Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3whq_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N THR 19.A OG1 no hydrogen 3.148 N/A THR 1.A OG1 THR 19.A OG1 no hydrogen 2.582 N/A THR 2.A N THR 18.A O no hydrogen 2.817 N/A HIS 3.A ND1 THR 17.A OG1 no hydrogen 2.763 N/A PHE 4.A N TYR 16.A O no hydrogen 2.946 N/A THR 5.A OG1 VAL 14.A O no hydrogen 2.714 N/A THR 5.A OG1 THR 78.A OG1 no hydrogen 2.745 N/A VAL 6.A N VAL 14.A O no hydrogen 3.132 N/A ASP 8.A N ASN 12.A O no hydrogen 3.140 N/A TRP 10.A N ASP 8.A OD1 no hydrogen 2.893 N/A GLY 11.A N ASP 8.A O no hydrogen 3.353 N/A ASN 12.A N ASP 8.A OD1 no hydrogen 2.974 N/A VAL 14.A N VAL 6.A O no hydrogen 2.800 N/A SER 15.A OG THR 67.A O no hydrogen 3.300 N/A SER 15.A OG VAL 79.A O no hydrogen 3.547 N/A TYR 16.A N PHE 4.A O no hydrogen 2.962 N/A THR 17.A OG1 HIS 3.A ND1 no hydrogen 2.763 N/A THR 18.A N THR 2.A O no hydrogen 2.995 N/A THR 19.A OG1 THR 1.A OG1 no hydrogen 2.582 N/A GLU 21.A N THR 19.A OG1 no hydrogen 2.913 N/A GLY 25.A N GLN 22.A O no hydrogen 2.844 N/A THR 26.A N LEU 37.A O no hydrogen 2.953 N/A THR 26.A OG1 LEU 37.A O no hydrogen 2.958 N/A GLY 27.A N PHE 24.A O no hydrogen 2.766 N/A ILE 28.A N THR 26.A OG1 no hydrogen 3.021 N/A VAL 30.A N VAL 35.A O no hydrogen 2.883 N/A TYR 33.A N VAL 30.A O no hydrogen 3.029 N/A GLY 34.A N VAL 30.A O no hydrogen 3.127 N/A LEU 37.A N ILE 28.A O no hydrogen 2.827 N/A ASN 39.A N ILE 20.A O no hydrogen 3.170 N/A GLU 40.A N ASN 38.A OD1 no hydrogen 2.805 N/A THR 42.A N ASN 39.A O no hydrogen 3.083 N/A THR 42.A OG1 ASN 39.A O no hydrogen 3.066 N/A THR 42.A OG1 ASN 39.A OD1 no hydrogen 2.894 N/A ASP 43.A N GLU 40.A O no hydrogen 2.956 N/A PHE 44.A N LEU 41.A O no hydrogen 3.046 N/A ASP 45.A N ASN 52.A O no hydrogen 2.852 N/A GLY 49.A N GLU 53.A OE1 no hydrogen 2.737 N/A ASN 52.A ND2 ASP 43.A O no hydrogen 2.800 N/A GLU 53.A N GLY 50.A O no hydrogen 3.151 N/A GLN 55.A NE2 GLU 53.A OE2 no hydrogen 2.751 N/A LYS 58.A N GLN 55.A O no hydrogen 3.138 N/A LYS 58.A NZ ALA 51.A O no hydrogen 2.753 N/A LYS 58.A NZ GLU 53.A O no hydrogen 2.760 N/A LEU 61.A N ASN 52.A OD1 no hydrogen 2.976 N/A SER 63.A OG GLY 84.A O no hydrogen 2.288 N/A MET 64.A N SER 62.A OG no hydrogen 3.010 N/A THR 65.A OG1 SER 63.A O no hydrogen 2.738 N/A THR 67.A N VAL 79.A O no hydrogen 2.928 N/A THR 67.A OG1 THR 65.A O no hydrogen 2.864 N/A LEU 69.A N LEU 77.A O no hydrogen 2.776 N/A LYS 71.A N LYS 74.A O no hydrogen 2.871 N/A LYS 74.A N LYS 71.A O no hydrogen 3.063 N/A VAL 76.A N LEU 69.A O no hydrogen 2.754 N/A LEU 77.A N LEU 69.A O no hydrogen 3.276 N/A THR 78.A N ILE 156.A O no hydrogen 2.832 N/A THR 78.A OG1 THR 5.A OG1 no hydrogen 2.745 N/A VAL 79.A N THR 67.A O no hydrogen 3.050 N/A SER 81.A OG PRO 82.A O no hydrogen 2.646 N/A THR 86.A N GLY 83.A O no hydrogen 3.011 N/A THR 86.A OG1 GLY 83.A O no hydrogen 2.751 N/A ILE 87.A N GLY 84.A O no hydrogen 3.128 N/A SER 90.A N THR 86.A O no hydrogen 3.035 N/A VAL 91.A N ILE 87.A O no hydrogen 3.057 N/A LEU 92.A N ILE 88.A O no hydrogen 2.906 N/A GLN 93.A N SER 89.A O no hydrogen 2.923 N/A GLN 93.A NE2 SER 89.A O no hydrogen 2.815 N/A GLN 93.A NE2 ILE 114.A O no hydrogen 2.901 N/A THR 94.A N SER 90.A O no hydrogen 3.012 N/A THR 94.A OG1 SER 90.A O no hydrogen 2.945 N/A ILE 95.A N VAL 91.A O no hydrogen 3.097 N/A LEU 96.A N LEU 92.A O no hydrogen 2.881 N/A TYR 97.A N GLN 93.A O no hydrogen 2.800 N/A HIS 98.A N THR 94.A O no hydrogen 2.951 N/A HIS 98.A ND1 MET 103.A O no hydrogen 2.780 N/A ILE 99.A N ILE 95.A O no hydrogen 2.738 N/A TYR 101.A N LEU 96.A O no hydrogen 2.985 N/A MET 103.A N TYR 97.A O no hydrogen 2.863 N/A LYS 106.A N GLU 104.A OE2 no hydrogen 2.956 N/A LYS 106.A NZ GLU 110.A OE2 no hydrogen 2.936 N/A LYS 106.A NZ ALA 169.A O no hydrogen 2.607 N/A ALA 107.A N GLU 104.A OE1 no hydrogen 2.982 N/A ALA 108.A N GLU 104.A O no hydrogen 2.908 N/A VAL 109.A N LEU 105.A O no hydrogen 2.971 N/A GLU 110.A N LYS 106.A O no hydrogen 2.943 N/A ARG 113.A N GLU 125.A OE2 no hydrogen 2.803 N/A ARG 113.A NH1 ILE 150.A O no hydrogen 2.778 N/A ARG 113.A NH1 ASP 170.A OD2 no hydrogen 3.127 N/A ARG 113.A NH2 ASP 170.A OD2 no hydrogen 3.014 N/A ILE 114.A N GLN 93.A OE1 no hydrogen 2.944 N/A TYR 115.A N ARG 123.A O no hydrogen 2.958 N/A THR 116.A OG1 SER 121.A O no hydrogen 2.682 N/A SER 118.A OG SER 120.A OG no hydrogen 3.391 N/A SER 120.A N SER 118.A OG no hydrogen 3.115 N/A SER 120.A OG SER 118.A OG no hydrogen 3.391 N/A SER 121.A N SER 118.A O no hydrogen 3.409 N/A SER 121.A OG ASN 117.A OD1 no hydrogen 2.951 N/A TYR 122.A OH HIS 141.A ND1 no hydrogen 2.705 N/A ARG 123.A N TYR 115.A O no hydrogen 2.785 N/A TYR 124.A OH GLY 144.A O no hydrogen 3.094 N/A GLU 125.A N ARG 113.A O no hydrogen 3.025 N/A VAL 128.A N GLU 125.A O no hydrogen 3.282 N/A LEU 133.A N PRO 129.A O no hydrogen 3.053 N/A SER 134.A N LYS 130.A O no hydrogen 3.019 N/A LYS 135.A N ASP 131.A O no hydrogen 2.956 N/A LEU 136.A N VAL 132.A O no hydrogen 2.816 N/A ASN 137.A N LEU 133.A O no hydrogen 2.877 N/A ASN 137.A ND2 PHE 143.A O no hydrogen 2.936 N/A GLY 138.A N SER 134.A O no hydrogen 3.009 N/A MET 139.A N LYS 135.A O no hydrogen 3.370 N/A MET 139.A N LEU 136.A O no hydrogen 3.076 N/A GLY 140.A N ASN 137.A O no hydrogen 2.936 N/A HIS 141.A N LEU 136.A O no hydrogen 3.189 N/A HIS 141.A ND1 TYR 122.A OH no hydrogen 2.705 N/A LYS 142.A NZ MET 119.A O no hydrogen 2.942 N/A PHE 143.A N ASN 137.A OD1 no hydrogen 2.921 N/A VAL 148.A N TYR 124.A O no hydrogen 2.801 N/A ILE 150.A N GLU 125.A OE1 no hydrogen 2.777 N/A ASN 152.A N SER 81.A OG no hydrogen 2.922 N/A VAL 153.A N ASP 170.A OD2 no hydrogen 2.906 N/A SER 155.A N VAL 168.A O no hydrogen 3.004 N/A SER 155.A OG THR 78.A O no hydrogen 2.709 N/A ILE 156.A N THR 78.A OG1 no hydrogen 3.206 N/A SER 157.A N LYS 166.A O no hydrogen 2.782 N/A ILE 158.A N VAL 76.A O no hydrogen 2.936 N/A ASP 159.A N THR 164.A O no hydrogen 2.868 N/A HIS 160.A NE2 PRO 75.A O no hydrogen 2.604 N/A GLU 161.A N ASP 159.A OD1 no hydrogen 3.197 N/A ASN 162.A N ASP 159.A OD1 no hydrogen 2.953 N/A THR 164.A N ASP 159.A O no hydrogen 3.050 N/A LYS 166.A N SER 157.A O no hydrogen 2.867 N/A LYS 166.A NZ GLU 104.A OE2 no hydrogen 2.804 N/A VAL 168.A N SER 155.A O no hydrogen 2.769 N/A SER 171.A N GLU 110.A OE2 no hydrogen 2.908 N/A SER 171.A OG GLU 110.A OE1 no hydrogen 2.519 N/A SER 171.A OG GLU 110.A OE2 no hydrogen 3.293 N/A SER 172.A N ASP 170.A OD1 no hydrogen 2.979 N/A SER 172.A OG GLY 151.A O no hydrogen 2.773 N/A SER 172.A OG ASN 152.A OD1 no hydrogen 2.851 N/A ARG 173.A N ASP 170.A O no hydrogen 3.329 N/A ARG 173.A NH1 THR 1.A O no hydrogen 3.016 N/A ARG 173.A NH2 THR 1.A O no hydrogen 3.170 N/A