Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ccu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N GLU 61.A OE2 no hydrogen 3.167 N/A PHE 3.A N GLU 83.A OE2 no hydrogen 2.837 N/A ARG 4.A N VAL 81.A O no hydrogen 3.237 N/A ARG 4.A NH1 GLU 80.A OE2 no hydrogen 2.670 N/A ARG 4.A NH2 GLU 6.A OE2 no hydrogen 3.117 N/A GLN 5.A NE2 GLU 83.A OE2 no hydrogen 3.119 N/A ASP 9.A N ASN 7.A OD1 no hydrogen 2.922 N/A ASP 10.A N ASN 7.A O no hydrogen 2.933 N/A TYR 11.A N VAL 8.A O no hydrogen 2.947 N/A TYR 11.A OH GLU 6.A OE1 no hydrogen 2.568 N/A TYR 12.A N VAL 8.A O no hydrogen 2.935 N/A TYR 12.A OH GLU 80.A OE1 no hydrogen 2.616 N/A ASP 13.A N ARG 30.A O no hydrogen 3.008 N/A GLY 15.A N LYS 28.A O no hydrogen 2.755 N/A LEU 18.A N VAL 26.A O no hydrogen 2.732 N/A GLY 19.A N VAL 26.A O no hydrogen 3.415 N/A GLY 21.A N ALA 24.A O no hydrogen 2.858 N/A VAL 25.A N PHE 42.A O no hydrogen 3.113 N/A VAL 26.A N GLY 19.A O no hydrogen 2.870 N/A LYS 27.A N ALA 40.A O no hydrogen 2.857 N/A LYS 27.A NZ GLU 17.A OE1 no hydrogen 2.785 N/A LYS 28.A N GLU 16.A O no hydrogen 2.744 N/A LYS 28.A NZ GLN 37.A OE1 no hydrogen 3.390 N/A CYS 29.A N TYR 38.A O no hydrogen 2.882 N/A ARG 30.A N ASP 13.A O no hydrogen 2.845 N/A GLU 31.A N LEU 36.A O no hydrogen 2.818 N/A LYS 32.A N TYR 11.A O no hydrogen 2.832 N/A LYS 32.A NZ ASP 9.A O no hydrogen 2.836 N/A THR 34.A OG1 GLU 31.A OE1 no hydrogen 3.538 N/A GLY 35.A N GLU 31.A O no hydrogen 2.856 N/A LEU 36.A N THR 34.A OG1 no hydrogen 3.206 N/A TYR 38.A N CYS 29.A O no hydrogen 2.951 N/A ALA 39.A N LEU 92.A O no hydrogen 2.788 N/A ALA 40.A N LYS 27.A O no hydrogen 2.745 N/A LYS 41.A N LEU 90.A O no hydrogen 2.797 N/A PHE 42.A N VAL 25.A O no hydrogen 2.787 N/A ILE 43.A N VAL 88.A O no hydrogen 2.731 N/A LYS 44.A N PHE 23.A O no hydrogen 2.849 N/A LYS 45.A N THR 86.A O no hydrogen 2.901 N/A LYS 45.A NZ GLU 83.A OE1 no hydrogen 2.794 N/A LYS 45.A NZ ASN 84.A O no hydrogen 2.719 N/A ARG 46.A N VAL 55.A O no hydrogen 3.230 N/A ARG 46.A NE ARG 53.A O no hydrogen 3.182 N/A ARG 46.A NE GLY 54.A O no hydrogen 3.294 N/A ARG 53.A N SER 51.A OG no hydrogen 3.094 N/A VAL 55.A N LYS 44.A O no hydrogen 2.893 N/A ARG 57.A NE GLU 61.A OE2 no hydrogen 2.856 N/A ARG 57.A NH1 GLU 83.A OE1 no hydrogen 2.722 N/A ARG 57.A NH2 THR 1.A O no hydrogen 2.684 N/A ARG 57.A NH2 GLU 83.A OE1 no hydrogen 3.175 N/A ARG 57.A NH2 GLU 83.A OE2 no hydrogen 3.292 N/A ASP 59.A N SER 56.A OG no hydrogen 3.116 N/A ILE 60.A N SER 56.A O no hydrogen 2.940 N/A GLU 61.A N ARG 57.A O no hydrogen 2.816 N/A ARG 62.A N GLU 58.A O no hydrogen 2.992 N/A ARG 62.A NH1 ASP 59.A OD1 no hydrogen 2.828 N/A GLU 63.A N ASP 59.A O no hydrogen 3.143 N/A VAL 64.A N ILE 60.A O no hydrogen 2.953 N/A SER 65.A N GLU 61.A O no hydrogen 2.872 N/A ILE 66.A N ARG 62.A O no hydrogen 3.019 N/A LEU 67.A N GLU 63.A O no hydrogen 2.992 N/A LYS 68.A N VAL 64.A O no hydrogen 2.891 N/A GLU 69.A N ILE 66.A O no hydrogen 2.974 N/A ILE 70.A N LEU 67.A O no hydrogen 3.325 N/A GLN 71.A N TYR 128.A OH no hydrogen 2.824 N/A ASN 74.A N HIS 72.A ND1 no hydrogen 2.980 N/A ASN 74.A ND2 GLN 121.A OE1 no hydrogen 3.527 N/A ASN 74.A ND2 ILE 156.A O no hydrogen 3.016 N/A VAL 75.A N HIS 72.A O no hydrogen 3.115 N/A ILE 76.A N ILE 158.A O no hydrogen 3.038 N/A THR 77.A N GLU 93.A OE1 no hydrogen 3.123 N/A THR 77.A OG1 GLU 93.A OE1 no hydrogen 3.102 N/A HIS 79.A N ILE 91.A O no hydrogen 2.746 N/A HIS 79.A NE2 GLU 31.A OE1 no hydrogen 3.164 N/A GLU 80.A N ILE 91.A O no hydrogen 3.314 N/A TYR 82.A N ILE 89.A O no hydrogen 2.920 N/A TYR 82.A OH GLU 80.A OE1 no hydrogen 2.896 N/A GLU 83.A N ARG 4.A O no hydrogen 2.819 N/A ASN 84.A N ASP 87.A O no hydrogen 2.894 N/A THR 86.A N ASN 84.A OD1 no hydrogen 2.934 N/A THR 86.A OG1 ASN 84.A OD1 no hydrogen 2.986 N/A ASP 87.A N ASN 84.A OD1 no hydrogen 2.918 N/A VAL 88.A N ILE 43.A O no hydrogen 2.958 N/A ILE 89.A N TYR 82.A O no hydrogen 2.785 N/A LEU 90.A N LYS 41.A O no hydrogen 2.868 N/A ILE 91.A N GLU 80.A O no hydrogen 2.835 N/A LEU 92.A N ALA 39.A O no hydrogen 2.718 N/A GLU 93.A N THR 77.A O no hydrogen 2.837 N/A GLY 97.A N LEU 146.A O no hydrogen 2.742 N/A LEU 100.A N ILE 144.A O no hydrogen 2.707 N/A PHE 101.A N PRO 141.A O no hydrogen 3.177 N/A PHE 103.A N GLU 99.A O no hydrogen 3.079 N/A LEU 104.A N LEU 100.A O no hydrogen 2.942 N/A ALA 105.A N PHE 101.A O no hydrogen 3.244 N/A GLU 106.A N PHE 103.A O no hydrogen 3.154 N/A LYS 107.A N PHE 103.A O no hydrogen 3.442 N/A LYS 107.A NZ GLU 114.A OE2 no hydrogen 3.512 N/A GLU 108.A N LEU 104.A O no hydrogen 2.792 N/A SER 109.A OG LEU 210.A O no hydrogen 3.205 N/A LEU 110.A N LEU 209.A O no hydrogen 3.146 N/A THR 111.A N GLU 114.A OE1 no hydrogen 3.034 N/A GLU 114.A N THR 111.A OG1 no hydrogen 2.976 N/A ALA 115.A N THR 111.A O no hydrogen 2.835 N/A THR 116.A N GLU 112.A O no hydrogen 2.811 N/A THR 116.A OG1 GLU 112.A O no hydrogen 2.873 N/A THR 116.A OG1 GLU 113.A O no hydrogen 3.065 N/A GLU 117.A N GLU 113.A O no hydrogen 2.850 N/A PHE 118.A N GLU 114.A O no hydrogen 3.271 N/A LEU 119.A N ALA 115.A O no hydrogen 2.745 N/A LYS 120.A N THR 116.A O no hydrogen 2.771 N/A GLN 121.A NE2 GLU 117.A O no hydrogen 3.142 N/A GLN 121.A NE2 PRO 154.A O no hydrogen 2.949 N/A ILE 122.A N PHE 118.A O no hydrogen 3.026 N/A LEU 123.A N LEU 119.A O no hydrogen 2.712 N/A ASN 124.A N LYS 120.A O no hydrogen 2.902 N/A GLY 125.A N GLN 121.A O no hydrogen 2.944 N/A VAL 126.A N ILE 122.A O no hydrogen 2.843 N/A TYR 127.A N LEU 123.A O no hydrogen 2.734 N/A TYR 128.A N ASN 124.A O no hydrogen 3.097 N/A LEU 129.A N GLY 125.A O no hydrogen 3.056 N/A HIS 130.A N VAL 126.A O no hydrogen 2.748 N/A HIS 130.A NE2 ASP 198.A OD2 no hydrogen 2.889 N/A SER 131.A N TYR 127.A O no hydrogen 2.891 N/A SER 131.A OG TYR 127.A O no hydrogen 2.640 N/A LEU 132.A N TYR 128.A O no hydrogen 3.271 N/A LEU 132.A N LEU 129.A O no hydrogen 2.956 N/A GLN 133.A N HIS 130.A O no hydrogen 2.934 N/A GLN 133.A NE2 ILE 167.A O no hydrogen 2.859 N/A ILE 134.A N LEU 129.A O no hydrogen 2.908 N/A ALA 135.A N HIS 165.A O no hydrogen 2.931 N/A HIS 136.A N ASP 198.A OD2 no hydrogen 2.838 N/A HIS 136.A NE2 ILE 159.A O no hydrogen 2.910 N/A PHE 137.A N ASP 198.A OD1 no hydrogen 2.847 N/A ASP 138.A N HIS 136.A ND1 no hydrogen 3.000 N/A LYS 140.A NZ THR 179.A OG1 no hydrogen 2.719 N/A GLU 142.A N GLU 142.A OE2 no hydrogen 2.701 N/A ASN 143.A N LYS 140.A O no hydrogen 2.863 N/A ASN 143.A ND2 ASP 138.A O no hydrogen 2.803 N/A ASN 143.A ND2 ASP 138.A OD2 no hydrogen 3.084 N/A ILE 144.A N PRO 141.A O no hydrogen 3.316 N/A MET 145.A N LYS 157.A O no hydrogen 2.923 N/A LEU 146.A N GLY 98.A O no hydrogen 2.853 N/A LEU 147.A N ARG 155.A O no hydrogen 2.729 N/A ASN 150.A N ASP 148.A OD1 no hydrogen 2.994 N/A ARG 155.A NE LYS 153.A O no hydrogen 3.167 N/A ARG 155.A NH2 LYS 153.A O no hydrogen 3.438 N/A ILE 156.A N GLN 121.A OE1 no hydrogen 2.944 N/A LYS 157.A N MET 145.A O no hydrogen 2.852 N/A LYS 157.A NZ VAL 75.A O no hydrogen 3.018 N/A LYS 157.A NZ GLU 93.A OE1 no hydrogen 2.740 N/A LYS 157.A NZ GLU 93.A OE2 no hydrogen 3.134 N/A ILE 158.A N ASN 74.A O no hydrogen 2.789 N/A ILE 159.A N ASN 143.A O no hydrogen 2.958 N/A ALA 164.A N PHE 161.A O no hydrogen 3.086 N/A HIS 165.A N ALA 135.A O no hydrogen 2.948 N/A HIS 165.A ND1 LEU 163.A O no hydrogen 2.869 N/A LYS 166.A NZ GLU 69.A OE1 no hydrogen 3.018 N/A LYS 166.A NZ LEU 132.A O no hydrogen 2.836 N/A ILE 167.A N GLN 133.A O no hydrogen 2.658 N/A GLU 172.A N LEU 193.A O no hydrogen 2.692 N/A LYS 174.A NZ HIS 165.A NE2 no hydrogen 3.136 N/A PHE 182.A N THR 179.A O no hydrogen 2.860 N/A VAL 183.A N THR 179.A O no hydrogen 3.226 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.773 N/A ILE 187.A N ALA 184.A O no hydrogen 2.937 N/A VAL 188.A N ALA 184.A O no hydrogen 3.159 N/A ASN 189.A N PRO 185.A O no hydrogen 2.843 N/A ASN 189.A ND2 PRO 185.A O no hydrogen 2.995 N/A ASN 189.A ND2 SER 229.A OG no hydrogen 2.889 N/A TYR 190.A N ILE 187.A O no hydrogen 3.108 N/A GLU 191.A N GLU 186.A O no hydrogen 2.884 N/A LEU 193.A N GLU 172.A O no hydrogen 2.821 N/A ALA 197.A N GLY 194.A O no hydrogen 3.214 N/A ASP 198.A N LEU 195.A O no hydrogen 3.135 N/A MET 199.A N GLU 196.A O no hydrogen 2.958 N/A TRP 200.A N GLU 196.A O no hydrogen 3.242 N/A SER 201.A N ALA 197.A O no hydrogen 3.218 N/A SER 201.A OG PHE 182.A O no hydrogen 2.795 N/A SER 201.A OG ALA 197.A O no hydrogen 3.318 N/A ILE 202.A N ASP 198.A O no hydrogen 2.994 N/A GLY 203.A N MET 199.A O no hydrogen 3.095 N/A VAL 204.A N TRP 200.A O no hydrogen 3.060 N/A ILE 205.A N SER 201.A O no hydrogen 2.919 N/A THR 206.A N ILE 202.A O no hydrogen 2.828 N/A THR 206.A OG1 ILE 202.A O no hydrogen 2.763 N/A TYR 207.A N GLY 203.A O no hydrogen 3.000 N/A TYR 207.A OH GLU 234.A O no hydrogen 2.614 N/A ILE 208.A N VAL 204.A O no hydrogen 3.008 N/A LEU 209.A N ILE 205.A O no hydrogen 2.821 N/A LEU 210.A N THR 206.A O no hydrogen 3.099 N/A SER 211.A N TYR 207.A O no hydrogen 3.097 N/A SER 211.A N ILE 208.A O no hydrogen 3.324 N/A SER 211.A OG TYR 207.A O no hydrogen 2.817 N/A GLY 212.A N ILE 208.A O no hydrogen 2.788 N/A ALA 213.A N SER 211.A OG no hydrogen 3.010 N/A SER 214.A OG GLU 181.A OE1 no hydrogen 2.847 N/A GLY 218.A N THR 224.A OG1 no hydrogen 2.885 N/A ASP 219.A N GLU 223.A OE1 no hydrogen 3.240 N/A GLN 222.A N GLN 222.A OE1 no hydrogen 2.861 N/A GLU 223.A N THR 220.A OG1 no hydrogen 3.206 N/A THR 224.A N THR 220.A O no hydrogen 3.069 N/A THR 224.A OG1 THR 220.A O no hydrogen 3.276 N/A LEU 225.A N LYS 221.A O no hydrogen 2.924 N/A ALA 226.A N GLN 222.A O no hydrogen 2.935 N/A ASN 227.A N GLU 223.A O no hydrogen 2.848 N/A ASN 227.A ND2 PHE 216.A O no hydrogen 3.013 N/A VAL 228.A N THR 224.A O no hydrogen 2.930 N/A SER 229.A N LEU 225.A O no hydrogen 3.075 N/A ALA 230.A N ALA 226.A O no hydrogen 3.183 N/A VAL 231.A N VAL 228.A O no hydrogen 3.039 N/A ASN 232.A N ASN 227.A O no hydrogen 2.854 N/A TYR 239.A N GLU 236.A O no hydrogen 2.989 N/A PHE 240.A N GLU 236.A O no hydrogen 2.871 N/A THR 243.A N PHE 240.A O no hydrogen 2.979 N/A SER 244.A N GLU 112.A OE2 no hydrogen 2.789 N/A SER 244.A OG GLU 112.A OE1 no hydrogen 2.753 N/A SER 244.A OG GLU 112.A OE2 no hydrogen 3.515 N/A ALA 247.A N SER 244.A OG no hydrogen 3.080 N/A LYS 248.A N SER 244.A O no hydrogen 3.260 N/A ASP 249.A N ALA 245.A O no hydrogen 2.842 N/A PHE 250.A N LEU 246.A O no hydrogen 3.000 N/A ILE 251.A N ALA 247.A O no hydrogen 3.169 N/A ARG 252.A N LYS 248.A O no hydrogen 2.829 N/A ARG 253.A N ASP 249.A O no hydrogen 3.023 N/A ARG 253.A NE ASP 249.A OD1 no hydrogen 2.867 N/A ARG 253.A NE ASP 249.A OD2 no hydrogen 3.353 N/A ARG 253.A NH2 ASP 249.A OD2 no hydrogen 3.057 N/A LEU 254.A N ILE 251.A O no hydrogen 3.001 N/A LEU 255.A N ILE 251.A O no hydrogen 2.947 N/A LYS 257.A NZ SER 229.A O no hydrogen 2.753 N/A LYS 260.A N ASP 258.A OD1 no hydrogen 3.077 N/A LYS 261.A N ASP 258.A O no hydrogen 2.991 N/A LYS 261.A NZ ASP 258.A OD2 no hydrogen 2.689 N/A ARG 262.A N PRO 259.A O no hydrogen 3.350 N/A ARG 262.A NE VAL 256.A O no hydrogen 2.914 N/A ARG 262.A NH1 GLU 186.A OE1 no hydrogen 3.555 N/A ARG 262.A NH1 GLU 186.A OE2 no hydrogen 2.807 N/A ARG 262.A NH1 GLU 196.A O no hydrogen 2.901 N/A ARG 262.A NH2 GLU 186.A OE1 no hydrogen 2.977 N/A ARG 262.A NH2 VAL 256.A O no hydrogen 2.831 N/A MET 263.A N ARG 253.A O no hydrogen 3.060 N/A THR 264.A N ASP 267.A OD2 no hydrogen 3.021 N/A ASP 267.A N THR 264.A OG1 no hydrogen 3.048 N/A SER 268.A N THR 264.A O no hydrogen 2.903 N/A SER 268.A OG.A ILE 265.A O no hydrogen 2.756 N/A SER 268.A OG.B THR 264.A O no hydrogen 3.072 N/A LEU 269.A N ILE 265.A O no hydrogen 3.158 N/A GLN 270.A N GLN 266.A O no hydrogen 3.261 N/A GLN 270.A N ASP 267.A O no hydrogen 3.193 N/A HIS 271.A N SER 268.A O no hydrogen 3.432 N/A HIS 271.A NE2 ASP 249.A OD1 no hydrogen 2.748 N/A TRP 273.A N HIS 271.A ND1 no hydrogen 2.991 N/A TRP 273.A NE1 GLU 112.A OE1 no hydrogen 2.932 N/A ILE 274.A N HIS 271.A O no hydrogen 2.846 N/A LYS 275.A N HIS 271.A O no hydrogen 2.820 N/A LYS 275.A NZ GLN 270.A OE1 no hydrogen 2.830 N/A