Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pqq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 2.A SG GLN 58.A OE1 no hydrogen 3.618 N/A CYS 2.A SG SER 142.A OG no hydrogen 3.370 N/A ARG 3.A N GLY 143.A O no hydrogen 2.979 N/A LEU 5.A N LEU 141.A O no hydrogen 2.932 N/A TYR 7.A OH VAL 139.A O no hydrogen 2.743 N/A ALA 8.A N LYS 50.A O no hydrogen 2.867 N/A HIS 10.A N ILE 48.A O no hydrogen 2.830 N/A HIS 10.A NE2 GLU 84.A OE2 no hydrogen 2.815 N/A LYS 11.A N ILE 48.A O no hydrogen 3.234 N/A LYS 11.A NZ GLU 84.A OE1 no hydrogen 2.878 N/A SER 13.A N TYR 46.A O no hydrogen 3.010 N/A SER 13.A OG GLN 45.A OE1 no hydrogen 2.650 N/A SER 13.A OG TYR 46.A O no hydrogen 3.351 N/A SER 14.A OG GLN 45.A OE1 no hydrogen 2.719 N/A SER 16.A N SER 37.A O no hydrogen 2.832 N/A THR 18.A OG1 SER 17.A O no hydrogen 2.681 N/A TYR 19.A N SER 16.A O no hydrogen 2.956 N/A TYR 19.A OH GLN 32.A OE1 no hydrogen 3.283 N/A ASN 23.A N LEU 20.A O no hydrogen 2.964 N/A ASN 23.A ND2 ARG 35.A O no hydrogen 3.042 N/A ILE 24.A N PRO 21.A O no hydrogen 3.256 N/A LEU 25.A N GLU 22.A O no hydrogen 3.135 N/A VAL 26.A N ASN 23.A O no hydrogen 3.414 N/A ASP 31.A N LYS 28.A O no hydrogen 2.991 N/A GLN 32.A NE2 TYR 19.A OH no hydrogen 3.347 N/A SER 33.A N ASP 31.A OD1 no hydrogen 2.971 N/A SER 33.A OG ASP 31.A OD1 no hydrogen 2.699 N/A SER 33.A OG ASP 31.A OD2 no hydrogen 3.286 N/A SER 34.A N ASP 31.A O no hydrogen 3.016 N/A ARG 35.A N SER 33.A O no hydrogen 2.889 N/A ARG 35.A NE GLN 32.A O no hydrogen 2.859 N/A ARG 35.A NH1 GLN 32.A OE1 no hydrogen 2.971 N/A ARG 35.A NH2 SER 135.A OG no hydrogen 2.949 N/A TRP 36.A N ILE 136.A O no hydrogen 2.978 N/A TRP 36.A NE1 SER 14.A O no hydrogen 2.880 N/A SER 37.A OG SER 135.A OG no hydrogen 2.730 N/A SER 38.A N PHE 134.A O no hydrogen 2.895 N/A SER 38.A OG SER 40.A O no hydrogen 2.702 N/A GLU 39.A N SER 14.A OG no hydrogen 2.890 N/A TYR 42.A N SER 40.A OG no hydrogen 3.282 N/A GLN 45.A NE2 TYR 42.A O no hydrogen 2.863 N/A TYR 46.A N SER 13.A OG no hydrogen 2.924 N/A LEU 47.A N ILE 122.A O no hydrogen 3.008 N/A ILE 48.A N LYS 11.A O no hydrogen 2.805 N/A LEU 49.A N ILE 120.A O no hydrogen 2.751 N/A LYS 50.A N ALA 8.A O no hydrogen 2.861 N/A LEU 51.A N ARG 118.A O no hydrogen 2.815 N/A GLU 52.A N PRO 6.A O no hydrogen 3.205 N/A ALA 55.A N CYS 117.A O no hydrogen 3.005 N/A ILE 56.A N ILE 144.A O no hydrogen 2.777 N/A GLN 58.A N SER 142.A O no hydrogen 2.816 N/A GLN 58.A NE2 HIS 108.A NE2 no hydrogen 3.233 N/A ASN 59.A N SER 142.A O no hydrogen 3.012 N/A ASN 59.A ND2 SER 142.A OG no hydrogen 3.303 N/A ILE 60.A N PHE 104.A O no hydrogen 2.942 N/A THR 61.A N GLU 140.A O no hydrogen 2.768 N/A THR 61.A OG1 THR 103.A OG1 no hydrogen 2.656 N/A PHE 62.A N GLU 102.A O no hydrogen 2.824 N/A GLY 63.A N TYR 138.A O no hydrogen 2.835 N/A LYS 64.A NZ LYS 96.A O no hydrogen 2.925 N/A LYS 64.A NZ ASP 98.A OD1 no hydrogen 2.808 N/A LYS 64.A NZ ASN 100.A O no hydrogen 2.763 N/A LYS 64.A NZ GLU 102.A OE1 no hydrogen 2.714 N/A GLU 66.A N PRO 29.A O no hydrogen 2.755 N/A HIS 69.A N ASN 97.A OD1 no hydrogen 2.924 N/A CYS 71.A N HIS 69.A ND1 no hydrogen 3.066 N/A CYS 71.A SG SER 131.A OG no hydrogen 3.207 N/A CYS 71.A SG ASN 133.A O no hydrogen 3.869 N/A ASN 72.A N HIS 69.A O no hydrogen 3.077 N/A ASN 72.A ND2 ASN 97.A OD1 no hydrogen 2.865 N/A LYS 74.A N LEU 126.A O no hydrogen 2.593 N/A LYS 75.A N LEU 126.A O no hydrogen 3.064 N/A PHE 76.A N SER 93.A O no hydrogen 2.790 N/A LYS 77.A N VAL 123.A O no hydrogen 2.911 N/A VAL 78.A N LEU 91.A O no hydrogen 2.904 N/A PHE 79.A N LYS 121.A O no hydrogen 2.824 N/A GLY 80.A N THR 88.A O no hydrogen 2.920 N/A GLY 81.A N PHE 119.A O no hydrogen 3.106 N/A GLU 85.A N ASN 83.A OD1 no hydrogen 2.764 N/A ASN 86.A N ASN 83.A O no hydrogen 3.125 N/A THR 88.A N GLY 80.A O no hydrogen 2.934 N/A LEU 90.A N VAL 78.A O no hydrogen 2.699 N/A LEU 91.A N VAL 78.A O no hydrogen 3.243 N/A SER 93.A N PHE 76.A O no hydrogen 3.042 N/A LEU 95.A N LEU 73.A O no hydrogen 2.863 N/A LYS 96.A N GLU 102.A OE1 no hydrogen 2.711 N/A ASN 100.A N ASP 98.A OD1 no hydrogen 2.992 N/A ASN 100.A ND2 ASP 98.A OD2 no hydrogen 3.147 N/A LYS 101.A NZ ASP 27.A OD2 no hydrogen 2.547 N/A GLU 102.A N PHE 62.A O no hydrogen 3.057 N/A THR 103.A OG1 THR 61.A OG1 no hydrogen 2.656 N/A PHE 104.A N ILE 60.A O no hydrogen 2.829 N/A LEU 106.A N GLN 58.A O no hydrogen 2.843 N/A LYS 107.A N LEU 90.A O no hydrogen 3.014 N/A HIS 108.A ND1 LEU 106.A O no hydrogen 2.991 N/A ILE 110.A N GLN 113.A O no hydrogen 2.971 N/A GLN 113.A N ILE 110.A O no hydrogen 3.138 N/A GLN 113.A NE2 MET 114.A O no hydrogen 2.921 N/A PHE 115.A N HIS 108.A O no hydrogen 3.019 N/A CYS 117.A N ALA 55.A O no hydrogen 2.808 N/A ARG 118.A N GLY 81.A O no hydrogen 2.907 N/A ARG 118.A NE LEU 51.A O no hydrogen 2.802 N/A PHE 119.A N GLY 81.A O no hydrogen 2.959 N/A ILE 120.A N LEU 49.A O no hydrogen 2.933 N/A LYS 121.A N PHE 79.A O no hydrogen 2.797 N/A ILE 122.A N LEU 47.A O no hydrogen 2.852 N/A VAL 123.A N LYS 77.A O no hydrogen 2.820 N/A LEU 125.A N LYS 75.A O no hydrogen 2.827 N/A LEU 126.A N LYS 75.A O no hydrogen 3.164 N/A SER 127.A OG GLY 129.A O no hydrogen 2.857 N/A TRP 128.A N ASN 72.A O no hydrogen 2.981 N/A TRP 128.A NE1 LEU 95.A O no hydrogen 2.855 N/A GLY 129.A N VAL 70.A O no hydrogen 2.996 N/A SER 131.A OG ASN 133.A O no hydrogen 2.961 N/A ASN 133.A N SER 131.A OG no hydrogen 3.090 N/A ASN 133.A ND2 SER 38.A O no hydrogen 2.830 N/A PHE 134.A N SER 38.A OG no hydrogen 2.965 N/A SER 135.A N CYS 71.A O no hydrogen 3.018 N/A SER 135.A OG SER 37.A OG no hydrogen 2.730 N/A ILE 136.A N TRP 36.A O no hydrogen 2.933 N/A TRP 137.A NE1 ASN 72.A OD1 no hydrogen 2.807 N/A TYR 138.A OH GLU 140.A OE2 no hydrogen 2.458 N/A VAL 139.A N ILE 24.A O no hydrogen 2.947 N/A GLU 140.A N THR 61.A O no hydrogen 2.952 N/A SER 142.A N ASN 59.A O no hydrogen 3.009 N/A GLY 143.A N ARG 3.A O no hydrogen 2.943 N/A ILE 144.A N ILE 56.A O no hydrogen 2.870 N/A ASP 148.A N ASP 146.A OD1 no hydrogen 2.991 N/A ILE 149.A N ASP 146.A O no hydrogen 2.933 N/A VAL 150.A N ASP 146.A O no hydrogen 2.836 N/A GLN 151.A N PRO 147.A O no hydrogen 2.929 N/A CYS 153.A N VAL 150.A O no hydrogen 2.826 N/A CYS 153.A SG MET 114.A O no hydrogen 3.434 N/A CYS 153.A SG ILE 149.A O no hydrogen 3.413 N/A LEU 154.A N GLN 151.A O no hydrogen 3.073 N/A