Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1agw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 7.A N ASP 5.A OD1 no hydrogen 2.986 N/A ARG 7.A NE ASP 5.A OD1 no hydrogen 3.107 N/A ARG 7.A NE ASP 5.A OD2 no hydrogen 3.470 N/A ARG 7.A NH2 ASP 5.A OD2 no hydrogen 2.998 N/A TRP 8.A N ASP 5.A O no hydrogen 3.063 N/A GLU 9.A N ASP 5.A O no hydrogen 3.080 N/A LEU 10.A N ALA 78.A O no hydrogen 2.789 N/A ARG 12.A NE GLN 81.A O no hydrogen 2.801 N/A ARG 12.A NH1 PRO 84.A O no hydrogen 2.700 N/A ARG 12.A NH2 GLN 81.A O no hydrogen 3.082 N/A ARG 12.A NH2 PRO 84.A O no hydrogen 2.824 N/A ARG 14.A N PRO 11.A O no hydrogen 3.013 N/A ARG 14.A NE ASP 13.A OD1 no hydrogen 3.062 N/A ARG 14.A NH2 ASP 13.A O no hydrogen 2.945 N/A LEU 15.A N ARG 12.A O no hydrogen 3.060 N/A VAL 16.A N GLU 28.A O no hydrogen 2.736 N/A GLY 18.A N LEU 26.A O no hydrogen 2.699 N/A LEU 21.A N VAL 24.A O no hydrogen 2.768 N/A GLY 22.A N VAL 24.A O no hydrogen 3.154 N/A VAL 24.A N GLY 22.A O no hydrogen 2.801 N/A VAL 25.A N VAL 41.A O no hydrogen 2.859 N/A LEU 26.A N LYS 19.A O no hydrogen 2.765 N/A ALA 27.A N VAL 39.A O no hydrogen 2.971 N/A GLU 28.A N VAL 16.A O no hydrogen 2.957 N/A ALA 29.A N THR 37.A O no hydrogen 2.891 N/A ILE 30.A N ARG 14.A O no hydrogen 2.820 N/A GLY 31.A N ARG 35.A O no hydrogen 2.895 N/A THR 37.A N ALA 29.A O no hydrogen 2.871 N/A VAL 39.A N ALA 27.A O no hydrogen 2.926 N/A ALA 40.A N VAL 89.A O no hydrogen 2.970 N/A VAL 41.A N VAL 25.A O no hydrogen 2.811 N/A LYS 42.A N VAL 87.A O no hydrogen 2.886 N/A MET 43.A N GLN 23.A O no hydrogen 2.935 N/A ALA 48.A N LYS 45.A O no hydrogen 3.127 N/A THR 49.A N ASP 52.A OD2 no hydrogen 3.018 N/A THR 49.A OG1 ASP 52.A OD2 no hydrogen 3.106 N/A LYS 51.A NZ ASP 55.A OD1 no hydrogen 3.153 N/A LEU 53.A N THR 49.A O no hydrogen 3.165 N/A SER 54.A N GLU 50.A O no hydrogen 2.870 N/A SER 54.A OG GLU 50.A O no hydrogen 2.741 N/A ASP 55.A N LYS 51.A O no hydrogen 2.892 N/A LEU 56.A N ASP 52.A O no hydrogen 3.046 N/A ILE 57.A N LEU 53.A O no hydrogen 2.959 N/A SER 58.A N SER 54.A O no hydrogen 2.888 N/A SER 58.A OG SER 54.A O no hydrogen 2.870 N/A GLU 59.A N ASP 55.A O no hydrogen 2.918 N/A MET 60.A N LEU 56.A O no hydrogen 3.235 N/A GLU 61.A N ILE 57.A O no hydrogen 2.963 N/A MET 62.A N SER 58.A O no hydrogen 2.997 N/A MET 63.A N GLU 59.A O no hydrogen 3.044 N/A LYS 64.A N MET 60.A O no hydrogen 3.020 N/A LYS 64.A NZ ASP 5.A OD2 no hydrogen 2.815 N/A LYS 64.A NZ GLU 61.A OE2 no hydrogen 2.884 N/A MET 65.A N GLU 61.A O no hydrogen 3.220 N/A ILE 66.A N MET 62.A O no hydrogen 3.109 N/A GLY 67.A N MET 63.A O no hydrogen 3.369 N/A LYS 68.A NZ LEU 75.A O no hydrogen 3.149 N/A HIS 69.A N ASN 74.A OD1 no hydrogen 3.037 N/A ASN 71.A N HIS 69.A ND1 no hydrogen 3.020 N/A ASN 71.A ND2 GLN 122.A OE1 no hydrogen 3.539 N/A ASN 71.A ND2 MET 153.A O no hydrogen 2.928 N/A ILE 72.A N HIS 69.A O no hydrogen 3.390 N/A ILE 73.A N ILE 155.A O no hydrogen 2.827 N/A ASN 74.A N GLU 90.A OE1 no hydrogen 3.032 N/A ASN 74.A ND2 HIS 69.A O no hydrogen 2.951 N/A ASN 74.A ND2 GLU 90.A OE1 no hydrogen 2.852 N/A ASN 74.A ND2 GLU 90.A OE2 no hydrogen 3.397 N/A LEU 76.A N ILE 88.A O no hydrogen 2.742 N/A GLY 77.A N ILE 88.A O no hydrogen 3.266 N/A ALA 78.A N TRP 8.A O no hydrogen 2.764 N/A CYS 79.A N TYR 86.A O no hydrogen 2.984 N/A CYS 79.A SG LEU 10.A O no hydrogen 3.426 N/A THR 80.A N GLU 9.A OE2 no hydrogen 2.874 N/A THR 80.A OG1 GLU 9.A OE1 no hydrogen 2.725 N/A THR 80.A OG1 GLU 9.A OE2 no hydrogen 3.277 N/A GLN 81.A N GLU 9.A OE2 no hydrogen 3.365 N/A GLN 81.A NE2 LEU 2.A O no hydrogen 2.946 N/A GLN 81.A NE2 THR 80.A OG1 no hydrogen 3.067 N/A TYR 86.A N CYS 79.A O no hydrogen 2.793 N/A VAL 87.A N LYS 42.A O no hydrogen 3.070 N/A ILE 88.A N GLY 77.A O no hydrogen 3.063 N/A VAL 89.A N ALA 40.A O no hydrogen 2.787 N/A GLU 90.A N ASN 74.A O no hydrogen 2.962 N/A SER 93.A OG GLU 149.A OE1 no hydrogen 2.836 N/A LYS 94.A N VAL 147.A O no hydrogen 2.890 N/A LYS 94.A NZ GLU 149.A O no hydrogen 3.279 N/A LYS 94.A NZ ASN 151.A OD1 no hydrogen 3.023 N/A GLY 95.A N ALA 92.A O no hydrogen 3.408 N/A LEU 97.A N VAL 145.A O no hydrogen 2.687 N/A GLU 99.A N ASN 96.A OD1 no hydrogen 2.846 N/A TYR 100.A N ASN 96.A O no hydrogen 3.087 N/A TYR 100.A OH ASN 151.A OD1 no hydrogen 3.291 N/A LEU 101.A N LEU 97.A O no hydrogen 2.913 N/A GLN 102.A N ARG 98.A O no hydrogen 2.852 N/A GLN 102.A NE2 GLY 213.A O no hydrogen 2.845 N/A ALA 103.A N GLU 99.A O no hydrogen 2.813 N/A ARG 104.A N LEU 101.A O no hydrogen 3.194 N/A ARG 104.A NH1 TYR 100.A O no hydrogen 2.864 N/A ARG 105.A N GLN 102.A O no hydrogen 3.216 N/A ARG 105.A NE LEU 212.A O no hydrogen 2.779 N/A ARG 105.A NH2 THR 211.A O no hydrogen 3.234 N/A SER 112.A N ASP 115.A OD2 no hydrogen 3.107 N/A LYS 114.A NZ VAL 274.A O no hydrogen 2.706 N/A LYS 114.A NZ THR 277.A O no hydrogen 2.548 N/A ASP 115.A N SER 112.A OG no hydrogen 3.018 N/A LEU 116.A N SER 112.A O no hydrogen 2.971 N/A VAL 117.A N SER 113.A O no hydrogen 3.075 N/A SER 118.A N LYS 114.A O no hydrogen 2.889 N/A CYS 119.A N ASP 115.A O no hydrogen 2.950 N/A CYS 119.A SG.B ASP 115.A O no hydrogen 3.133 N/A ALA 120.A N LEU 116.A O no hydrogen 3.155 N/A TYR 121.A N VAL 117.A O no hydrogen 3.024 N/A GLN 122.A N SER 118.A O no hydrogen 3.167 N/A GLN 122.A NE2 SER 118.A O no hydrogen 3.409 N/A VAL 123.A N CYS 119.A O no hydrogen 3.237 N/A ALA 124.A N ALA 120.A O no hydrogen 2.883 N/A ARG 125.A N TYR 121.A O no hydrogen 2.847 N/A GLY 126.A N GLN 122.A O no hydrogen 2.937 N/A MET 127.A N VAL 123.A O no hydrogen 3.045 N/A GLU 128.A N ALA 124.A O no hydrogen 2.840 N/A TYR 129.A N ARG 125.A O no hydrogen 3.239 N/A TYR 129.A OH ILE 66.A O no hydrogen 2.673 N/A LEU 130.A N GLY 126.A O no hydrogen 3.038 N/A ALA 131.A N MET 127.A O no hydrogen 2.779 N/A SER 132.A N GLU 128.A O no hydrogen 2.991 N/A SER 132.A OG TYR 129.A O no hydrogen 2.641 N/A LYS 133.A N TYR 129.A O no hydrogen 2.952 N/A LYS 133.A N LEU 130.A O no hydrogen 3.131 N/A LYS 134.A N ALA 131.A O no hydrogen 2.907 N/A CYS 135.A N LEU 130.A O no hydrogen 2.877 N/A CYS 135.A SG PHE 158.A O no hydrogen 3.469 N/A HIS 137.A N ASP 198.A OD2 no hydrogen 2.793 N/A HIS 137.A NE2 ALA 156.A O no hydrogen 2.787 N/A ARG 138.A N ASP 198.A OD1 no hydrogen 2.992 N/A ASP 139.A N HIS 137.A ND1 no hydrogen 3.017 N/A ALA 142.A N GLU 208.A OE2 no hydrogen 3.128 N/A ARG 143.A NH2 ASP 139.A OD1 no hydrogen 2.953 N/A ASN 144.A N ALA 141.A O no hydrogen 2.989 N/A ASN 144.A ND2 ASP 139.A O no hydrogen 2.750 N/A ASN 144.A ND2 ASP 139.A OD2 no hydrogen 3.084 N/A VAL 145.A N ALA 142.A O no hydrogen 3.431 N/A LEU 146.A N LYS 154.A O no hydrogen 2.721 N/A VAL 147.A N GLY 95.A O no hydrogen 2.787 N/A THR 148.A N VAL 152.A O no hydrogen 3.069 N/A ASP 150.A N THR 148.A OG1 no hydrogen 3.313 N/A ASN 151.A N THR 148.A O no hydrogen 2.745 N/A VAL 152.A N THR 148.A OG1 no hydrogen 3.191 N/A MET 153.A N GLN 122.A OE1 no hydrogen 3.122 N/A LYS 154.A N LEU 146.A O no hydrogen 2.764 N/A LYS 154.A NZ LYS 70.A O no hydrogen 2.693 N/A LYS 154.A NZ ILE 72.A O no hydrogen 3.251 N/A LYS 154.A NZ GLU 90.A OE1 no hydrogen 2.781 N/A ILE 155.A N ASN 71.A O no hydrogen 3.006 N/A ALA 156.A N ASN 144.A O no hydrogen 2.895 N/A HIS 165.A N ASP 163.A OD1 no hydrogen 3.020 N/A HIS 166.A N ASP 163.A O no hydrogen 2.779 N/A TYR 169.A OH LEU 188.A O no hydrogen 2.996 N/A THR 173.A N ARG 177.A O no hydrogen 2.556 N/A GLY 176.A N THR 173.A O no hydrogen 2.778 N/A ARG 177.A N THR 173.A OG1 no hydrogen 2.994 N/A ARG 177.A NH2 GLY 213.A O no hydrogen 3.040 N/A LYS 181.A N LEU 178.A O no hydrogen 2.848 N/A LYS 181.A NZ TYR 217.A O no hydrogen 2.799 N/A LYS 181.A NZ VAL 220.A O no hydrogen 2.816 N/A TRP 182.A N PRO 179.A O no hydrogen 2.997 N/A TRP 182.A NE1 GLU 208.A OE2 no hydrogen 2.853 N/A MET 183.A N VAL 180.A O no hydrogen 3.378 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 3.110 N/A LEU 188.A N ALA 184.A O no hydrogen 2.831 N/A PHE 189.A N PRO 185.A O no hydrogen 2.713 N/A ASP 190.A N GLU 186.A O no hydrogen 2.842 N/A ARG 191.A N ALA 187.A O no hydrogen 2.923 N/A ILE 192.A N GLU 186.A O no hydrogen 3.253 N/A THR 194.A N SER 197.A OG no hydrogen 2.803 N/A THR 194.A OG1 GLN 196.A OE1 no hydrogen 3.304 N/A GLN 196.A N THR 194.A OG1 no hydrogen 3.188 N/A SER 197.A N THR 194.A O no hydrogen 3.194 N/A SER 197.A N THR 194.A OG1 no hydrogen 3.269 N/A SER 197.A OG THR 194.A O no hydrogen 2.839 N/A ASP 198.A N THR 194.A O no hydrogen 3.279 N/A VAL 199.A N HIS 195.A O no hydrogen 2.994 N/A TRP 200.A N GLN 196.A O no hydrogen 3.109 N/A SER 201.A N SER 197.A O no hydrogen 2.996 N/A SER 201.A OG TRP 182.A O no hydrogen 2.750 N/A SER 201.A OG SER 197.A O no hydrogen 3.336 N/A PHE 202.A N ASP 198.A O no hydrogen 2.856 N/A GLY 203.A N VAL 199.A O no hydrogen 3.073 N/A GLY 203.A N TRP 200.A O no hydrogen 2.961 N/A VAL 204.A N TRP 200.A O no hydrogen 3.249 N/A LEU 205.A N SER 201.A O no hydrogen 2.878 N/A LEU 206.A N PHE 202.A O no hydrogen 2.713 N/A TRP 207.A N GLY 203.A O no hydrogen 3.054 N/A GLU 208.A N VAL 204.A O no hydrogen 3.102 N/A ILE 209.A N LEU 205.A O no hydrogen 3.137 N/A PHE 210.A N LEU 206.A O no hydrogen 3.047 N/A THR 211.A N GLU 208.A O no hydrogen 3.306 N/A THR 211.A OG1 TRP 207.A O no hydrogen 2.855 N/A THR 211.A OG1 GLU 208.A O no hydrogen 3.163 N/A LEU 212.A N ILE 209.A O no hydrogen 3.141 N/A GLY 213.A N GLU 208.A O no hydrogen 2.881 N/A GLY 214.A N THR 211.A OG1 no hydrogen 3.004 N/A TYR 217.A OH HIS 233.A ND1 no hydrogen 2.988 N/A VAL 220.A N TYR 217.A O no hydrogen 3.139 N/A LEU 225.A N PRO 221.A O no hydrogen 2.965 N/A PHE 226.A N VAL 222.A O no hydrogen 3.094 N/A LYS 227.A NZ GLU 231.A OE2 no hydrogen 2.858 N/A LEU 228.A N GLU 224.A O no hydrogen 3.028 N/A LEU 229.A N LEU 225.A O no hydrogen 2.890 N/A LYS 230.A N PHE 226.A O no hydrogen 2.817 N/A GLU 231.A N LYS 227.A O no hydrogen 2.948 N/A GLY 232.A N LEU 229.A O no hydrogen 2.952 N/A HIS 233.A N LEU 228.A O no hydrogen 3.038 N/A HIS 233.A ND1 TYR 217.A OH no hydrogen 2.988 N/A ARG 234.A NE TRP 253.A O no hydrogen 3.058 N/A ARG 234.A NH1 HIS 233.A O no hydrogen 2.712 N/A ARG 234.A NH2 TRP 253.A O no hydrogen 2.914 N/A LYS 237.A NZ PRO 238.A O no hydrogen 3.462 N/A LYS 237.A NZ CYS 241.A O no hydrogen 2.826 N/A CYS 241.A SG THR 242.A O no hydrogen 3.811 N/A LEU 245.A N THR 242.A OG1 no hydrogen 3.221 N/A TYR 246.A N THR 242.A O no hydrogen 3.112 N/A TYR 246.A OH MET 235.A O no hydrogen 2.822 N/A MET 247.A N ASN 243.A O no hydrogen 2.863 N/A MET 248.A N GLU 244.A O no hydrogen 3.139 N/A MET 249.A N LEU 245.A O no hydrogen 3.199 N/A ARG 250.A N TYR 246.A O no hydrogen 2.834 N/A ARG 250.A NH1 TYR 246.A OH no hydrogen 3.304 N/A ASP 251.A N MET 247.A O no hydrogen 2.724 N/A CYS 252.A N MET 248.A O no hydrogen 2.896 N/A CYS 252.A SG MET 248.A O no hydrogen 3.366 N/A TRP 253.A N MET 249.A O no hydrogen 2.997 N/A TRP 253.A N ARG 250.A O no hydrogen 3.141 N/A HIS 254.A N ASP 251.A O no hydrogen 3.309 N/A GLN 259.A N VAL 256.A O no hydrogen 2.995 N/A ARG 260.A N PRO 257.A O no hydrogen 3.233 N/A ARG 260.A NE HIS 254.A O no hydrogen 2.828 N/A ARG 260.A NH1 GLU 186.A OE2 no hydrogen 2.926 N/A ARG 260.A NH1 GLN 196.A O no hydrogen 2.856 N/A ARG 260.A NH2 GLU 186.A OE1 no hydrogen 2.958 N/A ARG 260.A NH2 HIS 254.A O no hydrogen 3.094 N/A THR 262.A N GLN 265.A OE1 no hydrogen 2.777 N/A THR 262.A OG1 GLN 265.A OE1 no hydrogen 2.917 N/A GLN 265.A N THR 262.A OG1 no hydrogen 3.234 N/A LEU 266.A N THR 262.A O no hydrogen 2.933 N/A VAL 267.A N PHE 263.A O no hydrogen 2.807 N/A GLU 268.A N LYS 264.A O no hydrogen 3.243 N/A ASP 269.A N GLN 265.A O no hydrogen 2.890 N/A LEU 270.A N LEU 266.A O no hydrogen 2.804 N/A ASP 271.A N VAL 267.A O no hydrogen 2.933 N/A ARG 272.A N GLU 268.A O no hydrogen 3.050 N/A ARG 272.A NH1 GLU 244.A OE2 no hydrogen 3.081 N/A ARG 272.A NH2 GLU 244.A OE2 no hydrogen 3.100 N/A ILE 273.A N ASP 269.A O no hydrogen 2.832 N/A VAL 274.A N LEU 270.A O no hydrogen 2.795 N/A LEU 276.A N ARG 272.A O no hydrogen 3.321 N/A LEU 276.A N ILE 273.A O no hydrogen 2.782 N/A THR 277.A N VAL 274.A O no hydrogen 2.836 N/A THR 277.A OG1 ILE 273.A O no hydrogen 2.677 N/A