Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pxo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N PHE 58.A O no hydrogen 3.030 N/A LYS 4.A NZ TYR 6.A OH no hydrogen 3.312 N/A MET 5.A N GLU 29.A O no hydrogen 2.775 N/A TYR 6.A N ALA 56.A O no hydrogen 2.784 N/A GLY 7.A N VAL 31.A O no hydrogen 2.753 N/A ASN 8.A ND2 LEU 33.A O no hydrogen 2.884 N/A ARG 10.A N ASN 8.A OD1 no hydrogen 2.935 N/A ARG 10.A NH1 ASP 36.A OD1 no hydrogen 3.060 N/A ARG 10.A NH1 ASP 36.A OD2 no hydrogen 3.305 N/A ARG 10.A NH2 ASP 36.A OD2 no hydrogen 3.056 N/A SER 11.A N ASN 8.A OD1 no hydrogen 2.949 N/A ALA 14.A N SER 11.A OG no hydrogen 2.967 N/A PHE 15.A N SER 11.A O no hydrogen 3.043 N/A ARG 16.A N ALA 12.A O no hydrogen 3.090 N/A ARG 16.A NE SER 172.A OG no hydrogen 3.058 N/A ARG 16.A NH1 SER 68.A OG no hydrogen 2.914 N/A VAL 17.A N ALA 13.A O no hydrogen 3.438 N/A ARG 18.A N ALA 14.A O no hydrogen 2.840 N/A ARG 18.A NE GLU 30.A OE2 no hydrogen 2.736 N/A ARG 18.A NH1 ASN 8.A O no hydrogen 3.180 N/A ARG 18.A NH1 GLU 30.A OE1 no hydrogen 2.801 N/A ARG 18.A NH1 GLU 30.A OE2 no hydrogen 3.444 N/A ARG 18.A NH2 ALA 206.A O no hydrogen 2.830 N/A ILE 19.A N PHE 15.A O no hydrogen 2.943 N/A ALA 20.A N ARG 16.A O no hydrogen 3.235 N/A LEU 21.A N VAL 17.A O no hydrogen 2.955 N/A ASN 22.A N ARG 18.A O no hydrogen 3.054 N/A ASN 22.A ND2 ALA 202.A O no hydrogen 2.996 N/A LEU 23.A N ILE 19.A O no hydrogen 2.813 N/A LYS 24.A N ALA 20.A O no hydrogen 3.002 N/A LYS 24.A NZ GLU 76.A OE1 no hydrogen 3.022 N/A LYS 24.A NZ ARG 79.A O no hydrogen 3.005 N/A LYS 24.A NZ VAL 82.A O no hydrogen 2.815 N/A GLY 25.A N ASN 22.A O no hydrogen 3.110 N/A ILE 26.A N LEU 21.A O no hydrogen 2.886 N/A GLU 29.A N VAL 3.A O no hydrogen 2.923 N/A VAL 31.A N MET 5.A O no hydrogen 2.734 N/A LEU 33.A N GLY 7.A O no hydrogen 2.881 N/A ASP 34.A N ASP 39.A OD2 no hydrogen 2.779 N/A ASP 36.A N ASP 34.A OD1 no hydrogen 2.909 N/A ALA 37.A N ASP 34.A OD1 no hydrogen 2.898 N/A ASP 39.A N ASP 34.A O no hydrogen 3.177 N/A GLN 40.A N GLN 40.A OE1 no hydrogen 2.648 N/A GLN 40.A NE2 LEU 35.A O no hydrogen 2.937 N/A HIS 41.A N GLY 38.A O no hydrogen 3.040 N/A LYS 42.A N ASP 39.A O no hydrogen 3.304 N/A LYS 42.A NZ ASP 39.A OD1 no hydrogen 3.492 N/A LEU 46.A N LYS 42.A O no hydrogen 2.965 N/A ALA 47.A N PRO 43.A O no hydrogen 2.955 N/A ILE 48.A N PHE 45.A O no hydrogen 2.895 N/A ASN 49.A N PHE 45.A O no hydrogen 2.836 N/A ASN 49.A ND2 ALA 53.A O no hydrogen 2.822 N/A GLN 51.A N ASN 49.A OD1 no hydrogen 3.087 N/A GLY 52.A N ASN 49.A O no hydrogen 2.831 N/A ALA 56.A N TYR 6.A O no hydrogen 3.222 N/A LEU 57.A N LEU 65.A O no hydrogen 2.753 N/A PHE 58.A N LYS 4.A O no hydrogen 2.783 N/A LEU 65.A N LEU 57.A O no hydrogen 2.794 N/A GLN 67.A NE2 GLN 51.A OE1 no hydrogen 3.117 N/A ILE 71.A N GLN 67.A O no hydrogen 2.907 N/A LEU 72.A N SER 68.A O no hydrogen 2.837 N/A ASP 73.A N LEU 69.A O no hydrogen 2.968 N/A TYR 74.A N ALA 70.A O no hydrogen 2.898 N/A TYR 74.A OH ASP 59.A OD2 no hydrogen 2.621 N/A LEU 75.A N ILE 71.A O no hydrogen 2.909 N/A GLU 76.A N LEU 72.A O no hydrogen 2.994 N/A GLU 77.A N ASP 73.A O no hydrogen 2.933 N/A GLU 77.A N TYR 74.A O no hydrogen 3.182 N/A THR 78.A N TYR 74.A O no hydrogen 2.945 N/A THR 78.A OG1 TYR 74.A O no hydrogen 2.782 N/A ARG 79.A N LEU 75.A O no hydrogen 2.900 N/A ARG 79.A NH1 ASP 59.A OD2 no hydrogen 2.785 N/A ARG 79.A NH1 THR 78.A OG1 no hydrogen 3.103 N/A ARG 79.A NH2 ASP 59.A OD1 no hydrogen 2.988 N/A LEU 84.A N GLU 76.A OE1 no hydrogen 2.993 N/A LEU 84.A N GLU 76.A OE2 no hydrogen 2.970 N/A LEU 85.A N GLU 76.A OE2 no hydrogen 3.334 N/A ARG 90.A N GLU 88.A OE1 no hydrogen 2.933 N/A ALA 91.A N GLU 88.A OE2 no hydrogen 2.918 N/A ARG 92.A N GLU 88.A O no hydrogen 2.939 N/A ARG 92.A NH1 PRO 86.A O no hydrogen 3.172 N/A ALA 93.A N PRO 89.A O no hydrogen 2.923 N/A ARG 94.A N ARG 90.A O no hydrogen 2.952 N/A ARG 94.A NE GLU 151.A OE2 no hydrogen 2.758 N/A ARG 94.A NH1 CYS 158.A O no hydrogen 2.824 N/A ARG 94.A NH1 GLN 159.A OE1 no hydrogen 2.749 N/A ARG 94.A NH2 GLU 151.A OE2 no hydrogen 3.137 N/A ARG 94.A NH2 THR 154.A OG1 no hydrogen 2.929 N/A ALA 95.A N ALA 91.A O no hydrogen 2.978 N/A ARG 96.A N ARG 92.A O no hydrogen 2.910 N/A ARG 96.A NH2 ASP 73.A OD1 no hydrogen 2.972 N/A SER 97.A N ALA 93.A O no hydrogen 2.869 N/A LEU 98.A N ARG 94.A O no hydrogen 2.942 N/A ALA 99.A N ALA 95.A O no hydrogen 2.989 N/A GLN 100.A N ARG 96.A O no hydrogen 2.849 N/A VAL 101.A N SER 97.A O no hydrogen 2.898 N/A ALA 103.A N ALA 99.A O no hydrogen 2.804 N/A CYS 104.A N GLN 100.A O no hydrogen 2.789 N/A ASP 105.A N GLN 100.A O no hydrogen 3.225 N/A THR 106.A N VAL 102.A O no hydrogen 3.232 N/A THR 106.A OG1 VAL 101.A O no hydrogen 2.774 N/A HIS 107.A N VAL 102.A O no hydrogen 2.845 N/A LEU 109.A N THR 106.A O no hydrogen 3.049 N/A TYR 110.A N HIS 107.A O no hydrogen 2.957 N/A VAL 114.A N VAL 111.A O no hydrogen 2.979 N/A ARG 115.A N VAL 111.A O no hydrogen 3.170 N/A ARG 115.A NH2 TYR 110.A O no hydrogen 2.703 N/A THR 116.A N PRO 112.A O no hydrogen 2.879 N/A THR 116.A OG1.A PRO 112.A O no hydrogen 2.969 N/A THR 116.A OG1.A ARG 113.A O no hydrogen 3.171 N/A THR 116.A OG1.B PRO 112.A O no hydrogen 3.124 N/A PHE 117.A N ARG 113.A O no hydrogen 2.987 N/A LEU 118.A N VAL 114.A O no hydrogen 3.028 N/A MET 119.A N ARG 115.A O no hydrogen 3.364 N/A GLU 120.A N THR 116.A O no hydrogen 2.820 N/A ASN 121.A N PHE 117.A O no hydrogen 2.699 N/A TYR 122.A N LEU 118.A O no hydrogen 3.307 N/A GLY 123.A N MET 119.A O no hydrogen 2.832 N/A GLU 127.A N GLU 127.A OE2 no hydrogen 2.872 N/A ARG 128.A N PRO 125.A O no hydrogen 3.037 N/A ARG 128.A NE.A GLU 131.A OE1 no hydrogen 3.257 N/A ARG 128.A NE.A GLU 131.A OE2 no hydrogen 3.179 N/A ARG 128.A NH1.A GLU 131.A OE2 no hydrogen 2.722 N/A MET 129.A N PRO 125.A O no hydrogen 2.877 N/A LEU 130.A N ARG 126.A O no hydrogen 2.920 N/A GLU 131.A N ARG 128.A O no hydrogen 3.001 N/A PHE 132.A N MET 129.A O no hydrogen 3.009 N/A ARG 134.A N LEU 130.A O no hydrogen 2.823 N/A ASN 135.A N GLU 131.A O no hydrogen 2.964 N/A ALA 136.A N PHE 132.A O no hydrogen 3.004 N/A PHE 137.A N LEU 133.A O no hydrogen 3.014 N/A ILE 138.A N ARG 134.A O no hydrogen 2.891 N/A THR 139.A N ASN 135.A O no hydrogen 2.925 N/A THR 139.A OG1 ASN 135.A O no hydrogen 2.690 N/A THR 139.A OG1 ASN 135.A OD1 no hydrogen 3.477 N/A GLY 140.A N ALA 136.A O no hydrogen 3.027 N/A LEU 141.A N PHE 137.A O no hydrogen 2.797 N/A LYS 142.A N ILE 138.A O no hydrogen 2.887 N/A THR 143.A N THR 139.A O no hydrogen 3.145 N/A THR 143.A OG1 THR 139.A O no hydrogen 3.063 N/A LEU 144.A N GLY 140.A O no hydrogen 2.918 N/A GLU 145.A N LEU 141.A O no hydrogen 2.838 N/A THR 146.A N LYS 142.A O no hydrogen 3.003 N/A THR 146.A OG1 LYS 142.A O no hydrogen 2.928 N/A ARG 147.A N THR 143.A O no hydrogen 2.957 N/A ARG 147.A NE GLU 151.A OE1 no hydrogen 2.884 N/A ARG 147.A NE GLU 151.A OE2 no hydrogen 3.463 N/A ARG 147.A NH1 SER 97.A OG no hydrogen 2.804 N/A ARG 147.A NH2 GLU 151.A OE2 no hydrogen 3.434 N/A LEU 148.A N LEU 144.A O no hydrogen 2.810 N/A SER 149.A N GLU 145.A O no hydrogen 2.976 N/A SER 149.A OG.A GLU 145.A O no hydrogen 2.726 N/A SER 149.A OG.A GLU 145.A OE2 no hydrogen 2.981 N/A SER 149.A OG.A THR 189.A OG1 no hydrogen 2.713 N/A SER 149.A OG.B GLU 145.A O no hydrogen 2.798 N/A SER 149.A OG.B THR 146.A O no hydrogen 3.379 N/A ASN 150.A N THR 146.A O no hydrogen 3.062 N/A ASN 150.A ND2 THR 146.A O no hydrogen 2.962 N/A GLU 151.A N ARG 147.A O no hydrogen 2.971 N/A THR 154.A N GLU 151.A O no hydrogen 3.491 N/A THR 154.A OG1 LEU 148.A O no hydrogen 2.791 N/A THR 154.A OG1 GLU 151.A O no hydrogen 3.516 N/A GLY 155.A N PHE 157.A O no hydrogen 3.013 N/A ARG 156.A N ASP 161.A OD1 no hydrogen 2.902 N/A ARG 156.A NE GLU 196.A OE1 no hydrogen 2.692 N/A PHE 157.A N GLY 160.A O no hydrogen 3.026 N/A CYS 158.A N ASP 167.A OD1 no hydrogen 2.909 N/A CYS 158.A SG ASP 167.A OD1 no hydrogen 3.245 N/A GLY 160.A N GLY 153.A O no hydrogen 2.805 N/A SER 164.A N ASP 167.A OD2 no hydrogen 2.817 N/A HIS 165.A N LEU 84.A O no hydrogen 2.984 N/A ALA 166.A N SER 164.A OG no hydrogen 3.213 N/A LEU 168.A N SER 164.A O no hydrogen 3.238 N/A CYS 169.A N HIS 165.A O no hydrogen 3.048 N/A CYS 169.A SG ALA 99.A O no hydrogen 3.738 N/A CYS 169.A SG HIS 165.A O no hydrogen 3.588 N/A LEU 170.A N ALA 166.A O no hydrogen 2.825 N/A ILE 171.A N ASP 167.A O no hydrogen 2.907 N/A SER 172.A N LEU 168.A O no hydrogen 3.185 N/A SER 172.A OG CYS 169.A O no hydrogen 2.758 N/A LEU 173.A N CYS 169.A O no hydrogen 3.070 N/A TRP 174.A N LEU 170.A O no hydrogen 2.869 N/A VAL 175.A N ILE 171.A O no hydrogen 2.974 N/A THR 177.A N LEU 173.A O no hydrogen 3.183 N/A THR 177.A N TRP 174.A O no hydrogen 2.961 N/A THR 177.A OG1 TRP 174.A O no hydrogen 2.600 N/A ILE 179.A N VAL 175.A O no hydrogen 3.018 N/A PHE 180.A N GLY 176.A O no hydrogen 2.719 N/A ILE 182.A N THR 177.A O no hydrogen 2.845 N/A ALA 185.A N ASP 183.A OD1 no hydrogen 3.037 N/A TYR 187.A N THR 184.A O no hydrogen 3.061 N/A THR 189.A N GLU 145.A OE2 no hydrogen 3.048 N/A THR 189.A OG1 GLU 145.A OE2 no hydrogen 2.918 N/A THR 189.A OG1 SER 149.A OG.A no hydrogen 2.713 N/A VAL 190.A N GLU 145.A OE1 no hydrogen 2.979 N/A LYS 191.A N TYR 187.A O no hydrogen 2.917 N/A LYS 191.A NZ GLU 195.A OE1 no hydrogen 3.327 N/A LYS 191.A NZ GLU 195.A OE2 no hydrogen 2.958 N/A ARG 192.A N PRO 188.A O no hydrogen 2.932 N/A ARG 192.A NH1 GLY 155.A O no hydrogen 2.882 N/A ARG 192.A NH2 GLY 155.A O no hydrogen 3.502 N/A ARG 192.A NH2 ARG 156.A O no hydrogen 3.170 N/A ILE 193.A N THR 189.A O no hydrogen 3.065 N/A SER 194.A N VAL 190.A O no hydrogen 2.877 N/A SER 194.A OG VAL 190.A O no hydrogen 2.729 N/A GLU 195.A N LYS 191.A O no hydrogen 2.927 N/A GLU 196.A N ARG 192.A O no hydrogen 3.034 N/A VAL 197.A N ILE 193.A O no hydrogen 2.931 N/A LEU 198.A N SER 194.A O no hydrogen 2.826 N/A ALA 199.A N GLU 195.A O no hydrogen 3.081 N/A LEU 200.A N VAL 197.A O no hydrogen 3.136 N/A VAL 203.A N LEU 200.A O no hydrogen 3.081 N/A ALA 204.A N LEU 200.A O no hydrogen 2.883 N/A ARG 205.A N ASP 201.A O no hydrogen 2.881 N/A ARG 205.A NE ASP 201.A OD1 no hydrogen 3.190 N/A ARG 205.A NE ASP 201.A OD2 no hydrogen 3.259 N/A ARG 205.A NH1 ASP 201.A OD2 no hydrogen 3.148 N/A ALA 206.A N VAL 203.A O no hydrogen 3.014 N/A HIS 207.A N ALA 204.A O no hydrogen 3.085 N/A LEU 209.A N HIS 207.A ND1 no hydrogen 3.061 N/A ARG 210.A N HIS 207.A O no hydrogen 2.910 N/A GLN 211.A N PRO 208.A O no hydrogen 3.035 N/A GLN 211.A NE2 ARG 205.A O no hydrogen 3.108 N/A GLN 211.A NE2 HIS 207.A O no hydrogen 2.963 N/A ALA 214.A N GLN 211.A O no hydrogen 3.144 N/A