Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pgp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N VAL 56.A O no hydrogen 2.870 N/A SER 4.A OG VAL 56.A O no hydrogen 3.460 N/A ARG 6.A N VAL 54.A O no hydrogen 3.229 N/A ARG 6.A NH1 PRO 7.A O no hydrogen 3.193 N/A ARG 6.A NH1 ASP 12.A OD1 no hydrogen 3.568 N/A ARG 6.A NH1 ASP 12.A OD2 no hydrogen 2.758 N/A ARG 6.A NH2 ASP 12.A OD1 no hydrogen 2.914 N/A ALA 8.A N SER 52.A O no hydrogen 2.927 N/A GLU 9.A N ASP 12.A OD2 no hydrogen 2.811 N/A ASP 12.A N GLU 9.A O no hydrogen 2.901 N/A LEU 13.A N.A THR 10.A O no hydrogen 3.105 N/A LEU 13.A N.B THR 10.A O no hydrogen 3.071 N/A VAL 16.A N ASP 12.A O no hydrogen 3.057 N/A ALA 17.A N LEU 13.A O.A no hydrogen 2.836 N/A ALA 17.A N LEU 13.A O.B no hydrogen 2.844 N/A GLY 18.A N THR 15.A O no hydrogen 2.984 N/A PHE 19.A N VAL 16.A O no hydrogen 2.944 N/A GLN 21.A N GLU 25.A OE1 no hydrogen 2.901 N/A GLN 21.A NE2 PHE 19.A O no hydrogen 3.119 N/A GLU 25.A N ASP 22.A OD1 no hydrogen 2.950 N/A LEU 26.A N ASP 22.A O no hydrogen 3.064 N/A PHE 27.A N ARG 23.A O no hydrogen 3.005 N/A TYR 28.A N ASP 24.A O no hydrogen 2.912 N/A CYS 29.A N GLU 25.A O no hydrogen 3.231 N/A CYS 29.A N LEU 26.A O no hydrogen 3.255 N/A CYS 29.A SG GLU 25.A O no hydrogen 3.383 N/A CYS 29.A SG LEU 26.A O no hydrogen 3.851 N/A TYR 30.A N LEU 26.A O no hydrogen 2.815 N/A TYR 30.A OH GLN 41.A O no hydrogen 2.875 N/A ALA 33.A N TYR 30.A O no hydrogen 3.026 N/A ILE 34.A N.A GLN 41.A OE1 no hydrogen 2.843 N/A ILE 34.A N.B GLN 41.A OE1 no hydrogen 2.837 N/A GLN 41.A N SER 38.A OG no hydrogen 3.175 N/A GLN 41.A NE2 ILE 34.A O.A no hydrogen 2.942 N/A GLN 41.A NE2 ILE 34.A O.B no hydrogen 2.944 N/A LEU 42.A N SER 38.A O no hydrogen 3.008 N/A ALA 43.A N VAL 39.A O no hydrogen 2.715 N/A ALA 44.A N ALA 40.A O no hydrogen 3.010 N/A ALA 45.A N GLN 41.A O no hydrogen 3.183 N/A ILE 46.A N LEU 42.A O no hydrogen 2.959 N/A ALA 47.A N ALA 43.A O no hydrogen 3.007 N/A GLU 48.A N ALA 44.A O no hydrogen 3.235 N/A GLU 48.A N ALA 45.A O no hydrogen 3.024 N/A ARG 49.A N ILE 46.A O no hydrogen 3.145 N/A ARG 49.A NH2 ASN 66.A OD1 no hydrogen 2.993 N/A ARG 50.A N PHE 67.A O no hydrogen 3.141 N/A ARG 50.A NH1 ARG 49.A O no hydrogen 2.900 N/A THR 53.A N ALA 65.A O no hydrogen 2.960 N/A THR 53.A OG1 GLY 51.A O no hydrogen 2.726 N/A VAL 54.A N ARG 6.A O no hydrogen 2.934 N/A ALA 55.A N GLY 63.A O no hydrogen 2.937 N/A VAL 56.A N SER 4.A O no hydrogen 2.802 N/A HIS 57.A N GLN 60.A O.A no hydrogen 2.958 N/A HIS 57.A N GLN 60.A O.B no hydrogen 2.959 N/A HIS 57.A ND1 GLN 2.A O no hydrogen 2.665 N/A GLN 60.A N.A HIS 57.A O no hydrogen 2.957 N/A GLN 60.A N.B HIS 57.A O no hydrogen 2.954 N/A GLN 60.A NE2.A ASP 58.A O no hydrogen 3.546 N/A LEU 62.A N ALA 55.A O no hydrogen 2.832 N/A GLY 63.A N ALA 55.A O no hydrogen 3.412 N/A PHE 64.A N MET 82.A O no hydrogen 2.943 N/A ALA 65.A N THR 53.A O no hydrogen 3.133 N/A ASN 66.A N GLY 79.A O no hydrogen 3.104 N/A ASN 66.A ND2 SER 52.A OG no hydrogen 3.291 N/A ASN 66.A ND2 ASN 80.A OD1 no hydrogen 2.936 N/A PHE 67.A N ARG 50.A O no hydrogen 2.878 N/A TYR 68.A N ALA 77.A O no hydrogen 2.926 N/A GLN 71.A N PHE 75.A O no hydrogen 2.948 N/A GLY 73.A N TYR 108.A O no hydrogen 2.856 N/A ASP 74.A N GLN 71.A O no hydrogen 2.931 N/A PHE 75.A N GLN 71.A O no hydrogen 3.161 N/A CYS 76.A N LEU 112.A O no hydrogen 3.244 N/A ALA 77.A N GLN 69.A O no hydrogen 2.912 N/A LEU 78.A N LYS 114.A O no hydrogen 2.993 N/A GLY 79.A N ASN 66.A O no hydrogen 2.833 N/A ASN 80.A ND2 CYS 29.A O no hydrogen 2.993 N/A MET 82.A N PHE 64.A O no hydrogen 3.066 N/A ALA 84.A N LEU 62.A O no hydrogen 2.842 N/A ALA 87.A N ALA 84.A O no hydrogen 2.909 N/A ARG 88.A N PRO 85.A O no hydrogen 3.438 N/A ARG 88.A NE VAL 83.A O no hydrogen 2.907 N/A ARG 88.A NH1 GLU 25.A OE1 no hydrogen 3.362 N/A ARG 88.A NH1 GLU 25.A OE2 no hydrogen 2.842 N/A ARG 88.A NH2 GLU 25.A OE1 no hydrogen 2.902 N/A ARG 88.A NH2 VAL 83.A O no hydrogen 3.039 N/A ARG 94.A NH2 GLN 130.A OE1 no hydrogen 3.089 N/A TYR 95.A N GLY 91.A O no hydrogen 2.961 N/A LEU 96.A N VAL 92.A O no hydrogen 2.886 N/A ILE 97.A N ALA 93.A O no hydrogen 2.825 N/A GLY 98.A N ARG 94.A O no hydrogen 3.150 N/A VAL 99.A N TYR 95.A O no hydrogen 3.064 N/A MET 100.A N LEU 96.A O no hydrogen 2.881 N/A GLU 101.A N ILE 97.A O no hydrogen 2.770 N/A ASN 102.A N GLY 98.A O no hydrogen 3.010 N/A LEU 103.A N VAL 99.A O no hydrogen 2.960 N/A ALA 104.A N MET 100.A O no hydrogen 2.878 N/A ARG 105.A N GLU 101.A O no hydrogen 3.035 N/A ARG 105.A NH1 LEU 158.A O.B no hydrogen 2.769 N/A ARG 105.A NH2 ASN 102.A OD1 no hydrogen 2.614 N/A GLU 106.A N ASN 102.A O no hydrogen 2.786 N/A GLN 107.A N LEU 103.A O no hydrogen 2.880 N/A TYR 108.A N ALA 104.A O no hydrogen 3.103 N/A LYS 109.A NZ GLU 106.A O no hydrogen 2.885 N/A ALA 110.A N ALA 104.A O no hydrogen 2.942 N/A ARG 111.A N ASP 74.A O no hydrogen 3.069 N/A ARG 111.A NH1 LYS 109.A O no hydrogen 3.155 N/A MET 113.A N LYS 156.A O no hydrogen 2.976 N/A LYS 114.A N CYS 76.A O no hydrogen 2.826 N/A ILE 115.A N.A MET 154.A O no hydrogen 2.967 N/A ILE 115.A N.B MET 154.A O no hydrogen 2.968 N/A CYS 117.A N.A ILE 152.A O.A no hydrogen 2.927 N/A CYS 117.A N.A ILE 152.A O.B no hydrogen 2.924 N/A CYS 117.A N.B ILE 152.A O.A no hydrogen 2.919 N/A CYS 117.A N.B ILE 152.A O.B no hydrogen 2.916 N/A CYS 117.A SG.B PHE 118.A O no hydrogen 3.839 N/A CYS 117.A SG.B ASN 121.A O no hydrogen 3.683 N/A ASN 119.A N ALA 150.A O no hydrogen 2.824 N/A ASN 121.A N PHE 118.A O no hydrogen 2.972 N/A ALA 122.A N ALA 120.A O no hydrogen 2.936 N/A GLY 124.A N ASN 121.A OD1 no hydrogen 3.271 N/A LEU 125.A N ASN 121.A O no hydrogen 2.938 N/A LEU 126.A N ALA 122.A O no hydrogen 2.919 N/A LEU 127.A N ALA 123.A O no hydrogen 2.929 N/A TYR 128.A N GLY 124.A O no hydrogen 3.056 N/A THR 129.A N LEU 125.A O no hydrogen 3.087 N/A THR 129.A OG1 LEU 125.A O no hydrogen 2.796 N/A GLN 130.A N LEU 126.A O no hydrogen 2.837 N/A LEU 131.A N LEU 127.A O no hydrogen 3.072 N/A GLY 132.A N THR 129.A O no hydrogen 3.022 N/A TYR 133.A N TYR 128.A O no hydrogen 2.969 N/A TYR 133.A OH GLU 101.A OE2 no hydrogen 2.653 N/A GLN 134.A N ASP 155.A O no hydrogen 2.921 N/A ARG 136.A N GLN 153.A O no hydrogen 2.761 N/A ARG 136.A NE ASP 155.A OD1 no hydrogen 2.830 N/A ALA 137.A N GLN 153.A O no hydrogen 3.365 N/A ALA 139.A N LEU 151.A O no hydrogen 2.930 N/A ARG 141.A N VAL 149.A O no hydrogen 2.925 N/A ARG 141.A NH1 GLU 140.A O no hydrogen 3.111 N/A ASP 143.A N ARG 147.A O no hydrogen 2.929 N/A ASP 145.A N ASP 143.A OD1 no hydrogen 2.864 N/A GLY 146.A N ASP 143.A O no hydrogen 2.891 N/A ARG 147.A N ASP 143.A OD1 no hydrogen 3.005 N/A ARG 148.A NE GLU 140.A OE2 no hydrogen 3.015 N/A ARG 148.A NH1 GLU 140.A OE2 no hydrogen 3.097 N/A VAL 149.A N ARG 141.A O no hydrogen 2.875 N/A ALA 150.A N ASN 119.A OD1 no hydrogen 2.934 N/A LEU 151.A N ALA 139.A O no hydrogen 2.791 N/A ILE 152.A N.A CYS 117.A O.A no hydrogen 2.784 N/A ILE 152.A N.A CYS 117.A O.B no hydrogen 2.797 N/A ILE 152.A N.B CYS 117.A O.A no hydrogen 2.781 N/A ILE 152.A N.B CYS 117.A O.B no hydrogen 2.794 N/A GLN 153.A N ALA 137.A O no hydrogen 2.816 N/A MET 154.A N ILE 115.A O.A no hydrogen 2.814 N/A MET 154.A N ILE 115.A O.B no hydrogen 2.817 N/A ASP 155.A N GLN 134.A O no hydrogen 3.045 N/A LYS 156.A N MET 113.A O no hydrogen 2.968 N/A LYS 156.A NZ GLU 101.A OE1 no hydrogen 3.262 N/A LYS 156.A NZ GLU 101.A OE2 no hydrogen 2.827 N/A LYS 156.A NZ LEU 131.A O no hydrogen 2.786 N/A LEU 158.A N.A ARG 111.A O no hydrogen 2.776 N/A LEU 158.A N.B ARG 111.A O no hydrogen 2.893 N/A