Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pto_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ALA 176.A O no hydrogen 2.763 N/A LEU 9.A N PRO 6.A O no hydrogen 2.849 N/A PHE 10.A N LYS 7.A O no hydrogen 2.716 N/A THR 11.A N CYS 84.A O no hydrogen 3.234 N/A THR 11.A OG1 GLN 13.A O no hydrogen 3.215 N/A THR 11.A OG1 CYS 84.A O no hydrogen 3.014 N/A GLN 12.A NE2 PHE 10.A O no hydrogen 2.902 N/A TYR 17.A N ARG 80.A O no hydrogen 3.004 N/A GLY 18.A N THR 82.A OG1 no hydrogen 2.883 N/A ARG 19.A N ALA 16.A O no hydrogen 3.102 N/A ARG 19.A NE CYS 20.A O no hydrogen 2.681 N/A THR 24.A N PRO 21.A O no hydrogen 3.180 N/A THR 24.A OG1 PRO 21.A O no hydrogen 2.201 N/A ARG 25.A N ILE 85.A O no hydrogen 2.726 N/A ARG 25.A NH1 GLU 31.A OE2 no hydrogen 3.306 N/A ARG 25.A NH2 GLU 31.A OE2 no hydrogen 3.115 N/A LEU 27.A N PHE 83.A O no hydrogen 2.706 N/A THR 28.A N GLU 31.A OE1 no hydrogen 2.860 N/A THR 28.A OG1 ASP 175.A OD1 no hydrogen 2.565 N/A THR 28.A OG1 ASP 175.A OD2 no hydrogen 3.188 N/A VAL 29.A N ASP 56.A OD2 no hydrogen 3.308 N/A GLU 31.A N THR 28.A OG1 no hydrogen 3.129 N/A LEU 32.A N THR 28.A O no hydrogen 2.990 N/A ARG 33.A N VAL 29.A O no hydrogen 2.536 N/A ARG 33.A NH2 ASP 70.A OD2 no hydrogen 2.666 N/A GLY 34.A N GLU 31.A O no hydrogen 2.693 N/A ASN 35.A N GLU 31.A O no hydrogen 2.874 N/A GLU 37.A N GLU 37.A OE1 no hydrogen 3.018 N/A LEU 38.A N ASN 35.A OD1 no hydrogen 2.645 N/A GLN 39.A N ASN 35.A O no hydrogen 2.958 N/A THR 40.A N ALA 36.A O no hydrogen 2.792 N/A THR 40.A OG1 ALA 36.A O no hydrogen 2.852 N/A TYR 41.A N GLU 37.A O no hydrogen 2.548 N/A LEU 42.A N LEU 38.A O no hydrogen 2.766 N/A ARG 43.A N GLN 39.A O no hydrogen 3.014 N/A GLN 44.A N TYR 41.A O no hydrogen 3.281 N/A ILE 45.A N LEU 42.A O no hydrogen 2.727 N/A THR 46.A N LEU 42.A O no hydrogen 2.850 N/A THR 46.A OG1 LEU 42.A O no hydrogen 2.781 N/A THR 46.A OG1 TYR 59.A OH no hydrogen 3.255 N/A TYR 52.A N TYR 59.A O no hydrogen 2.599 N/A GLY 53.A N GLU 81.A O no hydrogen 2.591 N/A LEU 54.A N GLY 57.A O no hydrogen 3.114 N/A TYR 55.A N LEU 27.A O no hydrogen 3.339 N/A THR 58.A N LYS 69.A O no hydrogen 2.673 N/A THR 58.A OG1 LYS 69.A O no hydrogen 3.422 N/A TYR 59.A N TYR 52.A O no hydrogen 2.802 N/A TYR 59.A OH THR 46.A OG1 no hydrogen 3.255 N/A LEU 60.A N ILE 67.A O no hydrogen 2.738 N/A GLY 61.A N SER 50.A O no hydrogen 2.427 N/A ALA 63.A N GLN 62.A OE1 no hydrogen 2.597 N/A TYR 64.A N GLY 61.A O no hydrogen 2.588 N/A GLY 65.A N GLN 62.A O no hydrogen 2.698 N/A GLY 66.A N GLY 61.A O no hydrogen 3.263 N/A ILE 67.A N LEU 60.A O no hydrogen 2.844 N/A LYS 69.A N THR 58.A O no hydrogen 2.639 N/A LYS 69.A NZ ASP 70.A O no hydrogen 3.245 N/A GLY 74.A N TYR 55.A O no hydrogen 2.665 N/A ALA 75.A N PRO 72.A O no hydrogen 2.775 N/A ILE 78.A N ALA 75.A O no hydrogen 3.117 N/A TYR 79.A N GLY 76.A O no hydrogen 3.220 N/A THR 82.A N GLY 15.A O no hydrogen 2.942 N/A THR 82.A OG1 GLY 15.A O no hydrogen 3.273 N/A THR 82.A OG1 ARG 80.A O no hydrogen 3.152 N/A PHE 83.A N GLY 53.A O no hydrogen 2.879 N/A CYS 84.A SG THR 82.A O no hydrogen 3.708 N/A ILE 85.A N ARG 25.A O no hydrogen 2.855 N/A THR 86.A N LEU 9.A O no hydrogen 3.056 N/A THR 87.A N GLY 23.A O no hydrogen 2.898 N/A THR 87.A OG1 GLY 23.A O no hydrogen 2.749 N/A TYR 89.A N GLN 169.A O no hydrogen 2.693 N/A LYS 90.A NZ GLU 168.A OE2 no hydrogen 2.891 N/A THR 91.A OG1 LYS 166.A O no hydrogen 3.210 N/A GLN 93.A NE2 PRO 94.A O no hydrogen 3.456 N/A HIS 98.A N VAL 164.A O no hydrogen 3.212 N/A TYR 100.A N VAL 162.A O no hydrogen 3.148 N/A VAL 103.A N VAL 160.A O no hydrogen 3.233 N/A THR 104.A N VAL 121.A O no hydrogen 2.999 N/A THR 104.A OG1 VAL 121.A O no hydrogen 3.447 N/A THR 106.A N VAL 119.A O no hydrogen 2.861 N/A THR 106.A OG1 VAL 119.A O no hydrogen 2.787 N/A LEU 109.A N CYS 117.A O no hydrogen 3.314 N/A ARG 115.A N SER 114.A OG no hydrogen 2.678 N/A ARG 115.A NE ASP 172.A OD1 no hydrogen 3.009 N/A ARG 115.A NH2 THR 87.A OG1 no hydrogen 3.264 N/A ARG 115.A NH2 GLU 136.A OE1 no hydrogen 3.399 N/A LEU 116.A N ALA 132.A O no hydrogen 3.400 N/A CYS 117.A N LEU 109.A O no hydrogen 2.922 N/A ALA 118.A N ALA 130.A O no hydrogen 2.953 N/A VAL 119.A N THR 106.A O no hydrogen 2.670 N/A PHE 120.A N ILE 128.A O no hydrogen 2.655 N/A VAL 121.A N THR 104.A O no hydrogen 2.757 N/A ARG 122.A N GLN 125.A O no hydrogen 2.861 N/A ARG 122.A NE SER 101.A O no hydrogen 2.982 N/A ARG 122.A NH2 SER 101.A O no hydrogen 3.428 N/A VAL 127.A N PHE 120.A O no hydrogen 2.866 N/A ILE 128.A N PHE 120.A O no hydrogen 3.134 N/A GLY 129.A N GLN 179.A O no hydrogen 2.654 N/A ALA 130.A N ALA 118.A O no hydrogen 2.913 N/A CYS 131.A N TYR 181.A O no hydrogen 2.882 N/A ALA 132.A N LEU 116.A O no hydrogen 2.911 N/A TYR 135.A N SER 133.A OG no hydrogen 2.767 N/A ARG 138.A N GLU 168.A OE2 no hydrogen 3.367 N/A ARG 138.A NE ARG 138.A O no hydrogen 3.088 N/A TYR 139.A OH GLU 167.A OE2 no hydrogen 3.294 N/A ARG 140.A N GLY 137.A O no hydrogen 2.835 N/A MET 142.A N TYR 139.A O no hydrogen 2.687 N/A LEU 146.A N MET 142.A O no hydrogen 2.957 N/A ARG 147.A N TYR 143.A O no hydrogen 2.655 N/A ARG 147.A NH1 ASP 144.A OD2 no hydrogen 3.488 N/A ARG 148.A N ALA 145.A O no hydrogen 3.128 N/A ARG 148.A NH1 ASP 144.A OD1 no hydrogen 2.767 N/A LEU 149.A N LEU 146.A O no hydrogen 2.784 N/A LEU 150.A N LEU 146.A O no hydrogen 2.770 N/A TYR 151.A N ARG 147.A O no hydrogen 3.084 N/A MET 152.A N ARG 148.A O no hydrogen 3.381 N/A ILE 153.A N LEU 149.A O no hydrogen 2.887 N/A TYR 154.A N TYR 151.A O no hydrogen 3.045 N/A MET 155.A N TYR 151.A O no hydrogen 3.147 N/A SER 156.A N MET 152.A O no hydrogen 3.061 N/A SER 156.A OG MET 152.A O no hydrogen 2.726 N/A VAL 160.A N VAL 103.A O no hydrogen 2.906 N/A ARG 161.A N SER 187.A O no hydrogen 2.985 N/A VAL 162.A N TYR 100.A O no hydrogen 3.039 N/A HIS 163.A N GLY 185.A O no hydrogen 2.723 N/A VAL 164.A N HIS 98.A O no hydrogen 2.738 N/A SER 165.A N ALA 182.A O no hydrogen 3.052 N/A LYS 166.A NZ TYR 100.A OH no hydrogen 3.400 N/A GLU 167.A N SER 165.A OG no hydrogen 3.000 N/A GLN 169.A N TYR 89.A O no hydrogen 2.712 N/A TYR 170.A N THR 180.A O no hydrogen 2.744 N/A TYR 171.A N THR 87.A O no hydrogen 2.724 N/A TYR 173.A OH ARG 107.A O no hydrogen 2.438 N/A ASP 175.A N GLU 31.A OE2 no hydrogen 2.889 N/A TYR 181.A N GLY 129.A O no hydrogen 2.785 N/A LEU 183.A N CYS 131.A O no hydrogen 2.933 N/A THR 184.A N HIS 163.A O no hydrogen 2.964 N/A GLY 185.A N HIS 163.A O no hydrogen 3.299 N/A SER 187.A N ARG 161.A O no hydrogen 3.013 N/A CYS 189.A N ALA 159.A O no hydrogen 2.993 N/A SER 194.A N PRO 191.A O no hydrogen 2.524 N/A SER 194.A OG PRO 191.A O no hydrogen 3.493 N/A SER 194.A OG ALA 192.A O no hydrogen 3.534 N/A ILE 195.A N ASN 190.A O no hydrogen 2.593 N/A