Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pxb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N THR 37.A OG1 no hydrogen 2.948 N/A MET 4.A N THR 27.A O no hydrogen 2.947 N/A VAL 5.A N HIS 38.A O no hydrogen 3.174 N/A SER 7.A N VAL 40.A O no hydrogen 2.946 N/A THR 10.A N GLU 13.A OE1 no hydrogen 3.252 N/A GLU 13.A N THR 10.A OG1 no hydrogen 3.253 N/A PHE 14.A N THR 10.A O no hydrogen 2.674 N/A MET 15.A N PRO 11.A O no hydrogen 2.780 N/A LEU 16.A N GLU 12.A O no hydrogen 3.300 N/A VAL 17.A N GLU 13.A O no hydrogen 3.152 N/A TYR 18.A N PHE 14.A O no hydrogen 2.864 N/A LYS 19.A N MET 15.A O no hydrogen 2.809 N/A PHE 20.A N LEU 16.A O no hydrogen 2.889 N/A ALA 21.A N VAL 17.A O no hydrogen 2.718 N/A ARG 22.A N TYR 18.A O no hydrogen 2.822 N/A LYS 23.A N LYS 19.A O no hydrogen 3.054 N/A HIS 24.A N PHE 20.A O no hydrogen 3.071 N/A HIS 25.A N ARG 22.A O no hydrogen 3.348 N/A ILE 26.A N ALA 21.A O no hydrogen 3.090 N/A THR 27.A N MET 2.A O no hydrogen 3.014 N/A THR 29.A N MET 4.A O no hydrogen 2.939 N/A LEU 31.A N THR 29.A OG1 no hydrogen 3.415 N/A THR 33.A N THR 36.A OG1 no hydrogen 2.952 N/A THR 33.A OG1 GLU 35.A OE1 no hydrogen 3.007 N/A THR 37.A N SER 3.A O no hydrogen 2.749 N/A THR 37.A OG1 SER 3.A O no hydrogen 3.159 N/A THR 37.A OG1 HIS 38.A ND1 no hydrogen 2.550 N/A HIS 38.A N SER 3.A O no hydrogen 2.837 N/A HIS 38.A ND1 THR 37.A OG1 no hydrogen 2.550 N/A HIS 38.A NE2 GLU 83.A OE2 no hydrogen 2.924 N/A VAL 39.A N TRP 64.A O no hydrogen 2.788 N/A VAL 40.A N VAL 5.A O no hydrogen 3.112 N/A MET 41.A N VAL 66.A O no hydrogen 2.819 N/A LYS 42.A N SER 7.A O no hydrogen 3.224 N/A LYS 42.A NZ GLU 13.A OE2 no hydrogen 2.902 N/A THR 43.A OG1 ASP 44.A O no hydrogen 2.969 N/A THR 43.A OG1 SER 67.A OG no hydrogen 2.503 N/A ASP 44.A N VAL 48.A O no hydrogen 3.027 N/A GLU 46.A N ASP 44.A OD1 no hydrogen 2.835 N/A PHE 47.A N ASP 44.A O no hydrogen 2.948 N/A VAL 48.A N ASP 44.A OD1 no hydrogen 3.309 N/A CYS 49.A N GLY 90.A O no hydrogen 3.290 N/A CYS 49.A SG GLU 50.A O no hydrogen 3.229 N/A CYS 49.A SG GLY 90.A O no hydrogen 3.551 N/A ARG 51.A NH1 ASN 94.A OD1 no hydrogen 2.978 N/A ARG 51.A NH1 ASP 189.A OD1 no hydrogen 2.804 N/A ARG 51.A NH2 GLU 185.A OE1 no hydrogen 2.772 N/A ALA 52.A N GLU 50.A O no hydrogen 3.161 N/A LYS 54.A NZ VAL 6.A O no hydrogen 3.110 N/A LYS 54.A NZ ASN 30.A O no hydrogen 3.355 N/A TYR 55.A OH ASP 91.A OD2 no hydrogen 2.915 N/A PHE 56.A N ALA 52.A O no hydrogen 3.046 N/A LEU 57.A N LEU 53.A O no hydrogen 2.825 N/A GLY 58.A N LYS 54.A O no hydrogen 2.849 N/A ILE 59.A N TYR 55.A O no hydrogen 3.109 N/A ALA 60.A N PHE 56.A O no hydrogen 2.908 N/A GLY 61.A N LEU 57.A O no hydrogen 3.130 N/A GLY 61.A N GLY 58.A O no hydrogen 3.212 N/A GLY 62.A N ILE 59.A O no hydrogen 2.936 N/A LYS 63.A N GLY 58.A O no hydrogen 3.068 N/A LYS 63.A NZ THR 33.A O no hydrogen 3.016 N/A LYS 63.A NZ GLU 34.A O no hydrogen 2.966 N/A TRP 64.A N THR 37.A O no hydrogen 3.006 N/A VAL 66.A N VAL 39.A O no hydrogen 2.867 N/A SER 67.A N PHE 86.A O no hydrogen 3.350 N/A SER 67.A OG THR 43.A OG1 no hydrogen 2.503 N/A TYR 68.A N MET 41.A O no hydrogen 2.666 N/A TYR 68.A OH GLU 13.A O no hydrogen 3.417 N/A PHE 69.A N SER 67.A OG no hydrogen 3.290 N/A TRP 70.A N SER 67.A O no hydrogen 3.045 N/A TRP 70.A NE1 LEU 81.A O no hydrogen 3.164 N/A VAL 71.A N TYR 68.A O no hydrogen 3.032 N/A THR 72.A N TYR 68.A O no hydrogen 3.308 N/A GLN 73.A N PHE 69.A O no hydrogen 2.990 N/A SER 74.A N TRP 70.A O no hydrogen 3.194 N/A SER 74.A OG TRP 70.A O no hydrogen 2.597 N/A ILE 75.A N VAL 71.A O no hydrogen 2.892 N/A LYS 76.A N THR 72.A O no hydrogen 2.902 N/A ARG 78.A N ILE 75.A O no hydrogen 3.303 N/A LYS 79.A N SER 74.A O no hydrogen 3.083 N/A LEU 81.A N SER 74.A OG no hydrogen 2.868 N/A ASP 85.A N ASN 82.A O no hydrogen 2.712 N/A PHE 86.A N GLU 83.A O no hydrogen 3.302 N/A VAL 88.A N VAL 65.A O no hydrogen 2.996 N/A ARG 89.A N PHE 47.A O no hydrogen 3.033 N/A ASP 91.A N GLY 95.A O no hydrogen 2.866 N/A VAL 92.A N CYS 49.A O no hydrogen 3.189 N/A VAL 93.A N ASP 91.A OD1 no hydrogen 2.836 N/A ASN 94.A N ASP 91.A OD1 no hydrogen 2.864 N/A ASN 94.A ND2 ASP 189.A OD1 no hydrogen 2.922 N/A HIS 98.A N ARG 89.A O no hydrogen 2.887 N/A HIS 98.A NE2 ASP 91.A OD2 no hydrogen 2.997 N/A GLN 99.A N ARG 89.A O no hydrogen 2.814 N/A GLN 99.A NE2 ASN 97.A OD1 no hydrogen 3.543 N/A GLY 100.A N HIS 98.A ND1 no hydrogen 2.903 N/A ARG 103.A N GLN 99.A O no hydrogen 3.275 N/A ARG 103.A NH2 HIS 98.A O no hydrogen 3.566 N/A ALA 104.A N GLY 100.A O no hydrogen 2.901 N/A ARG 105.A N PRO 101.A O no hydrogen 2.796 N/A ARG 105.A NE GLU 87.A OE2 no hydrogen 2.679 N/A ARG 105.A NH2 GLU 87.A OE2 no hydrogen 3.428 N/A GLU 106.A N LYS 102.A O no hydrogen 2.971 N/A GLU 106.A N ARG 103.A O no hydrogen 3.249 N/A SER 107.A N ARG 103.A O no hydrogen 2.851 N/A SER 107.A OG ARG 103.A O no hydrogen 2.837 N/A GLN 108.A NE2 ALA 104.A O no hydrogen 2.491 N/A PHE 113.A N CYS 139.A O no hydrogen 2.951 N/A ARG 114.A N LYS 111.A O no hydrogen 2.953 N/A ARG 114.A NH1 LYS 111.A O no hydrogen 3.035 N/A LEU 116.A N PHE 113.A O no hydrogen 3.205 N/A GLU 117.A N HIS 157.A O no hydrogen 2.758 N/A ILE 118.A N SER 142.A O no hydrogen 2.912 N/A CYS 119.A N ILE 159.A O no hydrogen 2.990 N/A CYS 119.A SG VAL 144.A O no hydrogen 3.783 N/A TYR 121.A N VAL 161.A O no hydrogen 2.785 N/A THR 125.A N GLN 163.A OE1 no hydrogen 3.018 N/A GLN 131.A N PRO 128.A O no hydrogen 2.794 N/A GLN 131.A NE2 ASP 130.A OD2 no hydrogen 3.231 N/A LEU 132.A N PRO 128.A O no hydrogen 3.236 N/A GLU 133.A N THR 129.A O no hydrogen 2.822 N/A TRP 134.A N ASP 130.A O no hydrogen 2.792 N/A MET 135.A N GLN 131.A O no hydrogen 2.742 N/A VAL 136.A N LEU 132.A O no hydrogen 2.918 N/A GLN 137.A N GLU 133.A O no hydrogen 2.881 N/A LEU 138.A N TRP 134.A O no hydrogen 2.866 N/A LEU 138.A N MET 135.A O no hydrogen 3.015 N/A CYS 139.A N MET 135.A O no hydrogen 3.176 N/A CYS 139.A N VAL 136.A O no hydrogen 2.988 N/A CYS 139.A SG MET 135.A O no hydrogen 3.698 N/A GLY 140.A N GLN 137.A O no hydrogen 3.486 N/A ALA 141.A N VAL 136.A O no hydrogen 3.104 N/A SER 142.A N LEU 116.A O no hydrogen 2.811 N/A VAL 144.A N ILE 118.A O no hydrogen 2.971 N/A LYS 145.A NZ GLU 133.A OE1 no hydrogen 3.246 N/A LYS 145.A NZ GLU 133.A OE2 no hydrogen 3.255 N/A SER 149.A N GLU 146.A O no hydrogen 2.847 N/A THR 151.A N GLU 117.A OE1 no hydrogen 2.796 N/A THR 151.A OG1 GLU 117.A OE1 no hydrogen 3.515 N/A THR 151.A OG1 GLU 117.A OE2 no hydrogen 2.740 N/A ILE 159.A N GLU 117.A O no hydrogen 2.760 N/A VAL 160.A N PRO 180.A O no hydrogen 2.910 N/A VAL 161.A N CYS 119.A O no hydrogen 2.905 N/A VAL 162.A N VAL 182.A O no hydrogen 2.829 N/A GLN 163.A NE2 THR 125.A OG1 no hydrogen 3.245 N/A ALA 166.A N GLN 163.A O no hydrogen 3.105 N/A TRP 167.A N PRO 164.A O no hydrogen 3.175 N/A ALA 172.A N GLY 169.A O no hydrogen 3.237 N/A ILE 173.A N GLN 206.A OE1 no hydrogen 2.904 N/A GLY 174.A N GLN 206.A OE1 no hydrogen 2.917 N/A GLN 175.A NE2 PRO 208.A O no hydrogen 2.791 N/A MET 176.A N ILE 173.A O no hydrogen 2.673 N/A CYS 177.A N ILE 173.A O no hydrogen 3.250 N/A VAL 182.A N VAL 160.A O no hydrogen 2.806 N/A THR 183.A N TYR 202.A O no hydrogen 3.310 N/A ARG 184.A NH1 THR 125.A O no hydrogen 2.944 N/A ARG 184.A NH2 THR 125.A O no hydrogen 3.427 N/A TRP 186.A N THR 183.A O no hydrogen 3.092 N/A TRP 186.A NE1 GLN 197.A O no hydrogen 3.123 N/A LEU 188.A N ARG 184.A O no hydrogen 3.028 N/A ASP 189.A N GLU 185.A O no hydrogen 2.750 N/A SER 190.A N TRP 186.A O no hydrogen 3.018 N/A SER 190.A OG TRP 186.A O no hydrogen 2.461 N/A VAL 191.A N VAL 187.A O no hydrogen 2.697 N/A ALA 192.A N LEU 188.A O no hydrogen 2.866 N/A LEU 193.A N ASP 189.A O no hydrogen 3.157 N/A TYR 194.A N VAL 191.A O no hydrogen 3.033 N/A GLN 195.A N SER 190.A O no hydrogen 2.943 N/A CYS 196.A SG ILE 112.A O no hydrogen 3.422 N/A GLN 197.A N SER 190.A OG no hydrogen 3.217 N/A GLN 197.A NE2 GLN 195.A O no hydrogen 2.793 N/A TYR 202.A N LEU 199.A O no hydrogen 2.681 N/A TYR 202.A OH ASP 189.A OD2 no hydrogen 2.715 N/A LEU 203.A N LEU 199.A O no hydrogen 2.872 N/A ILE 204.A N VAL 181.A O no hydrogen 2.849 N/A GLN 206.A NE2 PHE 170.A O no hydrogen 2.923 N/A GLN 206.A NE2 ILE 204.A O no hydrogen 2.948 N/A ILE 207.A N HIS 171.A O no hydrogen 2.542 N/A