Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7jti_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N GLU 253.A OE2 no hydrogen 2.977 N/A GLN 3.A NE2 GLU 7.A OE2 no hydrogen 2.995 N/A ARG 4.A NE GLU 253.A OE1 no hydrogen 3.116 N/A ARG 4.A NH1 GLU 253.A OE1 no hydrogen 3.102 N/A LEU 5.A N VAL 1.A O no hydrogen 2.816 N/A GLN 6.A N ILE 2.A O no hydrogen 3.018 N/A GLU 7.A N GLN 3.A O no hydrogen 3.232 N/A ALA 8.A N ARG 4.A O no hydrogen 2.891 N/A LEU 9.A N LEU 5.A O no hydrogen 2.856 N/A ARG 10.A N GLN 6.A O no hydrogen 3.053 N/A ARG 10.A NE GLU 11.A OE2 no hydrogen 2.947 N/A ARG 10.A NH1 GLU 11.A OE2 no hydrogen 3.178 N/A GLU 11.A N GLU 7.A O no hydrogen 3.288 N/A TYR 13.A N LEU 9.A O no hydrogen 3.027 N/A TYR 13.A OH ASP 54.A OD2 no hydrogen 3.047 N/A THR 14.A N PRO 264.A O no hydrogen 2.766 N/A THR 14.A OG1 TYR 180.A O no hydrogen 3.295 N/A THR 14.A OG1 THR 267.A OG1 no hydrogen 2.761 N/A ARG 18.A N LEU 15.A O no hydrogen 2.992 N/A ARG 18.A NH1 TYR 13.A OH no hydrogen 3.437 N/A VAL 19.A N VAL 16.A O no hydrogen 3.018 N/A LEU 22.A N ARG 18.A O no hydrogen 3.132 N/A LEU 23.A N VAL 19.A O no hydrogen 2.948 N/A SER 24.A N PRO 20.A O no hydrogen 3.133 N/A SER 24.A OG PRO 20.A O no hydrogen 3.171 N/A HIS 25.A N ALA 21.A O no hydrogen 2.982 N/A LEU 26.A N LEU 22.A O no hydrogen 2.956 N/A ALA 28.A N HIS 25.A O no hydrogen 2.994 N/A SER 32.A OG ASP 30.A OD1 no hydrogen 3.021 N/A ASP 39.A N SER 36.A OG no hydrogen 3.159 N/A LEU 40.A N SER 36.A O no hydrogen 2.923 N/A VAL 41.A N GLU 37.A O no hydrogen 2.792 N/A THR 42.A N ASP 38.A O no hydrogen 2.987 N/A THR 42.A OG1 ASP 38.A O no hydrogen 3.127 N/A LYS 43.A N ASP 39.A O no hydrogen 2.807 N/A LEU 44.A N LEU 40.A O no hydrogen 2.959 N/A ASN 45.A N VAL 41.A O no hydrogen 2.742 N/A ALA 46.A N THR 42.A O no hydrogen 2.984 N/A GLY 47.A N LYS 43.A O no hydrogen 3.102 N/A LEU 48.A N LEU 44.A O no hydrogen 2.736 N/A GLN 49.A N ASN 45.A O no hydrogen 2.953 N/A GLN 49.A NE2 ASP 54.A O no hydrogen 2.848 N/A ALA 50.A N ALA 46.A O no hydrogen 3.056 N/A VAL 51.A N GLY 47.A O no hydrogen 3.091 N/A SER 52.A N LEU 48.A O no hydrogen 2.772 N/A SER 52.A OG LEU 48.A O no hydrogen 2.833 N/A GLU 53.A N GLN 49.A O no hydrogen 2.772 N/A ASP 54.A N SER 52.A OG no hydrogen 3.319 N/A ARG 56.A N ASP 54.A OD1 no hydrogen 3.185 N/A ARG 56.A NE ASP 54.A OD1 no hydrogen 2.745 N/A ARG 56.A NH1 LEU 266.A O no hydrogen 2.912 N/A ARG 56.A NH2 ASP 54.A OD1 no hydrogen 3.522 N/A ARG 56.A NH2 ASP 54.A OD2 no hydrogen 2.598 N/A LEU 57.A N ASP 54.A O no hydrogen 3.228 N/A GLN 58.A N THR 262.A O no hydrogen 3.072 N/A GLN 60.A N ALA 260.A O no hydrogen 2.837 N/A VAL 62.A N GLY 258.A O no hydrogen 3.482 N/A GLU 66.A N ARG 63.A O no hydrogen 2.896 N/A SER 69.A N GLU 66.A O no hydrogen 3.179 N/A GLU 84.A N ALA 81.A O no hydrogen 3.045 N/A VAL 85.A N VAL 82.A O no hydrogen 3.374 N/A VAL 91.A N ASP 88.A OD1 no hydrogen 3.004 N/A ARG 92.A N ASP 88.A O no hydrogen 2.948 N/A ARG 92.A NE PRO 86.A O no hydrogen 2.653 N/A ARG 92.A NH1 PRO 86.A O no hydrogen 3.489 N/A ARG 92.A NH1 GLU 87.A OE1 no hydrogen 2.652 N/A ARG 93.A N GLU 89.A O no hydrogen 2.980 N/A ALA 94.A N ALA 90.A O no hydrogen 2.987 N/A LEU 95.A N VAL 91.A O no hydrogen 2.874 N/A VAL 96.A N ARG 92.A O no hydrogen 3.015 N/A ASP 97.A N ARG 93.A O no hydrogen 2.886 N/A SER 98.A N ALA 94.A O no hydrogen 3.253 N/A SER 98.A N LEU 95.A O no hydrogen 3.133 N/A SER 98.A OG LEU 95.A O no hydrogen 3.049 N/A VAL 99.A N LEU 95.A O no hydrogen 2.969 N/A PHE 100.A N VAL 96.A O no hydrogen 3.081 N/A GLN 101.A N ARG 113.A O no hydrogen 2.777 N/A SER 103.A N TYR 111.A O no hydrogen 2.905 N/A LEU 105.A N VAL 109.A O no hydrogen 2.743 N/A ASN 108.A ND2 ASP 140.A O no hydrogen 2.890 N/A VAL 109.A N LEU 105.A O no hydrogen 3.184 N/A GLY 110.A N HIS 143.A O no hydrogen 2.791 N/A TYR 111.A N SER 103.A O no hydrogen 2.815 N/A TYR 111.A OH ASP 147.A OD2 no hydrogen 2.866 N/A LEU 112.A N ILE 145.A O no hydrogen 2.829 N/A ARG 113.A N GLN 101.A O no hydrogen 2.835 N/A ARG 113.A NE ASP 115.A OD1 no hydrogen 2.747 N/A ARG 113.A NE ASP 115.A OD2 no hydrogen 3.266 N/A ARG 113.A NH2 ASP 115.A OD2 no hydrogen 2.621 N/A PHE 117.A N GLY 153.A O no hydrogen 2.789 N/A ALA 120.A N SER 157.A OG no hydrogen 2.820 N/A SER 121.A N ASP 119.A OD2 no hydrogen 2.857 N/A SER 121.A OG ASP 119.A OD2 no hydrogen 3.055 N/A VAL 122.A N ASP 119.A O no hydrogen 2.983 N/A LEU 123.A N ASP 119.A O no hydrogen 3.066 N/A GLU 124.A N ALA 120.A O no hydrogen 2.945 N/A LEU 126.A N VAL 122.A O no hydrogen 3.109 N/A GLY 127.A N LEU 123.A O no hydrogen 2.805 N/A TYR 129.A N LEU 126.A O no hydrogen 2.971 N/A ILE 130.A N LEU 126.A O no hydrogen 3.054 N/A LEU 131.A N GLY 127.A O no hydrogen 3.243 N/A GLN 133.A N TYR 129.A O no hydrogen 3.143 N/A VAL 134.A N ILE 130.A O no hydrogen 2.831 N/A TRP 135.A N ILE 130.A O no hydrogen 3.428 N/A GLU 136.A N LEU 131.A O no hydrogen 2.942 N/A LEU 138.A N VAL 134.A O no hydrogen 3.305 N/A GLN 139.A N GLU 136.A O no hydrogen 3.004 N/A THR 141.A N LEU 138.A O no hydrogen 3.108 N/A THR 141.A OG1 LEU 138.A O no hydrogen 2.770 N/A THR 141.A OG1 HIS 143.A O no hydrogen 3.491 N/A THR 141.A OG1 TYR 201.A OH no hydrogen 2.901 N/A GLU 142.A N ASN 108.A O no hydrogen 3.372 N/A LEU 144.A N GLY 206.A O no hydrogen 2.758 N/A ILE 145.A N GLY 110.A O no hydrogen 2.778 N/A MET 146.A N TYR 208.A O no hydrogen 2.785 N/A ASP 147.A N LEU 112.A O no hydrogen 2.767 N/A LEU 148.A N LEU 210.A O no hydrogen 2.930 N/A ARG 149.A N ASP 147.A OD1 no hydrogen 3.034 N/A ARG 149.A NE ASP 147.A OD1 no hydrogen 2.830 N/A ARG 149.A NE ASP 147.A OD2 no hydrogen 3.135 N/A ARG 149.A NH1 ALA 289.A O no hydrogen 2.758 N/A ARG 149.A NH2 ASP 147.A OD2 no hydrogen 2.580 N/A ASN 151.A N LEU 148.A O no hydrogen 3.025 N/A ASN 151.A ND2 PHE 114.A O no hydrogen 2.853 N/A GLY 153.A N ASN 151.A OD1 no hydrogen 2.821 N/A GLY 154.A N THR 217.A OG1 no hydrogen 2.802 N/A SER 156.A OG GLU 221.A OE1 no hydrogen 3.181 N/A SER 156.A OG GLU 221.A OE2 no hydrogen 3.209 N/A SER 157.A OG ASP 119.A OD1 no hydrogen 2.575 N/A VAL 159.A N SER 156.A O no hydrogen 3.093 N/A LEU 162.A N ALA 158.A O no hydrogen 2.995 N/A LEU 163.A N VAL 159.A O no hydrogen 3.023 N/A SER 164.A N PRO 160.A O no hydrogen 3.240 N/A SER 164.A OG PRO 160.A O no hydrogen 2.776 N/A TYR 165.A N LEU 162.A O no hydrogen 3.190 N/A TYR 165.A OH LEU 197.A O no hydrogen 2.628 N/A PHE 166.A N LEU 163.A O no hydrogen 2.992 N/A GLN 167.A N SER 164.A O no hydrogen 3.355 N/A VAL 174.A N SER 192.A OG no hydrogen 2.901 N/A LEU 176.A N HIS 190.A O no hydrogen 2.841 N/A PHE 177.A N HIS 190.A O no hydrogen 3.446 N/A SER 178.A N ILE 269.A O no hydrogen 2.746 N/A THR 179.A N ARG 188.A O no hydrogen 2.930 N/A THR 179.A OG1 ARG 188.A O no hydrogen 3.183 N/A THR 179.A OG1 HIS 190.A NE2 no hydrogen 3.055 N/A TYR 180.A N THR 267.A O no hydrogen 2.881 N/A ARG 182.A N VAL 265.A O no hydrogen 2.808 N/A ARG 183.A N ASP 181.A OD1 no hydrogen 3.275 N/A ARG 183.A NE ASP 181.A OD1 no hydrogen 3.022 N/A ARG 183.A NH1 ASP 181.A OD2 no hydrogen 3.307 N/A ASN 185.A ND2 THR 184.A O no hydrogen 2.721 N/A ARG 188.A N THR 179.A O no hydrogen 2.962 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.807 N/A HIS 190.A N PHE 177.A O no hydrogen 2.819 N/A HIS 190.A NE2 THR 179.A OG1 no hydrogen 3.055 N/A SER 192.A N VAL 174.A O no hydrogen 2.963 N/A SER 192.A OG GLN 167.A OE1 no hydrogen 3.099 N/A SER 192.A OG VAL 174.A O no hydrogen 3.500 N/A GLN 193.A N SER 164.A OG no hydrogen 2.815 N/A ARG 199.A NE GLU 136.A OE1 no hydrogen 3.349 N/A TYR 201.A OH THR 141.A OG1 no hydrogen 2.901 N/A GLY 202.A N TYR 165.A O no hydrogen 3.175 N/A GLN 204.A NE2 THR 203.A OG1 no hydrogen 3.259 N/A TYR 208.A N LEU 144.A O no hydrogen 2.818 N/A LEU 209.A N THR 233.A O no hydrogen 2.917 N/A LEU 210.A N MET 146.A O no hydrogen 2.828 N/A THR 211.A N VAL 235.A O no hydrogen 2.858 N/A THR 211.A OG1 VAL 235.A O no hydrogen 3.504 N/A THR 211.A OG1 GLU 237.A O no hydrogen 3.039 N/A SER 212.A N THR 215.A OG1 no hydrogen 2.959 N/A SER 212.A OG ARG 149.A O no hydrogen 2.676 N/A HIS 213.A N GLU 237.A OE1 no hydrogen 2.743 N/A ARG 214.A N SER 212.A OG no hydrogen 2.934 N/A THR 215.A N SER 212.A O no hydrogen 3.168 N/A THR 215.A OG1 LEU 148.A O no hydrogen 2.947 N/A THR 215.A OG1 SER 212.A O no hydrogen 3.124 N/A ALA 216.A N ASN 151.A O no hydrogen 3.144 N/A THR 217.A N SER 242.A O no hydrogen 2.928 N/A THR 217.A OG1 PRO 152.A O no hydrogen 3.333 N/A THR 217.A OG1 GLY 154.A O no hydrogen 3.192 N/A ALA 219.A N ALA 216.A O no hydrogen 2.976 N/A GLU 220.A N ALA 216.A O no hydrogen 3.461 N/A GLU 221.A N THR 217.A O no hydrogen 3.084 N/A LEU 222.A N ALA 218.A O no hydrogen 2.887 N/A ALA 223.A N ALA 219.A O no hydrogen 2.984 N/A PHE 224.A N GLU 220.A O no hydrogen 2.818 N/A LEU 225.A N GLU 221.A O no hydrogen 2.872 N/A MET 226.A N LEU 222.A O no hydrogen 2.936 N/A GLN 227.A N ALA 223.A O no hydrogen 2.991 N/A GLN 227.A NE2 VAL 282.A O no hydrogen 2.930 N/A GLN 227.A NE2 ASP 284.A OD1 no hydrogen 3.397 N/A GLN 227.A NE2 ASP 284.A OD2 no hydrogen 3.166 N/A SER 228.A N PHE 224.A O no hydrogen 2.749 N/A SER 228.A OG PHE 224.A O no hydrogen 3.347 N/A SER 228.A OG LEU 225.A O no hydrogen 3.211 N/A SER 228.A OG ASN 271.A OD1 no hydrogen 3.372 N/A LEU 229.A N LEU 225.A O no hydrogen 3.062 N/A GLY 230.A N GLN 227.A O no hydrogen 2.953 N/A TRP 231.A N MET 226.A O no hydrogen 2.882 N/A ALA 232.A N MET 226.A O no hydrogen 3.100 N/A THR 233.A N VAL 207.A O no hydrogen 3.099 N/A LEU 234.A N ASP 284.A OD2 no hydrogen 2.739 N/A VAL 235.A N LEU 209.A O no hydrogen 2.807 N/A GLY 236.A N ALA 285.A O no hydrogen 2.963 N/A GLU 237.A N THR 211.A O no hydrogen 3.064 N/A THR 239.A N VAL 281.A O no hydrogen 3.218 N/A THR 239.A OG1 GLU 220.A OE1 no hydrogen 2.766 N/A ALA 240.A N THR 215.A O no hydrogen 3.097 N/A GLY 241.A N GLU 220.A OE1 no hydrogen 2.933 N/A SER 242.A N GLU 220.A OE2 no hydrogen 2.914 N/A HIS 247.A N VAL 263.A O no hydrogen 2.967 N/A VAL 249.A N LEU 261.A O no hydrogen 2.769 N/A LEU 251.A N LEU 259.A O no hydrogen 2.875 N/A THR 254.A N LEU 252.A O no hydrogen 2.941 N/A GLU 256.A N GLU 253.A O no hydrogen 3.156 N/A GLY 257.A N THR 254.A O no hydrogen 2.749 N/A LEU 259.A N GLU 256.A O no hydrogen 2.862 N/A ALA 260.A N GLN 60.A O no hydrogen 2.969 N/A LEU 261.A N VAL 249.A O no hydrogen 2.781 N/A THR 262.A N GLN 58.A O no hydrogen 2.991 N/A VAL 263.A N HIS 247.A O no hydrogen 2.805 N/A VAL 265.A N HIS 245.A O no hydrogen 2.945 N/A LEU 266.A N HIS 245.A O no hydrogen 3.172 N/A THR 267.A N TYR 180.A O no hydrogen 2.886 N/A THR 267.A OG1 THR 14.A OG1 no hydrogen 2.761 N/A ILE 269.A N SER 178.A O no hydrogen 2.901 N/A ASP 270.A N GLU 274.A O no hydrogen 2.931 N/A HIS 272.A N ASP 270.A OD1 no hydrogen 2.847 N/A GLY 273.A N ASP 270.A O no hydrogen 3.052 N/A GLU 274.A N ASP 270.A OD1 no hydrogen 3.016 N/A TRP 276.A N PHE 268.A O no hydrogen 2.855 N/A VAL 281.A N THR 239.A OG1 no hydrogen 2.718 N/A ALA 285.A N LEU 234.A O no hydrogen 3.031 N/A VAL 287.A N GLY 236.A O no hydrogen 3.011 N/A ALA 289.A N GLU 237.A OE2 no hydrogen 2.913 N/A GLU 290.A N GLU 290.A OE2 no hydrogen 2.728 N/A GLU 291.A N LEU 288.A O no hydrogen 2.918 N/A ALA 292.A N ALA 289.A O no hydrogen 3.379 N/A ARG 295.A N GLU 291.A O no hydrogen 2.994 N/A ALA 296.A N ALA 292.A O no hydrogen 3.001 N/A GLN 297.A N LEU 293.A O no hydrogen 3.149 N/A GLN 297.A NE2 GLU 301.A OE2 no hydrogen 3.091 N/A GLU 298.A N ASP 294.A O no hydrogen 2.894 N/A VAL 299.A N ARG 295.A O no hydrogen 2.973 N/A LEU 300.A N ALA 296.A O no hydrogen 3.000 N/A GLU 301.A N GLN 297.A O no hydrogen 2.914 N/A PHE 302.A N GLU 298.A O no hydrogen 3.085 N/A HIS 303.A N LEU 300.A O no hydrogen 3.386 N/A