Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pql_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N ASP 5.A OD2 no hydrogen 3.103 N/A ASP 5.A N THR 2.A OG1 no hydrogen 3.212 N/A CYS 6.A N THR 2.A O no hydrogen 3.022 N/A CYS 6.A SG THR 2.A O no hydrogen 3.503 N/A GLU 7.A N VAL 3.A O no hydrogen 2.840 N/A ASN 8.A N GLN 4.A O no hydrogen 2.794 N/A LYS 9.A N CYS 6.A O no hydrogen 3.204 N/A LEU 10.A N GLU 7.A O no hydrogen 3.112 N/A LEU 14.A N PRO 11.A O no hydrogen 2.741 N/A LYS 15.A NZ ASN 8.A O no hydrogen 3.522 N/A LYS 15.A NZ LEU 10.A O no hydrogen 3.226 N/A SER 16.A OG PRO 12.A O no hydrogen 3.289 N/A ARG 17.A N LEU 14.A O no hydrogen 3.164 N/A ARG 17.A NE GLU 20.A OE1 no hydrogen 3.403 N/A ARG 17.A NE GLU 20.A OE2 no hydrogen 3.477 N/A ARG 17.A NH2 GLU 20.A OE1 no hydrogen 3.381 N/A LEU 18.A N LYS 15.A O no hydrogen 3.437 N/A CYS 19.A SG ASN 143.A O no hydrogen 3.053 N/A ILE 21.A N ARG 17.A O no hydrogen 3.159 N/A ARG 22.A N LEU 18.A O no hydrogen 2.894 N/A ARG 22.A NE ASP 139.A OD1 no hydrogen 2.995 N/A ARG 22.A NH1 GLU 7.A OE2 no hydrogen 2.850 N/A ARG 22.A NH1 GLU 114.A OE2 no hydrogen 2.820 N/A ARG 22.A NH2 GLU 114.A OE1 no hydrogen 3.137 N/A ARG 22.A NH2 GLU 114.A OE2 no hydrogen 2.867 N/A ARG 22.A NH2 ASP 139.A OD1 no hydrogen 2.916 N/A ARG 23.A N GLU 20.A O no hydrogen 3.077 N/A ARG 23.A NE GLU 25.A OE2 no hydrogen 2.346 N/A ARG 23.A NH2 GLU 25.A OE1 no hydrogen 2.799 N/A ARG 23.A NH2 GLU 25.A OE2 no hydrogen 3.038 N/A TYR 24.A N ILE 21.A O no hydrogen 2.944 N/A TYR 24.A OH ASP 111.A OD1 no hydrogen 2.709 N/A GLU 25.A N GLU 20.A O no hydrogen 3.171 N/A ASP 33.A N GLY 29.A O no hydrogen 3.009 N/A LYS 34.A N GLU 31.A O no hydrogen 3.360 N/A HIS 35.A N GLU 31.A O no hydrogen 3.132 N/A ILE 36.A N MET 32.A O no hydrogen 2.997 N/A CYS 38.A N LYS 34.A O no hydrogen 3.228 N/A VAL 39.A N HIS 35.A O no hydrogen 2.845 N/A MET 40.A N ILE 36.A O no hydrogen 2.941 N/A ARG 41.A N HIS 37.A O no hydrogen 3.024 N/A ARG 41.A NH1 VAL 46.A O no hydrogen 3.048 N/A ALA 42.A N CYS 38.A O no hydrogen 2.976 N/A LEU 43.A N VAL 39.A O no hydrogen 2.888 N/A ASP 44.A N ARG 41.A O no hydrogen 2.984 N/A PHE 45.A N MET 40.A O no hydrogen 2.849 N/A TYR 47.A N ARG 51.A O no hydrogen 2.761 N/A GLY 50.A N TYR 47.A O no hydrogen 2.823 N/A ARG 51.A N ASP 49.A OD1 no hydrogen 3.354 N/A ASP 53.A N PHE 45.A O no hydrogen 2.868 N/A TYR 54.A OH ASP 71.A OD1 no hydrogen 2.644 N/A HIS 55.A N ASP 53.A OD1 no hydrogen 3.023 N/A LYS 56.A N ASP 53.A O no hydrogen 3.005 N/A LYS 56.A NZ ASP 44.A OD2 no hydrogen 2.991 N/A LEU 57.A N TYR 54.A O no hydrogen 3.150 N/A TYR 58.A N TYR 54.A O no hydrogen 2.926 N/A LEU 61.A N LEU 57.A O no hydrogen 2.895 N/A ASN 62.A N TYR 58.A O no hydrogen 3.090 N/A ASN 62.A ND2 TYR 58.A O no hydrogen 2.951 N/A ILE 63.A N ASP 59.A O no hydrogen 2.826 N/A GLU 65.A N LEU 61.A O no hydrogen 2.915 N/A ASP 67.A N ASN 62.A OD1 no hydrogen 3.118 N/A ARG 69.A N ASP 67.A OD1 no hydrogen 3.113 N/A ARG 69.A NE ASP 67.A OD1 no hydrogen 3.180 N/A ARG 69.A NE ASP 67.A OD2 no hydrogen 3.030 N/A ARG 69.A NH2 ASP 67.A OD2 no hydrogen 2.986 N/A HIS 70.A N ASP 67.A O no hydrogen 3.196 N/A HIS 70.A ND1 THR 102.A OG1 no hydrogen 2.856 N/A HIS 70.A NE2 GLU 65.A O no hydrogen 2.637 N/A VAL 72.A N LYS 68.A O no hydrogen 3.491 N/A ASN 73.A N ARG 69.A O no hydrogen 2.825 N/A ASN 73.A ND2 THR 101.A OG1 no hydrogen 3.037 N/A ASN 73.A ND2 THR 102.A OG1 no hydrogen 2.741 N/A LEU 74.A N HIS 70.A O no hydrogen 2.846 N/A GLU 75.A N ASP 71.A O no hydrogen 2.977 N/A LYS 76.A N VAL 72.A O no hydrogen 3.017 N/A LYS 76.A NZ GLU 80.A OE2 no hydrogen 2.793 N/A CYS 77.A N ASN 73.A O no hydrogen 2.891 N/A CYS 77.A SG ASN 73.A O no hydrogen 3.234 N/A ILE 78.A N LEU 74.A O no hydrogen 2.974 N/A GLY 79.A N GLU 75.A O no hydrogen 3.049 N/A GLU 80.A N LYS 76.A O no hydrogen 2.970 N/A CYS 81.A N CYS 77.A O no hydrogen 3.059 N/A CYS 81.A SG ILE 78.A O no hydrogen 3.271 N/A VAL 82.A N ILE 78.A O no hydrogen 3.021 N/A GLN 83.A N GLU 80.A O no hydrogen 2.987 N/A THR 86.A OG1 ASP 49.A O no hydrogen 2.756 N/A GLU 88.A N PRO 85.A O no hydrogen 2.950 N/A ARG 89.A NE CYS 81.A O no hydrogen 2.925 N/A ARG 89.A NH2 VAL 82.A O no hydrogen 3.465 N/A ARG 89.A NH2 VAL 84.A O no hydrogen 2.607 N/A HIS 91.A ND1 ASP 33.A OD1 no hydrogen 2.398 N/A VAL 92.A N GLU 88.A O no hydrogen 2.926 N/A PHE 93.A N ARG 89.A O no hydrogen 2.915 N/A TYR 94.A N ALA 90.A O no hydrogen 2.967 N/A LYS 95.A N HIS 91.A O no hydrogen 2.801 N/A LYS 95.A NZ GLU 28.A OE1 no hydrogen 2.846 N/A CYS 96.A N VAL 92.A O no hydrogen 2.902 N/A CYS 96.A SG GLU 80.A OE2 no hydrogen 3.615 N/A LEU 97.A N PHE 93.A O no hydrogen 2.961 N/A LEU 98.A N TYR 94.A O no hydrogen 3.077 N/A LYS 99.A N LYS 95.A O no hydrogen 3.214 N/A LYS 99.A N CYS 96.A O no hydrogen 3.238 N/A SER 100.A N CYS 96.A O no hydrogen 3.115 N/A SER 100.A N LEU 97.A O no hydrogen 3.163 N/A SER 100.A OG LEU 97.A O no hydrogen 2.661 N/A THR 102.A N SER 100.A OG no hydrogen 3.184 N/A THR 102.A OG1 HIS 70.A ND1 no hydrogen 2.856 N/A GLY 103.A N SER 100.A O no hydrogen 2.967 N/A ARG 104.A NH1 GLU 65.A OE2 no hydrogen 3.058 N/A THR 105.A OG1 GLU 65.A OE1 no hydrogen 2.729 N/A PHE 106.A N THR 102.A O no hydrogen 2.757 N/A LYS 107.A N GLY 103.A O no hydrogen 3.042 N/A VAL 109.A N THR 105.A O no hydrogen 3.019 N/A PHE 110.A N PHE 106.A O no hydrogen 2.800 N/A ASP 111.A N LYS 107.A O no hydrogen 2.870 N/A LEU 112.A N LYS 108.A O no hydrogen 2.969 N/A MET 113.A N VAL 109.A O no hydrogen 2.957 N/A GLU 114.A N PHE 110.A O no hydrogen 2.940 N/A LEU 115.A N ASP 111.A O no hydrogen 3.105 N/A LYS 116.A N LEU 112.A O no hydrogen 2.803 N/A LYS 116.A NZ GLN 123.A O no hydrogen 2.950 N/A LYS 116.A NZ GLN 125.A O no hydrogen 3.085 N/A LYS 117.A N MET 113.A O no hydrogen 2.972 N/A ALA 118.A N GLU 114.A O no hydrogen 3.022 N/A GLY 119.A N LYS 116.A O no hydrogen 3.007 N/A LYS 120.A N LEU 115.A O no hydrogen 2.896 N/A HIS 124.A N HIS 124.A ND1 no hydrogen 2.986 N/A GLN 125.A N PRO 122.A O no hydrogen 2.993 N/A GLN 125.A NE2 ARG 126.A O no hydrogen 2.988 N/A PHE 131.A N THR 128.A OG1 no hydrogen 2.955 N/A VAL 132.A N THR 128.A O no hydrogen 3.019 N/A GLN 133.A N ALA 129.A O no hydrogen 3.241 N/A GLN 133.A NE2 ASP 137.A OD1 no hydrogen 2.719 N/A ILE 134.A N GLU 130.A O no hydrogen 2.965 N/A MET 135.A N PHE 131.A O no hydrogen 2.848 N/A LYS 136.A N VAL 132.A O no hydrogen 2.985 N/A ASP 137.A N GLN 133.A O no hydrogen 2.923 N/A TYR 138.A N ILE 134.A O no hydrogen 2.962 N/A ASP 139.A N MET 135.A O no hydrogen 2.922 N/A LYS 140.A N LYS 136.A O no hydrogen 2.932 N/A ALA 141.A N ASP 137.A O no hydrogen 3.056 N/A LEU 142.A N ASP 139.A O no hydrogen 2.860 N/A ASN 143.A N LYS 140.A O no hydrogen 3.012 N/A CYS 144.A N ASP 139.A O no hydrogen 2.955 N/A CYS 144.A SG LEU 142.A O no hydrogen 3.933 N/A