Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6gue_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N MET 2.A O no hydrogen 2.987 N/A GLN 6.A N ARG 23.A O no hydrogen 2.819 N/A VAL 8.A N LYS 21.A O no hydrogen 2.843 N/A LYS 10.A NZ GLU 13.A OE1 no hydrogen 2.767 N/A ILE 11.A N VAL 19.A O no hydrogen 2.864 N/A GLY 14.A N GLY 17.A O no hydrogen 3.291 N/A VAL 19.A N GLY 12.A O no hydrogen 2.885 N/A TYR 20.A N LEU 33.A O no hydrogen 2.823 N/A LYS 21.A N GLU 9.A O no hydrogen 2.862 N/A ALA 22.A N VAL 31.A O no hydrogen 2.851 N/A ARG 23.A N GLN 6.A O no hydrogen 2.881 N/A ASN 24.A N GLU 29.A O no hydrogen 2.834 N/A LYS 25.A N ASN 4.A O no hydrogen 2.756 N/A LYS 25.A NZ GLU 3.A O no hydrogen 2.828 N/A LEU 26.A N ASN 24.A OD1 no hydrogen 2.913 N/A THR 27.A N ASN 24.A OD1 no hydrogen 3.086 N/A GLU 29.A N THR 27.A OG1 no hydrogen 3.336 N/A VAL 31.A N ALA 22.A O no hydrogen 2.791 N/A ALA 32.A N PHE 76.A O no hydrogen 2.903 N/A LEU 33.A N TYR 20.A O no hydrogen 2.782 N/A LYS 34.A N LEU 74.A O no hydrogen 2.839 N/A LYS 34.A NZ GLU 47.A OE1 no hydrogen 2.403 N/A LYS 35.A N VAL 18.A O no hydrogen 3.103 N/A ILE 36.A N LEU 72.A O no hydrogen 2.876 N/A ILE 45.A N PRO 41.A O no hydrogen 2.960 N/A ARG 46.A N SER 42.A O no hydrogen 2.833 N/A GLU 47.A N THR 43.A O no hydrogen 2.906 N/A ILE 48.A N ALA 44.A O no hydrogen 2.917 N/A SER 49.A N ILE 45.A O no hydrogen 3.089 N/A SER 49.A OG ILE 45.A O no hydrogen 2.678 N/A SER 49.A OG ARG 46.A O no hydrogen 3.326 N/A LEU 50.A N ARG 46.A O no hydrogen 2.980 N/A LEU 51.A N GLU 47.A O no hydrogen 3.021 N/A LYS 52.A N ILE 48.A O no hydrogen 2.967 N/A GLU 53.A N LEU 50.A O no hydrogen 3.197 N/A LEU 54.A N LEU 51.A O no hydrogen 3.211 N/A ASN 58.A N HIS 56.A ND1 no hydrogen 2.953 N/A ASN 58.A ND2 GLN 106.A OE1 no hydrogen 2.936 N/A ASN 58.A ND2 ILE 137.A O no hydrogen 2.918 N/A ILE 59.A N HIS 56.A O no hydrogen 3.143 N/A VAL 60.A N LEU 139.A O no hydrogen 2.865 N/A LYS 61.A N GLU 77.A OE2 no hydrogen 2.979 N/A LEU 63.A N VAL 75.A O no hydrogen 2.679 N/A ASP 64.A N VAL 75.A O no hydrogen 3.356 N/A VAL 65.A N ASP 64.A OD1 no hydrogen 2.845 N/A ILE 66.A N TYR 73.A O no hydrogen 2.856 N/A THR 68.A N LYS 71.A O no hydrogen 2.903 N/A LEU 72.A N ILE 36.A O no hydrogen 3.013 N/A TYR 73.A N ILE 66.A O no hydrogen 2.795 N/A LEU 74.A N LYS 34.A O no hydrogen 2.788 N/A VAL 75.A N ASP 64.A O no hydrogen 2.903 N/A PHE 76.A N ALA 32.A O no hydrogen 2.791 N/A GLU 77.A N LYS 61.A O no hydrogen 3.050 N/A HIS 80.A N ILE 131.A O no hydrogen 3.059 N/A GLN 81.A N ILE 131.A O no hydrogen 3.338 N/A LEU 83.A N LEU 129.A O no hydrogen 2.890 N/A LYS 84.A NZ ASP 88.A OD1 no hydrogen 3.162 N/A LYS 85.A N ASP 82.A OD1 no hydrogen 2.769 N/A LYS 85.A NZ GLN 81.A OE1 no hydrogen 3.305 N/A PHE 86.A N ASP 82.A O no hydrogen 3.277 N/A MET 87.A N LEU 83.A O no hydrogen 2.837 N/A ASP 88.A N LYS 84.A O no hydrogen 3.091 N/A ALA 89.A N LYS 85.A O no hydrogen 2.935 N/A SER 90.A N PHE 86.A O no hydrogen 3.033 N/A SER 90.A N MET 87.A O no hydrogen 3.030 N/A SER 90.A OG PHE 86.A O no hydrogen 2.944 N/A SER 90.A OG HIS 290.A NE2 no hydrogen 3.249 N/A ALA 91.A N ASP 88.A O no hydrogen 3.043 N/A THR 93.A OG1 GLY 94.A O no hydrogen 2.306 N/A GLY 94.A N SER 90.A O no hydrogen 2.869 N/A LEU 99.A N PRO 96.A O no hydrogen 2.976 N/A ILE 100.A N PRO 96.A O no hydrogen 3.109 N/A LYS 101.A N LEU 97.A O no hydrogen 2.928 N/A LYS 101.A NZ PHE 280.A O no hydrogen 2.949 N/A LYS 101.A NZ ASP 283.A OD1 no hydrogen 2.624 N/A SER 102.A N PRO 98.A O no hydrogen 3.002 N/A SER 102.A OG THR 285.A O no hydrogen 3.340 N/A TYR 103.A N LEU 99.A O no hydrogen 2.848 N/A LEU 104.A N ILE 100.A O no hydrogen 2.897 N/A PHE 105.A N LYS 101.A O no hydrogen 2.930 N/A GLN 106.A N SER 102.A O no hydrogen 2.990 N/A GLN 106.A NE2 SER 102.A O no hydrogen 3.388 N/A GLN 106.A NE2 SER 102.A OG no hydrogen 2.903 N/A GLN 106.A NE2 GLY 135.A O no hydrogen 2.854 N/A LEU 107.A N TYR 103.A O no hydrogen 2.897 N/A LEU 108.A N LEU 104.A O no hydrogen 2.934 N/A GLN 109.A N PHE 105.A O no hydrogen 2.950 N/A GLY 110.A N GLN 106.A O no hydrogen 2.940 N/A LEU 111.A N LEU 107.A O no hydrogen 2.881 N/A ALA 112.A N LEU 108.A O no hydrogen 2.872 N/A PHE 113.A N GLN 109.A O no hydrogen 3.069 N/A CYS 114.A N GLY 110.A O no hydrogen 3.033 N/A CYS 114.A SG GLY 110.A O no hydrogen 3.476 N/A HIS 115.A N LEU 111.A O no hydrogen 2.909 N/A HIS 115.A NE2 ASP 180.A OD2 no hydrogen 2.956 N/A SER 116.A N ALA 112.A O no hydrogen 2.893 N/A SER 116.A OG ALA 112.A O no hydrogen 3.001 N/A HIS 117.A N PHE 113.A O no hydrogen 3.115 N/A HIS 117.A N CYS 114.A O no hydrogen 3.002 N/A HIS 117.A ND1 PHE 113.A O no hydrogen 2.636 N/A ARG 118.A N HIS 115.A O no hydrogen 3.104 N/A ARG 118.A NH1 GLU 53.A OE2 no hydrogen 2.866 N/A ARG 118.A NH1 HIS 117.A O no hydrogen 2.902 N/A ARG 118.A NH2 GLU 53.A OE2 no hydrogen 2.730 N/A VAL 119.A N CYS 114.A O no hydrogen 2.898 N/A LEU 120.A N ARG 146.A O no hydrogen 2.958 N/A HIS 121.A N ASP 180.A OD2 no hydrogen 2.894 N/A HIS 121.A NE2 ALA 140.A O no hydrogen 2.911 N/A ARG 122.A N ASP 180.A OD1 no hydrogen 2.825 N/A ARG 122.A NE LEU 144.A O no hydrogen 2.856 N/A ARG 122.A NH1 TYR 175.A OH no hydrogen 2.834 N/A ARG 122.A NH2 LEU 144.A O no hydrogen 2.926 N/A ARG 122.A NH2 ALA 145.A O no hydrogen 3.512 N/A ASP 123.A N HIS 121.A ND1 no hydrogen 2.994 N/A LYS 125.A N ASP 123.A O no hydrogen 2.917 N/A ASN 128.A N LYS 125.A O no hydrogen 2.944 N/A ASN 128.A ND2 ASP 123.A O no hydrogen 2.755 N/A LEU 129.A N PRO 126.A O no hydrogen 3.316 N/A LEU 130.A N LYS 138.A O no hydrogen 2.849 N/A ILE 131.A N GLN 81.A O no hydrogen 2.858 N/A ASN 132.A N ALA 136.A O no hydrogen 3.275 N/A GLU 134.A N ASN 132.A OD1 no hydrogen 2.975 N/A GLY 135.A N ASN 132.A O no hydrogen 3.489 N/A ALA 136.A N ASN 132.A OD1 no hydrogen 2.976 N/A ILE 137.A N GLN 106.A OE1 no hydrogen 3.049 N/A LYS 138.A N LEU 130.A O no hydrogen 2.814 N/A LYS 138.A NZ GLU 77.A OE1 no hydrogen 2.922 N/A LYS 138.A NZ GLU 77.A OE2 no hydrogen 3.035 N/A LEU 139.A N ASN 58.A O no hydrogen 2.936 N/A ALA 140.A N ASN 128.A O no hydrogen 2.770 N/A PHE 142.A N GLU 47.A OE2 no hydrogen 2.706 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 3.052 N/A ALA 145.A N PHE 142.A O no hydrogen 3.165 N/A ARG 146.A N LEU 120.A O no hydrogen 3.062 N/A PHE 148.A N ARG 118.A O no hydrogen 2.719 N/A GLY 149.A N TYR 155.A OH no hydrogen 3.070 N/A ARG 153.A N TYR 155.A OH no hydrogen 3.301 N/A THR 154.A OG1 LYS 173.A O no hydrogen 3.364 N/A THR 160.A N ASP 123.A OD1 no hydrogen 2.965 N/A THR 160.A OG1 ASP 123.A OD1 no hydrogen 2.535 N/A THR 160.A OG1 ASP 123.A OD2 no hydrogen 3.306 N/A TRP 162.A NE1 GLY 200.A O no hydrogen 2.838 N/A TYR 163.A N THR 160.A O no hydrogen 2.853 N/A TYR 163.A OH GLU 190.A OE1 no hydrogen 2.534 N/A TYR 163.A OH GLU 190.A OE2 no hydrogen 3.387 N/A ARG 164.A N LEU 161.A O no hydrogen 3.101 N/A ARG 164.A NE VAL 158.A O no hydrogen 3.059 N/A ARG 164.A NE VAL 159.A O no hydrogen 2.951 N/A ARG 164.A NH2 VAL 159.A O no hydrogen 2.903 N/A GLU 167.A N GLU 167.A OE2 no hydrogen 2.709 N/A ILE 168.A N ALA 165.A O no hydrogen 2.942 N/A LEU 169.A N ALA 165.A O no hydrogen 3.141 N/A LEU 170.A N PRO 166.A O no hydrogen 2.778 N/A GLY 171.A N ILE 168.A O no hydrogen 2.844 N/A CYS 172.A N GLU 167.A O no hydrogen 3.101 N/A CYS 172.A SG GLU 167.A O no hydrogen 3.588 N/A LYS 173.A NZ TYR 174.A OH no hydrogen 3.106 N/A VAL 179.A N SER 176.A O no hydrogen 3.045 N/A ASP 180.A N THR 177.A O no hydrogen 3.048 N/A TRP 182.A N ALA 178.A O no hydrogen 2.962 N/A SER 183.A N VAL 179.A O no hydrogen 3.276 N/A SER 183.A OG TYR 163.A O no hydrogen 2.876 N/A SER 183.A OG VAL 179.A O no hydrogen 3.302 N/A LEU 184.A N ASP 180.A O no hydrogen 3.093 N/A GLY 185.A N ILE 181.A O no hydrogen 2.902 N/A CYS 186.A N TRP 182.A O no hydrogen 3.040 N/A CYS 186.A SG TRP 182.A O no hydrogen 3.582 N/A ILE 187.A N SER 183.A O no hydrogen 2.877 N/A PHE 188.A N LEU 184.A O no hydrogen 2.783 N/A ALA 189.A N GLY 185.A O no hydrogen 3.111 N/A GLU 190.A N CYS 186.A O no hydrogen 3.184 N/A MET 191.A N ILE 187.A O no hydrogen 2.850 N/A VAL 192.A N PHE 188.A O no hydrogen 3.241 N/A THR 193.A N ALA 189.A O no hydrogen 2.985 N/A THR 193.A OG1 ALA 189.A O no hydrogen 3.196 N/A THR 193.A OG1 ARG 195.A O no hydrogen 2.969 N/A ARG 194.A N GLU 190.A O no hydrogen 2.647 N/A ARG 195.A N THR 193.A OG1 no hydrogen 3.147 N/A GLY 200.A N PHE 198.A O no hydrogen 2.951 N/A GLY 200.A N GLN 206.A OE1 no hydrogen 2.812 N/A ASP 201.A N ASP 205.A OD2 no hydrogen 2.884 N/A ASP 205.A N SER 202.A OG no hydrogen 3.160 N/A GLN 206.A N SER 202.A O no hydrogen 2.850 N/A GLN 206.A NE2 PHE 198.A O no hydrogen 2.812 N/A LEU 207.A N GLU 203.A O no hydrogen 3.026 N/A PHE 208.A N ILE 204.A O no hydrogen 2.922 N/A ARG 209.A N ASP 205.A O no hydrogen 2.886 N/A ARG 209.A NE ASP 205.A OD2 no hydrogen 3.016 N/A ILE 210.A N GLN 206.A O no hydrogen 2.992 N/A PHE 211.A N LEU 207.A O no hydrogen 2.789 N/A ARG 212.A N PHE 208.A O no hydrogen 2.879 N/A THR 213.A N ARG 209.A O no hydrogen 3.321 N/A THR 213.A N ILE 210.A O no hydrogen 3.065 N/A THR 213.A OG1 ARG 209.A O no hydrogen 3.219 N/A LEU 214.A N ILE 210.A O no hydrogen 2.895 N/A GLY 215.A N PHE 211.A O no hydrogen 2.751 N/A THR 216.A N TRP 238.A O no hydrogen 2.832 N/A THR 216.A OG1 PRO 236.A O no hydrogen 2.723 N/A VAL 221.A N ASP 218.A OD1 no hydrogen 2.885 N/A TRP 222.A N ASP 218.A O no hydrogen 2.782 N/A GLY 224.A N GLU 219.A OE1 no hydrogen 2.882 N/A VAL 225.A N TRP 222.A O no hydrogen 3.027 N/A THR 226.A N GLU 219.A OE2 no hydrogen 3.035 N/A THR 226.A OG1 GLU 219.A OE2 no hydrogen 2.554 N/A SER 227.A N GLY 224.A O no hydrogen 3.036 N/A MET 228.A N VAL 225.A O no hydrogen 3.169 N/A ASP 230.A N LEU 170.A O no hydrogen 3.046 N/A TYR 231.A N MET 228.A O no hydrogen 3.087 N/A PHE 235.A N LYS 232.A O no hydrogen 2.944 N/A TRP 238.A N THR 216.A OG1 no hydrogen 2.830 N/A ARG 240.A NH1 LEU 214.A O no hydrogen 3.038 N/A SER 244.A OG ASP 242.A OD2 no hydrogen 3.177 N/A LYS 245.A N ASP 242.A O no hydrogen 2.844 N/A VAL 246.A N PHE 243.A O no hydrogen 2.930 N/A VAL 247.A N PHE 243.A O no hydrogen 3.414 N/A LEU 250.A N VAL 247.A O no hydrogen 3.092 N/A GLY 254.A N ASP 251.A OD1 no hydrogen 2.793 N/A ARG 255.A N ASP 251.A O no hydrogen 3.234 N/A ARG 255.A NH1 LEU 250.A O no hydrogen 2.759 N/A SER 256.A N GLU 252.A O no hydrogen 2.955 N/A SER 256.A OG GLN 260.A OE1 no hydrogen 2.930 N/A SER 256.A OG HIS 278.A NE2 no hydrogen 2.953 N/A LEU 257.A N ASP 253.A O no hydrogen 2.993 N/A LEU 258.A N GLY 254.A O no hydrogen 2.836 N/A SER 259.A N ARG 255.A O no hydrogen 3.053 N/A SER 259.A OG ARG 255.A O no hydrogen 3.216 N/A SER 259.A OG SER 256.A O no hydrogen 2.795 N/A GLN 260.A N SER 256.A O no hydrogen 3.139 N/A MET 261.A N LEU 257.A O no hydrogen 2.919 N/A LEU 262.A N LEU 258.A O no hydrogen 2.899 N/A TYR 264.A OH GLY 215.A O no hydrogen 2.569 N/A ASP 265.A N HIS 263.A ND1 no hydrogen 3.375 N/A ASN 267.A N ASP 265.A OD1 no hydrogen 3.113 N/A LYS 268.A N ASP 265.A O no hydrogen 2.956 N/A ARG 269.A N ASP 265.A O no hydrogen 3.158 N/A ARG 269.A NE HIS 263.A O no hydrogen 2.842 N/A ARG 269.A NH1 GLU 167.A OE1 no hydrogen 2.794 N/A ARG 269.A NH1 GLU 167.A OE2 no hydrogen 3.375 N/A ARG 269.A NH1 ALA 178.A O no hydrogen 2.978 N/A ARG 269.A NH2 GLU 167.A OE2 no hydrogen 2.894 N/A ARG 269.A NH2 HIS 263.A O no hydrogen 3.200 N/A ARG 269.A NH2 TYR 264.A O no hydrogen 3.031 N/A ILE 270.A N GLN 260.A O no hydrogen 3.023 N/A ALA 274.A N SER 271.A OG no hydrogen 2.934 N/A ALA 275.A N SER 271.A O no hydrogen 2.941 N/A LEU 276.A N ALA 272.A O no hydrogen 3.274 N/A LEU 276.A N LYS 273.A O no hydrogen 3.293 N/A ALA 277.A N ALA 274.A O no hydrogen 3.139 N/A HIS 278.A N ALA 275.A O no hydrogen 2.942 N/A HIS 278.A NE2 SER 256.A OG no hydrogen 2.953 N/A PHE 280.A N HIS 278.A ND1 no hydrogen 2.999 N/A PHE 281.A N HIS 278.A O no hydrogen 3.007 N/A GLN 282.A N PRO 279.A O no hydrogen 3.035 N/A GLN 282.A NE2 PRO 279.A O no hydrogen 2.889 N/A VAL 284.A N PHE 281.A O no hydrogen 2.976 N/A