Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ofb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N THR 37.A OG1 no hydrogen 2.812 N/A MET 4.A N THR 27.A O no hydrogen 2.779 N/A VAL 5.A N HIS 38.A O no hydrogen 3.033 N/A SER 7.A N VAL 40.A O no hydrogen 3.092 N/A SER 7.A OG THR 52.A OG1 no hydrogen 2.681 N/A THR 10.A N GLU 13.A OE1 no hydrogen 2.939 N/A GLU 12.A N GLU 12.A OE1 no hydrogen 2.698 N/A GLU 13.A N THR 10.A OG1 no hydrogen 3.243 N/A PHE 14.A N THR 10.A O no hydrogen 2.849 N/A MET 15.A N PRO 11.A O no hydrogen 3.008 N/A VAL 17.A N GLU 13.A O no hydrogen 3.109 N/A TYR 18.A N PHE 14.A O no hydrogen 2.896 N/A LYS 19.A N MET 15.A O no hydrogen 3.249 N/A PHE 20.A N LEU 16.A O no hydrogen 2.853 N/A ALA 21.A N VAL 17.A O no hydrogen 2.584 N/A ARG 22.A N TYR 18.A O no hydrogen 2.750 N/A LYS 23.A N LYS 19.A O no hydrogen 3.013 N/A HIS 24.A N PHE 20.A O no hydrogen 3.220 N/A HIS 24.A ND1 PHE 20.A O no hydrogen 3.153 N/A HIS 25.A N ARG 22.A O no hydrogen 3.250 N/A ILE 26.A N ALA 21.A O no hydrogen 2.539 N/A THR 29.A N MET 4.A O no hydrogen 2.880 N/A THR 29.A OG1 MET 4.A O no hydrogen 3.551 N/A THR 29.A OG1 LEU 31.A O no hydrogen 2.878 N/A THR 33.A N THR 36.A OG1 no hydrogen 2.881 N/A GLU 35.A N THR 33.A OG1 no hydrogen 3.149 N/A THR 36.A N THR 33.A O no hydrogen 2.978 N/A THR 36.A OG1 THR 33.A O no hydrogen 3.171 N/A THR 37.A N SER 3.A O no hydrogen 2.818 N/A THR 37.A OG1 SER 3.A O no hydrogen 3.409 N/A THR 37.A OG1 HIS 38.A ND1 no hydrogen 2.668 N/A HIS 38.A N SER 3.A O no hydrogen 2.936 N/A HIS 38.A ND1 THR 37.A OG1 no hydrogen 2.668 N/A VAL 39.A N TRP 64.A O no hydrogen 2.630 N/A VAL 40.A N VAL 5.A O no hydrogen 3.117 N/A MET 41.A N VAL 66.A O no hydrogen 2.951 N/A LYS 42.A N SER 7.A O no hydrogen 2.997 N/A LYS 42.A NZ GLU 13.A OE2 no hydrogen 2.848 N/A THR 43.A OG1 ASP 44.A O no hydrogen 2.860 N/A THR 43.A OG1 SER 67.A OG no hydrogen 2.535 N/A ASP 44.A N VAL 48.A O no hydrogen 3.046 N/A GLU 46.A N ASP 44.A OD1 no hydrogen 2.795 N/A PHE 47.A N ASP 44.A O no hydrogen 3.079 N/A VAL 48.A N ASP 44.A OD1 no hydrogen 2.908 N/A CYS 49.A N GLY 90.A O no hydrogen 3.223 N/A CYS 49.A SG GLU 50.A O no hydrogen 3.676 N/A CYS 49.A SG GLY 90.A O no hydrogen 3.832 N/A ARG 51.A NH1 ASN 94.A OD1 no hydrogen 2.832 N/A ARG 51.A NH1 ASP 190.A OD1 no hydrogen 3.056 N/A ARG 51.A NH2 GLU 186.A OE1 no hydrogen 3.210 N/A THR 52.A OG1 SER 7.A OG no hydrogen 2.681 N/A LYS 54.A NZ VAL 6.A O no hydrogen 2.694 N/A LYS 54.A NZ ASN 30.A O no hydrogen 3.098 N/A TYR 55.A N THR 52.A OG1 no hydrogen 3.272 N/A TYR 55.A OH ASP 91.A OD2 no hydrogen 2.773 N/A PHE 56.A N THR 52.A O no hydrogen 3.080 N/A LEU 57.A N LEU 53.A O no hydrogen 2.863 N/A GLY 58.A N LYS 54.A O no hydrogen 2.697 N/A ILE 59.A N TYR 55.A O no hydrogen 3.143 N/A ALA 60.A N PHE 56.A O no hydrogen 2.866 N/A GLY 61.A N LEU 57.A O no hydrogen 3.029 N/A GLY 62.A N ILE 59.A O no hydrogen 2.811 N/A LYS 63.A N GLY 58.A O no hydrogen 2.837 N/A LYS 63.A NZ THR 33.A O no hydrogen 3.320 N/A LYS 63.A NZ THR 36.A O no hydrogen 2.693 N/A TRP 64.A N THR 37.A O no hydrogen 3.110 N/A VAL 66.A N VAL 39.A O no hydrogen 2.995 N/A SER 67.A N PHE 86.A O no hydrogen 2.571 N/A SER 67.A OG THR 43.A OG1 no hydrogen 2.535 N/A TYR 68.A N MET 41.A O no hydrogen 2.931 N/A PHE 69.A N SER 67.A OG no hydrogen 3.134 N/A TRP 70.A N SER 67.A O no hydrogen 2.679 N/A TRP 70.A NE1 LEU 81.A O no hydrogen 2.878 N/A THR 72.A N TYR 68.A O no hydrogen 3.246 N/A THR 72.A OG1 PHE 69.A O no hydrogen 3.440 N/A GLN 73.A N PHE 69.A O no hydrogen 2.999 N/A GLN 73.A NE2 GLU 77.A OE2 no hydrogen 3.318 N/A SER 74.A N TRP 70.A O no hydrogen 3.186 N/A SER 74.A OG TRP 70.A O no hydrogen 2.612 N/A ILE 75.A N VAL 71.A O no hydrogen 2.887 N/A LYS 76.A N THR 72.A O no hydrogen 3.150 N/A GLU 77.A N GLN 73.A O no hydrogen 2.993 N/A ARG 78.A N ILE 75.A O no hydrogen 3.137 N/A LYS 79.A N SER 74.A O no hydrogen 3.134 N/A LYS 79.A NZ GLU 77.A OE1 no hydrogen 2.983 N/A LEU 81.A N SER 74.A OG no hydrogen 3.195 N/A GLU 83.A N GLU 83.A OE1 no hydrogen 2.552 N/A ASP 85.A N ASN 82.A O no hydrogen 3.025 N/A PHE 86.A N GLU 83.A O no hydrogen 3.097 N/A VAL 88.A N VAL 65.A O no hydrogen 2.806 N/A ARG 89.A N PHE 47.A O no hydrogen 3.148 N/A ASP 91.A N GLY 95.A O no hydrogen 2.837 N/A VAL 92.A N CYS 49.A O no hydrogen 2.918 N/A VAL 93.A N ASP 91.A OD1 no hydrogen 2.879 N/A ASN 94.A N ASP 91.A OD1 no hydrogen 2.792 N/A ASN 94.A ND2 ASP 190.A OD1 no hydrogen 2.948 N/A GLY 95.A N ASP 91.A O no hydrogen 3.289 N/A ARG 96.A NE GLU 46.A OE1 no hydrogen 3.188 N/A ARG 96.A NH1 ASP 44.A OD2 no hydrogen 3.444 N/A ARG 96.A NH2 ASP 44.A OD2 no hydrogen 2.859 N/A ARG 96.A NH2 GLU 46.A OE1 no hydrogen 2.347 N/A HIS 98.A NE2 ASP 91.A OD2 no hydrogen 2.548 N/A GLN 99.A N ARG 89.A O no hydrogen 2.720 N/A GLN 99.A NE2 ASN 97.A OD1 no hydrogen 2.664 N/A GLY 100.A N HIS 98.A ND1 no hydrogen 2.841 N/A LYS 102.A NZ GLN 99.A OE1 no hydrogen 3.392 N/A ARG 103.A N GLN 99.A O no hydrogen 3.161 N/A ARG 103.A NH1 HIS 98.A O no hydrogen 3.351 N/A ARG 103.A NH2 HIS 98.A O no hydrogen 3.135 N/A ALA 104.A N GLY 100.A O no hydrogen 3.121 N/A ARG 105.A N PRO 101.A O no hydrogen 3.346 N/A ARG 105.A NE GLU 87.A OE2 no hydrogen 3.163 N/A ARG 105.A NH2 GLU 87.A OE1 no hydrogen 3.132 N/A ARG 105.A NH2 GLU 87.A OE2 no hydrogen 3.527 N/A GLU 106.A N LYS 102.A O no hydrogen 3.265 N/A SER 107.A N ALA 104.A O no hydrogen 3.083 N/A SER 107.A OG ARG 103.A O no hydrogen 2.925 N/A GLN 108.A NE2 ALA 104.A O no hydrogen 2.646 N/A ARG 110.A N SER 107.A O no hydrogen 3.094 N/A LYS 111.A NZ LEU 138.A O no hydrogen 3.061 N/A PHE 113.A N CYS 139.A O no hydrogen 3.000 N/A ARG 114.A N LYS 111.A O no hydrogen 3.316 N/A LEU 116.A N PHE 113.A O no hydrogen 3.138 N/A GLU 117.A N HIS 157.A O no hydrogen 2.550 N/A ILE 118.A N SER 142.A O no hydrogen 2.657 N/A CYS 119.A N ILE 159.A O no hydrogen 3.111 N/A CYS 119.A SG VAL 144.A O no hydrogen 3.348 N/A TYR 121.A N VAL 161.A O no hydrogen 2.931 N/A THR 125.A N GLN 163.A OE1 no hydrogen 2.985 N/A GLN 131.A N PRO 128.A O no hydrogen 2.982 N/A GLN 131.A NE2 ASP 130.A OD2 no hydrogen 3.044 N/A LEU 132.A N PRO 128.A O no hydrogen 3.295 N/A GLU 133.A N THR 129.A O no hydrogen 2.755 N/A TRP 134.A N ASP 130.A O no hydrogen 3.029 N/A MET 135.A N GLN 131.A O no hydrogen 2.988 N/A VAL 136.A N LEU 132.A O no hydrogen 3.318 N/A GLN 137.A N GLU 133.A O no hydrogen 3.096 N/A LEU 138.A N TRP 134.A O no hydrogen 3.013 N/A CYS 139.A N MET 135.A O no hydrogen 3.194 N/A CYS 139.A SG MET 135.A O no hydrogen 3.603 N/A GLY 140.A N GLN 137.A O no hydrogen 2.782 N/A ALA 141.A N VAL 136.A O no hydrogen 2.783 N/A SER 142.A N LEU 116.A O no hydrogen 2.886 N/A VAL 144.A N ILE 118.A O no hydrogen 3.003 N/A SER 149.A N GLU 146.A O no hydrogen 2.918 N/A SER 149.A OG GLU 146.A O no hydrogen 2.383 N/A THR 151.A N GLU 117.A OE1 no hydrogen 2.911 N/A THR 151.A OG1 GLU 117.A OE2 no hydrogen 2.943 N/A VAL 156.A N GLY 153.A O no hydrogen 3.096 N/A HIS 157.A N GLY 115.A O no hydrogen 3.109 N/A ILE 159.A N GLU 117.A O no hydrogen 2.855 N/A VAL 160.A N PRO 181.A O no hydrogen 2.824 N/A VAL 161.A N CYS 119.A O no hydrogen 2.951 N/A VAL 162.A N VAL 183.A O no hydrogen 3.224 N/A GLN 163.A NE2 THR 125.A OG1 no hydrogen 3.046 N/A GLN 163.A NE2 ASP 165.A OD1 no hydrogen 2.515 N/A ALA 166.A N GLN 163.A O no hydrogen 2.927 N/A TRP 167.A N PRO 164.A O no hydrogen 2.940 N/A HIS 172.A N ASN 169.A O no hydrogen 3.322 N/A HIS 172.A ND1 PRO 206.A O no hydrogen 2.837 N/A ALA 173.A N GLY 170.A O no hydrogen 3.015 N/A GLY 175.A N GLN 207.A OE1 no hydrogen 2.831 N/A GLN 176.A NE2 ILE 208.A O no hydrogen 3.221 N/A GLN 176.A NE2 PRO 209.A O no hydrogen 2.875 N/A MET 177.A N ILE 174.A O no hydrogen 2.954 N/A VAL 183.A N VAL 160.A O no hydrogen 2.955 N/A THR 184.A N TYR 203.A O no hydrogen 3.006 N/A ARG 185.A N VAL 162.A O no hydrogen 3.131 N/A ARG 185.A NH1 THR 125.A O no hydrogen 3.227 N/A ARG 185.A NH2 THR 125.A O no hydrogen 3.364 N/A TRP 187.A N THR 184.A O no hydrogen 3.038 N/A TRP 187.A NE1 GLN 198.A O no hydrogen 2.923 N/A LEU 189.A N ARG 185.A O no hydrogen 3.189 N/A ASP 190.A N GLU 186.A O no hydrogen 3.027 N/A SER 191.A N TRP 187.A O no hydrogen 3.050 N/A SER 191.A OG TRP 187.A O no hydrogen 2.554 N/A VAL 192.A N VAL 188.A O no hydrogen 2.755 N/A ALA 193.A N LEU 189.A O no hydrogen 2.891 N/A LEU 194.A N ASP 190.A O no hydrogen 3.004 N/A TYR 195.A N VAL 192.A O no hydrogen 2.944 N/A GLN 196.A N SER 191.A O no hydrogen 2.976 N/A GLN 198.A N SER 191.A OG no hydrogen 3.301 N/A GLN 198.A NE2 GLN 196.A O no hydrogen 2.732 N/A TYR 203.A N LEU 200.A O no hydrogen 2.651 N/A TYR 203.A OH ASP 190.A OD2 no hydrogen 2.706 N/A LEU 204.A N ASP 201.A O no hydrogen 3.406 N/A ILE 205.A N VAL 182.A O no hydrogen 2.812 N/A GLN 207.A NE2 PHE 171.A O no hydrogen 2.915 N/A GLN 207.A NE2 ILE 205.A O no hydrogen 3.147 N/A ILE 208.A N HIS 172.A O no hydrogen 2.714 N/A