Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fe4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 4.A N GLU 1.A O no hydrogen 3.395 N/A GLN 6.A N HIS 3.A O no hydrogen 2.940 N/A TYR 8.A N TRP 4.A O no hydrogen 2.889 N/A CYS 11.A N TYR 8.A O no hydrogen 2.945 N/A GLY 12.A N PRO 9.A O no hydrogen 3.016 N/A GLY 13.A N ALA 10.A O no hydrogen 2.962 N/A ARG 15.A N GLU 191.A OE2 no hydrogen 2.801 N/A ARG 15.A NH1 GLU 191.A O no hydrogen 3.499 N/A ARG 15.A NH2 GLU 191.A O no hydrogen 3.438 N/A GLN 16.A NE2 CYS 189.A O no hydrogen 3.226 N/A GLN 16.A NE2 GLU 191.A OE2 no hydrogen 2.986 N/A SER 17.A N SER 183.A OG no hydrogen 2.954 N/A SER 17.A OG TYR 180.A OH no hydrogen 2.938 N/A SER 17.A OG SER 183.A O no hydrogen 3.282 N/A LEU 21.A N THR 92.A O no hydrogen 2.855 N/A ARG 23.A N ASP 94.A OD1 no hydrogen 2.851 N/A ARG 23.A NE ASP 94.A OD2 no hydrogen 2.545 N/A ARG 23.A NH2 ASP 94.A OD2 no hydrogen 2.542 N/A LYS 25.A N GLN 22.A O no hydrogen 2.984 N/A VAL 26.A N ARG 23.A O no hydrogen 3.438 N/A ARG 27.A N VAL 239.A O no hydrogen 2.860 N/A ARG 27.A NE GLU 240.A OE2 no hydrogen 3.037 N/A ARG 27.A NH2 GLU 240.A OE2 no hydrogen 2.948 N/A ASN 29.A N SER 241.A O no hydrogen 2.832 N/A ASN 29.A ND2 GLU 240.A OE1 no hydrogen 2.770 N/A SER 31.A N ASN 29.A OD1 no hydrogen 2.916 N/A SER 31.A OG ASN 29.A OD1 no hydrogen 2.690 N/A LEU 32.A N ASN 29.A O no hydrogen 2.953 N/A THR 38.A N ARG 65.A O no hydrogen 2.849 N/A THR 38.A OG1 ARG 65.A O no hydrogen 3.550 N/A TYR 40.A OH HIS 106.A NE2 no hydrogen 2.724 N/A GLU 41.A N GLU 41.A OE1 no hydrogen 2.785 N/A GLN 43.A N LEU 164.A O no hydrogen 3.189 N/A GLY 45.A N THR 162.A O no hydrogen 3.051 N/A PHE 47.A N LEU 161.A O no hydrogen 2.876 N/A MET 49.A N THR 159.A O no hydrogen 2.832 N/A VAL 50.A N GLN 57.A O no hydrogen 2.900 N/A ASN 51.A N GLN 157.A O no hydrogen 3.179 N/A ASN 51.A ND2 ILE 152.A O no hydrogen 2.982 N/A ASN 51.A ND2 LEU 217.A O no hydrogen 3.001 N/A ASN 52.A N THR 55.A O no hydrogen 3.151 N/A GLY 53.A N ASN 51.A OD1 no hydrogen 2.822 N/A HIS 54.A N ASN 52.A OD1 no hydrogen 2.760 N/A THR 55.A N ASN 52.A OD1 no hydrogen 2.653 N/A THR 55.A OG1 VAL 56.A O no hydrogen 3.196 N/A THR 55.A OG1 PHE 81.A O no hydrogen 2.786 N/A GLN 57.A N VAL 50.A O no hydrogen 2.947 N/A ILE 58.A N MET 79.A O no hydrogen 2.797 N/A SER 59.A N PRO 48.A O no hydrogen 2.903 N/A LEU 60.A N GLN 77.A O no hydrogen 2.922 N/A MET 64.A N PRO 61.A O no hydrogen 3.044 N/A ARG 65.A N THR 38.A O no hydrogen 3.021 N/A ARG 65.A NE SER 62.A O no hydrogen 2.774 N/A ARG 65.A NH2 SER 62.A O no hydrogen 3.037 N/A MET 66.A N TYR 74.A O no hydrogen 2.980 N/A THR 67.A N LEU 35.A O no hydrogen 3.159 N/A THR 67.A N ASN 36.A O no hydrogen 3.317 N/A VAL 68.A N THR 72.A O no hydrogen 3.066 N/A GLY 71.A N VAL 68.A O no hydrogen 2.915 N/A THR 72.A N ASP 70.A OD1 no hydrogen 3.006 N/A THR 72.A OG1 ASP 70.A OD1 no hydrogen 2.761 N/A THR 72.A OG1 ASP 70.A OD2 no hydrogen 3.531 N/A TYR 74.A N MET 66.A O no hydrogen 2.811 N/A ILE 75.A N TYR 107.A O no hydrogen 2.775 N/A ALA 76.A N MET 64.A O no hydrogen 2.850 N/A GLN 77.A N VAL 105.A O no hydrogen 2.775 N/A GLN 78.A N VAL 105.A O no hydrogen 3.401 N/A MET 79.A N ILE 58.A O no hydrogen 2.882 N/A HIS 80.A N HIS 103.A O no hydrogen 2.914 N/A HIS 80.A ND1 GLN 78.A OE1 no hydrogen 2.801 N/A PHE 81.A N THR 55.A OG1 no hydrogen 3.283 N/A HIS 82.A N GLU 101.A O no hydrogen 2.806 N/A TRP 83.A NE1 ILE 224.A O no hydrogen 2.975 N/A SER 89.A N HIS 98.A O no hydrogen 2.940 N/A SER 89.A OG HIS 91.A O no hydrogen 2.876 N/A SER 89.A OG HIS 98.A O no hydrogen 3.406 N/A GLU 90.A N GLU 101.A OE1 no hydrogen 3.001 N/A HIS 91.A N GLU 101.A OE1 no hydrogen 2.854 N/A HIS 91.A ND1 GLU 101.A OE2 no hydrogen 2.806 N/A HIS 91.A NE2 TYR 180.A OH no hydrogen 2.627 N/A THR 92.A N ILE 19.A O no hydrogen 3.329 N/A THR 92.A OG1 ASN 20.A OD1 no hydrogen 2.663 N/A VAL 93.A N ILE 96.A O no hydrogen 2.909 N/A ASP 94.A N LEU 21.A O no hydrogen 2.835 N/A GLY 95.A N ASN 20.A OD1 no hydrogen 2.744 N/A ILE 96.A N VAL 93.A O no hydrogen 2.858 N/A ARG 97.A NH1 SER 89.A O no hydrogen 2.755 N/A ARG 97.A NH1 GLU 90.A O no hydrogen 3.544 N/A HIS 98.A N SER 89.A OG no hydrogen 2.698 N/A GLU 101.A N HIS 82.A O no hydrogen 2.943 N/A ILE 102.A N ALA 129.A O no hydrogen 2.779 N/A HIS 103.A N HIS 80.A O no hydrogen 2.989 N/A HIS 103.A NE2 GLU 101.A OE2 no hydrogen 2.571 N/A ILE 104.A N LEU 127.A O no hydrogen 2.862 N/A VAL 105.A N GLN 78.A O no hydrogen 2.787 N/A HIS 106.A N ALA 125.A O no hydrogen 2.702 N/A HIS 106.A ND1 ILE 104.A O no hydrogen 3.126 N/A HIS 106.A NE2 TYR 40.A OH no hydrogen 2.724 N/A TYR 107.A N ILE 75.A O no hydrogen 2.851 N/A ASN 108.A N GLY 123.A O no hydrogen 2.756 N/A ASN 108.A ND2 ASP 122.A O no hydrogen 2.779 N/A SER 109.A N VAL 73.A O no hydrogen 2.874 N/A SER 109.A OG VAL 73.A O no hydrogen 3.161 N/A LYS 110.A N ASN 108.A OD1 no hydrogen 3.089 N/A TYR 111.A N ASN 108.A O no hydrogen 3.017 N/A TYR 111.A OH PRO 121.A O no hydrogen 3.002 N/A ILE 116.A N SER 113.A OG no hydrogen 3.166 N/A ALA 117.A N SER 113.A O no hydrogen 3.032 N/A GLN 118.A N TYR 114.A O no hydrogen 2.960 N/A GLN 118.A NE2 TYR 114.A O no hydrogen 3.484 N/A ASP 119.A N ILE 116.A O no hydrogen 3.258 N/A ALA 120.A N ALA 117.A O no hydrogen 3.022 N/A GLY 123.A N ALA 120.A O no hydrogen 3.184 N/A LEU 124.A N ASN 192.A O no hydrogen 3.048 N/A ALA 125.A N HIS 106.A O no hydrogen 2.959 N/A VAL 126.A N HIS 194.A O no hydrogen 3.088 N/A LEU 127.A N ILE 104.A O no hydrogen 2.942 N/A ALA 128.A N PHE 196.A O no hydrogen 2.715 N/A ALA 129.A N ILE 102.A O no hydrogen 2.972 N/A VAL 131.A N ILE 100.A O no hydrogen 2.963 N/A GLU 132.A N VAL 202.A O no hydrogen 2.906 N/A ASN 139.A N GLN 208.A OE1 no hydrogen 2.896 N/A ASN 139.A ND2 LYS 203.A O no hydrogen 2.988 N/A TYR 141.A N ASN 139.A OD1 no hydrogen 3.009 N/A TYR 142.A N ASN 139.A O no hydrogen 3.043 N/A TYR 142.A OH MET 169.A O no hydrogen 2.751 N/A SER 143.A N THR 140.A O no hydrogen 3.261 N/A SER 143.A OG GLU 138.A OE2 no hydrogen 2.643 N/A SER 143.A OG THR 140.A O no hydrogen 3.358 N/A ILE 146.A N TYR 142.A O no hydrogen 2.873 N/A SER 147.A N SER 143.A O no hydrogen 3.042 N/A SER 147.A OG.A SER 143.A O no hydrogen 3.024 N/A SER 147.A OG.B SER 143.A O no hydrogen 3.403 N/A SER 147.A OG.B ASN 144.A O no hydrogen 2.676 N/A HIS 148.A N ASN 144.A O no hydrogen 3.020 N/A HIS 148.A N PHE 145.A O no hydrogen 3.097 N/A HIS 148.A ND1 ASN 144.A O no hydrogen 2.742 N/A LEU 149.A N ILE 146.A O no hydrogen 3.097 N/A ASN 151.A N HIS 148.A O no hydrogen 2.935 N/A ILE 152.A N LEU 149.A O no hydrogen 3.006 N/A TYR 154.A N GLN 157.A OE1 no hydrogen 2.924 N/A GLY 156.A N ASN 51.A O no hydrogen 2.673 N/A GLN 157.A N TYR 154.A O no hydrogen 3.044 N/A THR 159.A N MET 49.A O no hydrogen 2.894 N/A LEU 161.A N PHE 47.A O no hydrogen 3.073 N/A LEU 164.A N GLN 43.A O no hydrogen 3.151 N/A GLN 167.A N TYR 40.A O no hydrogen 2.983 N/A ASP 168.A N ASP 165.A OD1 no hydrogen 3.192 N/A MET 169.A N ASP 165.A O no hydrogen 3.135 N/A MET 169.A N VAL 166.A O no hydrogen 2.993 N/A LEU 170.A N GLN 167.A O no hydrogen 3.176 N/A ASN 173.A N ASP 200.A OD2 no hydrogen 2.997 N/A ASN 173.A ND2 HIS 176.A ND1 no hydrogen 3.046 N/A GLN 175.A N ASN 173.A OD1 no hydrogen 2.636 N/A HIS 176.A N ASN 173.A OD1 no hydrogen 3.222 N/A TYR 177.A N ASN 242.A OD1 no hydrogen 2.963 N/A TYR 177.A OH LYS 33.A O no hydrogen 2.866 N/A TYR 178.A N VAL 197.A O no hydrogen 2.798 N/A THR 179.A N GLU 240.A O no hydrogen 2.868 N/A THR 179.A OG1 HIS 194.A NE2 no hydrogen 2.972 N/A THR 179.A OG1 TRP 195.A O no hydrogen 2.783 N/A TYR 180.A N TRP 195.A O no hydrogen 3.174 N/A TYR 180.A OH SER 17.A OG no hydrogen 2.938 N/A TYR 180.A OH HIS 91.A NE2 no hydrogen 2.627 N/A GLY 182.A N VAL 193.A O no hydrogen 2.863 N/A SER 183.A N SER 17.A OG no hydrogen 2.830 N/A SER 183.A OG LEU 184.A O no hydrogen 2.807 N/A LEU 184.A N THR 190.A O no hydrogen 3.047 N/A THR 185.A OG1 GLU 90.A OE2 no hydrogen 2.612 N/A CYS 189.A N THR 186.A O no hydrogen 2.759 N/A ASN 192.A ND2 GLN 118.A O no hydrogen 2.988 N/A ASN 192.A ND2 ALA 120.A O no hydrogen 2.957 N/A VAL 193.A N GLY 182.A O no hydrogen 3.223 N/A HIS 194.A N LEU 124.A O no hydrogen 2.837 N/A TRP 195.A N TYR 180.A O no hydrogen 2.892 N/A TRP 195.A NE1 SER 183.A O no hydrogen 3.256 N/A PHE 196.A N VAL 126.A O no hydrogen 2.868 N/A VAL 197.A N TYR 178.A O no hydrogen 2.804 N/A LEU 198.A N ALA 128.A O no hydrogen 2.955 N/A ALA 199.A N HIS 176.A O no hydrogen 3.120 N/A VAL 202.A N PHE 130.A O no hydrogen 2.855 N/A LEU 204.A N GLU 132.A O no hydrogen 3.375 N/A SER 205.A N GLN 208.A OE1 no hydrogen 3.283 N/A SER 205.A OG GLN 208.A OE1 no hydrogen 3.551 N/A ARG 206.A NE LYS 134.A O no hydrogen 2.864 N/A ARG 206.A NH2 LYS 134.A O no hydrogen 3.506 N/A GLN 208.A N SER 205.A OG no hydrogen 3.103 N/A GLN 208.A NE2 ASN 139.A O no hydrogen 2.922 N/A VAL 209.A N SER 205.A O no hydrogen 3.118 N/A TRP 210.A N ARG 206.A O no hydrogen 2.946 N/A LYS 211.A N THR 207.A O no hydrogen 2.922 N/A LEU 212.A N GLN 208.A O no hydrogen 3.024 N/A GLU 213.A N VAL 209.A O no hydrogen 3.000 N/A ASN 214.A N LYS 211.A O no hydrogen 3.179 N/A ASN 214.A ND2 TRP 210.A O no hydrogen 2.690 N/A SER 215.A OG LYS 211.A O no hydrogen 2.653 N/A LEU 217.A N LYS 153.A O no hydrogen 2.728 N/A ASP 218.A N LYS 222.A O no hydrogen 2.718 N/A ASN 221.A N ASP 218.A O no hydrogen 2.820 N/A LYS 222.A N ASP 218.A OD1 no hydrogen 2.817 N/A ILE 224.A N LEU 216.A O no hydrogen 2.984 N/A ARG 229.A NH1 GLN 16.A OE1 no hydrogen 2.722 N/A ARG 229.A NH1 SER 17.A O no hydrogen 2.982 N/A ARG 229.A NH2 CYS 11.A O no hydrogen 3.452 N/A ARG 229.A NH2 GLN 16.A OE1 no hydrogen 2.892 N/A ARG 230.A N GLU 1.A OE2 no hydrogen 3.187 N/A GLN 232.A N PRO 18.A O no hydrogen 2.733 N/A GLN 232.A NE2 ARG 230.A O no hydrogen 2.928 N/A ASN 235.A ND2 GLN 14.A O no hydrogen 2.967 N/A ARG 237.A N LEU 234.A O no hydrogen 3.064 N/A ARG 237.A NE LEU 234.A O no hydrogen 2.981 N/A ARG 237.A NH1 GLN 16.A O no hydrogen 3.114 N/A ARG 237.A NH1 HIS 181.A O no hydrogen 2.870 N/A ARG 237.A NH2 GLN 16.A O no hydrogen 2.889 N/A ARG 237.A NH2 PRO 233.A O no hydrogen 2.814 N/A GLU 240.A N THR 179.A O no hydrogen 3.062 N/A SER 241.A N ARG 27.A O no hydrogen 2.890 N/A SER 241.A OG PHE 243.A O no hydrogen 2.806 N/A ASN 242.A N TYR 177.A O no hydrogen 3.316 N/A ASN 242.A ND2 LYS 33.A O no hydrogen 3.019 N/A ASN 242.A ND2 GLN 175.A O no hydrogen 2.806 N/A