Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pwi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A SG LEU 3.A O no hydrogen 3.972 N/A CYS 1.A SG HIS 47.A ND1 no hydrogen 3.695 N/A MET 4.A N TYR 96.A O no hydrogen 2.910 N/A VAL 5.A N LEU 46.A O no hydrogen 3.248 N/A LYS 6.A N ILE 98.A O no hydrogen 2.845 N/A LYS 6.A NZ GLU 45.A OE2 no hydrogen 3.005 N/A VAL 7.A N GLY 44.A O no hydrogen 2.842 N/A LEU 8.A N ALA 100.A O no hydrogen 2.868 N/A ASP 9.A N SER 14.A O no hydrogen 2.789 N/A ALA 10.A N LEU 102.A O no hydrogen 2.854 N/A VAL 11.A N ASP 9.A OD1 no hydrogen 2.753 N/A ARG 12.A N ASP 9.A OD1 no hydrogen 2.881 N/A ARG 12.A NE ASP 9.A OD2 no hydrogen 3.156 N/A ARG 12.A NH2 TYR 69.A OH no hydrogen 3.023 N/A GLY 13.A N ASP 9.A O no hydrogen 3.002 N/A SER 14.A N ASP 9.A O no hydrogen 3.357 N/A SER 14.A OG PRO 15.A O no hydrogen 3.054 N/A ALA 16.A N VAL 7.A O no hydrogen 2.920 N/A ASN 18.A N THR 40.A O no hydrogen 2.960 N/A VAL 19.A N THR 40.A OG1 no hydrogen 2.860 N/A MET 21.A N GLY 38.A O no hydrogen 2.909 N/A HIS 22.A N GLU 63.A O no hydrogen 3.044 N/A VAL 23.A N ALA 36.A O no hydrogen 2.678 N/A PHE 24.A N LYS 61.A O no hydrogen 2.777 N/A ARG 25.A N GLU 33.A O no hydrogen 2.812 N/A ARG 25.A NH2 GLU 57.A O no hydrogen 2.684 N/A LYS 26.A N ILE 59.A O no hydrogen 2.861 N/A ALA 27.A N THR 31.A O no hydrogen 2.804 N/A ASP 30.A N ALA 27.A O no hydrogen 2.854 N/A THR 31.A N ASP 29.A OD1 no hydrogen 3.365 N/A THR 31.A OG1 ASP 29.A OD1 no hydrogen 2.791 N/A GLU 33.A N ARG 25.A O no hydrogen 2.877 N/A PHE 35.A N VAL 23.A O no hydrogen 2.806 N/A ALA 36.A N VAL 23.A O no hydrogen 3.245 N/A GLY 38.A N MET 21.A O no hydrogen 3.083 N/A LYS 39.A NZ ASN 18.A OD1 no hydrogen 2.990 N/A THR 40.A N VAL 19.A O no hydrogen 2.963 N/A THR 40.A OG1 ALA 16.A O no hydrogen 2.707 N/A SER 41.A N GLU 45.A O no hydrogen 2.881 N/A SER 41.A OG GLU 45.A O no hydrogen 3.114 N/A SER 43.A N SER 41.A OG no hydrogen 3.233 N/A SER 43.A OG SER 41.A OG no hydrogen 2.813 N/A GLY 44.A N SER 41.A O no hydrogen 2.911 N/A LEU 46.A N VAL 5.A O no hydrogen 2.795 N/A HIS 47.A NE2 GLU 45.A OE1 no hydrogen 2.675 N/A THR 50.A OG1 THR 51.A O no hydrogen 3.476 N/A THR 50.A OG1 GLU 54.A OE1 no hydrogen 2.666 N/A THR 51.A N THR 50.A OG1 no hydrogen 2.686 N/A GLU 53.A N GLU 53.A OE1 no hydrogen 2.803 N/A GLU 54.A N THR 51.A OG1 no hydrogen 3.235 N/A PHE 55.A N THR 51.A O no hydrogen 2.944 N/A VAL 56.A N GLU 54.A O no hydrogen 2.857 N/A GLY 58.A N ALA 88.A O no hydrogen 3.285 N/A TYR 60.A N PHE 86.A O no hydrogen 2.850 N/A TYR 60.A OH VAL 56.A O no hydrogen 2.659 N/A LYS 61.A N PHE 24.A O no hydrogen 2.849 N/A LYS 61.A NZ GLU 63.A OE1 no hydrogen 2.888 N/A VAL 62.A N VAL 84.A O no hydrogen 2.789 N/A GLU 63.A N HIS 22.A O no hydrogen 2.802 N/A ILE 64.A N ALA 82.A O no hydrogen 2.788 N/A ASP 65.A N ALA 20.A O no hydrogen 2.745 N/A THR 66.A N ILE 64.A O no hydrogen 2.802 N/A LYS 67.A NZ GLU 80.A OE1 no hydrogen 3.465 N/A LYS 67.A NZ GLU 80.A OE2 no hydrogen 2.984 N/A SER 68.A N ASP 65.A OD1 no hydrogen 3.133 N/A SER 68.A OG ASP 65.A OD1 no hydrogen 3.329 N/A SER 68.A OG ASP 65.A OD2 no hydrogen 2.605 N/A TYR 69.A OH ASP 9.A OD2 no hydrogen 2.547 N/A TRP 70.A N THR 66.A O no hydrogen 3.096 N/A LYS 71.A N LYS 67.A O no hydrogen 2.954 N/A LYS 71.A NZ SER 76.A OG no hydrogen 2.987 N/A ALA 72.A N SER 68.A O no hydrogen 3.166 N/A LEU 73.A N TRP 70.A O no hydrogen 2.924 N/A GLY 74.A N LYS 71.A O no hydrogen 2.929 N/A ILE 75.A N TRP 70.A O no hydrogen 2.898 N/A PHE 78.A N PRO 104.A O no hydrogen 2.902 N/A HIS 81.A NE2 GLU 83.A OE2 no hydrogen 2.569 N/A ALA 82.A N ILE 64.A O no hydrogen 3.026 N/A VAL 84.A N VAL 62.A O no hydrogen 2.867 N/A PHE 86.A N TYR 60.A O no hydrogen 2.939 N/A ALA 88.A N GLY 58.A O no hydrogen 2.788 N/A ASN 89.A N TYR 96.A OH no hydrogen 2.803 N/A ASN 89.A ND2 VAL 56.A O no hydrogen 3.477 N/A GLY 92.A N ASN 89.A O no hydrogen 3.176 N/A ARG 94.A N ASN 89.A OD1 no hydrogen 3.088 N/A ARG 94.A NH1 SER 91.A O no hydrogen 3.453 N/A ARG 94.A NH1 PRO 93.A O no hydrogen 3.101 N/A ARG 94.A NH2 SER 91.A O no hydrogen 3.506 N/A ARG 95.A N THR 114.A O no hydrogen 2.950 N/A TYR 96.A N PRO 2.A O no hydrogen 2.798 N/A THR 97.A N VAL 112.A O no hydrogen 2.879 N/A ILE 98.A N MET 4.A O no hydrogen 2.909 N/A ALA 99.A N THR 110.A O no hydrogen 2.962 N/A ALA 100.A N LYS 6.A O no hydrogen 2.889 N/A LEU 101.A N SER 108.A O no hydrogen 2.814 N/A LEU 102.A N LEU 8.A O no hydrogen 2.858 N/A SER 103.A N SER 106.A O no hydrogen 2.793 N/A SER 106.A N SER 103.A O no hydrogen 3.372 N/A SER 108.A N LEU 101.A O no hydrogen 2.980 N/A THR 109.A OG1 ALA 99.A O no hydrogen 2.875 N/A THR 110.A N ALA 99.A O no hydrogen 2.945 N/A VAL 112.A N THR 97.A O no hydrogen 2.782 N/A THR 114.A N ARG 95.A O no hydrogen 2.964 N/A