Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1up1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 7.A N PRO 4.A O no hydrogen 2.854 N/A ARG 8.A N GLU 5.A O no hydrogen 2.911 N/A ARG 8.A NE GLU 3.A O no hydrogen 2.881 N/A ARG 8.A NH1 TYR 56.A O no hydrogen 2.596 N/A LEU 10.A N VAL 54.A O no hydrogen 2.730 N/A PHE 11.A N LYS 81.A O no hydrogen 2.742 N/A ILE 12.A N GLY 52.A O no hydrogen 2.771 N/A GLY 13.A N GLU 79.A O no hydrogen 2.936 N/A LEU 15.A N GLY 50.A O no hydrogen 2.816 N/A GLU 18.A N SER 16.A OG no hydrogen 3.000 N/A THR 19.A N SER 16.A O no hydrogen 3.120 N/A THR 19.A OG1 SER 16.A O no hydrogen 3.453 N/A THR 19.A OG1 ASP 74.A OD2 no hydrogen 2.718 N/A THR 20.A N SER 23.A OG no hydrogen 2.924 N/A THR 20.A OG1 SER 23.A OG no hydrogen 3.383 N/A SER 23.A N THR 20.A OG1 no hydrogen 3.077 N/A SER 23.A OG THR 20.A O no hydrogen 3.280 N/A SER 23.A OG THR 20.A OG1 no hydrogen 3.383 N/A SER 23.A OG ASP 74.A OD2 no hydrogen 2.780 N/A LEU 24.A N THR 20.A O no hydrogen 2.916 N/A ARG 25.A N ASP 21.A O no hydrogen 2.926 N/A ARG 25.A NH1 GLU 29.A OE2 no hydrogen 2.781 N/A ARG 25.A NH1 LEU 34.A O no hydrogen 3.211 N/A ARG 25.A NH2 LEU 34.A O no hydrogen 3.468 N/A SER 26.A N GLU 22.A O no hydrogen 2.886 N/A SER 26.A OG GLU 22.A O no hydrogen 3.162 N/A HIS 27.A N SER 23.A O no hydrogen 3.060 N/A PHE 28.A N LEU 24.A O no hydrogen 2.958 N/A GLU 29.A N ARG 25.A O no hydrogen 2.883 N/A GLN 30.A N HIS 27.A O no hydrogen 3.161 N/A TRP 31.A N PHE 28.A O no hydrogen 3.110 N/A GLY 32.A N GLU 29.A O no hydrogen 3.391 N/A THR 33.A N GLU 61.A OE2 no hydrogen 2.984 N/A THR 35.A N THR 55.A O no hydrogen 2.741 N/A THR 35.A OG1 THR 55.A O no hydrogen 3.291 N/A ASP 36.A N THR 55.A O no hydrogen 3.455 N/A CYS 37.A SG ASP 21.A O no hydrogen 3.373 N/A VAL 38.A N PHE 53.A O no hydrogen 2.847 N/A VAL 39.A N ASP 21.A OD1 no hydrogen 2.827 N/A MET 40.A N PHE 51.A O no hydrogen 2.855 N/A ARG 41.A NH1 LYS 46.A O no hydrogen 3.081 N/A ASP 42.A N ARG 47.A O no hydrogen 2.910 N/A ASN 44.A N ASP 42.A OD2 no hydrogen 3.003 N/A THR 45.A N ASP 42.A OD2 no hydrogen 2.916 N/A LYS 46.A N ASP 42.A O no hydrogen 2.998 N/A LYS 46.A NZ ASP 42.A O no hydrogen 2.973 N/A ARG 47.A N THR 45.A OG1 no hydrogen 3.087 N/A ARG 49.A N MET 40.A O no hydrogen 2.777 N/A GLY 50.A N SER 48.A OG no hydrogen 2.797 N/A GLY 52.A N ILE 12.A O no hydrogen 2.897 N/A PHE 53.A N VAL 38.A O no hydrogen 2.898 N/A VAL 54.A N LEU 10.A O no hydrogen 2.929 N/A THR 55.A N ASP 36.A O no hydrogen 2.789 N/A TYR 56.A N ARG 8.A O no hydrogen 2.839 N/A TYR 56.A OH PHE 28.A O no hydrogen 2.634 N/A ALA 57.A N THR 33.A O no hydrogen 2.896 N/A THR 58.A N GLU 61.A OE1 no hydrogen 2.845 N/A VAL 59.A N GLU 3.A OE1 no hydrogen 2.916 N/A GLU 61.A N THR 58.A O no hydrogen 3.170 N/A GLU 61.A N THR 58.A OG1 no hydrogen 3.284 N/A VAL 62.A N THR 58.A O no hydrogen 3.331 N/A ASP 63.A N VAL 59.A O no hydrogen 2.972 N/A ALA 64.A N GLU 60.A O no hydrogen 2.923 N/A ALA 65.A N GLU 61.A O no hydrogen 2.878 N/A MET 66.A N VAL 62.A O no hydrogen 2.763 N/A ASN 67.A N ASP 63.A O no hydrogen 2.780 N/A ALA 68.A N ALA 64.A O no hydrogen 3.054 N/A ALA 68.A N ALA 65.A O no hydrogen 3.103 N/A ARG 69.A N MET 66.A O no hydrogen 3.238 N/A ARG 69.A NH1 MET 66.A O no hydrogen 3.463 N/A ARG 69.A NH1 ASP 143.A OD2 no hydrogen 2.981 N/A ARG 69.A NH2 ASP 143.A OD1 no hydrogen 2.658 N/A ARG 69.A NH2 ASP 143.A OD2 no hydrogen 2.972 N/A HIS 71.A NE2 ALA 65.A O no hydrogen 2.600 N/A VAL 73.A N ARG 76.A O no hydrogen 2.709 N/A ARG 76.A N VAL 73.A O no hydrogen 2.897 N/A VAL 78.A N HIS 71.A O no hydrogen 3.027 N/A GLU 79.A N GLY 13.A O no hydrogen 2.747 N/A LYS 81.A N PHE 11.A O no hydrogen 2.906 N/A LYS 81.A NZ THR 91.A OG1 no hydrogen 2.901 N/A ARG 82.A NE ASP 145.A OD1 no hydrogen 2.743 N/A ARG 82.A NH1 ASP 63.A OD1 no hydrogen 3.106 N/A ARG 82.A NH2 ASP 63.A OD1 no hydrogen 2.864 N/A ARG 82.A NH2 ASP 145.A OD2 no hydrogen 2.978 N/A ALA 83.A N LYS 9.A O no hydrogen 3.144 N/A LYS 93.A NZ ASP 142.A O no hydrogen 2.753 N/A ILE 95.A N VAL 139.A O no hydrogen 2.970 N/A PHE 96.A N ARG 166.A O no hydrogen 2.818 N/A VAL 97.A N ALA 137.A O no hydrogen 2.756 N/A GLY 98.A N GLU 164.A O no hydrogen 2.855 N/A GLY 99.A N GLY 135.A O no hydrogen 3.000 N/A ILE 100.A N GLY 135.A O no hydrogen 3.266 N/A THR 104.A OG1 ILE 100.A O no hydrogen 2.760 N/A GLU 105.A N HIS 108.A ND1 no hydrogen 2.872 N/A HIS 108.A N GLU 105.A O no hydrogen 2.920 N/A LEU 109.A N GLU 105.A O no hydrogen 3.397 N/A ARG 110.A N GLU 106.A O no hydrogen 2.772 N/A ARG 110.A NH1 GLU 106.A OE2 no hydrogen 2.765 N/A ASP 111.A N HIS 107.A O no hydrogen 2.941 N/A TYR 112.A N HIS 108.A O no hydrogen 3.166 N/A TYR 112.A OH HIS 156.A ND1 no hydrogen 2.698 N/A PHE 113.A N LEU 109.A O no hydrogen 2.774 N/A GLU 114.A N ARG 110.A O no hydrogen 2.873 N/A GLN 115.A N TYR 112.A O no hydrogen 3.439 N/A TYR 116.A N PHE 113.A O no hydrogen 2.936 N/A GLU 120.A N THR 140.A O no hydrogen 2.656 N/A VAL 121.A N THR 140.A O no hydrogen 3.077 N/A GLU 123.A N PHE 138.A O no hydrogen 2.812 N/A MET 125.A N PHE 136.A O no hydrogen 2.985 N/A ASP 127.A N LYS 132.A O no hydrogen 2.613 N/A GLY 129.A N ASP 127.A OD2 no hydrogen 2.848 N/A SER 130.A N ASP 127.A OD2 no hydrogen 2.954 N/A GLY 131.A N ASP 127.A O no hydrogen 2.801 N/A LYS 132.A N SER 130.A OG no hydrogen 3.243 N/A LYS 133.A N GLU 102.A OE2 no hydrogen 3.179 N/A LYS 133.A NZ THR 104.A O no hydrogen 2.829 N/A ARG 134.A N MET 125.A O no hydrogen 2.887 N/A ALA 137.A N VAL 97.A O no hydrogen 2.728 N/A PHE 138.A N GLU 123.A O no hydrogen 2.898 N/A VAL 139.A N ILE 95.A O no hydrogen 3.080 N/A THR 140.A N VAL 121.A O no hydrogen 2.727 N/A PHE 141.A N LYS 93.A O no hydrogen 2.797 N/A ASP 142.A N LYS 118.A O no hydrogen 2.979 N/A HIS 144.A ND1 ASP 148.A OD2 no hydrogen 2.924 N/A ASP 145.A N ASP 143.A OD2 no hydrogen 3.070 N/A SER 146.A OG TYR 116.A O no hydrogen 3.023 N/A ASP 148.A N HIS 144.A O no hydrogen 2.869 N/A LYS 149.A N ASP 145.A O no hydrogen 2.810 N/A LYS 149.A NZ TYR 116.A O no hydrogen 2.960 N/A ILE 150.A N SER 146.A O no hydrogen 2.977 N/A VAL 151.A N VAL 147.A O no hydrogen 2.977 N/A GLN 153.A N ILE 150.A O no hydrogen 3.056 N/A LYS 154.A NZ TYR 155.A OH no hydrogen 3.133 N/A HIS 156.A ND1 TYR 112.A OH no hydrogen 2.698 N/A HIS 156.A NE2 ILE 150.A O no hydrogen 2.758 N/A VAL 158.A N HIS 161.A O no hydrogen 2.848 N/A ASN 159.A ND2 ASP 103.A OD2 no hydrogen 2.958 N/A ASN 159.A ND2 THR 104.A OG1 no hydrogen 3.001 N/A HIS 161.A N VAL 158.A O no hydrogen 2.919 N/A CYS 163.A N HIS 156.A O no hydrogen 2.788 N/A CYS 163.A SG HIS 161.A O no hydrogen 3.555 N/A GLU 164.A N GLY 98.A O no hydrogen 3.060 N/A ARG 166.A N PHE 96.A O no hydrogen 2.986 N/A ARG 166.A NE GLU 164.A OE2 no hydrogen 3.039 N/A ARG 166.A NH2 GLU 164.A OE2 no hydrogen 2.715 N/A LYS 167.A NZ LEU 90.A O no hydrogen 3.234 N/A ALA 168.A N LYS 94.A O no hydrogen 2.745 N/A