Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q80_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 6.A N THR 2.A O no hydrogen 3.250 N/A LEU 7.A N VAL 3.A O no hydrogen 2.925 N/A LEU 8.A N GLN 4.A O no hydrogen 2.928 N/A GLU 9.A N ILE 6.A O no hydrogen 3.323 N/A TYR 11.A OH GLU 49.A OE1 no hydrogen 3.397 N/A LYS 12.A N LEU 8.A O no hydrogen 2.954 N/A TYR 13.A N GLU 9.A O no hydrogen 2.983 N/A TYR 13.A OH PRO 72.A O no hydrogen 2.613 N/A LEU 14.A N PRO 10.A O no hydrogen 3.336 N/A LEU 15.A N TYR 11.A O no hydrogen 3.175 N/A GLN 16.A N TYR 13.A O no hydrogen 2.981 N/A GLN 16.A NE2 TYR 13.A O no hydrogen 3.094 N/A LEU 17.A N LEU 14.A O no hydrogen 3.091 N/A LYS 20.A NZ GLU 49.A OE2 no hydrogen 2.821 N/A ARG 23.A N GLY 19.A O no hydrogen 3.351 N/A THR 24.A N LYS 20.A O no hydrogen 2.797 N/A THR 24.A OG1 LYS 20.A O no hydrogen 2.826 N/A LYS 25.A N GLN 21.A O no hydrogen 3.039 N/A LEU 26.A N VAL 22.A O no hydrogen 3.046 N/A SER 27.A N ARG 23.A O no hydrogen 3.295 N/A GLN 28.A N THR 24.A O no hydrogen 3.043 N/A GLN 28.A NE2 GLU 272.A OE2 no hydrogen 2.758 N/A ALA 29.A N LYS 25.A O no hydrogen 2.780 N/A PHE 30.A N LEU 26.A O no hydrogen 2.928 N/A ASN 31.A N SER 27.A O no hydrogen 2.766 N/A HIS 32.A N GLN 28.A O no hydrogen 3.102 N/A HIS 32.A N ALA 29.A O no hydrogen 2.930 N/A HIS 32.A NE2.B GLU 272.A OE1 no hydrogen 2.914 N/A TRP 33.A N PHE 30.A O no hydrogen 3.147 N/A LEU 34.A N PHE 30.A O no hydrogen 3.032 N/A LYS 35.A N ASN 31.A O no hydrogen 2.855 N/A VAL 36.A N ASN 31.A OD1 no hydrogen 2.601 N/A LYS 40.A NZ LEU 101.A O no hydrogen 3.072 N/A LEU 41.A N PRO 37.A O no hydrogen 2.962 N/A GLN 42.A N GLU 38.A O no hydrogen 3.145 N/A ILE 44.A N LYS 40.A O no hydrogen 3.078 N/A ILE 45.A N LEU 41.A O no hydrogen 2.834 N/A GLU 46.A N GLN 42.A O no hydrogen 3.036 N/A VAL 47.A N ILE 43.A O no hydrogen 2.891 N/A THR 48.A N ILE 44.A O no hydrogen 2.947 N/A THR 48.A OG1 ILE 44.A O no hydrogen 2.745 N/A GLU 49.A N ILE 45.A O no hydrogen 2.943 N/A MET 50.A N GLU 46.A O no hydrogen 3.060 N/A LEU 51.A N VAL 47.A O no hydrogen 3.144 N/A HIS 52.A N THR 48.A O no hydrogen 2.924 N/A ASN 53.A N GLU 49.A O no hydrogen 2.948 N/A ALA 54.A N MET 50.A O no hydrogen 2.768 N/A SER 55.A N LEU 51.A O no hydrogen 2.897 N/A SER 55.A OG LEU 51.A O no hydrogen 3.379 N/A SER 55.A OG HIS 52.A O no hydrogen 2.861 N/A LEU 56.A N HIS 52.A O no hydrogen 2.909 N/A LEU 57.A N ASN 53.A O no hydrogen 3.028 N/A ILE 58.A N ALA 54.A O no hydrogen 3.259 N/A ASP 59.A N SER 55.A O no hydrogen 2.840 N/A ASP 60.A N LEU 56.A O no hydrogen 2.954 N/A GLU 62.A N ILE 58.A O no hydrogen 2.725 N/A ASP 63.A N ASP 59.A O no hydrogen 2.688 N/A ASP 63.A N ASP 60.A O no hydrogen 3.333 N/A ASN 64.A N ILE 61.A O no hydrogen 3.492 N/A SER 65.A N ASP 60.A O no hydrogen 3.375 N/A LYS 66.A N GLU 195.A OE1 no hydrogen 2.627 N/A LYS 66.A NZ ASN 64.A O no hydrogen 3.079 N/A LEU 67.A N GLU 195.A OE2 no hydrogen 2.970 N/A ARG 68.A N PHE 71.A O no hydrogen 2.650 N/A ARG 68.A NE ASP 60.A OD2 no hydrogen 2.850 N/A ARG 68.A NH1 ASP 60.A OD1 no hydrogen 2.669 N/A PHE 71.A N ARG 68.A O no hydrogen 3.035 N/A VAL 73.A N LYS 66.A O no hydrogen 2.915 N/A SER 76.A N VAL 73.A O no hydrogen 2.823 N/A SER 76.A OG VAL 73.A O no hydrogen 2.525 N/A ILE 77.A N ALA 74.A O no hydrogen 2.940 N/A TYR 78.A N ALA 74.A O no hydrogen 3.078 N/A TYR 78.A OH GLU 9.A OE2 no hydrogen 2.753 N/A GLY 79.A N HIS 75.A O no hydrogen 3.005 N/A SER 82.A OG TYR 78.A O no hydrogen 3.236 N/A VAL 83.A N GLY 79.A O no hydrogen 3.110 N/A ILE 84.A N ILE 80.A O no hydrogen 3.018 N/A ASN 85.A N PRO 81.A O no hydrogen 3.321 N/A SER 86.A N SER 82.A O no hydrogen 3.010 N/A SER 86.A OG LEU 7.A O no hydrogen 2.175 N/A ALA 87.A N VAL 83.A O no hydrogen 2.830 N/A ASN 88.A N ILE 84.A O no hydrogen 3.052 N/A TYR 89.A N ASN 85.A O no hydrogen 2.869 N/A TYR 89.A OH GLN 4.A OE1 no hydrogen 2.855 N/A VAL 90.A N SER 86.A O no hydrogen 2.938 N/A TYR 91.A N ALA 87.A O no hydrogen 2.916 N/A PHE 92.A N ASN 88.A O no hydrogen 3.285 N/A LEU 93.A N TYR 89.A O no hydrogen 2.934 N/A GLY 94.A N VAL 90.A O no hydrogen 2.810 N/A LEU 95.A N TYR 91.A O no hydrogen 3.023 N/A GLU 96.A N PHE 92.A O no hydrogen 2.934 N/A LYS 97.A N LEU 93.A O no hydrogen 2.900 N/A LYS 97.A NZ GLU 46.A OE1 no hydrogen 2.920 N/A VAL 98.A N GLY 94.A O no hydrogen 2.711 N/A LEU 99.A N LEU 95.A O no hydrogen 3.145 N/A LEU 99.A N GLU 96.A O no hydrogen 3.157 N/A THR 100.A N LYS 97.A O no hydrogen 2.939 N/A THR 100.A OG1 LYS 97.A O no hydrogen 2.492 N/A LEU 101.A N VAL 98.A O no hydrogen 2.957 N/A ASP 102.A N LEU 99.A O no hydrogen 3.145 N/A ASP 105.A N HIS 103.A ND1 no hydrogen 3.038 N/A ALA 106.A N HIS 103.A O no hydrogen 3.192 N/A LEU 109.A N ASP 105.A O no hydrogen 3.052 N/A PHE 110.A N ALA 106.A O no hydrogen 2.947 N/A THR 111.A N VAL 107.A O no hydrogen 3.051 N/A THR 111.A OG1 VAL 107.A O no hydrogen 2.918 N/A ARG 112.A N LYS 108.A O no hydrogen 3.209 N/A GLN 113.A N LEU 109.A O no hydrogen 2.946 N/A GLN 113.A NE2 GLY 149.A O no hydrogen 3.550 N/A LEU 114.A N PHE 110.A O no hydrogen 2.980 N/A LEU 115.A N THR 111.A O no hydrogen 2.820 N/A GLU 116.A N ARG 112.A O no hydrogen 3.092 N/A LEU 117.A N GLN 113.A O no hydrogen 3.023 N/A HIS 118.A N LEU 114.A O no hydrogen 3.267 N/A HIS 118.A ND1 LEU 114.A O no hydrogen 2.865 N/A GLN 119.A N LEU 115.A O no hydrogen 3.265 N/A GLN 119.A NE2 LEU 115.A O no hydrogen 3.495 N/A GLY 120.A N GLU 116.A O no hydrogen 3.099 N/A GLN 121.A N LEU 117.A O no hydrogen 2.855 N/A GLN 121.A NE2 ASP 59.A OD1 no hydrogen 3.414 N/A GLY 122.A N HIS 118.A O no hydrogen 2.972 N/A LEU 123.A N GLN 119.A O no hydrogen 3.102 N/A ASP 124.A N GLY 120.A O no hydrogen 3.216 N/A ILE 125.A N GLN 121.A O no hydrogen 2.862 N/A TYR 126.A N GLY 122.A O no hydrogen 2.776 N/A TRP 127.A N LEU 123.A O no hydrogen 2.834 N/A ARG 128.A N ASP 124.A O no hydrogen 3.171 N/A ARG 128.A NE ASP 129.A OD1 no hydrogen 3.066 N/A ARG 128.A NH1 GLU 62.A O no hydrogen 3.398 N/A ARG 128.A NH1 ASP 63.A OD2 no hydrogen 3.078 N/A ARG 128.A NH1 GLU 199.A OE2 no hydrogen 3.239 N/A ARG 128.A NH2 GLU 62.A O no hydrogen 2.948 N/A ARG 128.A NH2 ASP 129.A OD1 no hydrogen 3.288 N/A ARG 128.A NH2 ASP 129.A OD2 no hydrogen 3.192 N/A ASP 129.A N ILE 125.A O no hydrogen 3.117 N/A ASN 130.A N TYR 126.A O no hydrogen 2.999 N/A ASN 130.A ND2 TYR 126.A O no hydrogen 2.589 N/A TYR 131.A N ARG 128.A O no hydrogen 3.255 N/A THR 132.A N TRP 127.A O no hydrogen 2.999 N/A THR 132.A OG1 ASN 130.A O no hydrogen 3.436 N/A CYS 133.A SG PRO 134.A O no hydrogen 3.345 N/A THR 135.A N GLU 138.A OE1 no hydrogen 2.718 N/A GLU 138.A N THR 135.A OG1 no hydrogen 3.094 N/A TYR 139.A N THR 135.A O no hydrogen 2.918 N/A TYR 139.A OH ASP 184.A OD1 no hydrogen 3.398 N/A TYR 139.A OH ASP 184.A OD2 no hydrogen 2.524 N/A LYS 140.A N GLU 136.A O no hydrogen 3.020 N/A LYS 140.A NZ GLU 136.A OE2 no hydrogen 2.666 N/A ALA 141.A N GLU 137.A O no hydrogen 2.982 N/A MET 142.A N GLU 138.A O no hydrogen 3.065 N/A VAL 143.A N TYR 139.A O no hydrogen 2.963 N/A LEU 144.A N LYS 140.A O no hydrogen 3.040 N/A GLN 145.A N ALA 141.A O no hydrogen 3.268 N/A GLN 145.A NE2 GLN 119.A OE1 no hydrogen 3.584 N/A LYS 146.A N MET 142.A O no hydrogen 2.720 N/A LYS 146.A NZ ASP 124.A OD2 no hydrogen 2.904 N/A LYS 146.A NZ GLN 180.A OE1 no hydrogen 3.103 N/A THR 147.A N VAL 143.A O no hydrogen 2.781 N/A THR 147.A OG1 VAL 143.A O no hydrogen 2.499 N/A GLY 148.A N LEU 144.A O no hydrogen 2.933 N/A GLY 149.A N LYS 146.A O no hydrogen 3.221 N/A PHE 151.A N THR 147.A O no hydrogen 2.898 N/A GLY 152.A N GLY 148.A O no hydrogen 3.017 N/A LEU 153.A N GLY 149.A O no hydrogen 3.080 N/A ALA 154.A N LEU 150.A O no hydrogen 3.133 N/A VAL 155.A N PHE 151.A O no hydrogen 3.223 N/A GLY 156.A N GLY 152.A O no hydrogen 2.946 N/A LEU 157.A N LEU 153.A O no hydrogen 2.953 N/A MET 158.A N ALA 154.A O no hydrogen 3.061 N/A GLN 159.A N VAL 155.A O no hydrogen 2.816 N/A LEU 160.A N GLY 156.A O no hydrogen 3.221 N/A LEU 160.A N LEU 157.A O no hydrogen 2.973 N/A PHE 161.A N MET 158.A O no hydrogen 3.027 N/A SER 162.A N GLN 159.A O no hydrogen 3.165 N/A SER 162.A OG LEU 34.A O no hydrogen 2.724 N/A TYR 164.A N SER 162.A OG no hydrogen 2.845 N/A LYS 169.A N ASP 167.A OD1 no hydrogen 3.367 N/A LEU 172.A N LEU 168.A O no hydrogen 2.961 N/A ASN 173.A N LYS 169.A O no hydrogen 2.975 N/A THR 174.A N PRO 170.A O no hydrogen 3.135 N/A THR 174.A OG1 PRO 170.A O no hydrogen 3.430 N/A THR 174.A OG1 GLN 263.A OE1 no hydrogen 2.510 N/A LEU 175.A N LEU 171.A O no hydrogen 2.966 N/A GLY 176.A N LEU 172.A O no hydrogen 2.845 N/A LEU 177.A N ASN 173.A O no hydrogen 3.037 N/A PHE 178.A N THR 174.A O no hydrogen 2.753 N/A PHE 179.A N LEU 175.A O no hydrogen 2.890 N/A GLN 180.A N GLY 176.A O no hydrogen 3.027 N/A GLN 180.A NE2 GLN 180.A O no hydrogen 3.320 N/A GLN 180.A NE2 ASP 184.A OD1 no hydrogen 2.987 N/A ILE 181.A N LEU 177.A O no hydrogen 3.004 N/A ARG 182.A N PHE 178.A O no hydrogen 2.956 N/A ARG 182.A NE LEU 280.A O no hydrogen 2.677 N/A ARG 182.A NH2 LEU 280.A O no hydrogen 3.266 N/A ASP 183.A N PHE 179.A O no hydrogen 2.968 N/A ASP 184.A N GLN 180.A O no hydrogen 2.856 N/A TYR 185.A N ILE 181.A O no hydrogen 2.819 N/A ALA 186.A N ARG 182.A O no hydrogen 3.026 N/A ASN 187.A N ASP 183.A O no hydrogen 3.045 N/A LEU 188.A N TYR 185.A O no hydrogen 3.216 N/A HIS 189.A N ALA 186.A O no hydrogen 3.404 N/A SER 190.A N ALA 186.A O no hydrogen 3.342 N/A SER 190.A OG ALA 186.A O no hydrogen 2.592 N/A SER 192.A N GLU 195.A OE2 no hydrogen 2.998 N/A CYS 194.A SG LEU 188.A O no hydrogen 4.000 N/A ASP 196.A N ASN 187.A OD1 no hydrogen 3.135 N/A LEU 197.A N CYS 194.A O no hydrogen 3.134 N/A THR 198.A OG1 THR 227.A O no hydrogen 2.889 N/A THR 198.A OG1 GLU 228.A OE1 no hydrogen 3.544 N/A GLU 199.A N GLU 195.A O no hydrogen 2.777 N/A GLY 200.A N ASP 196.A O no hydrogen 3.085 N/A GLY 200.A N LEU 197.A O no hydrogen 3.041 N/A LYS 201.A N ASP 196.A O no hydrogen 3.157 N/A SER 203.A N THR 206.A OG1 no hydrogen 2.860 N/A PHE 204.A N ASP 184.A OD2 no hydrogen 2.920 N/A THR 206.A OG1 SER 203.A O no hydrogen 2.969 N/A ILE 207.A N SER 203.A O no hydrogen 2.962 N/A HIS 208.A N PHE 204.A O no hydrogen 3.122 N/A HIS 208.A ND1 SER 245.A OG no hydrogen 2.671 N/A ALA 209.A N PRO 205.A O no hydrogen 3.126 N/A ILE 210.A N THR 206.A O no hydrogen 2.992 N/A TRP 211.A N ILE 207.A O no hydrogen 3.035 N/A TRP 211.A NE1 PRO 134.A O no hydrogen 3.005 N/A SER 212.A N HIS 208.A O no hydrogen 2.876 N/A SER 212.A OG HIS 208.A O no hydrogen 2.860 N/A ARG 213.A NH1 SER 212.A O no hydrogen 3.138 N/A SER 216.A N ARG 213.A O no hydrogen 2.964 N/A GLN 218.A N SER 216.A OG no hydrogen 3.270 N/A GLN 220.A N GLN 220.A OE1 no hydrogen 3.010 N/A ASN 221.A N THR 217.A O no hydrogen 2.762 N/A ASN 221.A ND2 THR 217.A O no hydrogen 2.599 N/A ILE 222.A N GLN 218.A O no hydrogen 2.898 N/A LEU 223.A N VAL 219.A O no hydrogen 2.790 N/A ARG 224.A N GLN 220.A O no hydrogen 2.914 N/A ARG 224.A NH1 ASN 221.A OD1 no hydrogen 2.960 N/A GLN 225.A N ASN 221.A O no hydrogen 3.324 N/A GLN 225.A N ILE 222.A O no hydrogen 3.060 N/A ARG 226.A N LEU 223.A O no hydrogen 3.163 N/A ARG 226.A NH1 LEU 223.A O no hydrogen 2.939 N/A ARG 226.A NH2 ARG 128.A O no hydrogen 3.259 N/A ASN 229.A N THR 227.A OG1 no hydrogen 2.964 N/A ASP 231.A N ASN 229.A OD1 no hydrogen 2.988 N/A ILE 232.A N ASN 229.A OD1 no hydrogen 3.197 N/A LYS 233.A N ASN 229.A O no hydrogen 3.109 N/A LYS 233.A NZ PHE 193.A O no hydrogen 2.782 N/A LYS 234.A N ILE 230.A O no hydrogen 2.828 N/A TYR 235.A N ASP 231.A O no hydrogen 3.042 N/A TYR 235.A OH GLN 218.A OE1 no hydrogen 2.522 N/A CYS 236.A N ILE 232.A O no hydrogen 2.963 N/A VAL 237.A N LYS 233.A O no hydrogen 3.084 N/A VAL 237.A N LYS 234.A O no hydrogen 3.094 N/A HIS 238.A N LYS 234.A O no hydrogen 2.997 N/A TYR 239.A N TYR 235.A O no hydrogen 2.955 N/A LEU 240.A N CYS 236.A O no hydrogen 3.007 N/A GLU 241.A N VAL 237.A O no hydrogen 3.057 N/A ASP 242.A N HIS 238.A O no hydrogen 3.085 N/A VAL 243.A N TYR 239.A O no hydrogen 2.971 N/A GLY 244.A N GLU 241.A O no hydrogen 3.117 N/A SER 245.A N LEU 240.A O no hydrogen 2.899 N/A SER 245.A OG HIS 208.A ND1 no hydrogen 2.671 N/A TYR 248.A N GLY 244.A O no hydrogen 2.993 N/A TYR 248.A OH GLU 136.A OE1 no hydrogen 2.335 N/A THR 249.A N SER 245.A O no hydrogen 3.004 N/A THR 249.A OG1 SER 245.A O no hydrogen 2.844 N/A ARG 250.A N PHE 246.A O no hydrogen 2.776 N/A ARG 250.A NH1 TYR 185.A OH no hydrogen 3.076 N/A ASN 251.A N GLU 247.A O no hydrogen 2.974 N/A THR 252.A N TYR 248.A O no hydrogen 3.005 N/A THR 252.A OG1 TYR 248.A O no hydrogen 3.033 N/A LEU 253.A N THR 249.A O no hydrogen 2.883 N/A LYS 254.A N ARG 250.A O no hydrogen 2.943 N/A LYS 254.A NZ ASN 251.A OD1 no hydrogen 3.299 N/A GLU 255.A N ASN 251.A O no hydrogen 2.996 N/A LEU 256.A N THR 252.A O no hydrogen 3.127 N/A GLU 257.A N LEU 253.A O no hydrogen 3.173 N/A ALA 258.A N LYS 254.A O no hydrogen 2.953 N/A LYS 259.A N GLU 255.A O no hydrogen 2.806 N/A ALA 260.A N LEU 256.A O no hydrogen 2.924 N/A TYR 261.A N GLU 257.A O no hydrogen 3.096 N/A TYR 261.A OH GLU 257.A OE2 no hydrogen 2.493 N/A LYS 262.A N ALA 258.A O no hydrogen 2.863 N/A GLN 263.A N LYS 259.A O no hydrogen 2.740 N/A ILE 264.A N ALA 260.A O no hydrogen 2.826 N/A ASP 265.A N TYR 261.A O no hydrogen 3.280 N/A ALA 266.A N LYS 262.A O no hydrogen 3.128 N/A ARG 267.A N ILE 264.A O no hydrogen 3.140 N/A ARG 267.A NE GLU 166.A OE1 no hydrogen 2.622 N/A GLY 268.A N ASP 265.A O no hydrogen 2.746 N/A GLY 269.A N ILE 264.A O no hydrogen 2.838 N/A ASN 270.A ND2 ALA 29.A O no hydrogen 2.954 N/A LEU 273.A N ASN 270.A OD1 no hydrogen 3.067 N/A VAL 274.A N ASN 270.A O no hydrogen 3.035 N/A ALA 275.A N PRO 271.A O no hydrogen 2.815 N/A LEU 276.A N GLU 272.A O no hydrogen 3.186 N/A VAL 277.A N LEU 273.A O no hydrogen 2.949 N/A LYS 278.A N VAL 274.A O no hydrogen 2.747 N/A HIS 279.A N ALA 275.A O no hydrogen 2.823 N/A LEU 280.A N LEU 276.A O no hydrogen 2.878 N/A SER 281.A N VAL 277.A O no hydrogen 2.887 N/A SER 281.A OG VAL 277.A O no hydrogen 2.756 N/A PHE 284.A N SER 281.A O no hydrogen 3.116 N/A