Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xqm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A OG1 THR 6.A O no hydrogen 2.967 N/A MET 7.A N GLY 30.A O no hydrogen 2.930 N/A PHE 9.A N GLY 28.A O no hydrogen 2.782 N/A LYS 10.A N LEU 110.A O no hydrogen 2.832 N/A THR 11.A N GLY 26.A O no hydrogen 2.946 N/A THR 11.A OG1 CYS 60.A O no hydrogen 3.019 N/A THR 11.A OG1 TYR 112.A O no hydrogen 3.475 N/A THR 12.A N TYR 112.A O no hydrogen 2.969 N/A THR 12.A OG1 TYR 112.A O no hydrogen 3.453 N/A ILE 13.A N CYS 24.A O no hydrogen 2.998 N/A GLU 14.A N VAL 114.A O no hydrogen 2.940 N/A GLY 15.A N PHE 22.A O no hydrogen 3.175 N/A THR 16.A N ILE 116.A O no hydrogen 3.018 N/A VAL 17.A N HIS 20.A O no hydrogen 2.971 N/A ASN 18.A N GLY 118.A O no hydrogen 2.956 N/A ASN 18.A ND2 PHE 121.A O no hydrogen 2.974 N/A HIS 20.A N VAL 17.A O no hydrogen 2.881 N/A HIS 20.A NE2 GLY 46.A O no hydrogen 2.640 N/A CYS 21.A SG THR 16.A OG1 no hydrogen 3.665 N/A PHE 22.A N GLY 15.A O no hydrogen 2.944 N/A LYS 23.A N GLU 45.A O no hydrogen 3.065 N/A CYS 24.A N ILE 13.A O no hydrogen 2.785 N/A ILE 25.A N GLU 42.A O no hydrogen 2.891 N/A GLY 26.A N THR 11.A O no hydrogen 2.920 N/A LYS 27.A N LYS 40.A O no hydrogen 3.149 N/A GLY 28.A N PHE 9.A O no hydrogen 2.981 N/A GLU 29.A N GLU 38.A O no hydrogen 3.004 N/A GLY 30.A N MET 7.A O no hydrogen 2.983 N/A ASN 31.A N THR 36.A O no hydrogen 2.838 N/A GLU 34.A N ASN 31.A O no hydrogen 3.018 N/A GLU 34.A N ASN 31.A OD1 no hydrogen 2.982 N/A GLY 35.A N ASN 31.A O no hydrogen 2.854 N/A THR 36.A N ASN 31.A O no hydrogen 3.416 N/A GLN 37.A N GLU 210.A O no hydrogen 3.075 N/A GLN 37.A NE2 SER 61.A OG no hydrogen 2.731 N/A GLU 38.A N GLU 29.A O no hydrogen 3.017 N/A MET 39.A N GLN 208.A O no hydrogen 2.991 N/A LYS 40.A N LYS 27.A O no hydrogen 2.837 N/A ILE 41.A N TYR 206.A O no hydrogen 2.768 N/A GLU 42.A N ILE 25.A O no hydrogen 2.694 N/A VAL 43.A N LYS 204.A O no hydrogen 2.758 N/A ILE 44.A N LYS 23.A O no hydrogen 2.766 N/A GLU 45.A N LYS 23.A O no hydrogen 3.217 N/A LEU 49.A N GLY 203.A O no hydrogen 2.810 N/A ALA 52.A N VAL 127.A O no hydrogen 2.830 N/A ILE 55.A N ALA 52.A O no hydrogen 3.440 N/A LEU 56.A N PHE 53.A O no hydrogen 2.849 N/A SER 57.A N HIS 54.A O no hydrogen 2.987 N/A SER 57.A OG HIS 54.A O no hydrogen 3.164 N/A SER 57.A OG GLN 208.A OE1 no hydrogen 2.855 N/A SER 59.A N LEU 56.A O no hydrogen 2.854 N/A CYS 60.A SG LEU 56.A O no hydrogen 3.820 N/A CYS 60.A SG SER 57.A O no hydrogen 3.836 N/A SER 61.A OG TYR 112.A OH no hydrogen 2.537 N/A LYS 62.A NZ GLU 140.A OE1 no hydrogen 2.893 N/A LYS 62.A NZ TYR 173.A OH no hydrogen 3.282 N/A LYS 62.A NZ GLU 190.A OE1 no hydrogen 2.887 N/A LYS 62.A NZ HIS 192.A NE2 no hydrogen 2.946 N/A PHE 64.A N SER 61.A O no hydrogen 3.327 N/A LYS 66.A N ALA 212.A O no hydrogen 3.192 N/A TYR 67.A OH GLU 190.A OE2 no hydrogen 2.804 N/A VAL 68.A N GLY 214.A O no hydrogen 2.904 N/A ILE 71.A N VAL 68.A O no hydrogen 3.070 N/A LYS 76.A N ASP 73.A OD1 no hydrogen 2.874 N/A LYS 76.A NZ PRO 32.A O no hydrogen 3.088 N/A LYS 76.A NZ THR 63.A O no hydrogen 2.860 N/A LYS 76.A NZ ILE 65.A O no hydrogen 3.053 N/A LYS 76.A NZ ASP 73.A OD2 no hydrogen 2.801 N/A GLN 77.A N ASP 73.A O no hydrogen 3.125 N/A GLN 77.A NE2 ASP 73.A O no hydrogen 2.972 N/A GLN 77.A NE2 LYS 183.A O no hydrogen 3.324 N/A SER 78.A N PHE 75.A O no hydrogen 3.051 N/A SER 78.A OG TYR 74.A O no hydrogen 2.637 N/A SER 78.A OG SER 175.A OG no hydrogen 2.737 N/A PHE 79.A N LYS 76.A O no hydrogen 3.424 N/A GLU 81.A N GLU 81.A OE2 no hydrogen 2.573 N/A GLY 82.A N SER 78.A O no hydrogen 2.772 N/A PHE 83.A N THR 103.A O no hydrogen 3.099 N/A THR 84.A N ARG 174.A O no hydrogen 2.931 N/A TRP 85.A N GLN 101.A O no hydrogen 3.049 N/A GLU 86.A N THR 172.A O no hydrogen 2.994 N/A ARG 87.A N ALA 99.A O no hydrogen 2.856 N/A ARG 87.A NE THR 171.A OG1 no hydrogen 2.656 N/A ARG 87.A NH1 THR 58.A O no hydrogen 3.029 N/A ARG 87.A NH2 TYR 173.A OH no hydrogen 3.311 N/A THR 88.A N HIS 170.A O no hydrogen 3.189 N/A THR 88.A OG1 THR 98.A OG1 no hydrogen 3.255 N/A THR 89.A N LEU 97.A O no hydrogen 2.799 N/A THR 90.A N HIS 168.A O no hydrogen 2.907 N/A THR 90.A OG1 HIS 168.A O no hydrogen 3.481 N/A TYR 91.A N GLY 95.A O no hydrogen 2.761 N/A GLU 92.A N THR 166.A O no hydrogen 2.969 N/A GLY 94.A N TYR 91.A O no hydrogen 3.006 N/A PHE 96.A N ASN 119.A O no hydrogen 2.913 N/A LEU 97.A N THR 89.A O no hydrogen 2.898 N/A THR 98.A N LEU 117.A O no hydrogen 2.782 N/A THR 98.A OG1 THR 88.A OG1 no hydrogen 3.255 N/A ALA 99.A N ARG 87.A O no hydrogen 2.807 N/A HIS 100.A N LYS 115.A O no hydrogen 3.032 N/A GLN 101.A N TRP 85.A O no hydrogen 2.906 N/A ASP 102.A N LYS 113.A O no hydrogen 2.890 N/A THR 103.A N PHE 83.A O no hydrogen 2.758 N/A THR 103.A OG1 GLN 101.A OE1 no hydrogen 2.794 N/A SER 104.A N VAL 111.A O no hydrogen 3.061 N/A SER 104.A OG VAL 111.A O no hydrogen 3.410 N/A ASP 106.A N CYS 109.A O no hydrogen 2.840 N/A CYS 109.A N ASP 106.A O no hydrogen 3.433 N/A CYS 109.A SG PRO 8.A O no hydrogen 3.451 N/A CYS 109.A SG LEU 110.A O no hydrogen 3.487 N/A LEU 110.A N PRO 8.A O no hydrogen 2.980 N/A VAL 111.A N SER 104.A O no hydrogen 2.763 N/A TYR 112.A N LYS 10.A O no hydrogen 2.783 N/A TYR 112.A OH SER 61.A OG no hydrogen 2.537 N/A LYS 113.A N ASP 102.A O no hydrogen 3.059 N/A VAL 114.A N THR 12.A O no hydrogen 2.867 N/A LYS 115.A N HIS 100.A O no hydrogen 2.901 N/A ILE 116.A N GLU 14.A O no hydrogen 2.776 N/A LEU 117.A N THR 98.A O no hydrogen 2.853 N/A GLY 118.A N THR 16.A O no hydrogen 2.787 N/A ASN 119.A N PHE 96.A O no hydrogen 2.910 N/A ASN 120.A ND2 ASN 119.A OD1 no hydrogen 2.530 N/A PHE 121.A N ASN 18.A OD1 no hydrogen 3.119 N/A ASP 124.A N ASP 124.A OD1 no hydrogen 2.648 N/A GLY 125.A N PRO 122.A O no hydrogen 3.013 N/A GLN 129.A N GLY 125.A O no hydrogen 2.986 N/A GLN 129.A NE2 ALA 123.A O no hydrogen 2.903 N/A ASN 130.A N VAL 127.A O no hydrogen 3.102 N/A LYS 131.A N PRO 126.A O no hydrogen 2.843 N/A GLY 133.A N LYS 158.A O no hydrogen 2.623 N/A ARG 134.A N LYS 158.A O no hydrogen 3.236 N/A TRP 135.A NE1 HIS 54.A O no hydrogen 3.025 N/A GLU 136.A N ALA 156.A O no hydrogen 2.875 N/A GLY 138.A N HIS 192.A O no hydrogen 2.888 N/A THR 139.A OG1 ASP 191.A OD1 no hydrogen 2.676 N/A GLU 140.A N GLU 190.A O no hydrogen 2.911 N/A ILE 141.A N GLN 152.A O no hydrogen 2.792 N/A VAL 142.A N HIS 188.A O no hydrogen 2.999 N/A TYR 143.A N ARG 150.A O no hydrogen 2.921 N/A VAL 145.A N VAL 148.A O no hydrogen 2.895 N/A VAL 148.A N VAL 145.A O no hydrogen 2.831 N/A LEU 149.A N TYR 173.A O no hydrogen 3.158 N/A ARG 150.A N TYR 143.A O no hydrogen 2.826 N/A GLY 151.A N THR 171.A O no hydrogen 2.909 N/A GLN 152.A N ILE 141.A O no hydrogen 3.031 N/A GLN 152.A NE2 TYR 143.A OH no hydrogen 2.855 N/A SER 153.A N LEU 169.A O no hydrogen 3.214 N/A MET 155.A N CYS 167.A O no hydrogen 2.995 N/A LEU 157.A N LEU 165.A O no hydrogen 2.920 N/A LYS 158.A N ARG 134.A O no hydrogen 2.680 N/A LYS 158.A NZ GLU 136.A OE2 no hydrogen 2.846 N/A CYS 159.A N ARG 163.A O no hydrogen 2.696 N/A CYS 159.A SG LEU 157.A O no hydrogen 3.559 N/A ARG 163.A N CYS 159.A O no hydrogen 3.064 N/A LEU 165.A N LEU 157.A O no hydrogen 2.987 N/A THR 166.A N GLU 92.A OE2 no hydrogen 2.755 N/A THR 166.A OG1 GLU 92.A OE2 no hydrogen 2.680 N/A CYS 167.A N MET 155.A O no hydrogen 2.967 N/A CYS 167.A SG MET 155.A O no hydrogen 3.840 N/A HIS 168.A N THR 90.A O no hydrogen 2.749 N/A HIS 168.A NE2 GLN 152.A OE1 no hydrogen 2.844 N/A LEU 169.A N SER 153.A O no hydrogen 2.799 N/A HIS 170.A N THR 88.A O no hydrogen 3.023 N/A THR 171.A N GLY 151.A O no hydrogen 2.802 N/A THR 172.A N GLU 86.A O no hydrogen 2.994 N/A TYR 173.A N LEU 149.A O no hydrogen 2.748 N/A TYR 173.A OH GLU 140.A OE1 no hydrogen 3.309 N/A TYR 173.A OH GLU 140.A OE2 no hydrogen 2.542 N/A ARG 174.A N THR 84.A O no hydrogen 2.876 N/A ARG 174.A NE GLU 86.A OE2 no hydrogen 3.360 N/A ARG 174.A NH2 GLU 86.A OE1 no hydrogen 2.837 N/A SER 175.A N TYR 74.A OH no hydrogen 2.763 N/A SER 175.A OG SER 78.A OG no hydrogen 2.737 N/A SER 175.A OG LYS 177.A O no hydrogen 3.454 N/A LYS 176.A N GLY 82.A O no hydrogen 2.924 N/A LYS 176.A NZ ASP 102.A OD2 no hydrogen 3.182 N/A LYS 177.A N SER 175.A OG no hydrogen 3.076 N/A LYS 177.A NZ GLN 77.A O no hydrogen 2.756 N/A LYS 177.A NZ PHE 79.A O no hydrogen 2.914 N/A ALA 181.A N PRO 178.A O no hydrogen 2.910 N/A LEU 182.A N ALA 179.A O no hydrogen 2.976 N/A LYS 183.A N GLN 77.A OE1 no hydrogen 2.810 N/A HIS 188.A N VAL 142.A O no hydrogen 3.159 N/A HIS 188.A ND1 GLY 186.A O no hydrogen 2.724 N/A HIS 188.A NE2 GLU 190.A OE2 no hydrogen 2.546 N/A PHE 189.A N ARG 215.A O no hydrogen 2.727 N/A GLU 190.A N GLU 140.A O no hydrogen 2.822 N/A ASP 191.A N VAL 213.A O no hydrogen 2.977 N/A HIS 192.A N GLY 138.A O no hydrogen 2.745 N/A ARG 193.A N ALA 211.A O no hydrogen 2.829 N/A GLU 195.A N TYR 209.A O no hydrogen 2.889 N/A MET 197.A N LYS 207.A O no hydrogen 2.687 N/A GLU 198.A N LYS 207.A O no hydrogen 3.408 N/A GLU 201.A N CYS 205.A O no hydrogen 3.174 N/A GLY 203.A N TYR 206.A OH no hydrogen 3.001 N/A LYS 204.A N GLU 201.A O no hydrogen 2.800 N/A CYS 205.A N GLU 201.A O no hydrogen 2.931 N/A CYS 205.A SG ILE 41.A O no hydrogen 3.576 N/A TYR 206.A N ILE 41.A O no hydrogen 3.004 N/A TYR 206.A OH GLU 199.A OE2 no hydrogen 2.775 N/A LYS 207.A N GLU 198.A O no hydrogen 2.919 N/A GLN 208.A N MET 39.A O no hydrogen 2.914 N/A GLN 208.A NE2 SER 57.A O no hydrogen 2.895 N/A TYR 209.A N GLU 195.A O no hydrogen 2.815 N/A GLU 210.A N GLN 37.A O no hydrogen 3.037 N/A ALA 211.A N ARG 193.A O no hydrogen 3.079 N/A ALA 212.A N GLY 35.A O no hydrogen 2.779 N/A VAL 213.A N ASP 191.A O no hydrogen 3.081 N/A GLY 214.A N LYS 66.A O no hydrogen 2.826 N/A ARG 215.A N PHE 189.A O no hydrogen 2.853 N/A ARG 215.A NE ASP 191.A OD2 no hydrogen 2.677 N/A ARG 215.A NH1 TYR 216.A O no hydrogen 2.994 N/A ARG 215.A NH2 ASP 191.A OD1 no hydrogen 3.105 N/A ARG 215.A NH2 ASP 191.A OD2 no hydrogen 3.235 N/A LEU 224.A N SER 222.A OG no hydrogen 3.114 N/A HIS 226.A N SER 222.A OG no hydrogen 2.912 N/A