Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3whs_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 THR 19.A OG1 no hydrogen 2.685 N/A THR 2.A N THR 18.A O no hydrogen 2.825 N/A HIS 3.A ND1 THR 17.A OG1 no hydrogen 2.762 N/A PHE 4.A N TYR 16.A O no hydrogen 2.975 N/A THR 5.A OG1 VAL 14.A O no hydrogen 2.701 N/A THR 5.A OG1 THR 78.A OG1 no hydrogen 3.417 N/A VAL 6.A N VAL 14.A O no hydrogen 3.040 N/A ASP 8.A N ASN 12.A O no hydrogen 3.074 N/A TRP 10.A N ASP 8.A OD1 no hydrogen 2.896 N/A GLY 11.A N ASP 8.A O no hydrogen 3.256 N/A ASN 12.A N ASP 8.A OD1 no hydrogen 2.943 N/A VAL 14.A N VAL 6.A O no hydrogen 2.769 N/A SER 15.A OG THR 67.A O no hydrogen 3.535 N/A SER 15.A OG VAL 79.A O no hydrogen 3.486 N/A TYR 16.A N PHE 4.A O no hydrogen 2.936 N/A THR 17.A OG1 HIS 3.A ND1 no hydrogen 2.762 N/A THR 18.A N THR 2.A O no hydrogen 2.977 N/A THR 19.A OG1 THR 1.A OG1 no hydrogen 2.685 N/A GLU 21.A N THR 19.A OG1 no hydrogen 2.813 N/A GLY 25.A N GLN 22.A O no hydrogen 2.738 N/A THR 26.A N LEU 37.A O no hydrogen 2.928 N/A THR 26.A OG1 LEU 37.A O no hydrogen 2.926 N/A GLY 27.A N PHE 24.A O no hydrogen 2.816 N/A ILE 28.A N THR 26.A OG1 no hydrogen 3.037 N/A VAL 30.A N VAL 35.A O no hydrogen 2.869 N/A TYR 33.A N VAL 30.A O no hydrogen 3.061 N/A GLY 34.A N VAL 30.A O no hydrogen 3.149 N/A LEU 37.A N ILE 28.A O no hydrogen 2.826 N/A ASN 39.A N ILE 20.A O no hydrogen 3.121 N/A GLU 40.A N ASN 38.A OD1 no hydrogen 2.786 N/A THR 42.A N ASN 39.A O no hydrogen 3.064 N/A THR 42.A OG1 ASN 39.A O no hydrogen 3.086 N/A THR 42.A OG1 ASN 39.A OD1 no hydrogen 2.983 N/A ASP 43.A N GLU 40.A O no hydrogen 2.973 N/A PHE 44.A N LEU 41.A O no hydrogen 3.016 N/A ASP 45.A N ASN 52.A O no hydrogen 2.876 N/A GLY 49.A N GLU 53.A OE1 no hydrogen 2.774 N/A ASN 52.A ND2 ASP 43.A O no hydrogen 2.834 N/A ASN 52.A ND2 ASP 45.A OD1 no hydrogen 3.478 N/A GLU 53.A N GLY 50.A O no hydrogen 3.149 N/A GLN 55.A NE2 GLU 53.A OE2 no hydrogen 2.817 N/A LYS 58.A N GLN 55.A O no hydrogen 3.133 N/A LYS 58.A NZ ALA 51.A O no hydrogen 2.814 N/A LYS 58.A NZ GLU 53.A O no hydrogen 2.841 N/A LEU 61.A N ASN 52.A OD1 no hydrogen 2.896 N/A MET 64.A N SER 62.A OG no hydrogen 2.967 N/A THR 65.A OG1 SER 63.A O no hydrogen 2.700 N/A THR 67.A N VAL 79.A O no hydrogen 2.898 N/A THR 67.A OG1 THR 65.A O no hydrogen 2.779 N/A LEU 69.A N LEU 77.A O no hydrogen 2.731 N/A LYS 71.A N LYS 74.A O no hydrogen 2.910 N/A LYS 74.A N LYS 71.A O no hydrogen 3.085 N/A VAL 76.A N LEU 69.A O no hydrogen 2.787 N/A LEU 77.A N LEU 69.A O no hydrogen 3.277 N/A THR 78.A N ILE 156.A O no hydrogen 2.841 N/A THR 78.A OG1 THR 5.A OG1 no hydrogen 3.417 N/A VAL 79.A N THR 67.A O no hydrogen 2.955 N/A SER 81.A OG PRO 82.A O no hydrogen 2.688 N/A THR 86.A N GLY 83.A O no hydrogen 3.144 N/A THR 86.A OG1 GLY 83.A O no hydrogen 2.660 N/A ILE 87.A N GLY 84.A O no hydrogen 2.984 N/A SER 90.A N THR 86.A O no hydrogen 2.921 N/A VAL 91.A N ILE 87.A O no hydrogen 2.956 N/A LEU 92.A N ILE 88.A O no hydrogen 2.946 N/A GLN 93.A N SER 89.A O no hydrogen 2.922 N/A GLN 93.A NE2 SER 89.A O no hydrogen 2.878 N/A GLN 93.A NE2 ILE 114.A O no hydrogen 2.856 N/A THR 94.A N SER 90.A O no hydrogen 3.024 N/A THR 94.A OG1 SER 90.A O no hydrogen 2.937 N/A ILE 95.A N VAL 91.A O no hydrogen 3.032 N/A LEU 96.A N LEU 92.A O no hydrogen 2.820 N/A TYR 97.A N GLN 93.A O no hydrogen 2.810 N/A HIS 98.A N THR 94.A O no hydrogen 3.036 N/A HIS 98.A ND1 MET 103.A O no hydrogen 2.833 N/A ILE 99.A N ILE 95.A O no hydrogen 2.886 N/A TYR 101.A N LEU 96.A O no hydrogen 2.939 N/A MET 103.A N TYR 97.A O no hydrogen 2.892 N/A LYS 106.A N GLU 104.A OE2 no hydrogen 2.983 N/A LYS 106.A NZ GLU 110.A OE2 no hydrogen 2.832 N/A LYS 106.A NZ ALA 169.A O no hydrogen 2.739 N/A ALA 107.A N GLU 104.A OE1 no hydrogen 2.937 N/A ALA 108.A N GLU 104.A O no hydrogen 2.827 N/A VAL 109.A N LEU 105.A O no hydrogen 2.953 N/A GLU 110.A N LYS 106.A O no hydrogen 2.946 N/A GLU 111.A N ALA 107.A O no hydrogen 2.979 N/A ARG 113.A N GLU 125.A OE2 no hydrogen 2.773 N/A ARG 113.A NH1 ILE 150.A O no hydrogen 2.737 N/A ARG 113.A NH1 ASP 170.A OD2 no hydrogen 3.155 N/A ARG 113.A NH2 ASP 170.A OD2 no hydrogen 3.068 N/A ILE 114.A N GLN 93.A OE1 no hydrogen 2.955 N/A TYR 115.A N ARG 123.A O no hydrogen 2.993 N/A THR 116.A OG1 SER 121.A O no hydrogen 2.713 N/A SER 118.A OG SER 120.A OG no hydrogen 3.416 N/A SER 120.A N SER 118.A OG no hydrogen 3.159 N/A SER 120.A OG SER 118.A OG no hydrogen 3.416 N/A SER 121.A N SER 118.A O no hydrogen 3.457 N/A SER 121.A OG ASN 117.A OD1 no hydrogen 2.781 N/A TYR 122.A OH HIS 141.A ND1 no hydrogen 2.580 N/A ARG 123.A N TYR 115.A O no hydrogen 2.810 N/A TYR 124.A OH GLY 144.A O no hydrogen 3.057 N/A GLU 125.A N ARG 113.A O no hydrogen 3.045 N/A VAL 128.A N GLU 125.A O no hydrogen 3.281 N/A LEU 133.A N PRO 129.A O no hydrogen 2.992 N/A SER 134.A N LYS 130.A O no hydrogen 2.885 N/A SER 134.A OG LYS 130.A O no hydrogen 2.928 N/A LYS 135.A N ASP 131.A O no hydrogen 2.834 N/A LEU 136.A N VAL 132.A O no hydrogen 2.948 N/A ASN 137.A N LEU 133.A O no hydrogen 2.951 N/A ASN 137.A ND2 PHE 143.A O no hydrogen 2.889 N/A GLY 138.A N SER 134.A O no hydrogen 2.882 N/A MET 139.A N LYS 135.A O no hydrogen 3.247 N/A MET 139.A N LEU 136.A O no hydrogen 3.070 N/A GLY 140.A N ASN 137.A O no hydrogen 2.954 N/A HIS 141.A N LEU 136.A O no hydrogen 3.139 N/A HIS 141.A ND1 TYR 122.A OH no hydrogen 2.580 N/A PHE 143.A N ASN 137.A OD1 no hydrogen 2.854 N/A VAL 148.A N TYR 124.A O no hydrogen 2.908 N/A ILE 150.A N GLU 125.A OE1 no hydrogen 2.813 N/A ASN 152.A N SER 81.A OG no hydrogen 2.884 N/A VAL 153.A N ASP 170.A OD2 no hydrogen 2.965 N/A SER 155.A N VAL 168.A O no hydrogen 2.957 N/A SER 155.A OG THR 78.A O no hydrogen 2.607 N/A SER 157.A N LYS 166.A O no hydrogen 2.799 N/A ILE 158.A N VAL 76.A O no hydrogen 2.917 N/A ASP 159.A N THR 164.A O no hydrogen 2.877 N/A HIS 160.A NE2 PRO 75.A O no hydrogen 2.638 N/A GLU 161.A N ASP 159.A OD1 no hydrogen 2.892 N/A ASN 162.A N ASP 159.A OD1 no hydrogen 3.018 N/A ASN 162.A ND2 ASP 159.A OD2 no hydrogen 2.636 N/A THR 164.A N ASP 159.A O no hydrogen 3.125 N/A LYS 166.A N SER 157.A O no hydrogen 2.899 N/A LYS 166.A NZ GLU 104.A OE2 no hydrogen 2.538 N/A VAL 168.A N SER 155.A O no hydrogen 2.798 N/A SER 171.A N GLU 110.A OE2 no hydrogen 2.811 N/A SER 171.A OG GLU 110.A OE1 no hydrogen 2.623 N/A SER 171.A OG GLU 110.A OE2 no hydrogen 3.302 N/A SER 172.A N ASP 170.A OD1 no hydrogen 2.951 N/A SER 172.A OG GLY 151.A O no hydrogen 2.774 N/A SER 172.A OG ASN 152.A OD1 no hydrogen 2.928 N/A ARG 173.A N ASP 170.A O no hydrogen 3.338 N/A ARG 173.A NH1 THR 1.A O no hydrogen 2.966 N/A ARG 173.A NH2 THR 1.A O no hydrogen 2.974 N/A