Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1f4f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N GLN 2.A OE1 no hydrogen 2.627 N/A GLN 2.A NE2 ARG 34.A O no hydrogen 3.078 N/A TYR 3.A OH VAL 169.A O no hydrogen 2.642 N/A GLU 5.A N LYS 1.A O no hydrogen 2.943 N/A LEU 6.A N GLN 2.A O no hydrogen 3.068 N/A MET 7.A N TYR 3.A O no hydrogen 2.957 N/A GLN 8.A N LEU 4.A O no hydrogen 2.952 N/A GLN 8.A NE2 GLN 8.A O no hydrogen 3.471 N/A GLN 8.A NE2 ASP 12.A OD1 no hydrogen 2.743 N/A LYS 9.A N GLU 5.A O no hydrogen 2.843 N/A LYS 9.A NZ GLU 13.A OE2 no hydrogen 3.231 N/A VAL 10.A N LEU 6.A O no hydrogen 2.988 N/A LEU 11.A N MET 7.A O no hydrogen 3.048 N/A ASP 12.A N GLN 8.A O no hydrogen 2.951 N/A GLU 13.A N LYS 9.A O no hydrogen 2.857 N/A GLY 14.A N VAL 10.A O no hydrogen 2.796 N/A THR 15.A N SER 27.A O no hydrogen 2.864 N/A LYS 17.A N THR 25.A O no hydrogen 2.708 N/A ASP 19.A N THR 23.A O no hydrogen 2.828 N/A GLY 22.A N ASP 19.A O no hydrogen 2.953 N/A THR 25.A N LYS 17.A O no hydrogen 3.255 N/A LEU 26.A N LEU 207.A O no hydrogen 2.842 N/A SER 27.A N THR 15.A O no hydrogen 2.918 N/A ILE 28.A N THR 205.A O no hydrogen 2.930 N/A GLY 30.A N GLY 203.A O no hydrogen 3.268 N/A GLN 32.A NE2 THR 201.A OG1 no hydrogen 3.026 N/A MET 33.A N TRP 200.A O no hydrogen 2.887 N/A ARG 34.A NH1 ASP 197.A OD2 no hydrogen 2.687 N/A PHE 35.A N PHE 198.A O no hydrogen 2.970 N/A LEU 37.A N GLY 196.A O no hydrogen 3.019 N/A GLN 38.A N ASN 36.A OD1 no hydrogen 3.001 N/A ASP 39.A N ASN 36.A O no hydrogen 2.838 N/A GLY 40.A N LEU 37.A O no hydrogen 3.245 N/A PHE 41.A N PRO 227.A O no hydrogen 2.874 N/A LEU 43.A N PHE 41.A O no hydrogen 2.831 N/A THR 46.A OG1 GLN 218.A OE1 no hydrogen 3.001 N/A LYS 47.A NZ PHE 170.A O no hydrogen 2.949 N/A CYS 49.A N TYR 251.A OH no hydrogen 2.890 N/A CYS 49.A SG VAL 44.A O no hydrogen 4.013 N/A CYS 49.A SG LYS 47.A O no hydrogen 3.763 N/A ARG 52.A NH1 ASN 74.A O no hydrogen 2.520 N/A ARG 52.A NH2 ASN 75.A O no hydrogen 2.658 N/A ILE 55.A N LEU 51.A O no hydrogen 2.841 N/A HIS 56.A N ARG 52.A O no hydrogen 3.122 N/A HIS 56.A ND1 TYR 70.A OH no hydrogen 2.746 N/A GLU 57.A N SER 53.A O no hydrogen 3.024 N/A LEU 58.A N ILE 54.A O no hydrogen 3.059 N/A LEU 59.A N ILE 55.A O no hydrogen 3.027 N/A TRP 60.A N HIS 56.A O no hydrogen 3.100 N/A TRP 60.A NE1 ASN 67.A O no hydrogen 2.808 N/A PHE 61.A N GLU 57.A O no hydrogen 2.821 N/A LEU 62.A N LEU 58.A O no hydrogen 2.943 N/A GLN 63.A N LEU 59.A O no hydrogen 3.097 N/A GLN 63.A N TRP 60.A O no hydrogen 3.154 N/A GLY 64.A N PHE 61.A O no hydrogen 2.794 N/A ASP 65.A N TRP 60.A O no hydrogen 3.382 N/A THR 66.A OG1 GLY 90.A O no hydrogen 3.313 N/A ASN 67.A N ASP 65.A OD1 no hydrogen 2.797 N/A ASN 67.A ND2 ASN 86.A O no hydrogen 2.948 N/A ASN 67.A ND2 ASP 88.A OD1 no hydrogen 2.649 N/A ILE 68.A N GLY 87.A O no hydrogen 2.900 N/A ALA 69.A N ASN 67.A OD1 no hydrogen 2.884 N/A HIS 72.A N ILE 68.A O no hydrogen 2.665 N/A GLU 73.A N ALA 69.A O no hydrogen 2.665 N/A ASN 74.A N TYR 70.A O no hydrogen 3.247 N/A ASN 74.A ND2 TYR 70.A O no hydrogen 2.954 N/A ASN 75.A N HIS 72.A O no hydrogen 2.955 N/A VAL 76.A N LEU 71.A O no hydrogen 2.785 N/A TRP 79.A NE1 GLU 57.A OE2 no hydrogen 2.720 N/A ASP 80.A N THR 77.A O no hydrogen 3.036 N/A TRP 82.A N TRP 79.A O no hydrogen 3.148 N/A ALA 83.A N ASP 80.A O no hydrogen 3.201 N/A ASP 84.A N ASP 88.A O no hydrogen 3.121 N/A ASN 86.A N ASP 84.A OD1 no hydrogen 2.839 N/A GLY 87.A N ASP 84.A O no hydrogen 3.001 N/A ASP 88.A N ASP 84.A OD1 no hydrogen 2.926 N/A LEU 89.A N THR 66.A O no hydrogen 3.065 N/A VAL 92.A N GLY 90.A O no hydrogen 2.886 N/A LYS 95.A N VAL 92.A O no hydrogen 2.774 N/A LYS 95.A NZ ALA 99.A O no hydrogen 2.770 N/A GLN 96.A NE2 PRO 91.A O no hydrogen 2.965 N/A GLN 96.A NE2 GLU 136.A OE1 no hydrogen 2.878 N/A TRP 97.A N TYR 93.A O no hydrogen 2.990 N/A ARG 98.A N GLY 94.A O no hydrogen 3.207 N/A ARG 98.A NE ASP 109.A OD1 no hydrogen 3.054 N/A ARG 98.A NE ASP 109.A OD2 no hydrogen 3.351 N/A ARG 98.A NH1 LEU 62.A O no hydrogen 2.843 N/A ARG 98.A NH2 ASP 109.A OD2 no hydrogen 3.007 N/A ALA 99.A N LYS 95.A O no hydrogen 2.717 N/A TRP 100.A N ILE 108.A O no hydrogen 3.084 N/A THR 102.A N ARG 106.A O no hydrogen 2.981 N/A THR 102.A OG1 ARG 106.A O no hydrogen 3.381 N/A GLY 105.A N THR 102.A O no hydrogen 3.363 N/A ARG 106.A N THR 102.A OG1 no hydrogen 3.154 N/A ILE 108.A N TRP 100.A O no hydrogen 2.815 N/A GLN 110.A N TRP 97.A O no hydrogen 2.865 N/A GLN 110.A NE2 GLN 96.A O no hydrogen 2.762 N/A GLN 110.A NE2 SER 130.A O no hydrogen 2.926 N/A ILE 111.A N TRP 97.A O no hydrogen 3.376 N/A THR 112.A N ASP 109.A OD1 no hydrogen 3.193 N/A THR 112.A OG1 ASP 109.A OD2 no hydrogen 2.707 N/A THR 113.A N ASP 109.A O no hydrogen 3.021 N/A THR 113.A OG1 ASP 109.A O no hydrogen 3.018 N/A VAL 114.A N GLN 110.A O no hydrogen 3.044 N/A LEU 115.A N ILE 111.A O no hydrogen 2.911 N/A ASN 116.A N THR 112.A O no hydrogen 2.948 N/A GLN 117.A N THR 113.A O no hydrogen 2.851 N/A GLN 117.A NE2 ARG 126.A O no hydrogen 3.036 N/A LEU 118.A N VAL 114.A O no hydrogen 2.806 N/A LYS 119.A N LEU 115.A O no hydrogen 3.049 N/A ASN 120.A N ASN 116.A O no hydrogen 2.864 N/A ASP 121.A N GLN 117.A O no hydrogen 2.736 N/A SER 124.A N ASP 121.A O no hydrogen 2.836 N/A ARG 126.A N SER 124.A OG no hydrogen 2.992 N/A VAL 129.A N PHE 149.A O no hydrogen 2.965 N/A SER 130.A N GLN 110.A OE1 no hydrogen 2.949 N/A ALA 131.A N ALA 147.A O no hydrogen 2.856 N/A TRP 132.A N SER 130.A OG no hydrogen 2.987 N/A ASN 133.A N ALA 131.A O no hydrogen 2.968 N/A ASN 133.A ND2 GLN 96.A OE1 no hydrogen 2.877 N/A GLU 136.A N ASN 133.A O no hydrogen 2.848 N/A LYS 139.A N GLU 136.A O no hydrogen 2.910 N/A LYS 139.A NZ GLU 136.A OE2 no hydrogen 3.107 N/A MET 140.A N LEU 137.A O no hydrogen 3.258 N/A ALA 141.A N LEU 89.A O no hydrogen 2.820 N/A CYS 145.A N TYR 93.A OH no hydrogen 2.701 N/A HIS 146.A N TYR 93.A OH no hydrogen 3.380 N/A HIS 146.A ND1 TYR 180.A OH no hydrogen 2.733 N/A ALA 147.A N TYR 163.A O no hydrogen 3.249 N/A PHE 149.A N VAL 129.A O no hydrogen 2.915 N/A GLN 150.A N GLN 161.A O no hydrogen 2.834 N/A PHE 151.A N ILE 127.A O no hydrogen 2.813 N/A TYR 152.A N SER 159.A O no hydrogen 3.034 N/A ALA 154.A N LYS 157.A O no hydrogen 3.179 N/A LYS 157.A N ALA 154.A O no hydrogen 3.020 N/A LEU 158.A N GLU 194.A O no hydrogen 2.705 N/A SER 159.A N TYR 152.A O no hydrogen 2.841 N/A SER 159.A OG ASP 197.A O no hydrogen 3.403 N/A CYS 160.A N ASP 197.A O no hydrogen 2.933 N/A CYS 160.A SG GLN 150.A O no hydrogen 3.738 N/A GLN 161.A N GLN 150.A O no hydrogen 2.729 N/A LEU 162.A N VAL 199.A O no hydrogen 2.949 N/A TYR 163.A N PHE 148.A O no hydrogen 2.793 N/A GLN 164.A N THR 201.A O no hydrogen 2.862 N/A GLN 164.A NE2 SER 166.A O no hydrogen 3.151 N/A GLN 164.A NE2 ASN 176.A OD1 no hydrogen 2.766 N/A ARG 165.A NE PRO 144.A O no hydrogen 2.789 N/A ARG 165.A NH2 ALA 143.A O no hydrogen 3.193 N/A ARG 165.A NH2 PRO 144.A O no hydrogen 3.553 N/A CYS 167.A N ASP 204.A O no hydrogen 2.937 N/A VAL 169.A N HIS 206.A O no hydrogen 2.950 N/A LEU 171.A N ASP 168.A OD1 no hydrogen 3.232 N/A GLY 172.A N ASP 168.A O no hydrogen 2.987 N/A LEU 173.A N ASP 168.A O no hydrogen 2.924 N/A ASN 176.A N GLY 172.A O no hydrogen 3.042 N/A ILE 177.A N LEU 173.A O no hydrogen 2.865 N/A ALA 178.A N PRO 174.A O no hydrogen 3.226 N/A SER 179.A N PHE 175.A O no hydrogen 2.885 N/A TYR 180.A N ASN 176.A O no hydrogen 3.197 N/A TYR 180.A OH HIS 146.A ND1 no hydrogen 2.733 N/A ALA 181.A N ILE 177.A O no hydrogen 3.054 N/A LEU 182.A N ALA 178.A O no hydrogen 2.967 N/A LEU 183.A N SER 179.A O no hydrogen 3.023 N/A VAL 184.A N TYR 180.A O no hydrogen 2.898 N/A HIS 185.A N ALA 181.A O no hydrogen 3.076 N/A MET 186.A N LEU 182.A O no hydrogen 3.017 N/A MET 187.A N LEU 183.A O no hydrogen 3.035 N/A ALA 188.A N VAL 184.A O no hydrogen 2.845 N/A GLN 189.A N HIS 185.A O no hydrogen 2.884 N/A GLN 189.A NE2 ARG 233.A O no hydrogen 3.101 N/A GLN 189.A NE2 TYR 241.A OH no hydrogen 2.512 N/A GLN 190.A N MET 186.A O no hydrogen 2.931 N/A GLN 190.A NE2 PRO 235.A O no hydrogen 3.099 N/A GLN 190.A NE2 TYR 241.A OH no hydrogen 2.914 N/A CYS 191.A N MET 187.A O no hydrogen 3.017 N/A CYS 191.A SG MET 187.A O no hydrogen 3.441 N/A ASP 192.A N GLN 189.A O no hydrogen 3.364 N/A LEU 193.A N ALA 188.A O no hydrogen 2.829 N/A GLU 194.A N GLY 156.A O no hydrogen 2.923 N/A GLY 196.A N LEU 158.A O no hydrogen 2.642 N/A ASP 197.A N SER 159.A OG no hydrogen 2.848 N/A PHE 198.A N PHE 35.A O no hydrogen 2.937 N/A VAL 199.A N CYS 160.A O no hydrogen 2.704 N/A TRP 200.A N MET 33.A O no hydrogen 2.784 N/A TRP 200.A NE1 GLN 164.A OE1 no hydrogen 2.798 N/A THR 201.A N LEU 162.A O no hydrogen 2.957 N/A THR 201.A OG1 GLN 161.A OE1 no hydrogen 2.761 N/A GLY 202.A N HIS 31.A O no hydrogen 2.903 N/A GLY 203.A N GLN 164.A O no hydrogen 2.779 N/A ASP 204.A N ARG 165.A O no hydrogen 2.992 N/A THR 205.A N ILE 28.A O no hydrogen 3.048 N/A THR 205.A OG1 GLY 203.A O no hydrogen 3.113 N/A HIS 206.A N CYS 167.A O no hydrogen 2.939 N/A HIS 206.A ND1 ASP 204.A OD1 no hydrogen 2.856 N/A LEU 207.A N LEU 26.A O no hydrogen 2.906 N/A SER 209.A N GLY 24.A O no hydrogen 2.890 N/A HIS 211.A N TYR 208.A O no hydrogen 2.888 N/A HIS 211.A NE2 PRO 260.A O no hydrogen 2.631 N/A MET 212.A N SER 209.A O no hydrogen 3.485 N/A GLN 214.A N GLN 214.A OE1 no hydrogen 2.740 N/A THR 215.A N HIS 211.A O no hydrogen 2.832 N/A THR 215.A OG1 HIS 211.A O no hydrogen 3.032 N/A HIS 216.A N MET 212.A O no hydrogen 3.018 N/A HIS 216.A ND1 MET 212.A O no hydrogen 2.953 N/A LEU 217.A N ASP 213.A O no hydrogen 2.861 N/A GLN 218.A N GLN 214.A O no hydrogen 2.931 N/A LEU 219.A N THR 215.A O no hydrogen 2.896 N/A SER 220.A N HIS 216.A O no hydrogen 3.175 N/A SER 220.A N LEU 217.A O no hydrogen 3.033 N/A SER 220.A OG LEU 217.A O no hydrogen 2.795 N/A ARG 221.A N GLN 218.A O no hydrogen 3.013 N/A ARG 221.A NH1 THR 46.A O no hydrogen 2.916 N/A ARG 221.A NH1 PRO 255.A O no hydrogen 2.781 N/A ARG 224.A N THR 45.A OG1 no hydrogen 2.805 N/A ARG 224.A NH1 ASP 252.A O no hydrogen 2.796 N/A LYS 228.A N GLU 249.A O no hydrogen 2.748 N/A ILE 230.A N GLU 247.A O no hydrogen 2.840 N/A LYS 232.A N ASP 245.A O no hydrogen 2.810 N/A ARG 233.A NE ASP 245.A OD1 no hydrogen 2.961 N/A ARG 233.A NH2 ASP 240.A O no hydrogen 2.980 N/A ARG 233.A NH2 ASP 245.A OD2 no hydrogen 2.741 N/A SER 237.A OG ASP 240.A OD2 no hydrogen 2.711 N/A PHE 239.A N SER 237.A OG no hydrogen 3.181 N/A ASP 240.A N SER 237.A O no hydrogen 3.027 N/A ARG 242.A N ASP 245.A OD2 no hydrogen 2.834 N/A ASP 245.A N ARG 242.A O no hydrogen 3.078 N/A PHE 246.A N PHE 243.A O no hydrogen 3.460 N/A GLU 247.A N ILE 230.A O no hydrogen 2.919 N/A GLU 249.A N LYS 228.A O no hydrogen 2.732 N/A TYR 251.A OH VAL 44.A O no hydrogen 2.808 N/A HIS 254.A N THR 45.A O no hydrogen 2.819 N/A HIS 254.A NE2 GLU 222.A O no hydrogen 2.711 N/A