Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ayt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N MET 220.A O no hydrogen 2.795 N/A ARG 4.A NE ASP 2.A OD1 no hydrogen 2.888 N/A ARG 4.A NH1 SER 53.A OG no hydrogen 3.147 N/A ARG 4.A NH1 ASP 91.A OD1 no hydrogen 2.962 N/A ARG 4.A NH1 ASP 91.A OD2 no hydrogen 3.463 N/A ARG 4.A NH2 ASP 2.A OD2 no hydrogen 2.885 N/A ARG 4.A NH2 ASP 91.A OD2 no hydrogen 2.747 N/A LEU 5.A N GLY 25.A O no hydrogen 2.932 N/A ALA 6.A N LEU 222.A O no hydrogen 3.041 N/A PHE 7.A N GLU 27.A O no hydrogen 3.129 N/A LEU 9.A N TYR 29.A O no hydrogen 2.834 N/A SER 10.A N ASP 31.A OD1 no hydrogen 2.994 N/A SER 10.A OG ASP 31.A OD1 no hydrogen 3.524 N/A SER 10.A OG ASP 31.A OD2 no hydrogen 2.714 N/A ARG 11.A N PRO 8.A O no hydrogen 2.930 N/A ARG 11.A NH1 GLU 14.A OE1 no hydrogen 2.922 N/A ARG 11.A NH1 GLU 14.A OE2 no hydrogen 3.070 N/A ALA 12.A N LEU 9.A O no hydrogen 3.084 N/A ALA 15.A N ARG 11.A O no hydrogen 3.120 N/A LEU 16.A N ALA 12.A O no hydrogen 2.956 N/A ARG 18.A NE ASP 227.A OD1 no hydrogen 2.535 N/A ARG 18.A NH2 ASP 227.A OD2 no hydrogen 3.154 N/A ARG 18.A NH2 GLU 229.A OE1 no hydrogen 3.419 N/A LEU 19.A N ALA 15.A O no hydrogen 3.057 N/A GLN 20.A N LEU 16.A O no hydrogen 3.201 N/A ALA 21.A N PRO 17.A O no hydrogen 3.128 N/A LEU 22.A N ARG 18.A O no hydrogen 3.158 N/A GLY 23.A N GLN 20.A O no hydrogen 3.386 N/A LEU 24.A N LEU 19.A O no hydrogen 2.905 N/A GLY 25.A N VAL 3.A O no hydrogen 2.864 N/A ALA 26.A N LYS 51.A O no hydrogen 2.839 N/A GLU 27.A N LEU 5.A O no hydrogen 2.858 N/A VAL 28.A N SER 53.A O no hydrogen 2.919 N/A TYR 29.A N PHE 7.A O no hydrogen 2.816 N/A LEU 30.A N HIS 55.A O no hydrogen 3.023 N/A ASP 31.A N TYR 29.A O no hydrogen 3.209 N/A LEU 34.A N ASP 31.A O no hydrogen 3.023 N/A LEU 35.A N PRO 32.A O no hydrogen 3.208 N/A GLU 37.A N LEU 34.A O no hydrogen 2.872 N/A LEU 40.A N GLU 37.A O no hydrogen 3.218 N/A GLN 42.A N ASP 38.A O no hydrogen 3.114 N/A SER 43.A N ALA 39.A O no hydrogen 2.833 N/A LEU 44.A N LEU 40.A O no hydrogen 2.999 N/A ARG 45.A N PHE 41.A O no hydrogen 2.941 N/A ARG 46.A N GLN 42.A O no hydrogen 3.068 N/A ARG 47.A N SER 43.A O no hydrogen 3.229 N/A ARG 47.A NH1 GLU 13.A OE2 no hydrogen 3.362 N/A ARG 47.A NH2 GLU 13.A OE1 no hydrogen 2.414 N/A ARG 47.A NH2 GLU 13.A OE2 no hydrogen 3.086 N/A PHE 48.A N LEU 44.A O no hydrogen 3.259 N/A SER 53.A N ALA 26.A O no hydrogen 2.936 N/A SER 53.A OG ALA 26.A O no hydrogen 3.499 N/A SER 53.A OG GLU 27.A OE2 no hydrogen 2.653 N/A VAL 54.A N ARG 92.A O no hydrogen 2.940 N/A HIS 55.A N VAL 28.A O no hydrogen 2.875 N/A HIS 55.A ND1 LEU 56.A O no hydrogen 2.808 N/A HIS 55.A NE2 GLU 136.A OE1 no hydrogen 3.124 N/A LEU 56.A N VAL 94.A O no hydrogen 2.722 N/A LEU 61.A N PHE 58.A O no hydrogen 3.149 N/A ASP 62.A N THR 74.A OG1 no hydrogen 2.859 N/A LEU 64.A N ASP 62.A OD1 no hydrogen 2.933 N/A SER 65.A N ASP 62.A O no hydrogen 3.079 N/A ASP 67.A N SER 65.A OG no hydrogen 3.104 N/A GLU 69.A N ASP 67.A OD1 no hydrogen 2.982 N/A VAL 70.A N ASP 67.A OD1 no hydrogen 3.465 N/A ARG 71.A N ASP 67.A O no hydrogen 3.079 N/A ARG 71.A NH1 SER 65.A O no hydrogen 2.747 N/A GLY 72.A N PRO 68.A O no hydrogen 3.017 N/A LEU 73.A N GLU 69.A O no hydrogen 2.947 N/A THR 74.A N VAL 70.A O no hydrogen 2.828 N/A THR 74.A OG1 VAL 70.A O no hydrogen 2.761 N/A LEU 75.A N ARG 71.A O no hydrogen 3.108 N/A ARG 76.A N GLY 72.A O no hydrogen 3.047 N/A ARG 77.A N LEU 73.A O no hydrogen 2.876 N/A LEU 78.A N THR 74.A O no hydrogen 2.974 N/A LEU 79.A N LEU 75.A O no hydrogen 2.983 N/A PHE 80.A N ARG 76.A O no hydrogen 2.913 N/A GLY 81.A N ARG 77.A O no hydrogen 2.846 N/A LEU 82.A N LEU 78.A O no hydrogen 2.922 N/A ASP 83.A N LEU 79.A O no hydrogen 3.081 N/A ARG 84.A N PHE 80.A O no hydrogen 2.972 N/A ARG 84.A NE LEU 35.A O no hydrogen 2.846 N/A ARG 84.A NH1 ASP 38.A OD1 no hydrogen 3.223 N/A ARG 84.A NH1 GLU 87.A OE1 no hydrogen 2.786 N/A ARG 84.A NH2 LEU 35.A O no hydrogen 2.767 N/A ARG 84.A NH2 ASP 38.A OD1 no hydrogen 2.743 N/A ALA 85.A N GLY 81.A O no hydrogen 2.879 N/A ALA 86.A N LEU 82.A O no hydrogen 2.910 N/A GLU 87.A N ASP 83.A O no hydrogen 3.077 N/A LEU 88.A N ARG 84.A O no hydrogen 2.929 N/A GLY 89.A N ALA 86.A O no hydrogen 3.004 N/A ALA 90.A N ALA 85.A O no hydrogen 2.850 N/A ASP 91.A N LEU 52.A O no hydrogen 2.872 N/A ARG 92.A NH1 GLU 184.A O no hydrogen 2.993 N/A ARG 92.A NH1 HIS 185.A ND1 no hydrogen 2.965 N/A ALA 93.A N ARG 132.A O no hydrogen 2.817 N/A VAL 94.A N VAL 54.A O no hydrogen 2.883 N/A PHE 95.A N LEU 134.A O no hydrogen 3.022 N/A SER 97.A OG GLU 140.A OE2 no hydrogen 2.540 N/A ILE 99.A N SER 97.A OG no hydrogen 3.146 N/A HIS 101.A ND1 HIS 139.A ND1 no hydrogen 3.082 N/A THR 104.A N GLU 107.A OE1 no hydrogen 2.992 N/A GLU 106.A N GLU 106.A OE2 no hydrogen 2.781 N/A GLU 107.A N THR 104.A OG1 no hydrogen 3.134 N/A ALA 108.A N THR 104.A O no hydrogen 2.936 N/A LEU 109.A N PRO 105.A O no hydrogen 2.872 N/A GLU 110.A N GLU 106.A O no hydrogen 3.129 N/A ARG 111.A N GLU 107.A O no hydrogen 3.225 N/A ARG 111.A N ALA 108.A O no hydrogen 3.065 N/A ARG 111.A NH1 ASP 62.A OD1 no hydrogen 3.372 N/A ARG 111.A NH1 ASP 62.A OD2 no hydrogen 2.949 N/A ARG 111.A NH2 ASP 62.A OD1 no hydrogen 2.791 N/A ALA 112.A N LEU 109.A O no hydrogen 3.077 N/A LEU 115.A N ARG 111.A O no hydrogen 2.842 N/A ALA 116.A N ALA 112.A O no hydrogen 2.844 N/A GLU 117.A N LEU 113.A O no hydrogen 3.008 N/A ALA 118.A N PRO 114.A O no hydrogen 2.932 N/A LEU 119.A N LEU 115.A O no hydrogen 2.877 N/A GLY 120.A N GLU 117.A O no hydrogen 3.081 N/A VAL 123.A N LEU 119.A O no hydrogen 2.855 N/A ARG 124.A N GLY 120.A O no hydrogen 2.890 N/A ARG 125.A N LEU 121.A O no hydrogen 2.980 N/A ALA 126.A N VAL 122.A O no hydrogen 3.023 N/A ARG 127.A N VAL 123.A O no hydrogen 2.960 N/A ARG 127.A NH1 GLU 156.A OE1 no hydrogen 3.543 N/A THR 128.A N ARG 124.A O no hydrogen 2.950 N/A THR 128.A OG1 ARG 124.A O no hydrogen 3.044 N/A LEU 129.A N ARG 125.A O no hydrogen 2.978 N/A GLY 130.A N ARG 127.A O no hydrogen 3.236 N/A VAL 131.A N ALA 126.A O no hydrogen 2.877 N/A ARG 132.A N ASP 91.A O no hydrogen 3.003 N/A ARG 132.A NE GLU 184.A OE1 no hydrogen 2.845 N/A ARG 132.A NH1 GLY 155.A O no hydrogen 2.507 N/A ARG 132.A NH2 GLY 155.A O no hydrogen 3.252 N/A ARG 132.A NH2 GLU 184.A OE2 no hydrogen 2.831 N/A LEU 134.A N ALA 93.A O no hydrogen 2.820 N/A LEU 135.A N GLY 158.A O no hydrogen 2.908 N/A GLU 136.A N PHE 95.A O no hydrogen 2.939 N/A ASN 137.A N CYS 160.A O no hydrogen 3.423 N/A ASN 137.A ND2 ASP 162.A O no hydrogen 3.004 N/A SER 138.A N GLU 140.A OE1 no hydrogen 2.740 N/A HIS 139.A ND1 HIS 101.A ND1 no hydrogen 3.082 N/A GLU 140.A N GLU 140.A OE1 no hydrogen 2.783 N/A GLU 144.A N GLU 144.A OE2 no hydrogen 2.782 N/A ALA 145.A N HIS 142.A O no hydrogen 3.060 N/A LEU 146.A N PRO 143.A O no hydrogen 2.955 N/A ARG 147.A N PRO 143.A O no hydrogen 2.990 N/A ARG 147.A NH2 ALA 180.A O no hydrogen 3.174 N/A LEU 150.A N LEU 146.A O no hydrogen 3.042 N/A GLU 151.A N ARG 147.A O no hydrogen 2.818 N/A ALA 152.A N PRO 148.A O no hydrogen 2.853 N/A HIS 153.A N VAL 149.A O no hydrogen 3.365 N/A HIS 153.A NE2 ALA 116.A O no hydrogen 2.783 N/A ALA 154.A N GLU 151.A O no hydrogen 2.998 N/A GLU 156.A N HIS 153.A O no hydrogen 2.952 N/A GLY 158.A N LEU 133.A O no hydrogen 2.967 N/A CYS 160.A N LEU 135.A O no hydrogen 2.913 N/A CYS 160.A SG HIS 185.A O no hydrogen 3.681 N/A PHE 161.A N HIS 185.A O no hydrogen 2.993 N/A ASP 162.A N ASN 137.A OD1 no hydrogen 2.778 N/A HIS 165.A N ASP 162.A OD1 no hydrogen 2.954 N/A HIS 165.A ND1 ASN 137.A O no hydrogen 2.953 N/A HIS 165.A NE2 ASP 196.A OD2 no hydrogen 3.020 N/A ALA 166.A N ASP 162.A O no hydrogen 3.233 N/A ARG 167.A N ALA 163.A O no hydrogen 2.898 N/A VAL 168.A N ALA 164.A O no hydrogen 2.893 N/A PHE 169.A N HIS 165.A O no hydrogen 2.846 N/A SER 170.A N ALA 166.A O no hydrogen 3.245 N/A SER 170.A OG ALA 166.A O no hydrogen 2.519 N/A ARG 171.A N PRO 141.A O no hydrogen 2.894 N/A THR 172.A N SER 170.A OG no hydrogen 2.891 N/A THR 172.A OG1 PRO 141.A O no hydrogen 2.896 N/A GLY 176.A N ASP 174.A OD1 no hydrogen 3.066 N/A TRP 178.A NE1 THR 172.A O no hydrogen 2.785 N/A LEU 179.A N PRO 175.A O no hydrogen 2.895 N/A ALA 180.A N GLY 176.A O no hydrogen 3.085 N/A LEU 181.A N TRP 178.A O no hydrogen 2.938 N/A ALA 182.A N LEU 179.A O no hydrogen 2.955 N/A GLU 184.A N PHE 159.A O no hydrogen 3.157 N/A HIS 185.A NE2 GLU 27.A OE2 no hydrogen 2.613 N/A LEU 186.A N THR 219.A O no hydrogen 2.854 N/A HIS 187.A N PHE 161.A O no hydrogen 2.888 N/A HIS 187.A NE2 GLU 27.A OE1 no hydrogen 2.703 N/A LEU 188.A N VAL 221.A O no hydrogen 2.720 N/A ASN 189.A ND2 GLU 223.A O no hydrogen 2.920 N/A ASP 190.A N TRP 199.A O no hydrogen 2.850 N/A THR 191.A N ASP 190.A OD1 no hydrogen 2.891 N/A THR 191.A OG1 ASP 192.A OD1 no hydrogen 3.348 N/A THR 191.A OG1 TYR 195.A O no hydrogen 2.534 N/A GLY 193.A N THR 191.A OG1 no hydrogen 2.796 N/A VAL 194.A N ASP 192.A OD1 no hydrogen 2.934 N/A TYR 195.A N ASP 192.A OD1 no hydrogen 2.939 N/A ARG 197.A NE ASP 192.A OD2 no hydrogen 2.996 N/A ARG 197.A NH2 ASP 192.A OD2 no hydrogen 3.405 N/A TRP 199.A N ASP 190.A O no hydrogen 2.996 N/A ASN 200.A N GLU 226.A OE2 no hydrogen 2.955 N/A ASN 200.A ND2 ASP 227.A O no hydrogen 2.799 N/A LEU 201.A N SER 231.A OG no hydrogen 2.810 N/A ARG 203.A N ASN 200.A O no hydrogen 3.406 N/A GLY 204.A N ASP 190.A OD2 no hydrogen 2.971 N/A VAL 205.A N THR 191.A O no hydrogen 2.903 N/A LEU 206.A N ASP 190.A OD1 no hydrogen 2.963 N/A ALA 210.A N GLY 207.A O no hydrogen 3.135 N/A TRP 211.A N HIS 208.A O no hydrogen 3.113 N/A TRP 211.A NE1 LEU 206.A O no hydrogen 2.904 N/A LEU 212.A N HIS 208.A O no hydrogen 2.768 N/A ARG 213.A NE GLY 209.A O no hydrogen 3.028 N/A TYR 215.A N LEU 212.A O no hydrogen 2.825 N/A LEU 216.A N ARG 213.A O no hydrogen 3.414 N/A ARG 218.A N TYR 215.A O no hydrogen 3.089 N/A ARG 218.A NE PRO 183.A O no hydrogen 3.070 N/A ARG 218.A NH2 PRO 183.A O no hydrogen 3.558 N/A THR 219.A OG1 ASP 2.A OD2 no hydrogen 2.819 N/A MET 220.A N ASP 2.A O no hydrogen 2.911 N/A VAL 221.A N LEU 186.A O no hydrogen 2.766 N/A LEU 222.A N ARG 4.A O no hydrogen 2.728 N/A GLU 223.A N LEU 188.A O no hydrogen 2.828 N/A ARG 225.A N HIS 198.A O no hydrogen 3.175 N/A ARG 225.A NE HIS 198.A ND1 no hydrogen 3.490 N/A GLU 229.A N ASP 227.A OD2 no hydrogen 3.407 N/A SER 231.A OG ASN 200.A OD1 no hydrogen 2.565 N/A LEU 232.A N PRO 228.A O no hydrogen 3.045 N/A ALA 233.A N GLU 229.A O no hydrogen 2.858 N/A PHE 234.A N ALA 230.A O no hydrogen 3.012 N/A LEU 235.A N SER 231.A O no hydrogen 2.950 N/A GLN 236.A N LEU 232.A O no hydrogen 2.923 N/A ALA 237.A N ALA 233.A O no hydrogen 2.792 N/A LEU 238.A N PHE 234.A O no hydrogen 3.103 N/A ALA 239.A N LEU 235.A O no hydrogen 2.886 N/A