Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a8o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 13.A N PRO 9.A O no hydrogen 3.075 N/A ARG 13.A NE ALA 8.A O no hydrogen 2.757 N/A ARG 13.A NH2 ALA 8.A O no hydrogen 3.148 N/A ALA 14.A N VAL 10.A O no hydrogen 2.822 N/A TRP 15.A N SER 11.A O no hydrogen 3.020 N/A ALA 16.A N ASP 12.A O no hydrogen 2.892 N/A LEU 17.A N ARG 13.A O no hydrogen 2.986 N/A PHE 18.A N ALA 14.A O no hydrogen 3.055 N/A ARG 19.A N TRP 15.A O no hydrogen 2.815 N/A ALA 20.A N ALA 16.A O no hydrogen 2.853 N/A LEU 21.A N LEU 17.A O no hydrogen 3.224 N/A ASP 22.A N PHE 18.A O no hydrogen 2.797 N/A GLY 23.A N ARG 19.A O no hydrogen 2.777 N/A LYS 24.A N LEU 21.A O no hydrogen 3.152 N/A GLY 25.A N ASP 22.A O no hydrogen 2.958 N/A LEU 26.A N LEU 21.A O no hydrogen 3.140 N/A TYR 31.A N PRO 28.A O no hydrogen 3.091 N/A GLU 33.A N GLU 33.A OE2 no hydrogen 2.937 N/A GLY 34.A N GLY 30.A O no hydrogen 2.899 N/A TRP 35.A N TYR 31.A O no hydrogen 3.079 N/A TRP 35.A NE1 TYR 31.A OH no hydrogen 3.196 N/A LYS 36.A N VAL 32.A O no hydrogen 2.902 N/A LYS 36.A NZ GLU 40.A OE1 no hydrogen 2.746 N/A LYS 37.A N GLU 33.A O no hydrogen 3.055 N/A LYS 37.A NZ GLU 41.A OE1 no hydrogen 2.787 N/A THR 38.A N GLY 34.A O no hydrogen 3.033 N/A THR 38.A OG1 GLY 34.A O no hydrogen 3.312 N/A PHE 39.A N TRP 35.A O no hydrogen 2.854 N/A GLU 40.A N LYS 36.A O no hydrogen 2.919 N/A GLU 41.A N LYS 37.A O no hydrogen 2.834 N/A ASP 42.A N THR 38.A O no hydrogen 3.025 N/A PHE 43.A N THR 38.A O no hydrogen 3.002 N/A SER 44.A N PRO 108.A O no hydrogen 3.415 N/A ARG 46.A N SER 44.A OG no hydrogen 3.041 N/A ARG 46.A NH1 VAL 180.A O no hydrogen 3.228 N/A ARG 46.A NH2 VAL 180.A O no hydrogen 3.172 N/A ARG 47.A N SER 44.A O no hydrogen 3.038 N/A ARG 47.A NH1 PRO 108.A O no hydrogen 3.162 N/A GLY 48.A N ILE 109.A O no hydrogen 2.899 N/A ALA 49.A N PRO 45.A O no hydrogen 2.954 N/A GLU 50.A N ARG 46.A O no hydrogen 3.025 N/A LEU 51.A N ARG 47.A O no hydrogen 3.075 N/A VAL 52.A N GLY 48.A O no hydrogen 2.952 N/A ALA 53.A N ALA 49.A O no hydrogen 2.911 N/A ARG 54.A N GLU 50.A O no hydrogen 3.044 N/A ARG 54.A NE ASP 58.A OD1 no hydrogen 2.884 N/A ARG 54.A NH1 TYR 76.A OH no hydrogen 2.937 N/A ARG 54.A NH2 ASP 58.A OD1 no hydrogen 3.138 N/A ALA 55.A N LEU 51.A O no hydrogen 2.946 N/A TRP 56.A N VAL 52.A O no hydrogen 2.877 N/A TRP 56.A NE1 PRO 162.A O no hydrogen 3.040 N/A THR 57.A N ALA 53.A O no hydrogen 3.214 N/A THR 57.A N ARG 54.A O no hydrogen 3.093 N/A THR 57.A OG1 ALA 53.A O no hydrogen 2.972 N/A THR 57.A OG1 ARG 54.A O no hydrogen 3.296 N/A PHE 61.A N ASP 58.A OD2 no hydrogen 3.193 N/A ARG 62.A N ASP 58.A O no hydrogen 2.944 N/A ARG 62.A NH2 GLU 90.A OE2 no hydrogen 2.972 N/A GLN 63.A N PRO 59.A O no hydrogen 3.048 N/A LEU 64.A N GLU 60.A O no hydrogen 3.121 N/A LEU 65.A N PHE 61.A O no hydrogen 2.747 N/A LEU 66.A N ARG 62.A O no hydrogen 3.018 N/A THR 67.A N LEU 64.A O no hydrogen 3.163 N/A THR 67.A OG1 GLN 63.A O no hydrogen 2.762 N/A THR 67.A OG1 LEU 64.A O no hydrogen 3.421 N/A ASP 68.A N LEU 64.A O no hydrogen 2.744 N/A ALA 71.A N ASP 68.A OD1 no hydrogen 3.168 N/A ALA 72.A N ASP 68.A O no hydrogen 3.125 N/A VAL 73.A N GLY 69.A O no hydrogen 2.923 N/A ALA 74.A N THR 70.A O no hydrogen 2.890 N/A GLN 75.A N ALA 71.A O no hydrogen 3.146 N/A TYR 76.A N VAL 73.A O no hydrogen 3.059 N/A GLY 77.A N ALA 74.A O no hydrogen 2.867 N/A TYR 78.A N VAL 73.A O no hydrogen 3.217 N/A TYR 78.A OH GLU 50.A OE2 no hydrogen 2.642 N/A GLY 80.A N GLY 83.A O no hydrogen 3.195 N/A GLY 83.A N GLY 80.A O no hydrogen 2.804 N/A ILE 86.A N THR 70.A OG1 no hydrogen 2.929 N/A VAL 87.A N ARG 157.A O no hydrogen 3.112 N/A VAL 89.A N MET 159.A O no hydrogen 2.904 N/A ASP 91.A N LEU 161.A O no hydrogen 3.031 N/A THR 92.A N LEU 95.A O no hydrogen 2.996 N/A THR 94.A N THR 92.A OG1 no hydrogen 3.162 N/A LEU 95.A N THR 92.A O no hydrogen 3.141 N/A LYS 96.A N GLU 146.A O no hydrogen 2.799 N/A LYS 96.A NZ ASP 91.A OD1 no hydrogen 3.552 N/A LYS 96.A NZ ASP 91.A OD2 no hydrogen 2.764 N/A LYS 96.A NZ ASN 97.A O no hydrogen 2.892 N/A LYS 96.A NZ GLY 187.A O no hydrogen 3.161 N/A ASN 97.A N ASP 91.A OD1 no hydrogen 2.847 N/A ASN 97.A ND2 ASP 91.A OD1 no hydrogen 2.862 N/A VAL 98.A N ARG 148.A O no hydrogen 2.922 N/A ILE 99.A N ILE 186.A O no hydrogen 2.924 N/A VAL 100.A N TYR 150.A O no hydrogen 3.006 N/A CYS 101.A SG THR 152.A O no hydrogen 3.494 N/A SER 102.A N ASP 151.A OD1 no hydrogen 2.863 N/A SER 102.A OG ASP 151.A OD1 no hydrogen 3.314 N/A SER 102.A OG ASP 151.A OD2 no hydrogen 2.697 N/A THR 105.A OG1 SER 104.A O no hydrogen 2.704 N/A TRP 107.A N THR 105.A O no hydrogen 2.793 N/A ILE 109.A N ALA 106.A O no hydrogen 3.144 N/A LEU 110.A N ALA 106.A O no hydrogen 2.926 N/A GLY 111.A N TRP 107.A O no hydrogen 2.855 N/A TYR 117.A N PRO 114.A O no hydrogen 2.965 N/A LYS 118.A N PRO 114.A O no hydrogen 3.280 N/A LYS 118.A NZ PRO 113.A O no hydrogen 3.056 N/A SER 119.A N TRP 116.A O no hydrogen 3.238 N/A SER 119.A OG TRP 116.A O no hydrogen 2.633 N/A GLU 121.A N GLU 121.A OE1 no hydrogen 2.804 N/A TYR 122.A N SER 119.A OG no hydrogen 3.093 N/A TYR 122.A OH ILE 99.A O no hydrogen 2.796 N/A ARG 123.A N SER 119.A O no hydrogen 3.052 N/A ARG 123.A NE SER 102.A O no hydrogen 2.871 N/A ARG 123.A NH2 SER 102.A O no hydrogen 3.114 N/A ALA 124.A N PHE 120.A O no hydrogen 2.897 N/A ARG 125.A N GLU 121.A O no hydrogen 3.007 N/A ARG 125.A NE GLU 129.A OE1 no hydrogen 2.758 N/A ARG 125.A NH1 GLU 136.A OE2 no hydrogen 2.935 N/A ARG 125.A NH2 GLU 129.A OE1 no hydrogen 3.266 N/A ARG 125.A NH2 GLU 136.A OE1 no hydrogen 3.384 N/A ARG 125.A NH2 GLU 136.A OE2 no hydrogen 3.067 N/A VAL 126.A N TYR 122.A O no hydrogen 3.098 N/A ARG 128.A N ARG 125.A O no hydrogen 3.020 N/A GLU 129.A N ARG 125.A O no hydrogen 2.803 N/A ARG 131.A NH1 ILE 145.A O no hydrogen 3.132 N/A VAL 133.A N GLU 129.A O no hydrogen 3.015 N/A LEU 134.A N PRO 130.A O no hydrogen 2.896 N/A SER 135.A N ARG 131.A O no hydrogen 2.933 N/A SER 135.A OG GLU 140.A OE1 no hydrogen 2.491 N/A GLU 136.A N LYS 132.A O no hydrogen 2.907 N/A MET 137.A N VAL 133.A O no hydrogen 2.986 N/A GLY 138.A N SER 135.A O no hydrogen 2.979 N/A THR 139.A N LEU 134.A O no hydrogen 2.838 N/A THR 139.A OG1 VAL 188.A O no hydrogen 2.676 N/A SER 143.A OG ASP 144.A OD2 no hydrogen 3.041 N/A ILE 145.A N ALA 142.A O no hydrogen 3.028 N/A GLU 146.A N THR 94.A O no hydrogen 2.999 N/A ARG 148.A N LYS 96.A O no hydrogen 2.842 N/A ARG 148.A NH2 GLU 146.A OE2 no hydrogen 3.377 N/A TYR 150.A N VAL 98.A O no hydrogen 2.811 N/A THR 152.A N VAL 100.A O no hydrogen 2.793 N/A THR 152.A OG1 VAL 100.A O no hydrogen 3.018 N/A THR 153.A OG1 ASP 151.A O no hydrogen 3.497 N/A ARG 157.A N TYR 85.A O no hydrogen 2.893 N/A ARG 157.A NE GLN 82.A OE1 no hydrogen 2.978 N/A ARG 157.A NH1 ALA 154.A O no hydrogen 2.742 N/A ARG 157.A NH1 THR 156.A O no hydrogen 2.867 N/A ARG 157.A NH2 GLN 82.A OE1 no hydrogen 2.811 N/A ARG 157.A NH2 ALA 154.A O no hydrogen 3.257 N/A MET 159.A N VAL 87.A O no hydrogen 3.142 N/A VAL 160.A N LEU 185.A O no hydrogen 2.955 N/A LEU 161.A N VAL 89.A O no hydrogen 2.889 N/A ARG 164.A NE THR 168.A OG1 no hydrogen 3.069 N/A ARG 164.A NH2 THR 168.A O no hydrogen 2.836 N/A GLY 167.A N GLU 169.A OE1 no hydrogen 2.947 N/A THR 168.A OG1 PRO 165.A O no hydrogen 2.766 N/A GLU 169.A N GLU 169.A OE1 no hydrogen 2.866 N/A TRP 171.A N THR 168.A O no hydrogen 3.015 N/A SER 172.A N GLN 175.A OE1 no hydrogen 2.842 N/A GLN 175.A N SER 172.A OG no hydrogen 3.062 N/A LEU 176.A N SER 172.A O no hydrogen 2.956 N/A GLN 177.A N GLN 173.A O no hydrogen 2.838 N/A GLU 178.A N GLU 174.A O no hydrogen 3.344 N/A ILE 179.A N LEU 176.A O no hydrogen 3.105 N/A VAL 180.A N GLN 177.A O no hydrogen 3.137 N/A LYS 182.A NZ LEU 110.A O no hydrogen 2.797 N/A LYS 182.A NZ LEU 112.A O no hydrogen 2.878 N/A CYS 184.A N THR 181.A OG1 no hydrogen 3.282 N/A CYS 184.A SG ILE 179.A O no hydrogen 3.914 N/A CYS 184.A SG THR 181.A OG1 no hydrogen 3.338 N/A CYS 184.A SG ALA 189.A O no hydrogen 3.841 N/A LEU 185.A N THR 181.A O no hydrogen 3.177 N/A ILE 186.A N LYS 182.A O no hydrogen 3.064 N/A GLY 187.A N ASP 183.A O no hydrogen 2.953 N/A ALA 189.A N ASP 183.A O no hydrogen 3.202 N/A GLN 192.A NE2 ILE 190.A O no hydrogen 2.780 N/A