Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gyy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A N THR 33.A O no hydrogen 2.876 N/A ARG 4.A N GLN 54.A OE1 no hydrogen 2.933 N/A ARG 4.A NE TYR 37.A OH no hydrogen 3.113 N/A ARG 4.A NH1 ILE 52.A O no hydrogen 2.864 N/A ARG 4.A NH2 TYR 37.A OH no hydrogen 3.008 N/A TYR 5.A N GLN 35.A O no hydrogen 2.703 N/A ALA 6.A N PHE 55.A O no hydrogen 2.915 N/A HIS 7.A N TYR 37.A O no hydrogen 2.881 N/A HIS 7.A NE2 ASP 16.A OD1 no hydrogen 3.031 N/A GLU 8.A N GLN 15.A OE1 no hydrogen 3.191 N/A GLU 9.A N HIS 7.A ND1 no hydrogen 2.873 N/A TYR 10.A N ASP 13.A OD2 no hydrogen 2.729 N/A GLY 12.A N ASP 16.A OD2 no hydrogen 3.006 N/A ASP 13.A N TYR 10.A O no hydrogen 3.076 N/A GLN 15.A N GLU 9.A OE1 no hydrogen 3.013 N/A GLN 15.A NE2 GLU 8.A OE1 no hydrogen 2.893 N/A GLN 15.A NE2 GLU 117.A OE2 no hydrogen 2.996 N/A VAL 17.A N ASP 13.A O no hydrogen 2.847 N/A PHE 18.A N VAL 14.A O no hydrogen 2.876 N/A ALA 19.A N GLN 15.A O no hydrogen 2.847 N/A GLN 20.A N ASP 16.A O no hydrogen 2.783 N/A ALA 21.A N VAL 17.A O no hydrogen 3.119 N/A PHE 22.A N PHE 18.A O no hydrogen 2.876 N/A LYS 23.A N ALA 19.A O no hydrogen 2.756 N/A LYS 23.A NZ GLU 27.A OE2 no hydrogen 2.698 N/A LYS 23.A NZ VAL 34.A O no hydrogen 2.656 N/A GLY 24.A N GLN 20.A O no hydrogen 2.694 N/A TYR 25.A N ALA 21.A O no hydrogen 3.253 N/A VAL 26.A N PHE 22.A O no hydrogen 3.235 N/A GLU 27.A N LYS 23.A O no hydrogen 3.013 N/A ASP 28.A N GLY 24.A O no hydrogen 2.822 N/A ASN 29.A N VAL 26.A O no hydrogen 3.258 N/A ASN 29.A ND2 TYR 25.A O no hydrogen 2.843 N/A SER 30.A OG VAL 26.A O no hydrogen 2.547 N/A VAL 34.A N GLU 27.A OE2 no hydrogen 2.961 N/A GLN 35.A N TRP 3.A O no hydrogen 2.605 N/A GLN 35.A NE2 VAL 36.A O no hydrogen 3.256 N/A TYR 37.A N TYR 5.A O no hydrogen 2.573 N/A ARG 38.A N GLU 41.A OE1 no hydrogen 2.831 N/A ARG 38.A NE ASP 16.A OD1 no hydrogen 2.838 N/A ARG 38.A NH2 ASP 16.A OD1 no hydrogen 3.490 N/A ARG 38.A NH2 GLN 20.A OE1 no hydrogen 3.296 N/A PHE 39.A N GLU 9.A O no hydrogen 2.860 N/A GLU 41.A N ARG 38.A O no hydrogen 3.375 N/A GLY 43.A N GLY 40.A O no hydrogen 3.274 N/A THR 48.A N ILE 44.A O no hydrogen 3.166 N/A THR 48.A OG1 ILE 44.A O no hydrogen 3.288 N/A GLN 49.A N MET 45.A O no hydrogen 3.057 N/A GLN 49.A NE2 HIS 107.A O no hydrogen 2.607 N/A ASN 50.A N GLU 46.A O no hydrogen 2.973 N/A ASN 50.A N GLN 47.A O no hydrogen 3.056 N/A GLY 51.A N THR 48.A O no hydrogen 3.202 N/A LEU 53.A N GLN 47.A O no hydrogen 3.387 N/A GLN 54.A N ARG 4.A O no hydrogen 2.952 N/A PHE 55.A N ARG 4.A O no hydrogen 2.824 N/A VAL 56.A N MET 210.A O no hydrogen 2.899 N/A ASN 57.A N ALA 6.A O no hydrogen 2.712 N/A ASN 57.A ND2 THR 207.A OG1 no hydrogen 3.115 N/A GLN 58.A NE2 PHE 62.A O no hydrogen 3.163 N/A GLN 58.A NE2 THR 63.A OG1 no hydrogen 3.294 N/A SER 59.A N GLU 8.A OE2 no hydrogen 2.773 N/A SER 59.A OG GLU 8.A OE1 no hydrogen 2.914 N/A SER 59.A OG THR 207.A OG1 no hydrogen 3.042 N/A PHE 62.A N SER 59.A O no hydrogen 2.847 N/A THR 63.A N PRO 60.A O no hydrogen 3.160 N/A THR 63.A OG1 SER 59.A O no hydrogen 2.777 N/A ILE 67.A N THR 63.A O no hydrogen 2.851 N/A ALA 70.A N ILE 67.A O no hydrogen 2.925 N/A GLN 71.A N PRO 68.A O no hydrogen 3.089 N/A GLN 71.A NE2 PRO 68.A O no hydrogen 2.957 N/A ILE 72.A N SER 69.A O no hydrogen 3.137 N/A PHE 74.A N GLN 71.A O no hydrogen 2.905 N/A ILE 75.A N ILE 72.A O no hydrogen 3.019 N/A TYR 77.A N HIS 202.A O no hydrogen 2.752 N/A TYR 77.A OH THR 200.A O no hydrogen 2.813 N/A LEU 78.A N ILE 75.A O no hydrogen 3.258 N/A THR 85.A N ASP 82.A OD2 no hydrogen 2.965 N/A THR 85.A OG1 ASP 82.A OD1 no hydrogen 2.959 N/A THR 85.A OG1 ASP 82.A OD2 no hydrogen 2.515 N/A VAL 86.A N ASP 82.A O no hydrogen 3.008 N/A LEU 87.A N MET 83.A O no hydrogen 3.290 N/A GLU 88.A N ASP 84.A O no hydrogen 3.183 N/A PHE 89.A N THR 85.A O no hydrogen 2.814 N/A PHE 90.A N VAL 86.A O no hydrogen 2.794 N/A ASP 91.A N GLU 88.A O no hydrogen 3.062 N/A GLU 92.A N GLU 88.A O no hydrogen 2.934 N/A SER 93.A N PHE 89.A O no hydrogen 2.844 N/A SER 93.A OG ASP 302.A OD2 no hydrogen 2.663 N/A ALA 95.A N ASP 302.A OD2 no hydrogen 2.744 N/A ILE 96.A N SER 93.A OG no hydrogen 3.084 N/A ASN 97.A N SER 93.A O no hydrogen 2.745 N/A ASN 97.A ND2 PHE 90.A O no hydrogen 3.091 N/A ASN 97.A ND2 SER 93.A O no hydrogen 3.039 N/A GLU 98.A N LYS 94.A O no hydrogen 2.837 N/A MET 99.A N LYS 94.A O no hydrogen 3.039 N/A PHE 100.A N ALA 95.A O no hydrogen 2.926 N/A LEU 103.A N MET 99.A O no hydrogen 3.175 N/A TYR 104.A N PHE 100.A O no hydrogen 3.066 N/A ALA 105.A N PRO 101.A O no hydrogen 2.770 N/A GLU 106.A N LYS 102.A O no hydrogen 3.112 N/A HIS 107.A N TYR 104.A O no hydrogen 3.085 N/A HIS 107.A ND1 LEU 103.A O no hydrogen 3.203 N/A GLY 108.A N ALA 105.A O no hydrogen 2.867 N/A LEU 109.A N TYR 104.A O no hydrogen 2.930 N/A GLU 110.A N ALA 211.A O no hydrogen 2.583 N/A LEU 112.A N MET 209.A O no hydrogen 2.884 N/A LYS 113.A N MET 209.A O no hydrogen 2.947 N/A LYS 113.A NZ ASP 232.A OD1 no hydrogen 2.862 N/A TYR 115.A N THR 207.A O no hydrogen 2.953 N/A TYR 115.A OH ASN 57.A OD1 no hydrogen 2.810 N/A GLU 117.A N PHE 205.A O no hydrogen 2.751 N/A MET 120.A N GLY 203.A O no hydrogen 2.867 N/A VAL 121.A N ASN 180.A O no hydrogen 2.865 N/A VAL 122.A N THR 198.A O no hydrogen 3.113 N/A THR 123.A N GLN 178.A O no hydrogen 2.923 N/A THR 123.A OG1 SER 194.A OG no hydrogen 3.015 N/A ALA 124.A N ASN 196.A O no hydrogen 2.985 N/A ILE 128.A N THR 198.A OG1 no hydrogen 3.204 N/A THR 129.A N ASP 133.A OD2 no hydrogen 2.717 N/A SER 130.A N ASP 133.A OD2 no hydrogen 3.136 N/A ASP 133.A N SER 130.A O no hydrogen 2.834 N/A PHE 134.A N PRO 131.A O no hydrogen 2.817 N/A ASP 135.A N GLU 132.A O no hydrogen 3.044 N/A ASP 135.A OD1.B ASP 135.A OD2.B no hydrogen 2.194 N/A ASP 135.A OD2.B ASP 135.A OD1.B no hydrogen 2.194 N/A LYS 137.A N PHE 134.A O no hydrogen 2.979 N/A LYS 137.A NZ ASP 133.A O no hydrogen 2.832 N/A LYS 138.A N ASP 176.A OD2 no hydrogen 2.969 N/A LYS 138.A NZ ASP 176.A OD2 no hydrogen 3.284 N/A ILE 139.A N THR 157.A O no hydrogen 3.098 N/A ARG 140.A N GLY 177.A O no hydrogen 2.778 N/A ARG 140.A NE LEU 161.A O no hydrogen 2.750 N/A ARG 140.A NH1 LEU 161.A O no hydrogen 2.870 N/A THR 141.A OG1 MET 142.A O no hydrogen 2.886 N/A ASN 144.A ND2 GLN 71.A OE1 no hydrogen 2.844 N/A LEU 146.A N ASN 144.A OD1 no hydrogen 2.855 N/A LEU 147.A N ASN 144.A O no hydrogen 2.811 N/A ALA 148.A N ASN 144.A O no hydrogen 3.111 N/A GLU 149.A N PRO 145.A O no hydrogen 3.061 N/A THR 150.A N LEU 146.A O no hydrogen 3.104 N/A THR 150.A OG1 PHE 74.A O no hydrogen 3.551 N/A THR 150.A OG1 LEU 146.A O no hydrogen 2.871 N/A TYR 151.A OH GLU 179.A OE1 no hydrogen 2.396 N/A LYS 152.A N ALA 148.A O no hydrogen 2.767 N/A ALA 153.A N GLU 149.A O no hydrogen 2.872 N/A PHE 154.A N THR 150.A O no hydrogen 3.069 N/A GLY 155.A N LYS 152.A O no hydrogen 3.257 N/A ALA 156.A N TYR 151.A O no hydrogen 2.802 N/A THR 157.A N LYS 137.A O no hydrogen 3.103 N/A THR 159.A N ILE 139.A O no hydrogen 2.799 N/A THR 159.A OG1 THR 157.A O no hydrogen 3.026 N/A GLU 165.A N PRO 162.A O no hydrogen 2.871 N/A VAL 166.A N TRP 163.A O no hydrogen 2.978 N/A TYR 167.A OH GLU 192.A OE1 no hydrogen 2.640 N/A GLY 169.A N GLU 165.A O no hydrogen 3.000 N/A GLY 169.A N VAL 166.A O no hydrogen 3.207 N/A LEU 170.A N VAL 166.A O no hydrogen 3.056 N/A LEU 170.A N TYR 167.A O no hydrogen 3.119 N/A GLN 171.A N TYR 167.A O no hydrogen 3.090 N/A THR 172.A N GLY 168.A O no hydrogen 3.089 N/A THR 172.A OG1 GLY 168.A O no hydrogen 2.851 N/A THR 172.A OG1 GLY 169.A O no hydrogen 3.515 N/A GLY 173.A N GLY 169.A O no hydrogen 3.013 N/A ILE 175.A N GLY 169.A O no hydrogen 3.002 N/A ASP 176.A N LYS 138.A O no hydrogen 2.890 N/A GLY 177.A N LYS 138.A O no hydrogen 3.413 N/A GLN 178.A N THR 123.A O no hydrogen 3.048 N/A GLN 178.A NE2 THR 123.A OG1 no hydrogen 3.023 N/A GLU 179.A N ARG 140.A O no hydrogen 3.321 N/A ASN 180.A N VAL 121.A O no hydrogen 2.923 N/A ASN 180.A ND2 GLN 178.A OE1 no hydrogen 2.723 N/A ILE 185.A N PRO 181.A O no hydrogen 2.994 N/A GLU 186.A N ILE 182.A O no hydrogen 2.717 N/A SER 187.A N PHE 183.A O no hydrogen 2.904 N/A GLY 188.A N TRP 184.A O no hydrogen 2.927 N/A GLY 189.A N GLU 186.A O no hydrogen 2.951 N/A LEU 190.A N ILE 185.A O no hydrogen 3.092 N/A GLU 192.A N GLY 189.A O no hydrogen 2.885 N/A VAL 193.A N LEU 190.A O no hydrogen 3.139 N/A SER 194.A OG THR 123.A OG1 no hydrogen 3.015 N/A ASN 196.A N ALA 124.A O no hydrogen 3.230 N/A ASN 196.A ND2 ALA 124.A O no hydrogen 3.146 N/A LEU 197.A N THR 261.A O no hydrogen 2.899 N/A THR 198.A N VAL 122.A O no hydrogen 2.745 N/A THR 198.A OG1 ILE 128.A O no hydrogen 3.429 N/A PHE 199.A N THR 263.A O no hydrogen 2.955 N/A THR 200.A OG1 HIS 202.A ND1 no hydrogen 2.697 N/A SER 201.A OG THR 81.A O no hydrogen 3.411 N/A SER 201.A OG GLU 119.A OE2 no hydrogen 3.179 N/A HIS 202.A ND1 THR 200.A OG1 no hydrogen 2.697 N/A TRP 204.A NE1 PRO 80.A O no hydrogen 3.037 N/A PHE 205.A N GLY 118.A O no hydrogen 3.091 N/A THR 206.A OG1 TRP 204.A O no hydrogen 3.127 N/A THR 207.A N TYR 115.A O no hydrogen 2.917 N/A THR 207.A OG1 SER 59.A OG no hydrogen 3.042 N/A ALA 208.A N THR 207.A OG1 no hydrogen 2.848 N/A MET 209.A N LYS 113.A O no hydrogen 2.670 N/A MET 210.A N VAL 56.A O no hydrogen 2.968 N/A ALA 211.A N GLU 110.A O no hydrogen 2.765 N/A ASN 212.A N GLN 54.A O no hydrogen 2.844 N/A ASN 212.A ND2 THR 48.A O no hydrogen 2.863 N/A GLN 213.A N GLY 108.A O no hydrogen 2.984 N/A GLN 213.A NE2 GLU 110.A OE1 no hydrogen 3.374 N/A PHE 215.A N ASN 212.A OD1 no hydrogen 2.503 N/A TYR 216.A N ASN 212.A O no hydrogen 2.825 N/A GLU 217.A N GLN 213.A O no hydrogen 2.776 N/A GLY 218.A N ASP 214.A O no hydrogen 3.105 N/A GLY 218.A N PHE 215.A O no hydrogen 2.978 N/A LEU 219.A N TYR 216.A O no hydrogen 3.203 N/A ASP 223.A N SER 220.A OG no hydrogen 3.018 N/A GLN 224.A N SER 220.A O no hydrogen 2.915 N/A GLN 224.A NE2 TYR 216.A O no hydrogen 3.015 N/A GLN 225.A N GLU 221.A O no hydrogen 3.216 N/A LEU 226.A N GLU 222.A O no hydrogen 2.866 N/A VAL 227.A N ASP 223.A O no hydrogen 2.950 N/A GLN 228.A N GLN 224.A O no hydrogen 3.113 N/A GLN 228.A NE2 TYR 216.A OH no hydrogen 2.599 N/A ASP 229.A N GLN 225.A O no hydrogen 2.874 N/A ALA 230.A N LEU 226.A O no hydrogen 2.782 N/A ALA 231.A N VAL 227.A O no hydrogen 2.922 N/A ASP 232.A N GLN 228.A O no hydrogen 2.997 N/A ALA 233.A N ASP 229.A O no hydrogen 2.949 N/A ALA 234.A N ALA 230.A O no hydrogen 2.862 N/A TYR 235.A N ALA 231.A O no hydrogen 2.833 N/A ASP 236.A N ASP 232.A O no hydrogen 3.084 N/A HIS 237.A N ALA 233.A O no hydrogen 3.020 N/A THR 238.A N ALA 234.A O no hydrogen 2.919 N/A THR 238.A OG1 ALA 234.A O no hydrogen 2.809 N/A ILE 239.A N TYR 235.A O no hydrogen 2.827 N/A GLU 240.A N ASP 236.A O no hydrogen 3.233 N/A HIS 241.A N HIS 237.A O no hydrogen 3.094 N/A ILE 242.A N THR 238.A O no hydrogen 2.989 N/A LYS 243.A N ILE 239.A O no hydrogen 3.051 N/A GLY 244.A N GLU 240.A O no hydrogen 2.965 N/A LEU 245.A N HIS 241.A O no hydrogen 2.669 N/A SER 246.A N ILE 242.A O no hydrogen 2.935 N/A SER 246.A OG ILE 242.A O no hydrogen 2.723 N/A GLU 247.A N LYS 243.A O no hydrogen 3.354 N/A GLU 248.A N GLY 244.A O no hydrogen 3.301 N/A SER 249.A N LEU 245.A O no hydrogen 2.950 N/A SER 249.A OG LEU 245.A O no hydrogen 2.790 N/A LEU 250.A N SER 246.A O no hydrogen 2.835 N/A GLU 251.A N GLU 247.A O no hydrogen 2.836 N/A LYS 252.A N GLU 248.A O no hydrogen 3.092 N/A ILE 253.A N SER 249.A O no hydrogen 3.121 N/A LYS 254.A N LEU 250.A O no hydrogen 3.288 N/A ALA 255.A N GLU 251.A O no hydrogen 2.922 N/A ALA 256.A N ILE 253.A O no hydrogen 3.136 N/A SER 257.A N ILE 253.A O no hydrogen 3.045 N/A GLU 259.A N SER 257.A OG no hydrogen 3.210 N/A THR 261.A N PRO 195.A O no hydrogen 2.915 N/A THR 261.A OG1 ASN 196.A OD1 no hydrogen 2.717 N/A THR 263.A N LEU 197.A O no hydrogen 2.778 N/A ASN 266.A N GLN 269.A OE1 no hydrogen 3.118 N/A GLN 269.A N ASN 266.A OD1 no hydrogen 2.730 N/A ILE 270.A N ASN 266.A O no hydrogen 3.287 N/A GLN 271.A N ASP 267.A O no hydrogen 3.238 N/A ALA 272.A N GLU 268.A O no hydrogen 3.246 N/A PHE 273.A N GLN 269.A O no hydrogen 3.399 N/A LYS 274.A N ILE 270.A O no hydrogen 3.001 N/A ARG 276.A N PHE 273.A O no hydrogen 3.085 N/A ARG 276.A NH1 ALA 153.A O no hydrogen 3.033 N/A ALA 277.A N LYS 274.A O no hydrogen 3.220 N/A GLN 279.A NE2 GLU 149.A OE2 no hydrogen 2.572 N/A VAL 280.A N ALA 277.A O no hydrogen 2.857 N/A GLU 281.A N ALA 277.A O no hydrogen 3.126 N/A GLU 282.A N PRO 278.A O no hydrogen 2.971 N/A LYS 283.A N GLN 279.A O no hydrogen 3.256 N/A PHE 284.A N VAL 280.A O no hydrogen 2.843 N/A ILE 285.A N GLU 281.A O no hydrogen 2.856 N/A GLU 286.A N GLU 282.A O no hydrogen 2.729 N/A MET 287.A N LYS 283.A O no hydrogen 3.182 N/A MET 287.A N PHE 284.A O no hydrogen 3.031 N/A THR 288.A N ILE 285.A O no hydrogen 3.217 N/A THR 288.A OG1 PHE 284.A O no hydrogen 2.756 N/A GLY 289.A N ILE 285.A O no hydrogen 2.672 N/A GLN 293.A N GLY 289.A O no hydrogen 2.750 N/A GLU 294.A N GLU 290.A O no hydrogen 2.889 N/A LEU 295.A N GLN 291.A O no hydrogen 2.879 N/A LEU 296.A N GLY 292.A O no hydrogen 2.767 N/A ASP 297.A N GLN 293.A O no hydrogen 2.997 N/A GLN 298.A N GLU 294.A O no hydrogen 3.312 N/A GLN 298.A NE2 GLN 298.A O no hydrogen 3.545 N/A GLN 298.A NE2 ASP 302.A OD1 no hydrogen 2.868 N/A PHE 299.A N LEU 295.A O no hydrogen 3.057 N/A LYS 300.A N LEU 296.A O no hydrogen 3.008 N/A LYS 300.A NZ GLU 281.A OE1 no hydrogen 2.927 N/A ALA 301.A N ASP 297.A O no hydrogen 2.958 N/A ASP 302.A N GLN 298.A O no hydrogen 2.770 N/A LEU 303.A N PHE 299.A O no hydrogen 3.103 N/A LYS 304.A N LYS 300.A O no hydrogen 3.381 N/A