3.172 N/A THR 61.A N SER 59.A OG no hydrogen 3.415 N/A THR 61.A OG1 GLU 48.A OE2 no hydrogen 2.651 N/A THR 61.A OG1 SER 59.A OG no hydrogen 3.172 N/A THR 61.A OG1 GLN 62.A OE1 no hydrogen 2.858 N/A GLN 62.A N SER 59.A O no hydrogen 2.932 N/A ARG 63.A N PRO 60.A O no hydrogen 3.469 N/A ARG 63.A NH1 VAL 155.A O no hydrogen 2.742 N/A ARG 63.A NH2 ARG 150.A O no hydrogen 3.022 N/A ARG 63.A NH2 VAL 155.A O no hydrogen 2.838 N/A GLY 65.A N GLN 62.A O no hydrogen 3.075 N/A GLY 66.A N THR 209.A OG1 no hydrogen 2.748 N/A LEU 69.A N LEU 207.A O no hydrogen 2.969 N/A ALA 75.A N GLY 142.A O no hydrogen 2.830 N/A HIS 77.A N THR 140.A O no hydrogen 2.825 N/A HIS 77.A NE2 THR 135.A O no hydrogen 2.879 N/A MET 81.A N GLY 139.A O no hydrogen 2.873 N/A SER 83.A N LYS 301.A O no hydrogen 3.191 N/A GLY 87.A N ALA 308.A O no hydrogen 2.852 N/A PHE 88.A N ASP 92.A OD2 no hydrogen 2.774 N/A ASP 92.A N SER 89.A OG no hydrogen 3.305 N/A ILE 93.A N SER 89.A O no hydrogen 3.145 N/A PHE 94.A N LYS 90.A O no hydrogen 3.010 N/A ALA 95.A N GLU 91.A O no hydrogen 2.867 N/A PHE 96.A N ASP 92.A O no hydrogen 2.917 N/A ASP 97.A N ILE 93.A O no hydrogen 3.083 N/A GLU 98.A N PHE 94.A O no hydrogen 2.902 N/A ARG 99.A N ALA 95.A O no hydrogen 2.977 N/A VAL 100.A N PHE 96.A O no hydrogen 2.936 N/A ARG 101.A N ASP 97.A O no hydrogen 2.878 N/A ARG 101.A NE ASP 97.A OD2 no hydrogen 3.008 N/A LYS 102.A N GLU 98.A O no hydrogen 2.825 N/A ALA 103.A N ARG 99.A O no hydrogen 3.070 N/A ILE 104.A N VAL 100.A O no hydrogen 2.922 N/A GLY 105.A N ARG 101.A O no hydrogen 2.735 N/A TYR 110.A N CYS 256.A O no hydrogen 2.741 N/A TYR 110.A OH ASP 97.A OD1 no hydrogen 2.612 N/A CYS 111.A N LYS 286.A O no hydrogen 2.721 N/A CYS 111.A SG GLU 113.A OE1 no hydrogen 3.635 N/A CYS 112.A N GLN 254.A O no hydrogen 2.823 N/A GLU 113.A N VAL 284.A O no hydrogen 2.968 N/A LYS 115.A N GLY 282.A O no hydrogen 2.888 N/A LYS 115.A NZ ASP 281.A OD1 no hydrogen 3.201 N/A LYS 115.A NZ ASP 281.A OD2 no hydrogen 3.070 N/A ASP 117.A N GLU 279.A O no hydrogen 3.035 N/A LEU 119.A N CYS 171.A O no hydrogen 2.849 N/A ILE 121.A N GLY 169.A O no hydrogen 2.788 N/A SER 122.A N ALA 134.A O no hydrogen 2.853 N/A SER 122.A OG GLU 166.A OE1 no hydrogen 2.639 N/A LEU 123.A N VAL 167.A O no hydrogen 2.709 N/A ARG 124.A N ARG 132.A O no hydrogen 2.837 N/A ARG 124.A NE GLU 166.A OE2 no hydrogen 3.152 N/A TYR 125.A N VAL 165.A O no hydrogen 2.824 N/A TYR 125.A OH PRO 156.A O no hydrogen 2.618 N/A GLU 126.A N VAL 129.A O no hydrogen 2.928 N/A ASN 127.A N SER 164.A OG no hydrogen 2.836 N/A GLY 128.A N ILE 163.A O no hydrogen 2.852 N/A VAL 129.A N GLU 126.A O no hydrogen 3.059 N/A PHE 130.A N MET 157.A O no hydrogen 2.997 N/A VAL 131.A N ARG 124.A O no hydrogen 2.927 N/A ARG 132.A N ARG 124.A O no hydrogen 3.382 N/A ARG 132.A NH1 PRO 76.A O.A no hydrogen 2.938 N/A ARG 132.A NH1 PRO 76.A O.B no hydrogen 2.931 N/A ARG 132.A NH2 PRO 76.A O.A no hydrogen 2.986 N/A ARG 132.A NH2 PRO 76.A O.B no hydrogen 2.978 N/A GLY 133.A N THR 146.A OG1 no hydrogen 2.752 N/A ALA 134.A N SER 122.A O no hydrogen 2.937 N/A THR 135.A N GLU 143.A O no hydrogen 3.119 N/A ARG 136.A N ALA 120.A O no hydrogen 3.148 N/A ARG 136.A NE MET 81.A O no hydrogen 2.758 N/A ARG 136.A NE TYR 82.A O no hydrogen 3.429 N/A ARG 136.A NH2 MET 81.A O no hydrogen 2.910 N/A ASP 138.A N VAL 141.A O no hydrogen 3.164 N/A GLY 139.A N ARG 136.A O no hydrogen 3.033 N/A THR 140.A N ASP 138.A OD2 no hydrogen 2.902 N/A THR 140.A OG1 ASP 138.A OD2 no hydrogen 3.186 N/A VAL 141.A N ASP 138.A OD2 no hydrogen 2.867 N/A GLY 142.A N ALA 75.A O no hydrogen 2.813 N/A GLU 143.A N THR 135.A OG1 no hydrogen 2.888 N/A ASN 144.A N GLU 73.A O.A no hydrogen 2.823 N/A ASN 144.A N GLU 73.A O.B no hydrogen 2.804 N/A ASN 144.A ND2 THR 146.A OG1 no hydrogen 2.665 N/A ILE 145.A N GLY 133.A O no hydrogen 2.870 N/A THR 146.A OG1 GLY 133.A O no hydrogen 3.460 N/A ASN 148.A ND2 LEU 204.A O no hydrogen 3.143 N/A ASN 148.A ND2 GLN 206.A O.A no hydrogen 2.825 N/A ASN 148.A ND2 GLN 206.A O.B no hydrogen 2.815 N/A LEU 149.A N ILE 145.A O no hydrogen 3.035 N/A ARG 150.A N THR 146.A O no hydrogen 3.158 N/A ARG 150.A N GLU 147.A O no hydrogen 3.302 N/A THR 151.A N ASN 148.A O no hydrogen 2.970 N/A THR 151.A OG1 ASN 148.A O no hydrogen 2.714 N/A VAL 152.A N LEU 149.A O no hydrogen 3.117 N/A ARG 153.A NH2 THR 151.A O no hydrogen 2.886 N/A ARG 153.A NH2 ALA 213.A O no hydrogen 3.349 N/A SER 154.A OG ASN 218.A OD1 no hydrogen 2.794 N/A SER 154.A OG THR 219.A OG1 no hydrogen 2.865 N/A VAL 155.A N VAL 152.A O no hydrogen 2.901 N/A ARG 158.A NE ASP 58.A OD2 no hydrogen 2.831 N/A LEU 159.A N GLY 128.A O no hydrogen 2.726 N/A ILE 163.A N GLU 161.A O no hydrogen 2.679 N/A VAL 165.A N TYR 125.A O no hydrogen 3.071 N/A VAL 167.A N LEU 123.A O no hydrogen 2.872 N/A ARG 168.A N THR 223.A O no hydrogen 2.805 N/A ARG 168.A NE SER 122.A OG no hydrogen 3.102 N/A ARG 168.A NH1 ILE 79.A O no hydrogen 3.083 N/A ARG 168.A NH1 PRO 80.A O no hydrogen 3.155 N/A ARG 168.A NH2 ILE 79.A O no hydrogen 2.610 N/A GLY 169.A N ILE 121.A O no hydrogen 3.071 N/A GLU 170.A N PHE 220.A O no hydrogen 2.901 N/A CYS 171.A N LEU 119.A O no hydrogen 2.727 N/A CYS 171.A SG ASN 218.A O no hydrogen 3.692 N/A TYR 172.A N ASN 218.A O no hydrogen 2.917 N/A LYS 175.A N PRO 277.A O no hydrogen 2.879 N/A LYS 175.A NZ LEU 276.A O no hydrogen 2.831 N/A PHE 178.A N PRO 174.A O no hydrogen 2.970 N/A VAL 179.A N LYS 175.A O no hydrogen 2.914 N/A ALA 180.A N GLN 176.A O no hydrogen 2.991 N/A LEU 181.A N SER 177.A O no hydrogen 2.884 N/A ASN 182.A N PHE 178.A O no hydrogen 3.038 N/A ASN 182.A ND2 PHE 193.A O no hydrogen 3.100 N/A GLU 183.A N VAL 179.A O no hydrogen 3.134 N/A GLU 184.A N ALA 180.A O no hydrogen 2.985 N/A ARG 185.A N LEU 181.A O no hydrogen 2.896 N/A ARG 185.A NE ASP 191.A O no hydrogen 2.596 N/A ARG 185.A NH1 ASP 191.A O no hydrogen 2.905 N/A GLU 186.A N ASN 182.A O no hydrogen 2.848 N/A GLU 187.A N GLU 183.A O no hydrogen 2.854 N/A ASN 188.A N GLU 184.A O no hydrogen 3.066 N/A ASN 188.A N ARG 185.A O no hydrogen 3.108 N/A GLY 189.A N GLU 186.A O no hydrogen 3.370 N/A GLN 190.A N ARG 185.A O no hydrogen 2.771 N/A PHE 193.A N ASN 182.A OD1 no hydrogen 2.799 N/A ARG 197.A NE ASN 198.A OD1 no hydrogen 3.187 N/A ARG 197.A NH2 ASN 198.A OD1 no hydrogen 3.371 N/A ASN 198.A N ASN 195.A OD1 no hydrogen 2.778 N/A ALA 199.A N ASN 195.A O no hydrogen 3.046 N/A ALA 200.A N PRO 196.A O no hydrogen 2.878 N/A ALA 201.A N ARG 197.A O no hydrogen 2.929 N/A GLY 202.A N ASN 198.A O no hydrogen 2.779 N/A SER 203.A N ALA 199.A O no hydrogen 2.973 N/A SER 203.A OG ALA 199.A O no hydrogen 2.624 N/A LEU 204.A N ALA 200.A O no hydrogen 3.067 N/A ARG 205.A N GLY 202.A O no hydrogen 3.257 N/A GLN 206.A N.A SER 203.A O no hydrogen 3.210 N/A GLN 206.A N.B SER 203.A O no hydrogen 3.193 N/A GLN 206.A NE2.B GLY 202.A O no hydrogen 3.346 N/A ASP 208.A N GLN 206.A OE1.A no hydrogen 3.056 N/A THR 209.A N LYS 67.A O no hydrogen 3.007 N/A THR 209.A OG1 LYS 67.A O no hydrogen 2.794 N/A LYS 210.A N ASP 208.A OD1 no hydrogen 2.950 N/A LYS 210.A NZ GLY 65.A O no hydrogen 3.153 N/A ILE 211.A N ASP 208.A O no hydrogen 3.012 N/A VAL 212.A N ASP 208.A O no hydrogen 3.470 N/A ALA 213.A N THR 209.A O no hydrogen 2.937 N/A LYS 214.A N ILE 211.A O no hydrogen 3.037 N/A ARG 215.A N VAL 212.A O no hydrogen 2.843 N/A ARG 215.A NH1 SER 203.A OG no hydrogen 2.951 N/A ASN 218.A N TYR 172.A O no hydrogen 2.814 N/A THR 219.A N ASN 218.A OD1 no hydrogen 2.703 N/A THR 219.A OG1 SER 154.A OG no hydrogen 2.865 N/A PHE 220.A N GLU 170.A O no hydrogen 3.091 N/A LEU 221.A N ARG 248.A O no hydrogen 2.772 N/A TYR 222.A N ARG 168.A O no hydrogen 2.964 N/A TYR 222.A OH GLU 170.A OE2 no hydrogen 2.813 N/A THR 223.A N ARG 168.A O no hydrogen 3.047 N/A ALA 225.A N GLU 166.A O no hydrogen 2.706 N/A GLY 228.A N ASP 226.A OD2 no hydrogen 2.836 N/A MET 230.A N PHE 227.A O no hydrogen 3.171 N/A LYS 231.A N GLU 241.A OE1 no hydrogen 2.912 N/A ALA 232.A N GLU 241.A OE2 no hydrogen 2.746 N/A LYS 233.A N GLU 237.A OE1 no hydrogen 2.884 N/A GLN 235.A N ASN 288.A O no hydrogen 2.888 N/A PHE 236.A N ASN 288.A OD1 no hydrogen 2.932 N/A GLU 237.A N THR 234.A OG1 no hydrogen 3.158 N/A ALA 238.A N THR 234.A O no hydrogen 2.878 N/A LEU 239.A N GLN 235.A O no hydrogen 2.934 N/A GLU 240.A N PHE 236.A O no hydrogen 3.322 N/A GLU 241.A N GLU 237.A O no hydrogen 2.838 N/A LEU 242.A N ALA 238.A O no hydrogen 2.824 N/A SER 243.A N LEU 239.A O no hydrogen 3.183 N/A ALA 244.A N GLU 240.A O no hydrogen 2.893 N/A ILE 245.A N GLU 241.A O no hydrogen 2.986 N/A GLY 246.A N SER 243.A O no hydrogen 2.993 N/A PHE 247.A N LEU 242.A O no hydrogen 2.941 N/A ARG 248.A NE ASP 28.A OD2 no hydrogen 2.877 N/A ARG 248.A NH1 ASP 28.A OD2 no hydrogen 2.862 N/A ARG 248.A NH2 TYR 172.A OH no hydrogen 2.823 N/A ARG 248.A NH2 THR 219.A O no hydrogen 2.888 N/A ARG 253.A NH1 THR 249.A OG1 no hydrogen 2.955 N/A ARG 253.A NH1 ASN 250.A O no hydrogen 3.094 N/A GLN 254.A N CYS 112.A O no hydrogen 2.982 N/A CYS 256.A N TYR 110.A O no hydrogen 2.706 N/A CYS 256.A SG GLN 254.A O no hydrogen 3.927 N/A GLN 257.A N GLU 261.A OE2 no hydrogen 2.816 N/A GLU 261.A N SER 258.A OG no hydrogen 2.998 N/A VAL 262.A N SER 258.A O no hydrogen 3.099 N/A TRP 263.A N ILE 259.A O no hydrogen 2.950 N/A ALA 264.A N ASP 260.A O no hydrogen 2.949 N/A TYR 265.A N GLU 261.A O no hydrogen 2.956 N/A TYR 265.A OH GLU 252.A O no hydrogen 2.584 N/A ILE 266.A N VAL 262.A O no hydrogen 3.026 N/A GLU 267.A N TRP 263.A O no hydrogen 3.069 N/A GLU 268.A N ALA 264.A O no hydrogen 2.913 N/A TYR 269.A N TYR 265.A O no hydrogen 3.017 N/A TYR 269.A OH GLU 252.A OE2 no hydrogen 2.677 N/A HIS 270.A N GLU 267.A O no hydrogen 3.185 N/A GLU 271.A N GLU 267.A O no hydrogen 3.280 N/A LYS 272.A N GLU 268.A O no hydrogen 3.150 N/A LYS 272.A NZ GLU 268.A OE2 no hydrogen 2.711 N/A ARG 273.A NE ILE 280.A O no hydrogen 3.290 N/A ARG 273.A NH2 ILE 280.A O no hydrogen 3.055 N/A THR 275.A N LYS 272.A O no hydrogen 2.916 N/A THR 275.A OG1 LYS 272.A O no hydrogen 2.612 N/A LEU 276.A N ARG 273.A O no hydrogen 3.186 N/A ASP 281.A N LYS 115.A O no hydrogen 3.041 N/A ILE 283.A N TYR 309.A O no hydrogen 2.903 N/A VAL 284.A N GLU 113.A O no hydrogen 2.743 N/A ILE 285.A N ILE 307.A O no hydrogen 2.817 N/A LYS 286.A N CYS 111.A O no hydrogen 2.981 N/A LYS 286.A NZ GLU 113.A OE1 no hydrogen 3.383 N/A LYS 286.A NZ GLU 113.A OE2 no hydrogen 2.866 N/A VAL 287.A N TRP 305.A O no hydrogen 2.888 N/A ASN 288.A N ALA 109.A O no hydrogen 3.035 N/A PHE 290.A N LYS 233.A O no hydrogen 2.959 N/A LEU 292.A N GLU 289.A O no hydrogen 3.030 N/A GLN 293.A N GLU 289.A O no hydrogen 2.998 N/A ASP 294.A N PHE 290.A O no hydrogen 2.999 N/A GLU 295.A N ALA 291.A O no hydrogen 3.248 N/A LEU 296.A N LEU 292.A O no hydrogen 3.025 N/A GLY 297.A N GLN 293.A O no hydrogen 2.992 N/A THR 299.A N ALA 302.A O no hydrogen 2.731 N/A THR 299.A OG1 ALA 302.A O no hydrogen 3.082 N/A ALA 302.A N THR 299.A OG1 no hydrogen 3.002 N/A ARG 304.A N GLY 297.A O no hydrogen 2.884 N/A ARG 304.A NH1 LEU 296.A O no hydrogen 2.954 N/A ILE 307.A N ILE 285.A O no hydrogen 2.990 N/A ALA 308.A N ASN 85.A O no hydrogen 2.791 N/A TYR 309.A N ILE 283.A O no hydrogen 2.711 N/A LYS 310.A N GLY 87.A O no hydrogen 2.880 N/A PHE 311.A N ASP 281.A O no hydrogen 2.948 N/A