Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f7j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ASP 7.A OD2 no hydrogen 2.525 N/A THR 3.A OG1 ASP 7.A OD2 no hydrogen 3.228 N/A SER 4.A N ASP 7.A OD2 no hydrogen 3.250 N/A LYS 6.A N SER 4.A OG no hydrogen 3.120 N/A LYS 6.A NZ GLY 44.A O no hydrogen 2.825 N/A ASP 7.A N SER 4.A O no hydrogen 3.220 N/A THR 8.A OG1 GLU 16.A OE1 no hydrogen 2.500 N/A VAL 9.A N MET 17.A O no hydrogen 2.770 N/A LEU 11.A N VAL 15.A O no hydrogen 2.807 N/A HIS 12.A NE2 LYS 158.A O no hydrogen 2.876 N/A ASN 13.A ND2 TYR 130.A OH no hydrogen 2.902 N/A ASN 13.A ND2 ARG 136.A O no hydrogen 2.991 N/A GLY 14.A N LEU 11.A O no hydrogen 2.910 N/A VAL 15.A N ASN 13.A OD1 no hydrogen 3.007 N/A MET 17.A N VAL 9.A O no hydrogen 2.821 N/A TRP 19.A N ASP 7.A O no hydrogen 3.042 N/A GLY 21.A N THR 229.A O no hydrogen 2.828 N/A LEU 22.A N SER 47.A O no hydrogen 2.909 N/A GLY 23.A N PRO 231.A O no hydrogen 3.090 N/A VAL 24.A N ASP 49.A O no hydrogen 2.869 N/A LYS 26.A NZ GLN 194.A OE1 no hydrogen 2.958 N/A VAL 27.A N VAL 24.A O no hydrogen 3.314 N/A GLU 28.A N GLU 32.A OE1 no hydrogen 3.122 N/A ALA 33.A N GLU 28.A O no hydrogen 3.018 N/A THR 34.A N GLY 30.A O no hydrogen 3.034 N/A THR 34.A OG1 GLY 30.A O no hydrogen 3.250 N/A THR 34.A OG1 GLY 59.A O no hydrogen 2.871 N/A GLU 35.A N ASN 31.A O no hydrogen 2.706 N/A SER 36.A N GLU 32.A O no hydrogen 3.105 N/A SER 36.A OG GLU 32.A O no hydrogen 2.928 N/A SER 36.A OG ILE 234.A O no hydrogen 3.350 N/A VAL 37.A N ALA 33.A O no hydrogen 3.054 N/A LYS 38.A N THR 34.A O no hydrogen 3.012 N/A LYS 38.A NZ GLU 66.A OE1 no hydrogen 3.182 N/A ALA 39.A N GLU 35.A O no hydrogen 3.163 N/A ALA 40.A N SER 36.A O no hydrogen 2.925 N/A ILE 41.A N VAL 37.A O no hydrogen 2.985 N/A LYS 42.A N LYS 38.A O no hydrogen 2.879 N/A ASN 43.A N ALA 39.A O no hydrogen 3.104 N/A ASN 43.A ND2 ALA 39.A O no hydrogen 2.685 N/A ASN 43.A ND2 GLU 236.A OE2 no hydrogen 3.030 N/A GLY 44.A N ILE 41.A O no hydrogen 3.119 N/A TYR 45.A N ALA 40.A O no hydrogen 2.902 N/A TYR 45.A OH ILE 239.A O no hydrogen 2.792 N/A ARG 46.A NH1 ILE 41.A O no hydrogen 2.928 N/A ARG 46.A NH1 TYR 45.A O no hydrogen 2.889 N/A ILE 48.A N PHE 75.A O no hydrogen 3.013 N/A ASP 49.A N LEU 22.A O no hydrogen 2.839 N/A THR 50.A N THR 77.A O no hydrogen 3.061 N/A THR 50.A OG1 ASN 56.A OD1 no hydrogen 2.560 N/A ALA 51.A N THR 50.A OG1 no hydrogen 2.702 N/A TYR 54.A N ALA 51.A O no hydrogen 2.979 N/A LYS 55.A N ALA 52.A O no hydrogen 3.185 N/A ASN 56.A ND2 VAL 24.A O no hydrogen 2.853 N/A ASN 56.A ND2 VAL 27.A O no hydrogen 2.806 N/A GLY 59.A N ASN 29.A OD1 no hydrogen 2.942 N/A VAL 60.A N ASN 56.A O no hydrogen 2.853 N/A GLY 61.A N GLU 57.A O no hydrogen 2.933 N/A ILE 62.A N GLU 58.A O no hydrogen 3.201 N/A GLY 63.A N GLY 59.A O no hydrogen 2.981 N/A ILE 64.A N VAL 60.A O no hydrogen 2.982 N/A LYS 65.A N GLY 61.A O no hydrogen 2.991 N/A LYS 65.A NZ GLN 102.A OE1 no hydrogen 3.421 N/A GLU 66.A N ILE 62.A O no hydrogen 2.801 N/A SER 67.A N ILE 64.A O no hydrogen 3.208 N/A SER 67.A OG ILE 64.A O no hydrogen 2.766 N/A VAL 69.A N SER 67.A OG no hydrogen 3.292 N/A ARG 71.A NH1 TYR 105.A O no hydrogen 3.095 N/A ARG 71.A NH1 ASP 107.A OD2 no hydrogen 2.605 N/A ARG 71.A NH2 ARG 71.A O no hydrogen 2.890 N/A ARG 71.A NH2 LEU 74.A O no hydrogen 2.911 N/A ARG 71.A NH2 ASP 107.A OD2 no hydrogen 2.654 N/A GLU 73.A N ALA 70.A O no hydrogen 3.058 N/A LEU 74.A N ARG 71.A O no hydrogen 3.037 N/A PHE 75.A N ARG 46.A O no hydrogen 2.715 N/A ILE 76.A N ASP 107.A OD2 no hydrogen 2.775 N/A THR 77.A N ILE 48.A O no hydrogen 3.111 N/A SER 78.A N LEU 108.A O no hydrogen 3.108 N/A SER 78.A OG GLU 57.A OE2 no hydrogen 2.782 N/A LYS 79.A N SER 78.A OG no hydrogen 2.585 N/A LYS 79.A NZ ASP 49.A OD1 no hydrogen 3.384 N/A LYS 79.A NZ ASP 49.A OD2 no hydrogen 2.639 N/A LYS 79.A NZ THR 50.A O no hydrogen 2.735 N/A LYS 79.A NZ TYR 54.A OH no hydrogen 3.012 N/A VAL 80.A N LEU 110.A O no hydrogen 2.898 N/A ASP 84.A N TRP 81.A O no hydrogen 2.850 N/A GLN 85.A N ASN 82.A O no hydrogen 3.083 N/A GLN 85.A NE2 TRP 113.A O no hydrogen 2.728 N/A GLY 86.A N THR 122.A OG1 no hydrogen 3.005 N/A THR 89.A OG1 ASP 84.A O no hydrogen 2.840 N/A THR 89.A OG1 GLN 85.A O no hydrogen 3.114 N/A THR 90.A N GLY 86.A O no hydrogen 3.062 N/A THR 90.A OG1 ASP 84.A O no hydrogen 3.315 N/A THR 90.A OG1 GLY 86.A O no hydrogen 2.715 N/A LEU 91.A N TYR 87.A O no hydrogen 3.232 N/A ALA 92.A N GLU 88.A O no hydrogen 3.065 N/A ALA 93.A N THR 89.A O no hydrogen 2.869 N/A PHE 94.A N THR 90.A O no hydrogen 2.881 N/A GLU 95.A N LEU 91.A O no hydrogen 3.297 N/A LYS 96.A N ALA 92.A O no hydrogen 3.159 N/A SER 97.A N ALA 93.A O no hydrogen 2.953 N/A SER 97.A OG GLU 57.A OE1 no hydrogen 3.230 N/A SER 97.A OG GLU 57.A OE2 no hydrogen 2.551 N/A LEU 98.A N PHE 94.A O no hydrogen 2.933 N/A GLU 99.A N GLU 95.A O no hydrogen 2.982 N/A ARG 100.A N LYS 96.A O no hydrogen 2.847 N/A ARG 100.A NE GLU 57.A OE1 no hydrogen 2.666 N/A ARG 100.A NH1 GLU 57.A OE1 no hydrogen 2.733 N/A LEU 101.A N SER 97.A O no hydrogen 2.748 N/A GLN 102.A N GLU 99.A O no hydrogen 3.375 N/A LEU 103.A N LEU 98.A O no hydrogen 3.069 N/A LEU 106.A N LYS 134.A O no hydrogen 3.107 N/A ASP 107.A N ILE 76.A O no hydrogen 2.981 N/A LEU 108.A N ILE 76.A O no hydrogen 3.151 N/A TYR 109.A N ALA 137.A O no hydrogen 3.347 N/A LEU 110.A N SER 78.A O no hydrogen 3.043 N/A ILE 111.A N GLY 139.A O no hydrogen 3.107 N/A HIS 112.A N VAL 80.A O no hydrogen 3.202 N/A LYS 116.A N PHE 276.A O no hydrogen 3.108 N/A LYS 120.A NZ GLU 150.A OE2 no hydrogen 2.215 N/A THR 122.A N LYS 118.A O no hydrogen 3.005 N/A THR 122.A OG1 LYS 118.A O no hydrogen 2.624 N/A TRP 123.A N TYR 119.A O no hydrogen 2.741 N/A TRP 123.A NE1 ILE 157.A O no hydrogen 2.917 N/A ARG 124.A N LYS 120.A O no hydrogen 3.116 N/A ARG 124.A NH2 ASP 121.A OD2 no hydrogen 3.120 N/A ALA 125.A N ASP 121.A O no hydrogen 3.267 N/A LEU 126.A N THR 122.A O no hydrogen 3.184 N/A GLU 127.A N TRP 123.A O no hydrogen 2.883 N/A LYS 128.A N ARG 124.A O no hydrogen 3.040 N/A LYS 128.A NZ ASP 132.A OD2 no hydrogen 2.556 N/A LEU 129.A N ALA 125.A O no hydrogen 2.982 N/A TYR 130.A N LEU 126.A O no hydrogen 2.900 N/A LYS 131.A N GLU 127.A O no hydrogen 2.931 N/A LYS 131.A NZ GLU 127.A O no hydrogen 2.821 N/A ASP 132.A N LYS 128.A O no hydrogen 2.857 N/A GLY 133.A N TYR 130.A O no hydrogen 2.976 N/A LYS 134.A N LEU 129.A O no hydrogen 2.988 N/A LYS 134.A NZ GLU 95.A OE1 no hydrogen 3.353 N/A ARG 136.A N LEU 106.A O no hydrogen 3.076 N/A ARG 136.A NH1 ASP 107.A OD1 no hydrogen 3.004 N/A GLY 139.A N TYR 109.A O no hydrogen 3.194 N/A VAL 140.A N VAL 161.A O no hydrogen 2.890 N/A SER 141.A N ILE 111.A O no hydrogen 2.731 N/A SER 141.A OG GLN 163.A O no hydrogen 2.779 N/A ASN 142.A N GLN 163.A O no hydrogen 2.913 N/A ASN 142.A ND2 HIS 112.A O no hydrogen 2.960 N/A PHE 143.A N ASN 162.A OD1 no hydrogen 3.309 N/A GLN 144.A N HIS 147.A ND1 no hydrogen 2.936 N/A GLN 144.A NE2 ASP 272.A OD2 no hydrogen 2.798 N/A HIS 146.A NE2 ASP 272.A OD1 no hydrogen 2.738 N/A LEU 148.A N GLN 144.A O no hydrogen 3.074 N/A GLU 149.A N VAL 145.A O no hydrogen 3.000 N/A GLU 150.A N HIS 146.A O no hydrogen 3.010 N/A LEU 151.A N HIS 147.A O no hydrogen 2.948 N/A LEU 152.A N LEU 148.A O no hydrogen 2.762 N/A LYS 153.A N GLU 149.A O no hydrogen 3.328 N/A LYS 153.A N GLU 150.A O no hydrogen 3.234 N/A ASP 154.A N LEU 151.A O no hydrogen 3.274 N/A ALA 155.A N LEU 151.A O no hydrogen 3.080 N/A GLU 156.A N GLU 127.A OE2 no hydrogen 2.782 N/A ILE 157.A N GLU 127.A OE2 no hydrogen 2.931 N/A LYS 158.A NZ GLN 182.A O no hydrogen 2.974 N/A LYS 158.A NZ GLN 182.A OE1 no hydrogen 3.063 N/A MET 160.A N ILE 138.A O no hydrogen 2.798 N/A ASN 162.A N GLN 185.A O no hydrogen 2.866 N/A ASN 162.A ND2 PHE 143.A O no hydrogen 2.950 N/A GLN 163.A N VAL 140.A O no hydrogen 2.990 N/A GLN 163.A NE2 ASP 49.A OD1 no hydrogen 2.779 N/A GLN 163.A NE2 GLU 187.A OE2 no hydrogen 2.905 N/A VAL 164.A N GLU 187.A O no hydrogen 2.761 N/A PHE 166.A N TRP 189.A O no hydrogen 3.455 N/A HIS 167.A N LEU 170.A O no hydrogen 3.134 N/A HIS 167.A NE2 GLU 165.A OE1 no hydrogen 2.765 N/A ARG 169.A N HIS 167.A ND1 no hydrogen 3.179 N/A ARG 169.A NH1 LEU 261.A O no hydrogen 2.645 N/A LEU 170.A N HIS 167.A O no hydrogen 2.897 N/A THR 171.A N ASN 262.A OD1 no hydrogen 3.040 N/A GLN 172.A NE2 GLU 165.A O no hydrogen 2.836 N/A LYS 173.A NZ ASP 177.A OD1 no hydrogen 2.942 N/A LYS 173.A NZ ASP 177.A OD2 no hydrogen 3.247 N/A ARG 176.A N GLN 172.A O no hydrogen 2.788 N/A ARG 176.A NE THR 171.A O no hydrogen 2.817 N/A ARG 176.A NH2 THR 171.A O no hydrogen 2.847 N/A ASP 177.A N LYS 173.A O no hydrogen 3.146 N/A TYR 178.A N GLU 174.A O no hydrogen 2.964 N/A CYS 179.A N LEU 175.A O no hydrogen 2.900 N/A CYS 179.A SG LEU 175.A O no hydrogen 3.429 N/A LYS 180.A N ARG 176.A O no hydrogen 2.944 N/A GLY 181.A N ASP 177.A O no hydrogen 3.148 N/A GLN 182.A N TYR 178.A O no hydrogen 3.104 N/A GLN 182.A N CYS 179.A O no hydrogen 3.074 N/A GLY 183.A N LYS 180.A O no hydrogen 3.078 N/A ILE 184.A N CYS 179.A O no hydrogen 2.942 N/A GLN 185.A N MET 160.A O no hydrogen 3.177 N/A GLN 185.A NE2 LEU 186.A O no hydrogen 2.859 N/A GLN 185.A NE2 GLY 226.A O no hydrogen 2.951 N/A GLU 187.A N ASN 162.A O no hydrogen 2.980 N/A ALA 188.A N VAL 228.A O no hydrogen 2.871 N/A TRP 189.A N VAL 164.A O no hydrogen 2.748 N/A MET 193.A N SER 190.A O no hydrogen 3.020 N/A GLN 194.A NE2 SER 190.A OG.A no hydrogen 3.275 N/A GLN 194.A NE2 SER 190.A OG.B no hydrogen 3.110 N/A GLY 195.A N LEU 192.A O no hydrogen 2.972 N/A GLN 196.A N MET 193.A O no hydrogen 3.068 N/A LEU 198.A N GLY 195.A O no hydrogen 3.301 N/A ASN 200.A N LEU 197.A O no hydrogen 2.930 N/A LEU 203.A N ASN 200.A OD1 no hydrogen 2.959 N/A THR 204.A N ASN 200.A O no hydrogen 2.884 N/A THR 204.A OG1 ASN 200.A O no hydrogen 3.102 N/A THR 204.A OG1 GLU 201.A O no hydrogen 2.701 N/A GLN 205.A N GLU 201.A O no hydrogen 3.208 N/A ILE 206.A N VAL 202.A O no hydrogen 3.342 N/A ALA 207.A N LEU 203.A O no hydrogen 2.872 N/A GLU 208.A N THR 204.A O no hydrogen 2.782 N/A LYS 209.A N GLN 205.A O no hydrogen 3.046 N/A LYS 209.A NZ ASP 254.A OD1 no hydrogen 3.291 N/A LYS 209.A NZ ASP 254.A OD2 no hydrogen 2.712 N/A HIS 210.A N ILE 206.A O no hydrogen 3.081 N/A HIS 210.A NE2 ASP 254.A OD1 no hydrogen 3.325 N/A ASN 211.A N GLU 208.A O no hydrogen 3.017 N/A LYS 212.A N ALA 207.A O no hydrogen 2.872 N/A LYS 212.A NZ ASP 244.A O no hydrogen 3.010 N/A LYS 212.A NZ ASP 247.A OD1 no hydrogen 2.721 N/A LYS 212.A NZ ASP 247.A OD2 no hydrogen 3.427 N/A SER 213.A N GLN 216.A OE1 no hydrogen 2.781 N/A SER 213.A OG GLU 241.A OE2 no hydrogen 2.330 N/A GLN 216.A N SER 213.A OG no hydrogen 3.241 N/A GLN 216.A NE2 GLU 241.A O no hydrogen 2.755 N/A VAL 217.A N SER 213.A O no hydrogen 3.003 N/A ILE 218.A N VAL 214.A O no hydrogen 2.991 N/A LEU 219.A N ALA 215.A O no hydrogen 3.070 N/A ARG 220.A N GLN 216.A O no hydrogen 2.992 N/A ARG 220.A NE GLN 224.A OE1 no hydrogen 2.963 N/A ARG 220.A NH2 ILE 245.A O no hydrogen 2.914 N/A TRP 221.A N VAL 217.A O no hydrogen 2.910 N/A TRP 221.A NE1 ASP 259.A OD1 no hydrogen 2.930 N/A ASP 222.A N ILE 218.A O no hydrogen 2.888 N/A LEU 223.A N LEU 219.A O no hydrogen 3.031 N/A GLN 224.A N ARG 220.A O no hydrogen 2.865 N/A GLN 224.A NE2 LEU 250.A O no hydrogen 2.877 N/A HIS 225.A N TRP 221.A O no hydrogen 2.949 N/A HIS 225.A NE2 ASP 259.A OD1 no hydrogen 2.782 N/A GLY 226.A N LEU 223.A O no hydrogen 2.974 N/A VAL 227.A N ASP 222.A O no hydrogen 3.087 N/A VAL 228.A N LEU 186.A O no hydrogen 3.178 N/A THR 229.A N TRP 19.A O no hydrogen 2.919 N/A THR 229.A OG1 ASP 222.A OD2 no hydrogen 2.745 N/A LYS 232.A NZ PHE 25.A O no hydrogen 3.434 N/A ILE 239.A N LYS 235.A O no hydrogen 2.871 N/A ILE 240.A N GLU 236.A O no hydrogen 2.881 N/A GLU 241.A N HIS 237.A O no hydrogen 3.019 N/A ASN 242.A N ARG 238.A O no hydrogen 2.903 N/A ALA 243.A N ILE 240.A O no hydrogen 3.339 N/A ASP 244.A N GLU 241.A O no hydrogen 2.972 N/A LEU 250.A N GLN 224.A OE1 no hydrogen 2.964 N/A SER 251.A N ASP 254.A OD1 no hydrogen 2.866 N/A SER 251.A OG GLU 253.A OE1 no hydrogen 3.510 N/A SER 251.A OG ASP 254.A OD1 no hydrogen 2.627 N/A GLN 252.A NE2 ASP 256.A OD1 no hydrogen 3.104 N/A ASP 254.A N SER 251.A OG no hydrogen 3.163 N/A MET 255.A N SER 251.A O no hydrogen 3.013 N/A ASP 256.A N GLN 252.A O no hydrogen 2.965 N/A LYS 257.A N GLU 253.A O no hydrogen 2.987 N/A ILE 258.A N ASP 254.A O no hydrogen 2.977 N/A ASP 259.A N MET 255.A O no hydrogen 3.014 N/A ALA 260.A N ASP 256.A O no hydrogen 3.099 N/A ALA 260.A N LYS 257.A O no hydrogen 3.301 N/A LEU 261.A N ILE 258.A O no hydrogen 2.993 N/A ASN 262.A N ASP 259.A O no hydrogen 3.290 N/A ASN 262.A ND2 ASP 264.A OD1 no hydrogen 3.194 N/A LYS 263.A N ARG 169.A O no hydrogen 3.000 N/A ASP 264.A N ASN 262.A OD1 no hydrogen 3.265 N/A GLU 265.A N ARG 169.A O no hydrogen 2.968 N/A VAL 267.A N GLU 165.A OE1 no hydrogen 2.730 N/A GLY 268.A N GLU 165.A OE2 no hydrogen 2.945 N/A ASP 272.A N ASN 270.A OD1 no hydrogen 2.851 N/A GLU 273.A N ASN 270.A O no hydrogen 2.758 N/A LEU 274.A N ASN 270.A O no hydrogen 2.956 N/A LEU 275.A N GLU 273.A O no hydrogen 2.940 N/A