Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4aoi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 6.A N ASP 3.A O no hydrogen 3.313 N/A LEU 11.A N ASN 8.A OD1 no hydrogen 2.792 N/A VAL 12.A N ASN 8.A O no hydrogen 3.003 N/A GLN 13.A N PRO 9.A O no hydrogen 2.935 N/A ALA 14.A N GLU 10.A O no hydrogen 3.212 N/A VAL 15.A N LEU 11.A O no hydrogen 2.915 N/A GLN 16.A N VAL 12.A O no hydrogen 2.874 N/A HIS 17.A N ALA 14.A O no hydrogen 3.244 N/A VAL 18.A N VAL 15.A O no hydrogen 2.978 N/A ILE 20.A N ILE 90.A O no hydrogen 2.716 N/A SER 24.A N GLY 21.A O no hydrogen 2.792 N/A LEU 25.A N PRO 22.A O no hydrogen 3.220 N/A ILE 26.A N THR 45.A O no hydrogen 2.886 N/A HIS 28.A N HIS 43.A O no hydrogen 2.893 N/A GLU 31.A N HIS 28.A O no hydrogen 3.049 N/A ILE 33.A N VAL 41.A O no hydrogen 2.775 N/A HIS 37.A N ASP 173.A OD1 no hydrogen 2.686 N/A PHE 38.A N ASP 173.A OD1 no hydrogen 3.369 N/A PHE 38.A N ASP 173.A OD2 no hydrogen 2.892 N/A VAL 41.A N GLY 34.A O no hydrogen 2.817 N/A TYR 42.A N VAL 54.A O no hydrogen 2.845 N/A HIS 43.A N GLU 31.A O no hydrogen 3.157 N/A HIS 43.A ND1 GLU 31.A OE1 no hydrogen 2.506 N/A GLY 44.A N CYS 52.A O no hydrogen 2.962 N/A THR 45.A N ILE 26.A O no hydrogen 2.733 N/A THR 45.A OG1 ILE 26.A O no hydrogen 3.570 N/A LEU 46.A N ILE 50.A O no hydrogen 2.738 N/A LEU 47.A N SER 24.A O no hydrogen 2.795 N/A ILE 50.A N LEU 46.A O no hydrogen 2.710 N/A CYS 52.A N GLY 44.A O no hydrogen 2.875 N/A ALA 53.A N LEU 102.A O no hydrogen 2.794 N/A VAL 54.A N TYR 42.A O no hydrogen 2.855 N/A LYS 55.A N VAL 100.A O no hydrogen 2.810 N/A LYS 55.A NZ SER 56.A O no hydrogen 3.146 N/A LYS 55.A NZ ASP 173.A OD2 no hydrogen 2.692 N/A SER 56.A N CYS 40.A O no hydrogen 2.888 N/A ASN 58.A N SER 56.A OG no hydrogen 3.064 N/A ARG 59.A N PHE 38.A O no hydrogen 2.919 N/A ILE 60.A N LEU 57.A O no hydrogen 2.869 N/A GLU 65.A N ASP 62.A O no hydrogen 3.025 N/A GLU 65.A N ASP 62.A OD2 no hydrogen 2.955 N/A VAL 66.A N ASP 62.A O no hydrogen 3.016 N/A SER 67.A N ILE 63.A O no hydrogen 2.965 N/A GLN 68.A N GLY 64.A O no hydrogen 3.116 N/A GLN 68.A NE2 GLU 72.A OE2 no hydrogen 2.914 N/A PHE 69.A N GLU 65.A O no hydrogen 2.954 N/A LEU 70.A N VAL 66.A O no hydrogen 2.946 N/A THR 71.A N SER 67.A O no hydrogen 2.923 N/A THR 71.A OG1 SER 67.A O no hydrogen 2.772 N/A GLU 72.A N GLN 68.A O no hydrogen 2.988 N/A GLY 73.A N LEU 70.A O no hydrogen 3.156 N/A ILE 74.A N LEU 70.A O no hydrogen 2.926 N/A MET 76.A N GLY 73.A O no hydrogen 3.076 N/A LYS 77.A N ILE 74.A O no hydrogen 2.946 N/A LYS 77.A NZ ASP 78.A OD1 no hydrogen 2.894 N/A ASP 78.A N ILE 75.A O no hydrogen 2.848 N/A PHE 79.A N MET 76.A O no hydrogen 3.251 N/A SER 80.A N TYR 139.A OH no hydrogen 2.892 N/A ASN 83.A N HIS 81.A ND1 no hydrogen 2.948 N/A ASN 83.A ND2 GLN 132.A OE1 no hydrogen 3.134 N/A ASN 83.A ND2 VAL 163.A O no hydrogen 3.102 N/A VAL 84.A N HIS 81.A O no hydrogen 3.055 N/A LEU 85.A N VAL 165.A O no hydrogen 2.939 N/A LEU 88.A N VAL 101.A O no hydrogen 2.908 N/A GLY 89.A N VAL 101.A O no hydrogen 3.202 N/A ILE 90.A N VAL 18.A O no hydrogen 2.885 N/A CYS 91.A N LEU 99.A O no hydrogen 2.827 N/A CYS 91.A SG ILE 20.A O no hydrogen 3.522 N/A ARG 93.A NE SER 97.A O no hydrogen 2.959 N/A ARG 93.A NH2 ASN 58.A OD1 no hydrogen 3.386 N/A ARG 93.A NH2 SER 97.A O no hydrogen 2.949 N/A SER 97.A N ASN 58.A OD1 no hydrogen 3.194 N/A SER 97.A OG LEU 57.A O no hydrogen 3.531 N/A SER 97.A OG ILE 60.A O no hydrogen 2.711 N/A LEU 99.A N CYS 91.A O no hydrogen 3.064 N/A VAL 100.A N LYS 55.A O no hydrogen 2.998 N/A VAL 101.A N GLY 89.A O no hydrogen 2.832 N/A LEU 102.A N ALA 53.A O no hydrogen 2.758 N/A HIS 107.A N LEU 157.A O no hydrogen 3.054 N/A HIS 107.A ND1 ASP 158.A O no hydrogen 2.753 N/A GLY 108.A N MET 105.A O no hydrogen 2.945 N/A LEU 110.A N CYS 155.A O no hydrogen 2.659 N/A ARG 111.A N ALA 152.A O no hydrogen 3.274 N/A ARG 111.A NE GLY 225.A O no hydrogen 3.182 N/A ARG 111.A NH2 GLY 225.A O no hydrogen 2.984 N/A ASN 112.A N ASP 109.A OD2 no hydrogen 3.011 N/A ASN 112.A ND2 ASP 109.A OD1 no hydrogen 2.797 N/A PHE 113.A N ASP 109.A O no hydrogen 3.053 N/A ILE 114.A N LEU 110.A O no hydrogen 3.077 N/A ARG 115.A N ARG 111.A O no hydrogen 3.040 N/A ARG 115.A NH1 GLY 225.A O no hydrogen 2.782 N/A ASN 116.A N ASN 112.A O no hydrogen 3.118 N/A THR 118.A N ASN 116.A OD1 no hydrogen 2.864 N/A THR 118.A OG1 ASN 116.A OD1 no hydrogen 2.610 N/A HIS 119.A N ASN 116.A O no hydrogen 3.112 N/A THR 122.A N ASP 125.A OD2 no hydrogen 2.899 N/A ASP 125.A N THR 122.A OG1 no hydrogen 3.054 N/A LEU 126.A N THR 122.A O no hydrogen 3.000 N/A ILE 127.A N VAL 123.A O no hydrogen 3.018 N/A GLY 128.A N LYS 124.A O no hydrogen 2.914 N/A PHE 129.A N ASP 125.A O no hydrogen 2.995 N/A GLY 130.A N LEU 126.A O no hydrogen 2.959 N/A LEU 131.A N ILE 127.A O no hydrogen 2.899 N/A GLN 132.A N GLY 128.A O no hydrogen 3.113 N/A GLN 132.A NE2 PHE 161.A O no hydrogen 3.349 N/A VAL 133.A N PHE 129.A O no hydrogen 3.126 N/A ALA 134.A N GLY 130.A O no hydrogen 3.032 N/A LYS 135.A N LEU 131.A O no hydrogen 3.060 N/A GLY 136.A N GLN 132.A O no hydrogen 3.061 N/A MET 137.A N VAL 133.A O no hydrogen 2.882 N/A LYS 138.A N ALA 134.A O no hydrogen 2.842 N/A TYR 139.A N LYS 135.A O no hydrogen 3.199 N/A LEU 140.A N GLY 136.A O no hydrogen 3.127 N/A ALA 141.A N MET 137.A O no hydrogen 2.834 N/A SER 142.A N LYS 138.A O no hydrogen 3.042 N/A SER 142.A OG TYR 139.A O no hydrogen 2.558 N/A LYS 143.A N TYR 139.A O no hydrogen 3.197 N/A LYS 143.A N LEU 140.A O no hydrogen 3.023 N/A LYS 144.A N ALA 141.A O no hydrogen 2.979 N/A PHE 145.A N LEU 140.A O no hydrogen 2.988 N/A HIS 147.A N ASP 210.A OD2 no hydrogen 2.825 N/A ARG 148.A N ASP 210.A OD1 no hydrogen 3.063 N/A ALA 152.A N GLU 220.A OE2 no hydrogen 2.968 N/A ARG 153.A NE TYR 180.A OH no hydrogen 3.108 N/A ARG 153.A NH2 ASP 149.A OD1 no hydrogen 3.246 N/A ARG 153.A NH2 TYR 180.A OH no hydrogen 3.450 N/A ASN 154.A N ALA 151.A O no hydrogen 2.877 N/A ASN 154.A ND2 ASP 149.A O no hydrogen 2.839 N/A ASN 154.A ND2 TYR 180.A OH no hydrogen 3.509 N/A CYS 155.A N ALA 152.A O no hydrogen 3.327 N/A CYS 155.A SG ALA 151.A O no hydrogen 3.736 N/A MET 156.A N LYS 164.A O no hydrogen 2.882 N/A LEU 157.A N GLY 108.A O no hydrogen 2.938 N/A ASP 158.A N THR 162.A O no hydrogen 3.080 N/A GLU 159.A N GLU 159.A OE1 no hydrogen 2.698 N/A LYS 160.A N ASP 158.A OD1 no hydrogen 2.905 N/A PHE 161.A N ASP 158.A O no hydrogen 2.889 N/A THR 162.A N ASP 158.A OD1 no hydrogen 2.897 N/A VAL 163.A N GLN 132.A OE1 no hydrogen 2.819 N/A LYS 164.A N MET 156.A O no hydrogen 2.719 N/A LYS 164.A NZ PRO 82.A O no hydrogen 2.697 N/A VAL 165.A N ASN 83.A O no hydrogen 2.920 N/A ALA 166.A N ASN 154.A O no hydrogen 2.905 N/A ALA 171.A N PHE 168.A O no hydrogen 3.077 N/A ARG 172.A N GLY 169.A O no hydrogen 3.076 N/A ASP 173.A N ASP 167.A OD1 no hydrogen 2.728 N/A MET 174.A N ASP 173.A OD1 no hydrogen 2.652 N/A TYR 175.A OH ALA 171.A O no hydrogen 2.686 N/A GLU 178.A N ASP 176.A OD1 no hydrogen 3.143 N/A TYR 179.A N ASP 176.A O no hydrogen 3.351 N/A TYR 180.A N LYS 177.A O no hydrogen 3.337 N/A TYR 180.A OH ASP 149.A OD1 no hydrogen 3.286 N/A TYR 180.A OH ASP 149.A OD2 no hydrogen 2.423 N/A SER 181.A N LEU 190.A O no hydrogen 2.850 N/A HIS 183.A N SER 181.A OG no hydrogen 3.048 N/A HIS 183.A ND1 THR 234.A OG1 no hydrogen 2.755 N/A ASN 184.A N VAL 182.A O no hydrogen 2.768 N/A ASN 184.A ND2 SER 181.A O no hydrogen 2.910 N/A ASN 184.A ND2 ALA 188.A O no hydrogen 2.851 N/A LYS 185.A NZ GLN 201.A O no hydrogen 2.742 N/A THR 186.A N ASN 184.A OD1 no hydrogen 2.893 N/A THR 186.A OG1 ASN 184.A OD1 no hydrogen 2.570 N/A GLY 187.A N ASN 184.A O no hydrogen 2.989 N/A ALA 188.A N THR 186.A OG1 no hydrogen 3.068 N/A LYS 189.A NZ TYR 180.A O no hydrogen 3.534 N/A LEU 190.A N SER 181.A O no hydrogen 3.012 N/A VAL 192.A N LEU 190.A O no hydrogen 2.889 N/A LYS 193.A NZ TYR 229.A O no hydrogen 2.812 N/A LYS 193.A NZ VAL 232.A O no hydrogen 2.749 N/A TRP 194.A N PRO 191.A O no hydrogen 2.863 N/A TRP 194.A NE1 GLU 220.A OE2 no hydrogen 2.905 N/A MET 195.A N VAL 192.A O no hydrogen 3.333 N/A GLU 198.A N GLU 198.A OE1 no hydrogen 2.773 N/A SER 199.A N ALA 196.A O no hydrogen 2.975 N/A SER 199.A OG LYS 204.A O no hydrogen 2.744 N/A LEU 200.A N ALA 196.A O no hydrogen 3.161 N/A GLN 201.A N LEU 197.A O no hydrogen 3.122 N/A THR 202.A N GLU 198.A O no hydrogen 2.765 N/A THR 202.A OG1 GLU 198.A O no hydrogen 2.611 N/A GLN 203.A N SER 199.A O no hydrogen 2.787 N/A LYS 204.A N THR 202.A OG1 no hydrogen 3.325 N/A THR 206.A N SER 209.A OG no hydrogen 2.650 N/A LYS 208.A NZ ARG 272.A O no hydrogen 2.697 N/A SER 209.A N THR 206.A OG1 no hydrogen 3.091 N/A SER 209.A OG THR 206.A O no hydrogen 2.662 N/A ASP 210.A N THR 206.A O no hydrogen 3.025 N/A VAL 211.A N THR 207.A O no hydrogen 2.966 N/A TRP 212.A N LYS 208.A O no hydrogen 3.223 N/A SER 213.A N SER 209.A O no hydrogen 3.130 N/A SER 213.A OG TRP 194.A O no hydrogen 2.815 N/A SER 213.A OG SER 209.A O no hydrogen 3.288 N/A PHE 214.A N ASP 210.A O no hydrogen 2.845 N/A GLY 215.A N VAL 211.A O no hydrogen 3.078 N/A VAL 216.A N TRP 212.A O no hydrogen 3.247 N/A LEU 217.A N SER 213.A O no hydrogen 2.881 N/A LEU 218.A N PHE 214.A O no hydrogen 2.831 N/A TRP 219.A N GLY 215.A O no hydrogen 3.087 N/A TRP 219.A NE1 LEU 248.A O no hydrogen 2.777 N/A GLU 220.A N VAL 216.A O no hydrogen 2.869 N/A LEU 221.A N LEU 217.A O no hydrogen 2.896 N/A MET 222.A N LEU 218.A O no hydrogen 3.045 N/A THR 223.A N TRP 219.A O no hydrogen 3.039 N/A THR 223.A OG1 TRP 219.A O no hydrogen 3.005 N/A THR 223.A OG1 GLU 220.A O no hydrogen 3.080 N/A ARG 224.A N LEU 221.A O no hydrogen 2.983 N/A ARG 224.A NE ILE 114.A O no hydrogen 2.841 N/A ARG 224.A NH2 ILE 114.A O no hydrogen 2.769 N/A GLY 225.A N GLU 220.A O no hydrogen 2.760 N/A ALA 226.A N THR 223.A OG1 no hydrogen 3.230 N/A ASP 231.A N ASP 231.A OD1 no hydrogen 2.549 N/A VAL 232.A N TYR 229.A O no hydrogen 3.084 N/A THR 234.A OG1 HIS 183.A ND1 no hydrogen 2.755 N/A THR 234.A OG1 ASN 233.A OD1 no hydrogen 3.551 N/A PHE 235.A N ASN 233.A OD1 no hydrogen 2.917 N/A ASP 236.A N ASN 233.A O no hydrogen 2.924 N/A TYR 240.A N ASP 236.A O no hydrogen 2.963 N/A LEU 241.A N ILE 237.A O no hydrogen 3.178 N/A LEU 242.A N THR 238.A O no hydrogen 2.903 N/A GLN 243.A N VAL 239.A O no hydrogen 2.927 N/A GLY 244.A N LEU 241.A O no hydrogen 2.905 N/A ARG 245.A N TYR 240.A O no hydrogen 3.279 N/A ARG 246.A NE TRP 265.A O no hydrogen 3.041 N/A ARG 246.A NH1 LEU 241.A O no hydrogen 3.039 N/A ARG 246.A NH1 ARG 245.A O no hydrogen 2.810 N/A ARG 246.A NH2 TRP 265.A O no hydrogen 2.988 N/A GLN 249.A NE2 CYS 253.A O no hydrogen 2.894 N/A GLN 249.A NE2 ASP 255.A OD1 no hydrogen 2.854 N/A CYS 253.A N PRO 250.A O no hydrogen 2.964 N/A CYS 253.A SG PRO 254.A O no hydrogen 3.413 N/A LEU 257.A N PRO 254.A O no hydrogen 2.874 N/A TYR 258.A N PRO 254.A O no hydrogen 3.105 N/A TYR 258.A OH LEU 247.A O no hydrogen 2.726 N/A GLU 259.A N ASP 255.A O no hydrogen 3.091 N/A VAL 260.A N PRO 256.A O no hydrogen 3.266 N/A MET 261.A N LEU 257.A O no hydrogen 3.062 N/A LEU 262.A N TYR 258.A O no hydrogen 2.929 N/A LYS 263.A N GLU 259.A O no hydrogen 2.997 N/A CYS 264.A N VAL 260.A O no hydrogen 3.091 N/A CYS 264.A SG VAL 260.A O no hydrogen 3.393 N/A TRP 265.A N LEU 262.A O no hydrogen 3.085 N/A HIS 266.A N LYS 263.A O no hydrogen 3.364 N/A GLU 270.A N GLU 270.A OE1 no hydrogen 2.666 N/A MET 271.A N LYS 268.A O no hydrogen 2.941 N/A ARG 272.A N ALA 269.A O no hydrogen 3.143 N/A ARG 272.A NE LYS 208.A O no hydrogen 3.228 N/A ARG 272.A NH1 GLU 198.A OE1 no hydrogen 3.428 N/A ARG 272.A NH1 HIS 266.A O no hydrogen 2.739 N/A ARG 272.A NH2 GLU 198.A OE2 no hydrogen 2.558 N/A ARG 272.A NH2 LYS 208.A O no hydrogen 2.881 N/A GLU 277.A N SER 274.A OG no hydrogen 3.072 N/A LEU 278.A N SER 274.A O no hydrogen 2.963 N/A VAL 279.A N PHE 275.A O no hydrogen 2.945 N/A SER 280.A N SER 276.A O no hydrogen 3.270 N/A SER 280.A OG SER 276.A O no hydrogen 3.430 N/A ARG 281.A N GLU 277.A O no hydrogen 2.925 N/A ARG 281.A NE GLU 277.A OE2 no hydrogen 2.810 N/A ARG 281.A NH2 GLU 277.A OE2 no hydrogen 3.321 N/A ILE 282.A N LEU 278.A O no hydrogen 2.878 N/A SER 283.A N VAL 279.A O no hydrogen 2.920 N/A ALA 284.A N SER 280.A O no hydrogen 3.276 N/A ILE 285.A N ARG 281.A O no hydrogen 3.180 N/A PHE 286.A N ILE 282.A O no hydrogen 2.778 N/A SER 287.A N SER 283.A O no hydrogen 3.001 N/A SER 287.A OG SER 283.A O no hydrogen 2.992 N/A THR 288.A N ILE 285.A O no hydrogen 3.259 N/A THR 288.A OG1 ILE 285.A O no hydrogen 2.625 N/A PHE 289.A N PHE 286.A O no hydrogen 2.924 N/A