Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2py2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 5.A N PRO 2.A O no hydrogen 2.872 N/A LYS 6.A N PHE 13.A O no hydrogen 2.837 N/A LYS 6.A NZ ASP 4.A O no hydrogen 3.372 N/A PHE 8.A N ARG 11.A O no hydrogen 2.856 N/A ARG 11.A N PHE 8.A O no hydrogen 3.063 N/A ARG 11.A NH1 SER 38.A O no hydrogen 3.055 N/A ARG 11.A NH1 GLU 44.A OE1 no hydrogen 2.817 N/A ARG 11.A NH2 SER 38.A O no hydrogen 3.282 N/A CYS 12.A N LYS 124.A O no hydrogen 2.778 N/A PHE 13.A N LYS 6.A O no hydrogen 2.683 N/A LEU 14.A N CYS 122.A O no hydrogen 2.909 N/A ASN 16.A N SER 120.A O no hydrogen 2.768 N/A LEU 18.A N ASN 16.A OD1 no hydrogen 3.174 N/A GLN 19.A NE2 PRO 17.A O no hydrogen 3.522 N/A LEU 20.A N HIS 118.A O no hydrogen 3.090 N/A TRP 22.A N CYS 114.A O no hydrogen 2.921 N/A TRP 22.A NE1 ILE 61.A O no hydrogen 3.007 N/A ASP 24.A N HIS 21.A ND1 no hydrogen 3.051 N/A ALA 25.A N HIS 21.A O no hydrogen 2.923 N/A GLN 26.A N TRP 22.A O no hydrogen 2.941 N/A GLN 26.A NE2 ASN 35.A OD1 no hydrogen 2.900 N/A GLU 27.A N ALA 23.A O no hydrogen 2.911 N/A SER 28.A N ASP 24.A O no hydrogen 2.800 N/A CYS 29.A N ALA 25.A O no hydrogen 3.034 N/A CYS 29.A SG ALA 25.A O no hydrogen 3.391 N/A MET 30.A N GLN 26.A O no hydrogen 2.936 N/A LYS 31.A N GLU 27.A O no hydrogen 3.194 N/A GLU 32.A N CYS 29.A O no hydrogen 2.864 N/A GLY 33.A N MET 30.A O no hydrogen 3.062 N/A ALA 34.A N CYS 29.A O no hydrogen 2.958 N/A ASN 35.A N ALA 123.A O no hydrogen 3.073 N/A LEU 36.A N GLN 26.A OE1 no hydrogen 2.874 N/A ALA 37.A N ILE 121.A O no hydrogen 2.816 N/A SER 38.A OG HIS 40.A NE2 no hydrogen 2.817 N/A SER 38.A OG ASP 76.A OD2 no hydrogen 2.591 N/A SER 38.A OG THR 78.A OG1 no hydrogen 3.236 N/A HIS 40.A N GLU 44.A OE2 no hydrogen 2.763 N/A HIS 40.A ND1 ASP 81.A OD1 no hydrogen 3.082 N/A HIS 40.A NE2 SER 38.A OG no hydrogen 2.817 N/A GLU 44.A N SER 41.A OG no hydrogen 3.041 N/A SER 45.A N SER 41.A O no hydrogen 2.907 N/A THR 46.A N LEU 42.A O no hydrogen 2.811 N/A THR 46.A OG1 LEU 42.A O no hydrogen 3.001 N/A PHE 47.A N GLU 43.A O no hydrogen 3.095 N/A VAL 48.A N GLU 44.A O no hydrogen 2.947 N/A LYS 49.A N SER 45.A O no hydrogen 2.923 N/A LYS 49.A NZ LYS 107.A O no hydrogen 3.033 N/A GLU 50.A N THR 46.A O no hydrogen 3.033 N/A LEU 51.A N VAL 48.A O no hydrogen 2.843 N/A THR 52.A N LYS 49.A O no hydrogen 3.054 N/A THR 52.A OG1 LYS 49.A O no hydrogen 2.707 N/A THR 52.A OG1 ASN 102.A OD1 no hydrogen 2.954 N/A SER 53.A OG THR 52.A O no hydrogen 2.464 N/A ASP 55.A N SER 53.A OG no hydrogen 3.236 N/A LEU 56.A N SER 53.A O no hydrogen 2.875 N/A ILE 57.A N THR 52.A O no hydrogen 3.224 N/A SER 59.A N MET 101.A O no hydrogen 3.046 N/A SER 59.A OG ILE 57.A O no hydrogen 2.768 N/A TRP 60.A N SER 119.A O no hydrogen 2.873 N/A TRP 60.A NE1 LEU 20.A O no hydrogen 3.057 N/A ILE 61.A N ILE 99.A O no hydrogen 3.134 N/A GLY 62.A N ALA 37.A O no hydrogen 2.853 N/A THR 64.A N PHE 73.A O no hydrogen 3.055 N/A ASP 65.A N CYS 97.A O no hydrogen 3.075 N/A CYS 66.A N THR 64.A OG1 no hydrogen 3.379 N/A SER 69.A OG THR 92.A O no hydrogen 2.672 N/A THR 70.A N ASP 65.A OD2 no hydrogen 2.940 N/A THR 70.A OG1 SER 69.A O no hydrogen 2.424 N/A ARG 71.A N VAL 68.A O no hydrogen 2.994 N/A PHE 73.A N THR 64.A O no hydrogen 2.950 N/A MET 75.A N GLY 62.A O no hydrogen 2.886 N/A SER 77.A N TRP 74.A O no hydrogen 3.059 N/A SER 77.A OG ASP 76.A O no hydrogen 2.474 N/A THR 78.A N ASP 76.A OD1 no hydrogen 3.080 N/A THR 78.A OG1 SER 38.A OG no hydrogen 3.236 N/A THR 78.A OG1 HIS 40.A NE2 no hydrogen 3.029 N/A THR 78.A OG1 ASP 76.A OD1 no hydrogen 2.649 N/A CYS 86.A N TRP 109.A O no hydrogen 2.857 N/A CYS 86.A SG VAL 103.A O no hydrogen 3.766 N/A CYS 86.A SG TRP 109.A O no hydrogen 3.429 N/A GLN 89.A N CYS 86.A O no hydrogen 2.995 N/A GLN 89.A NE2 ASP 91.A OD2 no hydrogen 3.281 N/A ASP 91.A N ASP 111.A OD1 no hydrogen 2.928 N/A THR 92.A N ASP 111.A OD2 no hydrogen 2.850 N/A THR 92.A OG1 SER 69.A OG no hydrogen 3.380 N/A THR 92.A OG1 ASP 91.A O no hydrogen 2.464 N/A THR 93.A OG1 GLU 96.A OE2 no hydrogen 3.079 N/A GLU 96.A N THR 93.A O no hydrogen 3.036 N/A CYS 97.A SG LEU 94.A O no hydrogen 3.314 N/A CYS 98.A N THR 112.A O no hydrogen 3.260 N/A ILE 99.A N GLY 63.A O no hydrogen 2.850 N/A GLN 100.A N ASN 110.A O no hydrogen 3.020 N/A MET 101.A N SER 59.A O no hydrogen 2.738 N/A VAL 103.A N CYS 108.A O no hydrogen 2.963 N/A LYS 107.A N GLY 104.A O no hydrogen 3.222 N/A LYS 107.A NZ ASP 55.A O no hydrogen 2.862 N/A LYS 107.A NZ LEU 56.A O no hydrogen 2.806 N/A CYS 108.A N VAL 103.A O no hydrogen 3.216 N/A CYS 108.A SG VAL 103.A O no hydrogen 3.756 N/A TRP 109.A N ASP 84.A O no hydrogen 2.754 N/A ASN 110.A N GLN 100.A O no hydrogen 2.976 N/A ASP 111.A N GLN 89.A OE1 no hydrogen 3.335 N/A THR 112.A N CYS 98.A O no hydrogen 2.767 N/A THR 112.A OG1 PRO 113.A O no hydrogen 3.395 N/A HIS 116.A N PRO 113.A O no hydrogen 3.138 N/A HIS 118.A N LEU 20.A O no hydrogen 3.015 N/A SER 119.A OG PRO 17.A O no hydrogen 3.147 N/A SER 120.A N ASN 16.A O no hydrogen 2.892 N/A ILE 121.A N TRP 60.A O no hydrogen 3.155 N/A CYS 122.A N LEU 14.A O no hydrogen 2.783 N/A ALA 123.A N ASN 35.A O no hydrogen 2.911 N/A LYS 124.A N CYS 12.A O no hydrogen 3.060 N/A LYS 124.A NZ GLU 32.A O no hydrogen 2.974 N/A LEU 126.A N GLY 10.A O no hydrogen 2.866 N/A