Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kfx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 ALA 89.A O no hydrogen 2.879 N/A ARG 2.A NH1 GLU 90.A O no hydrogen 3.241 N/A ARG 2.A NH2 ALA 89.A O no hydrogen 2.392 N/A LYS 4.A N PRO 92.A O no hydrogen 3.216 N/A LYS 4.A NZ LEU 230.A OXT no hydrogen 2.976 N/A LYS 5.A N ASP 143.A OD2 no hydrogen 2.708 N/A LYS 5.A NZ SER 139.A O no hydrogen 2.924 N/A LYS 5.A NZ GLU 141.A O no hydrogen 2.840 N/A ILE 6.A N LEU 94.A O no hydrogen 3.035 N/A SER 7.A N GLY 144.A O no hydrogen 3.087 N/A SER 7.A OG GLU 9.A OE1 no hydrogen 2.560 N/A ILE 8.A N PHE 96.A O no hydrogen 2.839 N/A GLU 9.A N ILE 146.A O no hydrogen 2.725 N/A ASN 11.A ND2 LEU 175.A O no hydrogen 2.879 N/A ILE 12.A N ASN 11.A OD1 no hydrogen 2.717 N/A ALA 14.A N ASN 11.A O no hydrogen 3.114 N/A LYS 16.A NZ GLY 10.A O no hydrogen 3.413 N/A LYS 16.A NZ ASN 11.A O no hydrogen 2.872 N/A SER 17.A OG GLU 97.A OE1 no hydrogen 2.999 N/A SER 17.A OG GLU 97.A OE2 no hydrogen 2.946 N/A PHE 19.A N GLY 15.A O no hydrogen 2.886 N/A VAL 20.A N LYS 16.A O no hydrogen 2.983 N/A ASN 21.A N SER 17.A O no hydrogen 2.997 N/A ILE 22.A N THR 18.A O no hydrogen 3.166 N/A LEU 23.A N PHE 19.A O no hydrogen 2.828 N/A LYS 24.A N VAL 20.A O no hydrogen 2.937 N/A LYS 24.A NZ GLU 31.A OE2 no hydrogen 3.429 N/A GLN 25.A N ILE 22.A O no hydrogen 3.169 N/A GLN 25.A NE2 ASN 21.A O no hydrogen 2.878 N/A LEU 26.A N LEU 23.A O no hydrogen 2.862 N/A TRP 30.A N SER 27.A O no hydrogen 3.149 N/A GLU 31.A N VAL 93.A O no hydrogen 3.011 N/A VAL 33.A N PHE 95.A O no hydrogen 2.791 N/A GLU 35.A N GLU 97.A OE1 no hydrogen 3.165 N/A VAL 37.A N GLU 35.A O no hydrogen 2.792 N/A ARG 39.A N PRO 36.A O no hydrogen 3.044 N/A ARG 39.A NH1 GLN 44.A O no hydrogen 2.849 N/A ARG 39.A NH2 GLN 44.A O no hydrogen 3.204 N/A TRP 40.A N PRO 36.A O no hydrogen 3.378 N/A TRP 40.A NE1 SER 73.A OG no hydrogen 2.727 N/A SER 41.A N VAL 37.A O no hydrogen 3.033 N/A SER 41.A OG VAL 37.A O no hydrogen 3.252 N/A SER 41.A OG ALA 38.A O no hydrogen 3.468 N/A ASN 42.A N ALA 38.A O no hydrogen 2.987 N/A VAL 43.A N GLY 49.A O no hydrogen 2.751 N/A ASN 50.A ND2 GLU 166.A OE2 no hydrogen 2.956 N/A VAL 51.A N TRP 40.A O no hydrogen 2.995 N/A LEU 52.A N TRP 40.A O no hydrogen 3.260 N/A GLN 53.A N ASN 50.A OD1 no hydrogen 3.066 N/A MET 54.A N ASN 50.A O no hydrogen 3.022 N/A MET 55.A N VAL 51.A O no hydrogen 2.963 N/A TYR 56.A N LEU 52.A O no hydrogen 3.087 N/A GLU 57.A N GLN 53.A O no hydrogen 2.818 N/A LYS 58.A N MET 54.A O no hydrogen 2.765 N/A ARG 61.A N LYS 58.A O no hydrogen 3.124 N/A ARG 61.A NH1 ARG 61.A O no hydrogen 2.926 N/A TRP 62.A N LYS 58.A O no hydrogen 2.917 N/A SER 63.A N PRO 59.A O no hydrogen 3.104 N/A SER 63.A OG PRO 59.A O no hydrogen 2.622 N/A PHE 66.A N TRP 62.A O no hydrogen 2.968 N/A GLN 67.A N SER 63.A O no hydrogen 2.765 N/A THR 68.A N PHE 64.A O no hydrogen 2.911 N/A THR 68.A OG1 PHE 64.A O no hydrogen 3.124 N/A TYR 69.A N THR 65.A O no hydrogen 2.987 N/A ALA 70.A N PHE 66.A O no hydrogen 2.824 N/A CYS 71.A N GLN 67.A O no hydrogen 3.121 N/A CYS 71.A SG ASP 103.A OD2 no hydrogen 3.499 N/A LEU 72.A N THR 68.A O no hydrogen 2.927 N/A SER 73.A N TYR 69.A O no hydrogen 2.801 N/A SER 73.A OG TYR 69.A O no hydrogen 3.001 N/A SER 73.A OG ALA 70.A O no hydrogen 3.104 N/A ARG 74.A N ALA 70.A O no hydrogen 2.983 N/A ARG 74.A NE ASP 103.A OD1 no hydrogen 3.384 N/A ARG 74.A NE ASP 103.A OD2 no hydrogen 2.676 N/A ARG 74.A NH1 GLU 97.A O no hydrogen 2.701 N/A ARG 74.A NH2 GLU 35.A OE1 no hydrogen 3.048 N/A ARG 74.A NH2 ASP 103.A OD1 no hydrogen 2.831 N/A ILE 75.A N CYS 71.A O no hydrogen 2.981 N/A ARG 76.A N LEU 72.A O no hydrogen 3.011 N/A ALA 77.A N SER 73.A O no hydrogen 2.968 N/A GLN 78.A N ARG 74.A O no hydrogen 2.842 N/A GLN 78.A NE2 ARG 98.A O no hydrogen 3.180 N/A LEU 79.A N ILE 75.A O no hydrogen 3.008 N/A ALA 80.A N ARG 76.A O no hydrogen 3.084 N/A SER 81.A N ALA 77.A O no hydrogen 3.211 N/A LEU 82.A N GLN 78.A O no hydrogen 3.205 N/A ASN 83.A N LEU 79.A O no hydrogen 3.019 N/A GLY 84.A N ALA 80.A O no hydrogen 3.146 N/A LYS 85.A N SER 81.A O no hydrogen 3.282 N/A LYS 85.A NZ ALA 80.A O no hydrogen 2.814 N/A LYS 91.A N ASP 29.A OD2 no hydrogen 2.987 N/A LYS 91.A NZ GLU 90.A OE2 no hydrogen 2.970 N/A VAL 93.A N ASP 29.A O no hydrogen 2.979 N/A LEU 94.A N LYS 4.A O no hydrogen 2.753 N/A PHE 95.A N GLU 31.A O no hydrogen 2.795 N/A PHE 96.A N ILE 6.A O no hydrogen 2.728 N/A GLU 97.A N VAL 33.A O no hydrogen 2.901 N/A ARG 98.A N ILE 8.A O no hydrogen 2.946 N/A ARG 98.A NE GLY 10.A O no hydrogen 3.152 N/A ARG 98.A NH1 GLU 35.A OE1 no hydrogen 2.951 N/A ARG 98.A NH2 GLY 10.A O no hydrogen 2.902 N/A SER 99.A N SER 102.A OG no hydrogen 3.191 N/A SER 99.A OG GLU 9.A OE1 no hydrogen 2.677 N/A SER 99.A OG SER 102.A OG no hydrogen 3.420 N/A TYR 101.A OH TYR 197.A OH no hydrogen 2.502 N/A SER 102.A N SER 99.A OG no hydrogen 3.393 N/A SER 102.A OG GLU 9.A OE1 no hydrogen 3.499 N/A SER 102.A OG GLU 9.A OE2 no hydrogen 2.738 N/A SER 102.A OG SER 99.A O no hydrogen 3.099 N/A SER 102.A OG SER 99.A OG no hydrogen 3.420 N/A ASP 103.A N SER 99.A O no hydrogen 3.165 N/A ARG 104.A N VAL 100.A O no hydrogen 3.269 N/A ARG 104.A NH1 HIS 129.A ND1 no hydrogen 3.324 N/A ARG 104.A NH1 ASP 130.A OD1 no hydrogen 2.661 N/A ARG 104.A NH2 ASP 130.A OD1 no hydrogen 3.508 N/A TYR 105.A N TYR 101.A O no hydrogen 2.848 N/A ILE 106.A N SER 102.A O no hydrogen 3.208 N/A PHE 107.A N SER 102.A O no hydrogen 3.011 N/A ALA 108.A N ASP 103.A O no hydrogen 2.796 N/A SER 109.A N ARG 104.A O no hydrogen 2.979 N/A SER 109.A OG GLU 113.A OE2 no hydrogen 3.466 N/A ASN 110.A N ILE 106.A O no hydrogen 3.022 N/A LEU 111.A N PHE 107.A O no hydrogen 3.150 N/A TYR 112.A N ALA 108.A O no hydrogen 2.990 N/A TYR 112.A OH GLU 119.A OE1 no hydrogen 2.668 N/A TYR 112.A OH GLU 119.A OE2 no hydrogen 3.115 N/A GLU 113.A N SER 109.A O no hydrogen 2.879 N/A SER 114.A N ASN 110.A O no hydrogen 2.866 N/A SER 114.A OG ASN 110.A O no hydrogen 2.621 N/A GLU 115.A N TYR 112.A O no hydrogen 3.060 N/A SER 116.A N LEU 111.A O no hydrogen 2.728 N/A MET 117.A N LEU 111.A O no hydrogen 3.370 N/A ASN 118.A N GLU 121.A OE1 no hydrogen 2.778 N/A GLU 121.A N ASN 118.A OD1 no hydrogen 2.850 N/A TRP 122.A N ASN 118.A O no hydrogen 2.918 N/A THR 123.A N GLU 119.A O no hydrogen 2.888 N/A THR 123.A OG1 GLU 119.A O no hydrogen 2.840 N/A ILE 124.A N THR 120.A O no hydrogen 2.940 N/A TYR 125.A N GLU 121.A O no hydrogen 2.886 N/A GLN 126.A N TRP 122.A O no hydrogen 2.911 N/A GLN 126.A NE2 TRP 122.A O no hydrogen 3.263 N/A ASP 127.A N THR 123.A O no hydrogen 2.902 N/A TRP 128.A N ILE 124.A O no hydrogen 2.816 N/A HIS 129.A N TYR 125.A O no hydrogen 2.785 N/A HIS 129.A NE2 VAL 100.A O no hydrogen 2.845 N/A ASP 130.A N GLN 126.A O no hydrogen 2.922 N/A TRP 131.A N ASP 127.A O no hydrogen 3.044 N/A MET 132.A N TRP 128.A O no hydrogen 2.811 N/A ASN 133.A N HIS 129.A O no hydrogen 2.970 N/A ASN 133.A ND2 HIS 129.A O no hydrogen 2.999 N/A ASN 134.A N ASP 130.A O no hydrogen 2.883 N/A GLN 135.A N TRP 131.A O no hydrogen 3.344 N/A PHE 136.A N MET 132.A O no hydrogen 3.343 N/A LEU 140.A N GLY 137.A O no hydrogen 3.291 N/A GLU 141.A N GLN 138.A O no hydrogen 3.361 N/A LEU 142.A N TYR 197.A OH no hydrogen 2.858 N/A ASP 143.A N LYS 5.A O no hydrogen 2.618 N/A ILE 145.A N PRO 202.A O no hydrogen 3.008 N/A ILE 146.A N SER 7.A O no hydrogen 2.659 N/A TYR 147.A N LEU 204.A O no hydrogen 2.865 N/A TYR 147.A OH GLU 183.A OE2 no hydrogen 2.578 N/A LEU 148.A N GLU 9.A O no hydrogen 2.779 N/A GLN 149.A N LEU 206.A O no hydrogen 2.735 N/A GLN 149.A NE2 GLU 183.A OE1 no hydrogen 3.327 N/A GLN 149.A NE2 GLU 183.A OE2 no hydrogen 2.674 N/A THR 151.A N ASN 209.A OD1 no hydrogen 2.898 N/A THR 151.A OG1 THR 154.A OG1 no hydrogen 2.990 N/A THR 151.A OG1 ASN 209.A OD1 no hydrogen 3.523 N/A GLU 153.A N GLU 153.A OE1 no hydrogen 2.717 N/A THR 154.A N THR 151.A OG1 no hydrogen 2.954 N/A THR 154.A OG1 THR 151.A OG1 no hydrogen 2.990 N/A THR 154.A OG1 ASN 209.A OD1 no hydrogen 2.718 N/A CYS 155.A N THR 151.A O no hydrogen 2.963 N/A CYS 155.A SG THR 151.A O no hydrogen 3.393 N/A LEU 156.A N PRO 152.A O no hydrogen 2.846 N/A HIS 157.A N GLU 153.A O no hydrogen 3.110 N/A ARG 158.A N THR 154.A O no hydrogen 3.061 N/A ARG 158.A NH1 ALA 14.A O no hydrogen 2.884 N/A ARG 158.A NH1 VAL 208.A O no hydrogen 2.810 N/A ARG 158.A NH2 VAL 208.A O no hydrogen 3.056 N/A ARG 158.A NH2 GLU 210.A O no hydrogen 3.273 N/A ILE 159.A N CYS 155.A O no hydrogen 2.901 N/A TYR 160.A N LEU 156.A O no hydrogen 3.215 N/A LEU 161.A N HIS 157.A O no hydrogen 2.891 N/A ARG 162.A N ARG 158.A O no hydrogen 2.770 N/A ARG 162.A NH2 GLU 167.A OE1 no hydrogen 2.772 N/A GLY 163.A N ILE 159.A O no hydrogen 3.053 N/A ARG 164.A NH1 GLU 167.A OE2 no hydrogen 2.848 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.686 N/A GLU 167.A N ARG 164.A O no hydrogen 3.027 N/A GLN 168.A N ASN 165.A O no hydrogen 3.194 N/A GLN 168.A NE2 ILE 159.A O no hydrogen 3.005 N/A GLN 168.A NE2 ARG 164.A O no hydrogen 3.040 N/A ILE 170.A N GLU 167.A O no hydrogen 3.112 N/A TYR 174.A N PRO 171.A O no hydrogen 3.126 N/A GLU 176.A N LEU 172.A O no hydrogen 2.905 N/A LYS 177.A N GLU 173.A O no hydrogen 3.101 N/A LEU 178.A N TYR 174.A O no hydrogen 3.148 N/A HIS 179.A N LEU 175.A O no hydrogen 2.836 N/A TYR 180.A N GLU 176.A O no hydrogen 2.947 N/A LYS 181.A N LYS 177.A O no hydrogen 3.289 N/A LYS 181.A NZ SER 109.A OG no hydrogen 3.396 N/A LYS 181.A NZ GLU 113.A OE1 no hydrogen 3.113 N/A HIS 182.A N LEU 178.A O no hydrogen 3.003 N/A HIS 182.A ND1 LEU 178.A O no hydrogen 2.866 N/A GLU 183.A N HIS 179.A O no hydrogen 2.901 N/A SER 184.A N TYR 180.A O no hydrogen 2.902 N/A SER 184.A OG THR 190.A OG1 no hydrogen 3.030 N/A TRP 185.A N LYS 181.A O no hydrogen 2.866 N/A LEU 186.A N HIS 182.A O no hydrogen 2.736 N/A LEU 187.A N GLU 183.A O no hydrogen 2.881 N/A HIS 188.A N GLU 183.A O no hydrogen 2.751 N/A ARG 189.A NH1 VAL 201.A O no hydrogen 3.152 N/A ARG 189.A NH2 LEU 198.A O no hydrogen 2.976 N/A THR 190.A N SER 184.A O no hydrogen 2.743 N/A THR 190.A OG1 SER 184.A O no hydrogen 3.360 N/A THR 190.A OG1 SER 184.A OG no hydrogen 3.030 N/A LEU 191.A N SER 184.A O no hydrogen 3.255 N/A LYS 192.A NZ ARG 189.A O no hydrogen 2.828 N/A ASN 194.A N TYR 105.A OH no hydrogen 2.917 N/A PHE 195.A N THR 193.A OG1 no hydrogen 2.989 N/A TYR 197.A OH TYR 101.A OH no hydrogen 2.502 N/A LEU 198.A N PHE 195.A O no hydrogen 3.144 N/A GLU 200.A N TYR 197.A O no hydrogen 3.104 N/A VAL 201.A N LEU 198.A O no hydrogen 2.878 N/A LEU 204.A N ILE 145.A O no hydrogen 2.940 N/A LEU 206.A N TYR 147.A O no hydrogen 2.850 N/A VAL 208.A N GLN 149.A O no hydrogen 2.796 N/A ASN 209.A N ASP 207.A OD2 no hydrogen 3.274 N/A ASN 209.A ND2 ASP 207.A OD2 no hydrogen 2.852 N/A LYS 213.A NZ ASP 211.A OD1 no hydrogen 3.079 N/A ASP 214.A N ASP 211.A O no hydrogen 3.058 N/A LYS 215.A NZ ASP 207.A O no hydrogen 3.562 N/A SER 218.A OG LYS 215.A O no hydrogen 2.818 N/A VAL 220.A N TYR 216.A O no hydrogen 3.237 N/A VAL 220.A N GLU 217.A O no hydrogen 3.260 N/A GLU 221.A N GLU 217.A O no hydrogen 3.262 N/A LYS 222.A N SER 218.A O no hydrogen 2.872 N/A VAL 223.A N LEU 219.A O no hydrogen 3.060 N/A LYS 224.A N VAL 220.A O no hydrogen 2.987 N/A GLU 225.A N GLU 221.A O no hydrogen 3.044 N/A PHE 226.A N LYS 222.A O no hydrogen 3.077 N/A LEU 227.A N VAL 223.A O no hydrogen 3.026 N/A SER 228.A N GLU 225.A O no hydrogen 3.122 N/A SER 228.A OG LYS 224.A O no hydrogen 3.274 N/A THR 229.A N PHE 226.A O no hydrogen 3.090 N/A THR 229.A OG1 PHE 226.A O no hydrogen 2.597 N/A LEU 230.A N LEU 227.A O no hydrogen 3.303 N/A