Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a1t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N THR 50.A O no hydrogen 2.960 N/A LYS 4.A N ASP 82.A OD2 no hydrogen 2.751 N/A VAL 5.A N ASN 52.A O no hydrogen 2.853 N/A ALA 6.A N LEU 83.A O no hydrogen 3.181 N/A LEU 7.A N ILE 54.A O no hydrogen 2.685 N/A ALA 8.A N ILE 85.A O no hydrogen 2.907 N/A CYS 10.A SG THR 59.A O no hydrogen 3.877 N/A CYS 10.A SG TYR 60.A O no hydrogen 3.931 N/A LYS 15.A NZ ASP 55.A OD1 no hydrogen 2.786 N/A LYS 15.A NZ ASP 55.A OD2 no hydrogen 3.530 N/A LYS 15.A NZ LEU 56.A O no hydrogen 2.759 N/A LEU 18.A N GLY 14.A O no hydrogen 3.152 N/A PHE 19.A N LYS 15.A O no hydrogen 2.777 N/A ASN 20.A N THR 16.A O no hydrogen 2.842 N/A ALA 21.A N SER 17.A O no hydrogen 2.968 N/A LEU 22.A N LEU 18.A O no hydrogen 2.955 N/A THR 23.A N PHE 19.A O no hydrogen 2.930 N/A THR 23.A OG1 PHE 19.A O no hydrogen 2.916 N/A THR 23.A OG1 GLN 27.A OE1 no hydrogen 3.123 N/A GLY 24.A N ASN 20.A O no hydrogen 2.707 N/A LYS 26.A N THR 23.A O no hydrogen 3.062 N/A GLN 27.A NE2 ASN 20.A OD1 no hydrogen 3.644 N/A TYR 28.A N GLU 41.A O no hydrogen 2.739 N/A ASN 31.A ND2 ALA 30.A O no hydrogen 3.055 N/A TRP 32.A N VAL 37.A O no hydrogen 3.341 N/A VAL 35.A N TRP 32.A O no hydrogen 3.474 N/A LYS 39.A N ALA 30.A O no hydrogen 2.580 N/A GLU 41.A N TYR 28.A O no hydrogen 3.236 N/A GLY 42.A N LEU 53.A O no hydrogen 2.815 N/A VAL 43.A N LYS 26.A O no hydrogen 2.812 N/A PHE 44.A N ILE 51.A O no hydrogen 3.148 N/A TYR 46.A N TYR 49.A O no hydrogen 2.949 N/A TYR 49.A N TYR 46.A O no hydrogen 2.750 N/A THR 50.A N HIS 1.A O no hydrogen 2.859 N/A ILE 51.A N PHE 44.A O no hydrogen 2.869 N/A ASN 52.A N VAL 3.A O no hydrogen 2.888 N/A LEU 53.A N GLY 42.A O no hydrogen 2.709 N/A ILE 54.A N VAL 5.A O no hydrogen 2.778 N/A ASP 55.A N LYS 40.A O no hydrogen 2.999 N/A LEU 56.A N LEU 7.A O no hydrogen 2.919 N/A THR 59.A N GLY 9.A O no hydrogen 2.918 N/A LEU 62.A N GLU 102.A OE1 no hydrogen 3.173 N/A TYR 64.A OH ASP 74.A OD1 no hydrogen 2.897 N/A TYR 64.A OH ASP 74.A OD2 no hydrogen 2.883 N/A SER 65.A N GLU 69.A OE1 no hydrogen 2.708 N/A SER 66.A N GLU 69.A OE1 no hydrogen 2.597 N/A GLU 69.A N SER 66.A OG no hydrogen 3.124 N/A LYS 70.A N SER 66.A O no hydrogen 3.007 N/A ILE 71.A N ILE 67.A O no hydrogen 2.975 N/A ALA 72.A N ASP 68.A O no hydrogen 3.037 N/A ARG 73.A N GLU 69.A O no hydrogen 2.816 N/A ARG 73.A NH1 LEU 62.A O no hydrogen 3.126 N/A ARG 73.A NH1 ASP 210.A OD1 no hydrogen 2.748 N/A ARG 73.A NH2 ASP 210.A OD1 no hydrogen 3.511 N/A ARG 73.A NH2 ASP 210.A OD2 no hydrogen 2.892 N/A ARG 73.A NH2 GLU 212.A OE1 no hydrogen 2.953 N/A ASP 74.A N LYS 70.A O no hydrogen 2.861 N/A TYR 75.A N ILE 71.A O no hydrogen 3.104 N/A TYR 75.A OH ASP 80.A OD1 no hydrogen 3.152 N/A LEU 76.A N ALA 72.A O no hydrogen 2.965 N/A LEU 77.A N ARG 73.A O no hydrogen 2.904 N/A LYS 78.A N ASP 74.A O no hydrogen 2.732 N/A LYS 78.A NZ GLU 212.A OE2 no hydrogen 3.174 N/A GLY 79.A N TYR 75.A O no hydrogen 2.786 N/A ASP 82.A N LYS 4.A O no hydrogen 2.687 N/A LEU 83.A N LYS 4.A O no hydrogen 3.333 N/A VAL 84.A N LYS 109.A O no hydrogen 2.857 N/A ILE 85.A N ALA 6.A O no hydrogen 2.817 N/A LEU 86.A N ILE 111.A O no hydrogen 2.841 N/A VAL 87.A N ALA 8.A O no hydrogen 2.785 N/A ALA 88.A N ALA 113.A O no hydrogen 2.838 N/A ASP 89.A N SER 96.A OG no hydrogen 3.331 N/A SER 90.A N THR 115.A O no hydrogen 3.136 N/A SER 90.A OG.A THR 115.A O no hydrogen 2.927 N/A SER 90.A OG.A ALA 116.A O no hydrogen 2.983 N/A SER 90.A OG.B THR 115.A O no hydrogen 2.676 N/A VAL 91.A N ASP 89.A OD2 no hydrogen 2.933 N/A ASN 92.A N ASP 89.A OD2 no hydrogen 3.483 N/A LEU 97.A N PRO 93.A O no hydrogen 2.903 N/A TYR 98.A N GLU 94.A O no hydrogen 3.126 N/A LEU 99.A N GLN 95.A O no hydrogen 3.038 N/A LEU 100.A N SER 96.A O no hydrogen 2.910 N/A LEU 101.A N LEU 97.A O no hydrogen 3.011 N/A GLU 102.A N TYR 98.A O no hydrogen 3.210 N/A ILE 103.A N LEU 99.A O no hydrogen 3.172 N/A LEU 104.A N LEU 100.A O no hydrogen 2.838 N/A GLU 105.A N LEU 101.A O no hydrogen 2.990 N/A MET 106.A N ILE 103.A O no hydrogen 3.019 N/A GLU 107.A N LEU 104.A O no hydrogen 3.016 N/A LYS 109.A NZ TYR 161.A O no hydrogen 3.157 N/A LYS 109.A NZ ALA 162.A O no hydrogen 3.487 N/A LYS 109.A NZ LYS 164.A O no hydrogen 3.533 N/A ILE 111.A N VAL 84.A O no hydrogen 2.793 N/A LEU 112.A N PRO 139.A O no hydrogen 2.945 N/A ALA 113.A N LEU 86.A O no hydrogen 2.887 N/A MET 114.A N VAL 141.A O no hydrogen 2.871 N/A THR 115.A N ALA 88.A O no hydrogen 2.820 N/A THR 115.A OG1 THR 143.A O no hydrogen 3.494 N/A THR 115.A OG1 THR 143.A OG1 no hydrogen 2.875 N/A ILE 117.A N THR 143.A O no hydrogen 3.074 N/A GLU 119.A N ALA 116.A O no hydrogen 2.946 N/A ALA 120.A N ALA 116.A O no hydrogen 3.319 N/A LYS 121.A N ILE 117.A O no hydrogen 2.975 N/A LYS 121.A NZ GLU 149.A OE1 no hydrogen 2.877 N/A LYS 121.A NZ GLU 149.A OE2 no hydrogen 3.564 N/A LYS 122.A N ASP 118.A O no hydrogen 3.046 N/A THR 123.A N GLU 119.A O no hydrogen 2.982 N/A GLY 124.A N LYS 121.A O no hydrogen 2.915 N/A MET 125.A N ALA 120.A O no hydrogen 2.934 N/A LYS 126.A N ALA 254.A O no hydrogen 3.013 N/A ASP 128.A N ALA 252.A O no hydrogen 2.736 N/A ARG 129.A NH2 VAL 140.A O no hydrogen 3.102 N/A GLU 131.A N ASP 128.A OD1 no hydrogen 3.051 N/A LEU 132.A N ASP 128.A O no hydrogen 3.198 N/A GLN 133.A N ARG 129.A O no hydrogen 3.113 N/A LYS 134.A N TYR 130.A O no hydrogen 3.057 N/A HIS 135.A N GLU 131.A O no hydrogen 3.104 N/A HIS 135.A ND1 GLU 131.A O no hydrogen 2.901 N/A LEU 136.A N LEU 132.A O no hydrogen 2.962 N/A GLY 137.A N GLN 133.A O no hydrogen 2.685 N/A VAL 140.A N GLN 133.A OE1 no hydrogen 3.016 N/A VAL 141.A N LEU 112.A O no hydrogen 2.822 N/A THR 143.A N MET 114.A O no hydrogen 2.903 N/A THR 143.A OG1 THR 115.A OG1 no hydrogen 2.875 N/A SER 144.A N GLU 149.A O no hydrogen 2.922 N/A SER 144.A OG ASP 118.A OD1 no hydrogen 2.765 N/A SER 144.A OG THR 147.A OG1 no hydrogen 3.221 N/A VAL 146.A N SER 144.A OG no hydrogen 3.103 N/A THR 147.A N SER 144.A OG no hydrogen 2.999 N/A GLY 148.A N SER 144.A O no hydrogen 2.840 N/A GLU 149.A N THR 147.A OG1 no hydrogen 3.216 N/A LEU 151.A N GLY 148.A O no hydrogen 3.342 N/A LEU 154.A N GLY 150.A O no hydrogen 2.802 N/A LYS 155.A N LEU 151.A O no hydrogen 3.163 N/A LYS 155.A NZ GLU 152.A OE2 no hydrogen 3.061 N/A GLU 156.A N GLU 152.A O no hydrogen 2.972 N/A LYS 157.A N GLU 153.A O no hydrogen 2.808 N/A ILE 158.A N LEU 154.A O no hydrogen 2.873 N/A VAL 159.A N LYS 155.A O no hydrogen 3.301 N/A GLU 160.A N GLU 156.A O no hydrogen 2.864 N/A TYR 161.A N LYS 157.A O no hydrogen 2.753 N/A ALA 162.A N ILE 158.A O no hydrogen 3.084 N/A GLN 163.A N VAL 159.A O no hydrogen 3.180 N/A GLN 163.A N GLU 160.A O no hydrogen 3.179 N/A LYS 164.A N TYR 161.A O no hydrogen 3.310 N/A LYS 164.A NZ GLU 160.A OE2 no hydrogen 3.036 N/A HIS 169.A ND1 GLY 137.A O no hydrogen 2.756 N/A TYR 175.A N GLU 180.A OE2 no hydrogen 2.845 N/A TYR 175.A OH GLU 105.A OE1 no hydrogen 2.478 N/A GLY 176.A N ASP 174.A OD1 no hydrogen 3.061 N/A LYS 178.A NZ GLU 182.A OE2 no hydrogen 3.236 N/A GLU 180.A N GLY 176.A O no hydrogen 2.961 N/A SER 181.A N GLU 177.A O no hydrogen 2.947 N/A SER 181.A OG.A GLU 177.A O no hydrogen 2.561 N/A SER 181.A OG.B GLU 177.A O no hydrogen 3.532 N/A SER 181.A OG.B LYS 178.A O no hydrogen 2.628 N/A GLU 182.A N LYS 178.A O no hydrogen 3.200 N/A ILE 183.A N VAL 179.A O no hydrogen 2.964 N/A LYS 184.A N GLU 180.A O no hydrogen 2.969 N/A LYS 185.A N SER 181.A O no hydrogen 2.945 N/A VAL 186.A N GLU 182.A O no hydrogen 3.033 N/A GLU 187.A N ILE 183.A O no hydrogen 2.864 N/A ASN 188.A N LYS 184.A O no hydrogen 2.913 N/A PHE 189.A N LYS 185.A O no hydrogen 3.103 N/A LEU 190.A N VAL 186.A O no hydrogen 2.999 N/A LYS 193.A N LEU 190.A O no hydrogen 2.896 N/A ARG 200.A NH1 GLU 180.A OE2 no hydrogen 2.841 N/A ARG 200.A NH2 GLU 180.A OE1 no hydrogen 3.051 N/A PHE 202.A N ASN 198.A O no hydrogen 2.801 N/A ALA 203.A N PRO 199.A O no hydrogen 2.869 N/A LEU 204.A N ARG 200.A O no hydrogen 3.045 N/A LYS 205.A N TYR 201.A O no hydrogen 3.111 N/A TYR 206.A N PHE 202.A O no hydrogen 2.990 N/A TYR 206.A OH PRO 223.A O no hydrogen 2.630 N/A LEU 207.A N ALA 203.A O no hydrogen 2.912 N/A SER 208.A N LEU 204.A O no hydrogen 3.124 N/A SER 208.A OG LEU 204.A O no hydrogen 2.689 N/A SER 208.A OG LYS 205.A O no hydrogen 3.503 N/A GLY 209.A N TYR 206.A O no hydrogen 3.139 N/A ASP 210.A N LYS 205.A O no hydrogen 2.844 N/A GLU 212.A N ASP 210.A OD2 no hydrogen 2.985 N/A PHE 213.A N ASP 210.A OD2 no hydrogen 3.022 N/A TYR 214.A N ASP 210.A O no hydrogen 2.817 N/A GLU 216.A N GLU 212.A O no hydrogen 2.998 N/A GLY 217.A N PHE 213.A O no hydrogen 2.736 N/A VAL 218.A N TYR 214.A O no hydrogen 3.062 N/A LYS 219.A N SER 215.A O no hydrogen 3.092 N/A LEU 220.A N GLU 216.A O no hydrogen 2.892 N/A GLY 221.A N VAL 218.A O no hydrogen 2.884 N/A LEU 222.A N GLY 217.A O no hydrogen 2.976 N/A LEU 225.A N TYR 214.A OH no hydrogen 2.719 N/A SER 226.A N GLU 229.A OE1 no hydrogen 2.950 N/A SER 226.A OG GLU 229.A OE1 no hydrogen 3.559 N/A GLU 228.A N GLU 228.A OE1 no hydrogen 2.809 N/A GLU 229.A N SER 226.A OG no hydrogen 2.901 N/A ARG 230.A N SER 226.A O no hydrogen 3.062 N/A ARG 230.A NE LEU 225.A O no hydrogen 3.009 N/A ARG 230.A NE SER 226.A O no hydrogen 3.273 N/A ARG 230.A NH2 LEU 225.A O no hydrogen 2.931 N/A ILE 231.A N GLU 227.A O no hydrogen 2.933 N/A GLY 232.A N GLU 228.A O no hydrogen 2.944 N/A TYR 233.A N GLU 229.A O no hydrogen 2.888 N/A ARG 234.A N ARG 230.A O no hydrogen 2.931 N/A ARG 234.A NE SER 208.A O no hydrogen 2.856 N/A ARG 234.A NH1 SER 208.A O no hydrogen 2.851 N/A LEU 235.A N ILE 231.A O no hydrogen 3.015 N/A LEU 236.A N GLY 232.A O no hydrogen 3.080 N/A ILE 237.A N TYR 233.A O no hydrogen 2.965 N/A ALA 238.A N ARG 234.A O no hydrogen 2.970 N/A LYS 239.A N LEU 235.A O no hydrogen 2.849 N/A ARG 240.A N LEU 236.A O no hydrogen 3.070 N/A ARG 240.A NE ASP 174.A O no hydrogen 2.794 N/A ARG 240.A NH1 ARG 240.A O no hydrogen 3.559 N/A ARG 240.A NH1 GLU 243.A OE2 no hydrogen 3.395 N/A LYS 241.A N ILE 237.A O no hydrogen 3.072 N/A LYS 241.A NZ GLU 105.A OE2 no hydrogen 2.799 N/A LYS 241.A NZ TYR 175.A OH no hydrogen 2.830 N/A ARG 242.A N ALA 238.A O no hydrogen 2.849 N/A GLU 243.A N LYS 239.A O no hydrogen 2.901 N/A TYR 244.A N ARG 240.A O no hydrogen 2.986 N/A TYR 244.A OH HIS 135.A O no hydrogen 2.535 N/A VAL 245.A N LYS 241.A O no hydrogen 2.966 N/A GLU 246.A N ARG 242.A O no hydrogen 2.925 N/A ASN 247.A N GLU 243.A O no hydrogen 3.015 N/A VAL 248.A N TYR 244.A O no hydrogen 2.888 N/A VAL 249.A N VAL 245.A O no hydrogen 2.917 N/A LYS 250.A N GLU 246.A O no hydrogen 3.006 N/A GLU 251.A N ASN 247.A O no hydrogen 3.024 N/A ALA 252.A N VAL 248.A O no hydrogen 2.899 N/A PHE 253.A N VAL 249.A O no hydrogen 2.901 N/A ALA 254.A N LYS 126.A O no hydrogen 2.687 N/A