Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6uao_S.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A SG VAL 4.A O no hydrogen 3.950 N/A TYR 6.A OH VAL 194.A O no hydrogen 2.605 N/A GLY 7.A N SER 5.A OG no hydrogen 3.186 N/A GLN 10.A N TYR 6.A O no hydrogen 3.091 N/A GLN 10.A NE2 ASP 172.A O no hydrogen 3.101 N/A GLN 10.A NE2 ASN 175.A OD1 no hydrogen 2.816 N/A ILE 11.A N GLY 7.A O no hydrogen 3.276 N/A LYS 12.A N ALA 9.A O no hydrogen 2.859 N/A ALA 13.A N VAL 8.A O no hydrogen 3.260 N/A HIS 17.A N ALA 13.A O no hydrogen 3.042 N/A HIS 17.A NE2 VAL 75.A O no hydrogen 2.678 N/A SER 18.A N PRO 14.A O no hydrogen 2.803 N/A SER 18.A OG PRO 14.A O no hydrogen 3.136 N/A GLN 19.A N ALA 15.A O no hydrogen 3.090 N/A GLY 20.A N HIS 17.A O no hydrogen 2.893 N/A TYR 21.A N LEU 16.A O no hydrogen 2.906 N/A THR 22.A OG1 SER 78.A OG no hydrogen 2.701 N/A GLY 23.A N SER 227.A OG no hydrogen 3.126 N/A LYS 27.A N ASP 111.A OD2 no hydrogen 2.795 N/A VAL 28.A N SER 80.A O no hydrogen 2.852 N/A ALA 29.A N VAL 112.A O no hydrogen 2.849 N/A ILE 30.A N TYR 82.A O no hydrogen 2.858 N/A LEU 31.A N ASN 114.A O no hydrogen 3.015 N/A ASP 32.A N VAL 84.A O no hydrogen 2.953 N/A THR 33.A N ASP 32.A OD1 no hydrogen 2.793 N/A THR 33.A OG1 ASP 32.A OD1 no hydrogen 3.343 N/A THR 33.A OG1 ASP 60.A OD1 no hydrogen 2.702 N/A ILE 35.A N PRO 57.A O no hydrogen 2.992 N/A ASP 36.A N THR 66.A OG1 no hydrogen 2.951 N/A SER 37.A N PHE 58.A O no hydrogen 3.191 N/A SER 37.A OG.B ILE 35.A O no hydrogen 2.926 N/A SER 38.A N ASP 36.A OD1 no hydrogen 2.996 N/A SER 38.A OG ASP 36.A OD1 no hydrogen 2.428 N/A SER 38.A OG ASP 36.A OD2 no hydrogen 3.348 N/A HIS 39.A N ASP 36.A O no hydrogen 3.040 N/A LEU 42.A N HIS 39.A O no hydrogen 3.408 N/A ALA 45.A N LEU 81.A O no hydrogen 2.770 N/A ALA 48.A N ALA 83.A O no hydrogen 2.909 N/A SER 49.A OG GLU 54.A O no hydrogen 2.687 N/A PHE 50.A N LYS 85.A O no hydrogen 2.853 N/A VAL 51.A N SER 49.A OG no hydrogen 3.214 N/A GLU 54.A N VAL 51.A O no hydrogen 2.943 N/A ASN 56.A ND2 GLN 59.A OE1 no hydrogen 2.891 N/A PHE 58.A N ASN 56.A OD1 no hydrogen 3.053 N/A GLN 59.A N ASN 56.A O no hydrogen 3.463 N/A GLN 59.A NE2 ASN 61.A OD1 no hydrogen 2.944 N/A SER 62.A N ASP 60.A OD1 no hydrogen 2.942 N/A SER 62.A OG ALA 89.A O no hydrogen 3.061 N/A SER 63.A N ASP 60.A OD1 no hydrogen 2.906 N/A SER 63.A OG SER 62.A O no hydrogen 2.645 N/A GLY 65.A N THR 33.A OG1 no hydrogen 3.010 N/A THR 66.A N ASP 60.A OD2 no hydrogen 2.988 N/A THR 66.A OG1 ASP 60.A OD2 no hydrogen 2.699 N/A HIS 67.A N SER 63.A O no hydrogen 3.147 N/A HIS 67.A NE2 GLY 206.A O no hydrogen 2.936 N/A ILE 68.A N GLY 64.A O no hydrogen 2.904 N/A ALA 69.A N GLY 65.A O no hydrogen 2.975 N/A GLY 70.A N THR 66.A O no hydrogen 3.063 N/A THR 71.A N HIS 67.A O no hydrogen 3.022 N/A THR 71.A OG1 HIS 67.A O no hydrogen 3.375 N/A VAL 72.A N ILE 68.A O no hydrogen 2.987 N/A LEU 73.A N ALA 69.A O no hydrogen 3.110 N/A ALA 74.A N GLY 70.A O no hydrogen 2.740 N/A VAL 75.A N THR 71.A O no hydrogen 3.025 N/A ALA 76.A N VAL 72.A O no hydrogen 2.755 N/A SER 78.A N THR 22.A O no hydrogen 2.888 N/A SER 78.A OG THR 22.A OG1 no hydrogen 2.701 N/A ALA 79.A N ALA 76.A O no hydrogen 3.006 N/A SER 80.A N VAL 26.A O no hydrogen 2.846 N/A TYR 82.A N VAL 28.A O no hydrogen 2.871 N/A ALA 83.A N GLY 46.A O no hydrogen 2.994 N/A VAL 84.A N ILE 30.A O no hydrogen 3.032 N/A LYS 85.A N ALA 48.A O no hydrogen 2.870 N/A LYS 85.A NZ THR 33.A O no hydrogen 2.963 N/A LYS 85.A NZ ASN 56.A O no hydrogen 2.895 N/A LYS 85.A NZ GLN 59.A O no hydrogen 2.826 N/A VAL 86.A N ASP 32.A O no hydrogen 2.833 N/A LEU 87.A N ASP 32.A O no hydrogen 3.153 N/A GLY 88.A N LYS 92.A O no hydrogen 2.836 N/A ALA 89.A N GLU 54.A OE2 no hydrogen 2.793 N/A GLY 91.A N GLY 88.A O no hydrogen 2.763 N/A LYS 92.A N ASP 90.A OD1 no hydrogen 3.044 N/A TRP 97.A N GLN 94.A O no hydrogen 3.146 N/A ILE 98.A N GLN 94.A O no hydrogen 3.285 N/A ILE 99.A N ALA 95.A O no hydrogen 2.888 N/A ASN 100.A N SER 96.A O no hydrogen 2.840 N/A ASN 100.A ND2 GLU 103.A OE1.B no hydrogen 3.495 N/A GLY 101.A N TRP 97.A O no hydrogen 2.961 N/A ILE 102.A N ILE 98.A O no hydrogen 2.902 N/A GLU 103.A N ILE 99.A O no hydrogen 2.860 N/A TRP 104.A N ASN 100.A O no hydrogen 2.981 N/A ALA 105.A N GLY 101.A O no hydrogen 2.978 N/A ILE 106.A N ILE 102.A O no hydrogen 2.979 N/A ALA 107.A N GLU 103.A O no hydrogen 2.900 N/A ASN 108.A N TRP 104.A O no hydrogen 2.880 N/A ASN 108.A ND2 TRP 104.A O no hydrogen 2.991 N/A ASN 109.A N ILE 106.A O no hydrogen 3.144 N/A MET 110.A N ALA 105.A O no hydrogen 2.985 N/A ASP 111.A N LYS 27.A O no hydrogen 2.810 N/A VAL 112.A N LYS 27.A O no hydrogen 3.062 N/A ILE 113.A N VAL 139.A O no hydrogen 2.820 N/A ASN 114.A N ALA 29.A O no hydrogen 2.910 N/A ASN 114.A ND2 SER 116.A OG no hydrogen 2.964 N/A MET 115.A N VAL 141.A O no hydrogen 2.872 N/A SER 116.A OG SER 212.A O no hydrogen 2.823 N/A SER 119.A N TYR 158.A O no hydrogen 2.823 N/A SER 121.A N SER 119.A OG.A no hydrogen 3.224 N/A GLY 122.A N SER 119.A OG.A no hydrogen 3.322 N/A GLY 122.A N SER 119.A OG.B no hydrogen 2.851 N/A SER 123.A N TYR 162.A OH no hydrogen 3.269 N/A VAL 126.A N SER 123.A OG no hydrogen 2.993 N/A LYS 127.A N SER 123.A O no hydrogen 2.967 N/A LYS 127.A NZ ASP 131.A OD2 no hydrogen 2.822 N/A ALA 128.A N ALA 124.A O no hydrogen 3.097 N/A ALA 129.A N ALA 125.A O no hydrogen 3.135 N/A VAL 130.A N VAL 126.A O no hydrogen 2.898 N/A ASP 131.A N LYS 127.A O no hydrogen 2.939 N/A LYS 132.A N ALA 128.A O no hydrogen 2.977 N/A ALA 133.A N ALA 129.A O no hydrogen 2.920 N/A VAL 134.A N VAL 130.A O no hydrogen 2.954 N/A ALA 135.A N ASP 131.A O no hydrogen 2.884 N/A SER 136.A N LYS 132.A O no hydrogen 2.915 N/A SER 136.A N ALA 133.A O no hydrogen 3.198 N/A SER 136.A OG.A LYS 132.A O no hydrogen 3.533 N/A SER 136.A OG.A ALA 133.A O no hydrogen 2.636 N/A SER 136.A OG.B LYS 132.A O no hydrogen 2.737 N/A GLY 137.A N VAL 134.A O no hydrogen 2.995 N/A VAL 138.A N ALA 133.A O no hydrogen 3.024 N/A VAL 139.A N ASP 111.A O no hydrogen 2.949 N/A VAL 141.A N ILE 113.A O no hydrogen 2.907 N/A ALA 142.A N ILE 166.A O no hydrogen 2.892 N/A ALA 143.A N MET 115.A O no hydrogen 3.061 N/A ALA 144.A N VAL 168.A O no hydrogen 2.825 N/A GLY 145.A N THR 211.A OG1 no hydrogen 3.091 N/A SER 147.A N SER 182.A OG no hydrogen 3.028 N/A GLY 148.A N PHE 180.A O no hydrogen 2.964 N/A SER 153.A N SER 150.A O no hydrogen 2.942 N/A SER 154.A OG VAL 183.A O no hydrogen 3.406 N/A SER 154.A OG GLU 186.A OE1 no hydrogen 2.739 N/A THR 155.A N VAL 183.A O no hydrogen 2.743 N/A THR 155.A OG1 GLY 148.A O no hydrogen 2.648 N/A THR 155.A OG1 VAL 183.A O no hydrogen 3.533 N/A VAL 156.A N SER 154.A OG no hydrogen 3.284 N/A THR 157.A N ALA 144.A O no hydrogen 2.903 N/A THR 157.A OG1 ALA 144.A O no hydrogen 3.314 N/A TYR 158.A N SER 119.A O no hydrogen 2.926 N/A LYS 161.A N THR 157.A O no hydrogen 2.886 N/A TYR 162.A N PRO 159.A O no hydrogen 3.082 N/A SER 164.A OG ASP 131.A OD1 no hydrogen 2.681 N/A VAL 165.A N TYR 162.A O no hydrogen 3.044 N/A ILE 166.A N VAL 140.A O no hydrogen 2.965 N/A ALA 167.A N ASP 188.A OD2.A no hydrogen 2.851 N/A VAL 168.A N ALA 142.A O no hydrogen 2.989 N/A GLY 169.A N VAL 189.A O no hydrogen 2.938 N/A ALA 170.A N SER 181.A OG no hydrogen 2.909 N/A VAL 171.A N ALA 191.A O no hydrogen 2.988 N/A ASP 172.A N GLN 176.A O no hydrogen 2.960 N/A SER 174.A N ASP 172.A OD1 no hydrogen 2.850 N/A ASN 175.A N ASP 172.A O no hydrogen 3.023 N/A GLN 176.A N ASP 172.A OD1 no hydrogen 3.026 N/A GLN 176.A NE2 SER 174.A O no hydrogen 3.001 N/A ARG 177.A N TYR 254.A OH no hydrogen 2.919 N/A ARG 177.A NE SER 181.A O no hydrogen 2.994 N/A ARG 177.A NH2 SER 181.A O no hydrogen 2.840 N/A ALA 178.A N ALA 170.A O no hydrogen 2.905 N/A SER 181.A N ALA 178.A O no hydrogen 2.904 N/A SER 182.A N GLY 145.A O no hydrogen 2.842 N/A SER 182.A OG THR 155.A O no hydrogen 2.838 N/A SER 182.A OG THR 155.A OG1 no hydrogen 3.378 N/A VAL 183.A N THR 155.A OG1 no hydrogen 2.932 N/A GLY 184.A N PHE 252.A O no hydrogen 2.891 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.789 N/A LEU 187.A N GLY 184.A O no hydrogen 3.066 N/A ASP 188.A N ALA 167.A O no hydrogen 2.959 N/A VAL 189.A N ALA 167.A O no hydrogen 3.283 N/A MET 190.A N GLY 257.A O no hydrogen 2.771 N/A ALA 191.A N GLY 169.A O no hydrogen 2.940 N/A GLY 193.A N VAL 171.A O no hydrogen 2.894 N/A VAL 194.A N TYR 6.A OH no hydrogen 3.316 N/A SER 195.A N SER 209.A OG no hydrogen 2.859 N/A ILE 196.A N LEU 208.A O no hydrogen 2.949 N/A SER 198.A N GLY 206.A O no hydrogen 2.983 N/A SER 198.A OG HIS 67.A O no hydrogen 2.663 N/A THR 199.A N SER 198.A OG no hydrogen 2.794 N/A THR 199.A OG1 THR 66.A O no hydrogen 2.778 N/A LEU 200.A N LYS 204.A O no hydrogen 2.877 N/A GLY 202.A N ASP 36.A OD2 no hydrogen 2.910 N/A LYS 204.A N LEU 200.A O no hydrogen 3.250 N/A TYR 205.A OH ASP 41.A OD2 no hydrogen 2.637 N/A GLY 206.A N SER 198.A O no hydrogen 2.914 N/A LEU 208.A N ILE 196.A O no hydrogen 3.013 N/A GLY 210.A N GLY 193.A O no hydrogen 2.843 N/A THR 211.A N ASN 146.A OD1 no hydrogen 2.858 N/A THR 211.A OG1 ASN 146.A OD1 no hydrogen 2.805 N/A SER 212.A OG SER 116.A O no hydrogen 3.214 N/A MET 213.A N GLY 210.A O no hydrogen 2.996 N/A SER 215.A N THR 211.A O no hydrogen 2.987 N/A SER 215.A OG ASN 114.A OD1 no hydrogen 2.706 N/A HIS 217.A N ALA 214.A O no hydrogen 3.039 N/A HIS 217.A ND1 MET 213.A O no hydrogen 2.839 N/A ALA 219.A N SER 215.A O no hydrogen 2.921 N/A GLY 220.A N PRO 216.A O no hydrogen 2.832 N/A ALA 221.A N HIS 217.A O no hydrogen 2.883 N/A ALA 222.A N VAL 218.A O no hydrogen 2.869 N/A ALA 223.A N ALA 219.A O no hydrogen 3.122 N/A LEU 224.A N GLY 220.A O no hydrogen 2.909 N/A ILE 225.A N ALA 221.A O no hydrogen 2.906 N/A LEU 226.A N ALA 222.A O no hydrogen 2.898 N/A SER 227.A N ALA 223.A O no hydrogen 2.942 N/A SER 227.A OG LEU 224.A O no hydrogen 2.833 N/A LYS 228.A N LEU 224.A O no hydrogen 3.169 N/A LYS 228.A NZ GLN 19.A OE1 no hydrogen 2.772 N/A LYS 228.A NZ GLN 266.A OXT no hydrogen 2.686 N/A HIS 229.A N ILE 225.A O no hydrogen 2.823 N/A HIS 229.A NE2 ALA 265.A O no hydrogen 2.539 N/A TRP 232.A N HIS 229.A O no hydrogen 2.984 N/A THR 233.A N GLN 236.A OE1 no hydrogen 2.933 N/A THR 233.A OG1 GLN 236.A OE1 no hydrogen 3.351 N/A ASN 234.A ND2 VAL 134.A O no hydrogen 2.853 N/A ASN 234.A ND2 VAL 138.A O no hydrogen 2.900 N/A THR 235.A OG1 ASN 234.A OD1 no hydrogen 3.503 N/A GLN 236.A N THR 233.A OG1 no hydrogen 3.144 N/A VAL 237.A N THR 233.A O no hydrogen 2.955 N/A ARG 238.A N ASN 234.A O no hydrogen 2.909 N/A ARG 238.A NE ASP 188.A OD2.B no hydrogen 3.442 N/A ARG 238.A NE GLU 242.A OE2 no hydrogen 2.744 N/A ARG 238.A NH1 PRO 163.A O no hydrogen 2.757 N/A ARG 238.A NH2 PRO 163.A O no hydrogen 3.078 N/A ARG 238.A NH2 ASP 188.A OD1.A no hydrogen 3.475 N/A ARG 238.A NH2 ASP 188.A OD2.B no hydrogen 3.503 N/A SER 239.A N THR 235.A O no hydrogen 2.896 N/A SER 239.A OG THR 235.A O no hydrogen 3.085 N/A SER 240.A N GLN 236.A O no hydrogen 2.959 N/A SER 240.A OG.A VAL 237.A O no hydrogen 2.715 N/A SER 240.A OG.A ALA 264.A O no hydrogen 3.421 N/A SER 240.A OG.B ALA 264.A O no hydrogen 2.338 N/A LEU 241.A N VAL 237.A O no hydrogen 3.123 N/A GLU 242.A N ARG 238.A O no hydrogen 2.990 N/A ASN 243.A N SER 239.A O no hydrogen 2.763 N/A THR 244.A N SER 240.A O no hydrogen 3.152 N/A THR 244.A OG1 SER 240.A O no hydrogen 2.681 N/A THR 246.A N LEU 258.A O no hydrogen 2.837 N/A PHE 252.A N ASP 250.A OD1 no hydrogen 2.788 N/A TYR 253.A N ASP 250.A O no hydrogen 2.976 N/A TYR 254.A N ASP 250.A O no hydrogen 3.044 N/A GLY 255.A N SER 251.A O no hydrogen 2.825 N/A LYS 256.A N ASP 188.A O no hydrogen 2.828 N/A GLY 257.A N TYR 254.A O no hydrogen 2.954 N/A LEU 258.A N THR 246.A O no hydrogen 2.912 N/A ILE 259.A N MET 190.A O no hydrogen 3.077 N/A VAL 261.A N ILE 11.A O no hydrogen 2.937 N/A ALA 263.A N ASN 260.A OD1 no hydrogen 3.057 N/A ALA 264.A N ASN 260.A O no hydrogen 2.874 N/A ALA 265.A N VAL 261.A O no hydrogen 2.898 N/A GLN 266.A N ALA 263.A O no hydrogen 3.229 N/A GLN 266.A NE2 SER 240.A OG.B no hydrogen 2.985 N/A