Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n6n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ GLN 113.A O no hydrogen 3.537 N/A HIS 4.A ND1 GLY 258.A O no hydrogen 2.715 N/A TRP 5.A N HIS 115.A O no hydrogen 2.841 N/A TRP 5.A NE1 ASP 114.A OD2 no hydrogen 2.893 N/A VAL 6.A N GLN 40.A O no hydrogen 2.946 N/A VAL 7.A N PHE 117.A O no hydrogen 2.950 N/A ILE 8.A N VAL 42.A O no hydrogen 2.847 N/A VAL 9.A N TYR 119.A O no hydrogen 2.864 N/A ALA 10.A N MET 44.A O no hydrogen 2.926 N/A GLY 11.A N THR 121.A O no hydrogen 3.106 N/A SER 12.A OG HIS 20.A ND1 no hydrogen 2.689 N/A GLY 14.A N ASP 48.A OD2 no hydrogen 2.836 N/A TRP 15.A NE1 ARG 198.A O no hydrogen 2.865 N/A ASN 17.A N GLY 14.A O no hydrogen 3.069 N/A ASN 17.A ND2 ASN 13.A O no hydrogen 2.804 N/A TYR 18.A N TRP 15.A O no hydrogen 2.999 N/A ARG 19.A NE ASP 204.A OD2 no hydrogen 2.988 N/A HIS 20.A N ASN 17.A O no hydrogen 3.114 N/A HIS 20.A ND1 SER 12.A OG no hydrogen 2.689 N/A GLN 21.A NE2 ASP 48.A OD1 no hydrogen 2.927 N/A ALA 22.A N TYR 18.A O no hydrogen 3.023 N/A ASP 23.A N ARG 19.A O no hydrogen 2.710 N/A ALA 24.A N HIS 20.A O no hydrogen 3.104 N/A CYS 25.A N GLN 21.A O no hydrogen 2.965 N/A CYS 25.A SG GLN 21.A O no hydrogen 3.254 N/A HIS 26.A N ALA 22.A O no hydrogen 3.006 N/A HIS 26.A ND1 ASN 63.A OD1 no hydrogen 2.677 N/A HIS 26.A NE2 ASP 215.A OD2 no hydrogen 2.675 N/A ALA 27.A N ASP 23.A O no hydrogen 2.935 N/A TYR 28.A N ALA 24.A O no hydrogen 3.055 N/A TYR 28.A OH ASP 38.A OD1 no hydrogen 2.702 N/A TYR 28.A OH GLY 73.A O no hydrogen 3.260 N/A GLN 29.A N CYS 25.A O no hydrogen 3.137 N/A GLN 29.A NE2 VAL 70.A O no hydrogen 2.763 N/A GLN 29.A NE2 GLN 72.A O no hydrogen 2.842 N/A ILE 30.A N HIS 26.A O no hydrogen 3.189 N/A ILE 31.A N ALA 27.A O no hydrogen 3.192 N/A HIS 32.A N TYR 28.A O no hydrogen 2.805 N/A ARG 33.A N GLN 29.A O no hydrogen 2.980 N/A ARG 33.A NH2 ASP 215.A OD1 no hydrogen 2.753 N/A ASN 34.A N ILE 30.A O no hydrogen 3.058 N/A ASN 34.A ND2 GLN 257.A O no hydrogen 3.107 N/A GLY 35.A N HIS 32.A O no hydrogen 3.161 N/A ILE 36.A N ILE 31.A O no hydrogen 3.351 N/A GLU 39.A N GLU 39.A OE1 no hydrogen 2.737 N/A GLN 40.A N PRO 37.A O no hydrogen 2.931 N/A GLN 40.A NE2 HIS 4.A O no hydrogen 2.780 N/A ILE 41.A N ASP 38.A O no hydrogen 3.083 N/A VAL 42.A N VAL 6.A O no hydrogen 2.914 N/A VAL 43.A N ASP 77.A OD2 no hydrogen 2.925 N/A MET 44.A N ILE 8.A O no hydrogen 2.800 N/A MET 45.A N TYR 78.A O no hydrogen 3.064 N/A ASP 47.A N GLN 21.A OE1 no hydrogen 2.762 N/A SER 52.A N ILE 49.A O no hydrogen 3.144 N/A ASP 54.A N SER 52.A OG no hydrogen 3.068 N/A ASN 55.A N SER 52.A O no hydrogen 3.082 N/A ASN 55.A ND2 ILE 49.A O no hydrogen 3.547 N/A ASN 55.A ND2 ALA 50.A O no hydrogen 2.807 N/A ASN 55.A ND2 ILE 60.A O no hydrogen 3.195 N/A THR 57.A N ASN 55.A OD1 no hydrogen 3.102 N/A THR 57.A OG1 ASN 55.A OD1 no hydrogen 3.334 N/A GLY 59.A N ALA 50.A O no hydrogen 2.722 N/A ILE 60.A N THR 57.A O no hydrogen 3.050 N/A VAL 61.A N ASP 69.A OD1 no hydrogen 2.986 N/A ILE 62.A N TYR 18.A OH no hydrogen 3.023 N/A ASN 63.A ND2 ASP 23.A OD1 no hydrogen 3.017 N/A ASN 63.A ND2 LEU 202.A O no hydrogen 2.919 N/A GLY 67.A N ARG 64.A O no hydrogen 2.992 N/A VAL 70.A N VAL 61.A O no hydrogen 2.892 N/A TYR 71.A N ASP 69.A OD1 no hydrogen 3.021 N/A TYR 71.A OH ASP 47.A OD1 no hydrogen 2.719 N/A GLN 72.A N ASP 69.A OD2 no hydrogen 3.041 N/A VAL 74.A N TYR 71.A O no hydrogen 3.155 N/A LYS 76.A NZ ASP 47.A OD2 no hydrogen 2.798 N/A LYS 76.A NZ TYR 71.A OH no hydrogen 2.749 N/A TYR 78.A N VAL 43.A O no hydrogen 3.284 N/A TYR 78.A OH LYS 106.A O no hydrogen 2.795 N/A GLY 80.A N TYR 46.A O no hydrogen 3.035 N/A ASP 82.A N THR 79.A O no hydrogen 3.133 N/A VAL 83.A N GLY 80.A O no hydrogen 3.272 N/A ASN 87.A N THR 84.A OG1 no hydrogen 3.100 N/A ASN 87.A ND2 ASP 82.A O no hydrogen 2.754 N/A PHE 88.A N THR 84.A O no hydrogen 3.008 N/A LEU 89.A N PRO 85.A O no hydrogen 2.920 N/A ALA 90.A N GLN 86.A O no hydrogen 3.020 N/A VAL 91.A N ASN 87.A O no hydrogen 3.035 N/A LEU 92.A N PHE 88.A O no hydrogen 3.113 N/A ARG 93.A N LEU 89.A O no hydrogen 2.893 N/A ARG 93.A NH2 ASP 95.A OD2 no hydrogen 2.909 N/A GLY 94.A N VAL 91.A O no hydrogen 3.216 N/A ASP 95.A N ALA 90.A O no hydrogen 2.832 N/A ALA 96.A N GLY 94.A O no hydrogen 3.092 N/A ALA 98.A N ASP 95.A O no hydrogen 3.274 N/A ALA 98.A N ASP 95.A OD1 no hydrogen 3.187 N/A LYS 100.A N GLU 97.A O no hydrogen 3.430 N/A ILE 102.A N VAL 99.A O no hydrogen 3.091 N/A SER 104.A N ASP 77.A O no hydrogen 2.943 N/A SER 104.A OG ASP 77.A O no hydrogen 3.518 N/A SER 104.A OG ASP 77.A OD1 no hydrogen 2.817 N/A GLY 105.A N ILE 102.A O no hydrogen 3.081 N/A LYS 106.A N SER 104.A OG no hydrogen 3.284 N/A LYS 106.A NZ ASP 38.A O no hydrogen 2.675 N/A LYS 106.A NZ ILE 41.A O no hydrogen 2.917 N/A LYS 106.A NZ ASP 77.A OD1 no hydrogen 3.117 N/A LEU 108.A N VAL 91.A O no hydrogen 2.942 N/A SER 110.A OG MET 152.A O no hydrogen 2.574 N/A GLY 111.A N ASP 114.A OD2 no hydrogen 3.012 N/A ASP 114.A N GLY 111.A O no hydrogen 3.123 N/A HIS 115.A N LYS 3.A O no hydrogen 2.914 N/A HIS 115.A ND1 GLN 255.A O no hydrogen 2.749 N/A VAL 116.A N LYS 155.A O no hydrogen 3.021 N/A PHE 117.A N TRP 5.A O no hydrogen 2.872 N/A ILE 118.A N VAL 157.A O no hydrogen 2.816 N/A TYR 119.A N VAL 7.A O no hydrogen 2.929 N/A TYR 119.A OH SER 207.A OG no hydrogen 2.656 N/A PHE 120.A N TYR 159.A O no hydrogen 3.080 N/A THR 121.A N VAL 9.A O no hydrogen 2.903 N/A THR 121.A OG1 ASP 23.A OD2 no hydrogen 3.076 N/A HIS 122.A NE2 ASN 17.A OD1 no hydrogen 2.773 N/A SER 124.A N ILE 127.A O no hydrogen 3.104 N/A THR 125.A OG1 GLU 163.A OE1 no hydrogen 2.865 N/A GLY 126.A N SER 166.A OG no hydrogen 2.848 N/A ILE 127.A N SER 124.A O no hydrogen 2.986 N/A LEU 128.A N LEU 135.A O no hydrogen 2.917 N/A VAL 129.A N HIS 122.A O no hydrogen 3.113 N/A PHE 130.A N GLU 133.A O no hydrogen 2.771 N/A GLU 133.A N PHE 130.A O no hydrogen 3.445 N/A LEU 135.A N LEU 128.A O no hydrogen 2.813 N/A VAL 137.A N GLY 126.A O no hydrogen 2.903 N/A ASP 139.A N HIS 136.A O no hydrogen 3.020 N/A LEU 140.A N HIS 136.A O no hydrogen 3.129 N/A ASN 141.A N VAL 137.A O no hydrogen 2.876 N/A GLU 142.A N LYS 138.A O no hydrogen 3.019 N/A THR 143.A N ASP 139.A O no hydrogen 3.146 N/A THR 143.A OG1 ASP 139.A O no hydrogen 2.949 N/A ILE 144.A N LEU 140.A O no hydrogen 2.960 N/A HIS 145.A N ASN 141.A O no hydrogen 3.120 N/A HIS 145.A ND1 ASN 141.A O no hydrogen 3.029 N/A TYR 146.A N GLU 142.A O no hydrogen 2.956 N/A MET 147.A N THR 143.A O no hydrogen 2.968 N/A TYR 148.A N ILE 144.A O no hydrogen 2.954 N/A LYS 149.A N HIS 145.A O no hydrogen 2.932 N/A HIS 150.A N TYR 146.A O no hydrogen 2.993 N/A HIS 150.A ND1 TYR 146.A O no hydrogen 2.989 N/A LYS 151.A N TYR 148.A O no hydrogen 3.179 N/A MET 152.A N MET 147.A O no hydrogen 3.013 N/A TYR 153.A OH ILE 175.A O no hydrogen 2.728 N/A ARG 154.A N ASP 114.A O no hydrogen 2.708 N/A ARG 154.A NH1 GLN 113.A OE1 no hydrogen 3.294 N/A LYS 155.A N ASP 114.A O no hydrogen 3.441 N/A MET 156.A N ASN 176.A O no hydrogen 3.012 N/A VAL 157.A N VAL 116.A O no hydrogen 2.811 N/A PHE 158.A N TYR 178.A O no hydrogen 2.974 N/A TYR 159.A N ILE 118.A O no hydrogen 2.851 N/A TYR 159.A OH GLN 227.A OE1 no hydrogen 2.646 N/A ILE 160.A N THR 180.A O no hydrogen 3.058 N/A GLU 161.A N PHE 120.A O no hydrogen 2.845 N/A SER 164.A N ALA 162.A O no hydrogen 3.274 N/A SER 164.A OG ALA 162.A O no hydrogen 2.962 N/A SER 164.A OG ALA 183.A O no hydrogen 3.406 N/A GLY 165.A N ALA 183.A O no hydrogen 2.866 N/A SER 166.A N GLU 163.A O no hydrogen 3.013 N/A SER 166.A OG GLU 163.A O no hydrogen 2.661 N/A MET 167.A N SER 164.A O no hydrogen 3.027 N/A MET 168.A N GLY 165.A O no hydrogen 3.148 N/A HIS 170.A ND1 ASN 169.A OD1 no hydrogen 3.081 N/A LEU 171.A N MET 168.A O no hydrogen 3.070 N/A TYR 178.A N MET 156.A O no hydrogen 2.950 N/A TYR 178.A OH GLN 242.A OE1 no hydrogen 2.728 N/A ALA 179.A N TYR 243.A O no hydrogen 3.008 N/A THR 180.A N PHE 158.A O no hydrogen 2.904 N/A THR 180.A OG1 TYR 206.A OH no hydrogen 2.638 N/A THR 181.A N MET 241.A O no hydrogen 2.952 N/A THR 181.A OG1 ALA 183.A O no hydrogen 2.862 N/A ALA 182.A N ILE 160.A O no hydrogen 2.868 N/A ALA 183.A N SER 164.A OG no hydrogen 3.035 N/A ASN 184.A N GLU 187.A OE2 no hydrogen 2.984 N/A ARG 186.A N ASN 184.A OD1 no hydrogen 2.883 N/A SER 188.A OG SER 189.A O no hydrogen 3.118 N/A SER 189.A OG GLU 161.A OE2 no hydrogen 2.814 N/A CYS 192.A N GLY 203.A O no hydrogen 2.790 N/A TYR 193.A OH GLU 212.A OE1 no hydrogen 3.321 N/A TYR 193.A OH GLU 212.A OE2 no hydrogen 2.800 N/A ASP 195.A N THR 200.A O no hydrogen 2.909 N/A ARG 198.A N ASP 195.A OD2 no hydrogen 3.009 N/A ARG 198.A NH1 ASP 195.A OD2 no hydrogen 2.920 N/A ARG 198.A NH2 THR 57.A OG1 no hydrogen 3.122 N/A SER 199.A OG GLU 196.A O no hydrogen 3.537 N/A THR 200.A N ASP 195.A O no hydrogen 3.372 N/A THR 200.A OG1 TRP 15.A O no hydrogen 3.339 N/A LEU 202.A N TYR 193.A O no hydrogen 2.878 N/A GLY 203.A N CYS 192.A O no hydrogen 3.275 N/A TRP 205.A N TYR 190.A O no hydrogen 3.159 N/A TYR 206.A OH THR 180.A OG1 no hydrogen 2.638 N/A SER 207.A N GLU 161.A OE1 no hydrogen 2.884 N/A SER 207.A OG ASP 23.A OD2 no hydrogen 3.385 N/A SER 207.A OG TYR 119.A OH no hydrogen 2.656 N/A SER 207.A OG GLU 161.A OE1 no hydrogen 2.599 N/A VAL 208.A N ASP 204.A O no hydrogen 2.809 N/A ASN 209.A N TRP 205.A O no hydrogen 2.839 N/A ASN 209.A ND2 THR 235.A OG1 no hydrogen 2.905 N/A TRP 210.A N TYR 206.A O no hydrogen 3.146 N/A MET 211.A N SER 207.A O no hydrogen 3.040 N/A GLU 212.A N VAL 208.A O no hydrogen 2.844 N/A ASP 213.A N ASN 209.A O no hydrogen 3.225 N/A SER 214.A N TRP 210.A O no hydrogen 2.934 N/A SER 214.A OG TRP 210.A O no hydrogen 3.283 N/A SER 214.A OG GLN 257.A OE1 no hydrogen 2.616 N/A ASP 215.A N MET 211.A O no hydrogen 2.915 N/A VAL 216.A N ASP 213.A O no hydrogen 3.041 N/A GLU 217.A N ASP 213.A O no hydrogen 2.936 N/A THR 220.A N ASP 218.A OD1 no hydrogen 2.936 N/A THR 220.A OG1 ASP 218.A OD1 no hydrogen 2.640 N/A LYS 221.A N ASP 218.A O no hydrogen 3.100 N/A GLU 222.A N ASP 218.A O no hydrogen 2.838 N/A LEU 224.A N MET 251.A O no hydrogen 2.995 N/A HIS 225.A N SER 249.A O no hydrogen 2.776 N/A LYS 226.A N THR 223.A OG1 no hydrogen 3.019 N/A GLN 227.A N THR 223.A O no hydrogen 3.015 N/A GLN 227.A NE2 ASP 213.A OD2 no hydrogen 2.912 N/A GLN 227.A NE2 SER 214.A OG no hydrogen 2.923 N/A TYR 228.A N LEU 224.A O no hydrogen 2.751 N/A TYR 228.A OH VAL 240.A O no hydrogen 2.847 N/A HIS 229.A N HIS 225.A O no hydrogen 3.041 N/A LEU 230.A N LYS 226.A O no hydrogen 2.990 N/A VAL 231.A N GLN 227.A O no hydrogen 2.892 N/A LYS 232.A N TYR 228.A O no hydrogen 2.786 N/A SER 233.A N HIS 229.A O no hydrogen 2.833 N/A SER 233.A OG HIS 229.A O no hydrogen 2.814 N/A HIS 234.A N LEU 230.A O no hydrogen 2.841 N/A THR 235.A N VAL 231.A O no hydrogen 2.881 N/A THR 235.A OG1 VAL 231.A O no hydrogen 2.674 N/A GLN 236.A NE2 SER 233.A O no hydrogen 3.347 N/A SER 238.A OG ALA 182.A O no hydrogen 2.644 N/A HIS 239.A N GLU 187.A OE2 no hydrogen 2.628 N/A HIS 239.A ND1 GLU 187.A OE1 no hydrogen 2.807 N/A MET 241.A N THR 181.A O no hydrogen 3.043 N/A TYR 243.A N ALA 179.A O no hydrogen 2.769 N/A ASN 245.A N VAL 177.A O no hydrogen 2.943 N/A LYS 246.A NZ GLN 242.A O no hydrogen 2.861 N/A THR 247.A N ASN 245.A OD1 no hydrogen 3.008 N/A THR 247.A OG1 ASN 245.A OD1 no hydrogen 3.394 N/A ILE 248.A N ASN 245.A O no hydrogen 3.263 N/A SER 249.A N LYS 246.A O no hydrogen 2.976 N/A SER 249.A OG LYS 246.A O no hydrogen 2.525 N/A THR 250.A N THR 247.A O no hydrogen 2.983 N/A THR 250.A OG1 THR 247.A O no hydrogen 2.528 N/A MET 251.A N ILE 248.A O no hydrogen 3.058 N/A LYS 252.A N GLN 255.A OE1 no hydrogen 3.029 N/A VAL 253.A N GLU 222.A O no hydrogen 2.897 N/A MET 254.A N LEU 219.A O no hydrogen 3.019 N/A GLN 255.A N LYS 252.A O no hydrogen 3.105 N/A PHE 256.A N VAL 253.A O no hydrogen 3.141 N/A GLN 257.A N VAL 253.A O no hydrogen 2.954 N/A GLN 257.A NE2 GLN 227.A OE1 no hydrogen 2.996 N/A MET 259.A N ASN 34.A O no hydrogen 3.063 N/A