Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kxo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N ASP 56.A OD1 no hydrogen 3.031 N/A LYS 4.A N GLU 54.A O no hydrogen 3.000 N/A LEU 5.A N GLU 29.A O no hydrogen 2.824 N/A THR 6.A N ILE 52.A O no hydrogen 3.031 N/A TYR 7.A N HIS 31.A O no hydrogen 3.114 N/A MET 10.A N PHE 8.A O no hydrogen 2.839 N/A ARG 11.A N LEU 198.A O no hydrogen 2.852 N/A ARG 11.A NH1 THR 196.A O no hydrogen 2.814 N/A ARG 11.A NH1 LYS 197.A O no hydrogen 3.492 N/A ARG 11.A NH2 LYS 197.A O no hydrogen 3.054 N/A GLY 12.A N LEU 198.A OXT no hydrogen 2.822 N/A ARG 13.A N TYR 7.A OH no hydrogen 3.107 N/A ARG 13.A NH1 SER 99.A OG no hydrogen 3.411 N/A ALA 14.A N ARG 11.A O no hydrogen 3.244 N/A ARG 18.A N ALA 14.A O no hydrogen 3.116 N/A ARG 18.A NE ASP 30.A OD2 no hydrogen 2.859 N/A ARG 18.A NH1 MET 10.A O no hydrogen 2.922 N/A ARG 18.A NH1 ARG 11.A O no hydrogen 3.284 N/A ARG 18.A NH1 GLU 15.A OE1 no hydrogen 2.895 N/A ARG 18.A NH2 MET 10.A O no hydrogen 3.395 N/A TYR 19.A N GLU 15.A O no hydrogen 2.822 N/A TYR 19.A OH GLU 153.A OE1 no hydrogen 2.561 N/A ILE 20.A N ILE 16.A O no hydrogen 3.137 N/A PHE 21.A N ILE 17.A O no hydrogen 2.958 N/A ALA 22.A N ARG 18.A O no hydrogen 3.137 N/A TYR 23.A N TYR 19.A O no hydrogen 2.775 N/A TYR 23.A OH ASP 75.A OD2 no hydrogen 2.587 N/A LEU 24.A N ILE 20.A O no hydrogen 2.888 N/A ASP 25.A N ALA 22.A O no hydrogen 2.953 N/A ILE 26.A N PHE 21.A O no hydrogen 2.849 N/A GLU 29.A N TYR 3.A O no hydrogen 2.811 N/A HIS 31.A N LEU 5.A O no hydrogen 2.706 N/A ARG 32.A NE ASP 30.A OD1 no hydrogen 2.995 N/A ARG 32.A NH1 ASN 9.A OD1 no hydrogen 3.105 N/A ARG 32.A NH2 ASP 30.A OD1 no hydrogen 3.033 N/A ILE 33.A N TYR 7.A O no hydrogen 3.001 N/A ASP 37.A N GLU 34.A O no hydrogen 2.786 N/A TRP 38.A N GLN 35.A O no hydrogen 3.346 N/A GLU 40.A N GLU 40.A OE1 no hydrogen 2.635 N/A ILE 41.A N ASP 37.A O no hydrogen 3.117 N/A LYS 42.A N TRP 38.A O no hydrogen 2.889 N/A LYS 42.A NZ GLY 48.A O no hydrogen 2.632 N/A SER 43.A OG GLU 40.A O no hydrogen 2.932 N/A THR 44.A N ILE 41.A O no hydrogen 3.057 N/A THR 44.A OG1 ILE 41.A O no hydrogen 2.545 N/A LEU 45.A N LYS 42.A O no hydrogen 3.308 N/A ILE 52.A N THR 6.A O no hydrogen 3.219 N/A LEU 53.A N LEU 60.A O no hydrogen 2.824 N/A GLU 54.A N LYS 4.A O no hydrogen 2.929 N/A VAL 55.A N LEU 58.A O no hydrogen 2.774 N/A ASP 56.A N ASN 2.A O no hydrogen 3.344 N/A LEU 58.A N VAL 55.A O no hydrogen 3.294 N/A LEU 60.A N LEU 53.A O no hydrogen 2.758 N/A ILE 66.A N GLN 62.A O no hydrogen 3.008 N/A ALA 67.A N SER 63.A O no hydrogen 2.862 N/A ARG 68.A N LEU 64.A O no hydrogen 2.952 N/A ARG 68.A NE ASP 88.A OD1 no hydrogen 2.870 N/A ARG 68.A NH2 ASP 88.A OD1 no hydrogen 3.338 N/A TYR 69.A N ALA 65.A O no hydrogen 3.076 N/A LEU 70.A N ILE 66.A O no hydrogen 2.959 N/A THR 71.A N ALA 67.A O no hydrogen 3.110 N/A THR 71.A OG1 ALA 67.A O no hydrogen 3.009 N/A THR 71.A OG1 ARG 68.A O no hydrogen 3.223 N/A LYS 72.A N TYR 69.A O no hydrogen 3.364 N/A THR 74.A N THR 71.A O no hydrogen 3.057 N/A THR 74.A OG1 THR 71.A O no hydrogen 2.711 N/A LEU 76.A N THR 74.A OG1 no hydrogen 3.202 N/A ALA 77.A N THR 74.A O no hydrogen 3.346 N/A ASN 79.A N GLU 83.A OE2 no hydrogen 2.895 N/A ASN 79.A ND2 GLU 83.A OE2 no hydrogen 3.444 N/A GLU 83.A N THR 80.A OG1 no hydrogen 2.918 N/A GLN 84.A N THR 80.A O no hydrogen 3.015 N/A GLN 84.A NE2 GLY 78.A O no hydrogen 2.721 N/A CYS 85.A N GLU 81.A O no hydrogen 3.053 N/A HIS 86.A N MET 82.A O no hydrogen 3.008 N/A VAL 87.A N GLU 83.A O no hydrogen 2.810 N/A ASP 88.A N GLN 84.A O no hydrogen 2.957 N/A ALA 89.A N CYS 85.A O no hydrogen 2.793 N/A ILE 90.A N HIS 86.A O no hydrogen 3.006 N/A VAL 91.A N VAL 87.A O no hydrogen 2.972 N/A ASP 92.A N ASP 88.A O no hydrogen 3.001 N/A THR 93.A N ALA 89.A O no hydrogen 2.932 N/A THR 93.A OG1 ALA 89.A O no hydrogen 3.090 N/A LEU 94.A N ILE 90.A O no hydrogen 3.051 N/A ASP 95.A N VAL 91.A O no hydrogen 2.883 N/A ASP 96.A N ASP 92.A O no hydrogen 2.716 N/A PHE 97.A N THR 93.A O no hydrogen 3.415 N/A MET 98.A N LEU 94.A O no hydrogen 3.086 N/A SER 99.A N ASP 95.A O no hydrogen 2.945 N/A SER 99.A OG ASP 95.A O no hydrogen 2.817 N/A CYS 100.A N PHE 97.A O no hydrogen 3.211 N/A CYS 100.A SG ASP 96.A O no hydrogen 3.400 N/A PHE 101.A N MET 98.A O no hydrogen 3.412 N/A TRP 103.A NE1 MET 98.A O no hydrogen 3.065 N/A GLU 105.A N PRO 102.A O no hydrogen 3.303 N/A LYS 107.A N GLU 105.A OE2 no hydrogen 2.713 N/A LYS 111.A N LYS 107.A O no hydrogen 2.930 N/A GLU 112.A N GLN 108.A O no hydrogen 2.861 N/A GLN 113.A N ASP 109.A O no hydrogen 3.030 N/A GLN 113.A NE2 GLU 117.A OE1 no hydrogen 2.732 N/A MET 114.A N VAL 110.A O no hydrogen 3.096 N/A PHE 115.A N LYS 111.A O no hydrogen 2.913 N/A ASN 116.A N GLU 112.A O no hydrogen 3.045 N/A GLU 117.A N GLN 113.A O no hydrogen 2.918 N/A LEU 118.A N MET 114.A O no hydrogen 2.980 N/A LEU 119.A N PHE 115.A O no hydrogen 2.923 N/A THR 120.A N ASN 116.A O no hydrogen 2.897 N/A THR 120.A OG1 ASN 116.A O no hydrogen 2.515 N/A TYR 121.A N GLU 117.A O no hydrogen 2.901 N/A ASN 122.A ND2 GLU 117.A O no hydrogen 3.605 N/A ALA 123.A N LEU 118.A O no hydrogen 2.784 N/A LEU 126.A N ASN 122.A O no hydrogen 3.308 N/A MET 127.A N ALA 123.A O no hydrogen 2.873 N/A GLN 128.A N PRO 124.A O no hydrogen 2.940 N/A ASP 129.A N HIS 125.A O no hydrogen 2.937 N/A LEU 130.A N LEU 126.A O no hydrogen 2.931 N/A ASP 131.A N MET 127.A O no hydrogen 3.007 N/A THR 132.A N GLN 128.A O no hydrogen 3.139 N/A THR 132.A OG1 GLN 128.A O no hydrogen 3.103 N/A TYR 133.A N ASP 129.A O no hydrogen 2.958 N/A LEU 134.A N LEU 130.A O no hydrogen 2.752 N/A GLY 135.A N ASP 131.A O no hydrogen 2.887 N/A ARG 137.A N LEU 134.A O no hydrogen 3.184 N/A ARG 137.A NH1 LEU 140.A O no hydrogen 3.097 N/A ARG 137.A NH2 TYR 133.A O no hydrogen 2.977 N/A ARG 137.A NH2 LEU 140.A O no hydrogen 2.824 N/A LEU 140.A N ASP 149.A OD2 no hydrogen 2.905 N/A SER 144.A OG ASN 143.A OD1 no hydrogen 3.513 N/A THR 146.A N ASP 149.A OD1 no hydrogen 2.893 N/A TRP 147.A N LEU 76.A O no hydrogen 3.156 N/A ASP 149.A N THR 146.A O no hydrogen 2.983 N/A PHE 150.A N THR 146.A O no hydrogen 3.472 N/A TYR 151.A N TRP 147.A O no hydrogen 2.984 N/A TYR 151.A OH ASP 95.A OD1 no hydrogen 2.651 N/A TRP 152.A N ALA 148.A O no hydrogen 2.884 N/A GLU 153.A N ASP 149.A O no hydrogen 3.100 N/A ILE 154.A N PHE 150.A O no hydrogen 2.896 N/A CYS 155.A N TYR 151.A O no hydrogen 2.933 N/A CYS 155.A SG TYR 151.A O no hydrogen 3.307 N/A SER 156.A N TRP 152.A O no hydrogen 3.024 N/A SER 156.A OG TRP 152.A O no hydrogen 2.776 N/A SER 156.A OG GLU 153.A O no hydrogen 3.264 N/A THR 157.A N GLU 153.A O no hydrogen 3.065 N/A THR 157.A OG1 GLU 153.A O no hydrogen 2.917 N/A THR 157.A OG1 GLU 153.A OE2 no hydrogen 3.422 N/A THR 158.A N ILE 154.A O no hydrogen 3.419 N/A LEU 159.A N CYS 155.A O no hydrogen 2.976 N/A LEU 160.A N SER 156.A O no hydrogen 2.836 N/A VAL 161.A N THR 158.A O no hydrogen 3.114 N/A PHE 162.A N LEU 159.A O no hydrogen 3.012 N/A LYS 163.A N LEU 159.A O no hydrogen 2.857 N/A LYS 163.A NZ ASP 165.A OD1 no hydrogen 2.799 N/A LEU 166.A N LYS 163.A O no hydrogen 3.105 N/A ASP 168.A N ASP 165.A O no hydrogen 3.172 N/A HIS 170.A N LEU 167.A O no hydrogen 2.908 N/A HIS 170.A ND1 ASP 131.A OD1 no hydrogen 2.832 N/A ARG 172.A NE ASP 131.A OD2 no hydrogen 3.118 N/A ARG 172.A NH2 ASP 131.A OD2 no hydrogen 3.284 N/A LEU 173.A N HIS 170.A O no hydrogen 3.053 N/A VAL 174.A N HIS 170.A O no hydrogen 3.162 N/A THR 175.A N PRO 171.A O no hydrogen 2.863 N/A THR 175.A OG1 PRO 171.A O no hydrogen 3.178 N/A LEU 176.A N ARG 172.A O no hydrogen 3.212 N/A ARG 177.A N LEU 173.A O no hydrogen 3.103 N/A ARG 177.A NH1 SER 156.A OG no hydrogen 2.851 N/A ARG 177.A NH1 THR 157.A OG1 no hydrogen 3.123 N/A LYS 178.A N VAL 174.A O no hydrogen 3.086 N/A LYS 179.A N THR 175.A O no hydrogen 2.935 N/A VAL 180.A N LEU 176.A O no hydrogen 3.050 N/A GLN 181.A N ARG 177.A O no hydrogen 3.031 N/A GLN 181.A NE2 GLU 153.A OE2 no hydrogen 2.742 N/A ALA 182.A N LYS 178.A O no hydrogen 2.906 N/A ALA 182.A N LYS 179.A O no hydrogen 3.215 N/A ILE 183.A N VAL 180.A O no hydrogen 3.220 N/A ALA 187.A N ILE 183.A O no hydrogen 2.750 N/A ASN 188.A N PRO 184.A O no hydrogen 2.850 N/A TRP 189.A N ALA 185.A O no hydrogen 3.145 N/A TRP 189.A NE1 GLU 15.A OE2 no hydrogen 2.884 N/A ILE 190.A N VAL 186.A O no hydrogen 2.890 N/A LYS 191.A N ALA 187.A O no hydrogen 3.083 N/A LYS 191.A NZ ASN 188.A OD1 no hydrogen 2.791 N/A ARG 192.A N ASN 188.A O no hydrogen 3.096 N/A ARG 192.A N TRP 189.A O no hydrogen 3.086 N/A ARG 192.A NE ASN 188.A OD1 no hydrogen 2.877 N/A ARG 193.A N TRP 189.A O no hydrogen 2.784 N/A ARG 193.A NH1 GLU 15.A OE2 no hydrogen 2.885 N/A ARG 193.A NH1 TYR 19.A OH no hydrogen 3.049 N/A GLN 195.A NE2 ILE 190.A O no hydrogen 3.645 N/A GLN 195.A NE2 ARG 193.A O no hydrogen 3.056 N/A THR 196.A OG1 LEU 198.A O no hydrogen 2.651 N/A