Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4r52_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N MET 1.A O no hydrogen 2.920 N/A THR 3.A OG1 MET 1.A O no hydrogen 3.433 N/A GLY 5.A N LEU 2.A O no hydrogen 2.909 N/A ARG 12.A N ASN 9.A OD1 no hydrogen 2.853 N/A TRP 13.A N ASN 9.A O no hydrogen 3.126 N/A ILE 14.A N PHE 10.A O no hydrogen 2.884 N/A ASP 15.A N PRO 11.A O no hydrogen 2.940 N/A GLU 16.A N ARG 12.A O no hydrogen 2.917 N/A HIS 17.A N TRP 13.A O no hydrogen 3.075 N/A HIS 17.A N ILE 14.A O no hydrogen 3.129 N/A HIS 17.A ND1 TRP 13.A O no hydrogen 2.707 N/A ALA 18.A N ASP 15.A O no hydrogen 3.227 N/A LEU 20.A N HIS 17.A O no hydrogen 2.855 N/A LEU 21.A N ALA 18.A O no hydrogen 3.121 N/A LYS 22.A NZ HIS 19.A O no hydrogen 2.635 N/A GLY 26.A N LYS 22.A O no hydrogen 2.909 N/A ARG 28.A N VAL 40.A O no hydrogen 2.967 N/A GLN 29.A NE2 TRP 31.A O no hydrogen 2.945 N/A VAL 30.A N VAL 38.A O no hydrogen 2.714 N/A SER 34.A OG PHE 36.A O no hydrogen 2.595 N/A ILE 37.A N GLU 110.A O no hydrogen 2.754 N/A THR 39.A N VAL 108.A O no hydrogen 2.880 N/A VAL 40.A N ARG 28.A O no hydrogen 2.953 N/A VAL 41.A N CYS 106.A O no hydrogen 2.912 N/A GLY 42.A N GLY 26.A O no hydrogen 2.763 N/A GLY 43.A N LEU 21.A O no hydrogen 3.258 N/A ASN 45.A N ARG 99.A O no hydrogen 2.776 N/A ARG 47.A N GLN 98.A OE1 no hydrogen 2.967 N/A ARG 47.A NE ASP 49.A OD1 no hydrogen 3.311 N/A ARG 47.A NE ASP 49.A OD2 no hydrogen 2.907 N/A ARG 47.A NH2 ASP 49.A OD1 no hydrogen 3.001 N/A ARG 47.A NH2 ASP 49.A OD2 no hydrogen 3.538 N/A THR 48.A OG1 GLY 171.A O no hydrogen 2.853 N/A TYR 50.A N GLU 122.A O no hydrogen 2.697 N/A HIS 51.A N HIS 95.A O no hydrogen 2.795 N/A HIS 51.A NE2 ASP 119.A OD1 no hydrogen 2.543 N/A ASP 52.A N GLY 120.A O no hydrogen 2.821 N/A LEU 55.A N ASP 53.A OD1 no hydrogen 2.932 N/A GLU 57.A N LEU 89.A O no hydrogen 3.169 N/A PHE 58.A N ILE 109.A O no hydrogen 2.963 N/A PHE 59.A N PHE 87.A O no hydrogen 2.854 N/A TYR 60.A N LEU 107.A O no hydrogen 2.853 N/A GLN 61.A N ASP 85.A O no hydrogen 2.907 N/A GLN 61.A NE2 ARG 63.A O no hydrogen 2.992 N/A GLN 61.A NE2 GLY 64.A O no hydrogen 3.680 N/A LEU 62.A N ALA 105.A O no hydrogen 2.881 N/A ARG 63.A N ALA 105.A O no hydrogen 3.017 N/A ARG 63.A NH1 ASP 15.A OD1 no hydrogen 2.863 N/A ARG 63.A NH2 PRO 11.A O no hydrogen 3.288 N/A ARG 63.A NH2 ASP 15.A OD1 no hydrogen 3.070 N/A GLY 64.A N GLU 83.A OE2 no hydrogen 2.802 N/A ASN 65.A N GLU 101.A OE2 no hydrogen 3.129 N/A ASN 65.A ND2 GLU 101.A OE1 no hydrogen 2.878 N/A ALA 66.A N LEU 81.A O no hydrogen 2.856 N/A TYR 67.A N GLN 98.A O no hydrogen 3.010 N/A LEU 68.A N ALA 79.A O no hydrogen 2.800 N/A ASN 69.A N SER 96.A O no hydrogen 3.001 N/A LEU 70.A N GLU 77.A O no hydrogen 2.749 N/A TRP 71.A N ARG 94.A O no hydrogen 3.217 N/A VAL 72.A N ARG 75.A O no hydrogen 2.911 N/A ARG 75.A N VAL 72.A O no hydrogen 2.979 N/A ARG 75.A NH1 ASP 73.A OD1 no hydrogen 3.403 N/A ARG 75.A NH2 ASP 73.A OD1 no hydrogen 3.070 N/A GLU 77.A N LEU 70.A O no hydrogen 2.957 N/A ARG 78.A NE ASP 80.A OD1 no hydrogen 2.907 N/A ARG 78.A NE ASP 80.A OD2 no hydrogen 3.462 N/A ARG 78.A NH2 ASP 80.A OD2 no hydrogen 2.983 N/A ALA 79.A N LEU 68.A O no hydrogen 2.871 N/A LEU 81.A N ALA 66.A O no hydrogen 2.732 N/A LYS 82.A N ASP 85.A OD2 no hydrogen 2.890 N/A GLU 83.A N ASN 65.A OD1 no hydrogen 2.962 N/A GLY 84.A N GLN 61.A O no hydrogen 2.724 N/A ASP 85.A N LYS 82.A O no hydrogen 2.838 N/A PHE 87.A N PHE 59.A O no hydrogen 3.009 N/A LEU 89.A N GLU 57.A O no hydrogen 2.801 N/A HIS 92.A N ASP 53.A O no hydrogen 2.694 N/A HIS 92.A ND1 ASP 52.A OD1 no hydrogen 2.755 N/A ARG 94.A NE GLU 122.A OE1 no hydrogen 2.804 N/A ARG 94.A NH1 HIS 92.A O no hydrogen 2.737 N/A HIS 95.A N HIS 51.A O no hydrogen 3.094 N/A HIS 95.A ND1 VAL 93.A O no hydrogen 2.894 N/A SER 96.A N ASN 69.A O no hydrogen 2.718 N/A SER 96.A OG ARG 47.A O no hydrogen 3.418 N/A SER 96.A OG ASP 49.A O no hydrogen 2.713 N/A GLN 98.A N TYR 67.A O no hydrogen 2.750 N/A GLN 98.A NE2 ARG 47.A O no hydrogen 2.934 N/A GLN 98.A NE2 SER 96.A O no hydrogen 3.017 N/A ARG 99.A N ASN 45.A O no hydrogen 2.753 N/A ARG 99.A NH1 GLN 61.A OE1 no hydrogen 3.059 N/A SER 104.A OG GLU 101.A O no hydrogen 2.842 N/A ALA 105.A N ARG 63.A O no hydrogen 2.891 N/A CYS 106.A N VAL 41.A O no hydrogen 2.903 N/A CYS 106.A SG GLN 61.A OE1 no hydrogen 3.311 N/A CYS 106.A SG LEU 107.A O no hydrogen 3.711 N/A LEU 107.A N TYR 60.A O no hydrogen 2.825 N/A VAL 108.A N THR 39.A O no hydrogen 2.815 N/A ILE 109.A N PHE 58.A O no hydrogen 2.905 N/A GLU 110.A N ILE 37.A O no hydrogen 2.944 N/A GLN 112.A N ASP 35.A O no hydrogen 2.865 N/A GLN 112.A NE2 SER 34.A O no hydrogen 2.939 N/A ARG 113.A NE ASP 119.A OD1 no hydrogen 3.419 N/A ARG 113.A NE ASP 119.A OD2 no hydrogen 2.859 N/A ARG 113.A NH1 GLU 110.A OE2 no hydrogen 3.069 N/A ARG 113.A NH1 ARG 111.A O no hydrogen 2.813 N/A ARG 113.A NH2 GLU 110.A OE2 no hydrogen 3.086 N/A ARG 113.A NH2 ASP 119.A OD1 no hydrogen 2.771 N/A GLY 116.A N GLN 138.A OE1 no hydrogen 2.801 N/A MET 117.A N PRO 114.A O no hydrogen 3.023 N/A ASP 119.A N VAL 137.A O no hydrogen 2.876 N/A GLY 120.A N ASP 52.A O no hydrogen 2.939 N/A PHE 121.A N VAL 135.A O no hydrogen 2.874 N/A GLU 122.A N TYR 50.A O no hydrogen 2.909 N/A TRP 123.A N HIS 133.A O no hydrogen 3.044 N/A TYR 124.A OH GLU 122.A OE1 no hydrogen 2.368 N/A CYS 125.A N HIS 130.A O no hydrogen 2.807 N/A GLY 129.A N CYS 125.A O no hydrogen 2.791 N/A HIS 130.A ND1 LEU 131.A O no hydrogen 3.032 N/A VAL 132.A N TRP 123.A O no hydrogen 2.799 N/A ARG 134.A NE GLU 136.A OE2 no hydrogen 3.332 N/A ARG 134.A NH1 ASP 52.A OD2 no hydrogen 2.918 N/A ARG 134.A NH1 GLU 122.A OE2 no hydrogen 2.935 N/A ARG 134.A NH2 ASP 52.A OD2 no hydrogen 3.172 N/A ARG 134.A NH2 GLU 136.A OE2 no hydrogen 2.851 N/A VAL 135.A N PHE 121.A O no hydrogen 2.869 N/A VAL 137.A N ASP 119.A O no hydrogen 2.850 N/A GLN 138.A NE2 PRO 114.A O no hydrogen 3.103 N/A GLN 138.A NE2 MET 117.A O no hydrogen 3.373 N/A LYS 140.A N ASP 145.A OD2 no hydrogen 2.868 N/A SER 141.A N ASP 145.A OD2 no hydrogen 2.908 N/A THR 144.A OG1 ASP 145.A OD1 no hydrogen 3.036 N/A ASP 145.A N SER 141.A O no hydrogen 2.900 N/A PHE 150.A N LEU 146.A O no hydrogen 3.211 N/A GLU 151.A N PRO 147.A O no hydrogen 2.956 N/A SER 152.A N PRO 148.A O no hydrogen 2.868 N/A SER 152.A OG PRO 148.A O no hydrogen 3.297 N/A SER 152.A OG LEU 149.A O no hydrogen 2.714 N/A PHE 153.A N LEU 149.A O no hydrogen 3.292 N/A TYR 154.A N PHE 150.A O no hydrogen 3.119 N/A ALA 155.A N GLU 151.A O no hydrogen 3.089 N/A SER 156.A N PHE 153.A O no hydrogen 3.213 N/A LYS 159.A N SER 156.A OG no hydrogen 3.124 N/A ARG 160.A N SER 156.A O no hydrogen 3.026 N/A ARG 160.A NE HIS 169.A O no hydrogen 2.672 N/A ARG 160.A NH2 HIS 169.A O no hydrogen 3.233 N/A ARG 161.A N ASP 158.A O no hydrogen 3.277 N/A CYS 162.A N GLN 167.A O no hydrogen 2.852 N/A GLY 166.A N CYS 162.A O no hydrogen 2.960 N/A GLN 167.A NE2 VAL 168.A O no hydrogen 3.553 N/A HIS 169.A N ARG 160.A O no hydrogen 2.749 N/A GLY 171.A N HIS 169.A ND1 no hydrogen 2.933 N/A