Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pwh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A SG LEU 3.A O no hydrogen 3.852 N/A CYS 1.A SG HIS 47.A ND1 no hydrogen 3.877 N/A MET 4.A N TYR 96.A O no hydrogen 2.906 N/A VAL 5.A N LEU 46.A O no hydrogen 3.174 N/A LYS 6.A N ILE 98.A O.A no hydrogen 2.800 N/A LYS 6.A N ILE 98.A O.B no hydrogen 2.761 N/A LYS 6.A NZ GLU 45.A OE2 no hydrogen 3.437 N/A VAL 7.A N GLY 44.A O no hydrogen 2.877 N/A LEU 8.A N ALA 100.A O no hydrogen 2.844 N/A ASP 9.A N SER 14.A O no hydrogen 2.822 N/A ALA 10.A N LEU 102.A O no hydrogen 2.890 N/A VAL 11.A N ASP 9.A OD1 no hydrogen 2.809 N/A ARG 12.A N ASP 9.A OD1 no hydrogen 2.901 N/A ARG 12.A NE ASP 9.A OD2 no hydrogen 3.022 N/A ARG 12.A NH2 TYR 69.A OH no hydrogen 2.948 N/A GLY 13.A N ASP 9.A O no hydrogen 2.969 N/A SER 14.A N ASP 9.A O no hydrogen 3.309 N/A SER 14.A OG PRO 15.A O no hydrogen 3.047 N/A ALA 16.A N VAL 7.A O no hydrogen 2.976 N/A ASN 18.A N THR 40.A O no hydrogen 2.975 N/A VAL 19.A N THR 40.A OG1 no hydrogen 2.875 N/A MET 21.A N GLY 38.A O no hydrogen 2.948 N/A HIS 22.A N GLU 63.A O no hydrogen 3.026 N/A VAL 23.A N ALA 36.A O no hydrogen 2.670 N/A PHE 24.A N LYS 61.A O no hydrogen 2.847 N/A ARG 25.A N GLU 33.A O no hydrogen 2.794 N/A ARG 25.A NH2 GLU 57.A O no hydrogen 2.790 N/A LYS 26.A N ILE 59.A O no hydrogen 2.862 N/A ALA 27.A N THR 31.A O no hydrogen 2.752 N/A ASP 30.A N ALA 27.A O no hydrogen 2.798 N/A THR 31.A N ASP 29.A OD1 no hydrogen 3.414 N/A THR 31.A OG1 ASP 29.A OD1 no hydrogen 2.800 N/A GLU 33.A N ARG 25.A O no hydrogen 2.911 N/A PHE 35.A N VAL 23.A O no hydrogen 2.819 N/A ALA 36.A N VAL 23.A O no hydrogen 3.282 N/A GLY 38.A N MET 21.A O no hydrogen 3.162 N/A THR 40.A N VAL 19.A O no hydrogen 2.975 N/A THR 40.A OG1 ALA 16.A O no hydrogen 2.672 N/A SER 41.A N GLU 45.A O no hydrogen 2.862 N/A SER 41.A OG GLU 45.A O no hydrogen 3.230 N/A SER 43.A N SER 41.A OG no hydrogen 3.177 N/A SER 43.A OG SER 41.A OG no hydrogen 2.823 N/A GLY 44.A N SER 41.A O no hydrogen 2.899 N/A LEU 46.A N VAL 5.A O no hydrogen 2.815 N/A HIS 47.A NE2 GLU 45.A OE1 no hydrogen 2.672 N/A THR 50.A OG1 THR 51.A O no hydrogen 3.478 N/A THR 50.A OG1 GLU 54.A OE1 no hydrogen 2.573 N/A GLU 54.A N THR 51.A OG1 no hydrogen 3.200 N/A PHE 55.A N THR 51.A O no hydrogen 2.955 N/A VAL 56.A N GLU 54.A O no hydrogen 2.879 N/A GLY 58.A N ALA 88.A O no hydrogen 3.287 N/A TYR 60.A N PHE 86.A O no hydrogen 2.780 N/A TYR 60.A OH VAL 56.A O no hydrogen 2.699 N/A LYS 61.A N PHE 24.A O no hydrogen 2.898 N/A LYS 61.A NZ GLU 63.A OE1 no hydrogen 3.037 N/A VAL 62.A N VAL 84.A O no hydrogen 2.791 N/A GLU 63.A N HIS 22.A O no hydrogen 2.858 N/A ILE 64.A N ALA 82.A O no hydrogen 2.766 N/A ASP 65.A N ALA 20.A O no hydrogen 2.840 N/A THR 66.A N ILE 64.A O no hydrogen 2.802 N/A LYS 67.A NZ GLU 80.A OE2 no hydrogen 2.972 N/A SER 68.A N ASP 65.A OD1 no hydrogen 3.208 N/A SER 68.A OG ASP 65.A OD1 no hydrogen 3.394 N/A SER 68.A OG ASP 65.A OD2 no hydrogen 2.636 N/A TYR 69.A OH ASP 9.A OD2 no hydrogen 2.617 N/A TRP 70.A N THR 66.A O no hydrogen 3.075 N/A LYS 71.A N LYS 67.A O no hydrogen 2.929 N/A LYS 71.A NZ SER 76.A OG no hydrogen 3.232 N/A ALA 72.A N SER 68.A O no hydrogen 3.156 N/A LEU 73.A N TRP 70.A O no hydrogen 2.948 N/A GLY 74.A N LYS 71.A O no hydrogen 2.914 N/A ILE 75.A N TRP 70.A O no hydrogen 2.925 N/A PHE 78.A N PRO 104.A O no hydrogen 2.889 N/A HIS 81.A NE2 GLU 83.A OE2 no hydrogen 2.644 N/A ALA 82.A N ILE 64.A O no hydrogen 3.014 N/A VAL 84.A N VAL 62.A O no hydrogen 2.860 N/A PHE 86.A N TYR 60.A O no hydrogen 2.944 N/A ALA 88.A N GLY 58.A O no hydrogen 2.839 N/A ASN 89.A N TYR 96.A OH no hydrogen 2.810 N/A ASN 89.A ND2 VAL 56.A O no hydrogen 3.468 N/A GLY 92.A N ASN 89.A O no hydrogen 3.159 N/A ARG 94.A N ASN 89.A OD1 no hydrogen 3.038 N/A ARG 94.A NH1 SER 91.A O no hydrogen 3.436 N/A ARG 94.A NH1 PRO 93.A O no hydrogen 3.158 N/A ARG 95.A N THR 114.A O no hydrogen 2.918 N/A TYR 96.A N PRO 2.A O no hydrogen 2.710 N/A THR 97.A N VAL 112.A O no hydrogen 2.913 N/A ILE 98.A N.A MET 4.A O no hydrogen 2.894 N/A ILE 98.A N.B MET 4.A O no hydrogen 2.873 N/A ALA 99.A N THR 110.A O no hydrogen 2.907 N/A ALA 100.A N LYS 6.A O no hydrogen 2.789 N/A LEU 101.A N SER 108.A O no hydrogen 2.885 N/A LEU 102.A N LEU 8.A O no hydrogen 2.878 N/A SER 103.A N SER 106.A O no hydrogen 2.812 N/A SER 106.A N SER 103.A O no hydrogen 3.290 N/A SER 108.A N LEU 101.A O no hydrogen 2.996 N/A THR 109.A OG1 ALA 99.A O no hydrogen 3.193 N/A THR 110.A N ALA 99.A O no hydrogen 2.957 N/A VAL 112.A N THR 97.A O no hydrogen 2.862 N/A THR 114.A N ARG 95.A O no hydrogen 2.998 N/A