Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ahb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 6.A N ASP 4.A OD1 no hydrogen 2.875 N/A SER 8.A N ASP 4.A O no hydrogen 2.898 N/A SER 8.A OG ASP 4.A O no hydrogen 3.240 N/A LYS 9.A N PRO 5.A O no hydrogen 2.974 N/A LYS 9.A NZ SER 89.A O no hydrogen 3.092 N/A LYS 9.A NZ MET 91.A O no hydrogen 3.198 N/A GLU 11.A N VAL 7.A O no hydrogen 2.920 N/A GLU 12.A N SER 8.A O no hydrogen 3.057 N/A LEU 13.A N LYS 9.A O no hydrogen 3.316 N/A PHE 14.A N GLU 11.A O no hydrogen 3.193 N/A THR 15.A OG1 GLU 12.A O no hydrogen 3.233 N/A VAL 18.A N GLY 41.A O no hydrogen 2.872 N/A ILE 20.A N GLY 39.A O no hydrogen 2.790 N/A LEU 21.A N.A LEU 122.A O no hydrogen 2.808 N/A LEU 21.A N.B LEU 122.A O no hydrogen 2.828 N/A VAL 22.A N GLY 37.A O no hydrogen 2.804 N/A GLU 23.A N ASN 124.A O no hydrogen 2.932 N/A LEU 24.A N VAL 35.A O no hydrogen 2.887 N/A ASP 25.A N ILE 126.A O no hydrogen 2.937 N/A GLY 26.A N PHE 33.A O no hydrogen 2.870 N/A ASP 27.A N LEU 128.A O no hydrogen 2.962 N/A VAL 28.A N HIS 31.A O no hydrogen 2.986 N/A ASN 29.A N GLY 130.A O no hydrogen 3.058 N/A ASN 29.A ND2 PHE 133.A O no hydrogen 2.931 N/A ASN 29.A ND2 GLU 135.A OE2 no hydrogen 3.289 N/A GLY 30.A N ASP 27.A OD1 no hydrogen 3.012 N/A HIS 31.A N VAL 28.A O no hydrogen 2.915 N/A LYS 32.A NZ ASP 27.A OD2 no hydrogen 2.794 N/A PHE 33.A N GLY 26.A O no hydrogen 2.983 N/A SER 34.A N THR 56.A OG1 no hydrogen 3.075 N/A SER 34.A OG ASP 25.A OD1 no hydrogen 2.780 N/A VAL 35.A N LEU 24.A O no hydrogen 2.979 N/A SER 36.A N ILE 53.A O no hydrogen 2.918 N/A SER 36.A OG GLU 23.A OE1 no hydrogen 2.872 N/A GLY 37.A N VAL 22.A O no hydrogen 2.757 N/A GLU 38.A N LYS 51.A O no hydrogen 3.139 N/A GLY 39.A N ILE 20.A O no hydrogen 3.170 N/A GLU 40.A N THR 49.A O no hydrogen 2.972 N/A GLY 41.A N VAL 18.A O no hydrogen 2.860 N/A ASP 42.A N LYS 47.A O no hydrogen 2.763 N/A TYR 45.A N ASP 42.A O no hydrogen 3.013 N/A GLY 46.A N ALA 43.A O no hydrogen 3.196 N/A LYS 47.A N ASP 42.A O no hydrogen 3.164 N/A LEU 48.A N GLU 225.A O no hydrogen 2.885 N/A THR 49.A N GLU 40.A O no hydrogen 2.969 N/A THR 49.A OG1 GLU 40.A O no hydrogen 3.469 N/A LEU 50.A N LEU 223.A O no hydrogen 2.937 N/A LYS 51.A N GLU 38.A O no hydrogen 2.960 N/A LYS 51.A NZ ASP 213.A OD2 no hydrogen 2.911 N/A LYS 51.A NZ GLU 216.A OE1 no hydrogen 2.667 N/A PHE 52.A N MET 221.A O no hydrogen 2.794 N/A ILE 53.A N SER 36.A O no hydrogen 2.759 N/A CYS 54.A N ASP 219.A O no hydrogen 2.888 N/A CYS 54.A SG SER 34.A O no hydrogen 3.521 N/A CYS 54.A SG THR 56.A OG1 no hydrogen 3.278 N/A CYS 54.A SG GLY 57.A O no hydrogen 3.297 N/A THR 55.A N SER 34.A O no hydrogen 3.029 N/A LEU 59.A N ASP 219.A OD2 no hydrogen 2.898 N/A TRP 63.A NE1 ASP 219.A OD1 no hydrogen 2.849 N/A THR 65.A N PRO 62.A O no hydrogen 3.016 N/A THR 65.A OG1 PRO 62.A O no hydrogen 2.614 N/A THR 65.A OG1 TYR 109.A OH no hydrogen 2.921 N/A LEU 66.A N TRP 63.A O no hydrogen 2.966 N/A VAL 67.A N PRO 64.A O no hydrogen 3.286 N/A THR 68.A OG1 HIS 184.A NE2 no hydrogen 2.802 N/A LEU 70.A N LEU 66.A O no hydrogen 2.872 N/A PHE 74.A N VAL 71.A O no hydrogen 3.058 N/A SER 75.A N LEU 72.A O no hydrogen 3.080 N/A SER 75.A OG LEU 72.A O no hydrogen 2.843 N/A ARG 76.A N VAL 227.A O no hydrogen 2.838 N/A TYR 77.A OH HIS 202.A NE2 no hydrogen 2.789 N/A HIS 80.A NE2 ILE 232.A O no hydrogen 2.579 N/A MET 81.A N PRO 78.A O no hydrogen 2.762 N/A LYS 82.A N ASP 79.A O no hydrogen 3.364 N/A LYS 82.A NZ GLU 11.A OE1 no hydrogen 3.064 N/A LYS 82.A NZ TYR 77.A O no hydrogen 2.910 N/A GLN 83.A N.A GLN 83.A OE1.A no hydrogen 2.975 N/A HIS 84.A N MET 81.A O no hydrogen 2.962 N/A ASP 85.A N LYS 82.A O no hydrogen 3.231 N/A LYS 88.A N ASP 85.A OD1 no hydrogen 3.163 N/A LYS 88.A NZ CYS 73.A O no hydrogen 2.880 N/A LYS 88.A NZ SER 75.A O no hydrogen 2.809 N/A LYS 88.A NZ ASP 85.A OD2 no hydrogen 2.753 N/A SER 89.A N ASP 85.A O no hydrogen 3.341 N/A SER 89.A OG ASP 85.A O no hydrogen 3.559 N/A SER 89.A OG PHE 86.A O no hydrogen 2.805 N/A ALA 90.A N PHE 86.A O no hydrogen 3.117 N/A MET 91.A N LYS 88.A O no hydrogen 3.057 N/A GLU 93.A N GLU 93.A OE1 no hydrogen 2.688 N/A GLY 94.A N ALA 90.A O no hydrogen 2.737 N/A TYR 95.A N VAL 115.A O no hydrogen 3.020 N/A VAL 96.A N THR 189.A O no hydrogen 2.754 N/A GLN 97.A N ALA 113.A O no hydrogen 2.811 N/A GLU 98.A N GLN 187.A O no hydrogen 2.926 N/A ARG 99.A N THR 111.A O no hydrogen 3.139 N/A ARG 99.A NE GLN 186.A OE1 no hydrogen 2.849 N/A ARG 99.A NH1 THR 68.A O no hydrogen 2.750 N/A ARG 99.A NH2 GLN 186.A OE1 no hydrogen 2.900 N/A THR 100.A N TYR 185.A O no hydrogen 3.057 N/A ILE 101.A N TYR 109.A O no hydrogen 2.798 N/A PHE 102.A N ASP 183.A O no hydrogen 2.820 N/A PHE 103.A N GLY 107.A O no hydrogen 2.946 N/A LYS 104.A N LEU 181.A O no hydrogen 2.916 N/A ASP 106.A N PHE 103.A O no hydrogen 2.850 N/A ASN 108.A N ILE 131.A O no hydrogen 3.041 N/A TYR 109.A N ILE 101.A O no hydrogen 2.920 N/A TYR 109.A OH THR 65.A OG1 no hydrogen 2.921 N/A LYS 110.A N LYS 129.A O no hydrogen 2.739 N/A THR 111.A N ARG 99.A O no hydrogen 2.905 N/A ARG 112.A N GLU 127.A O no hydrogen 2.926 N/A ARG 112.A NH1 GLU 114.A OE2 no hydrogen 3.492 N/A ALA 113.A N GLN 97.A O no hydrogen 2.853 N/A GLU 114.A N ARG 125.A O no hydrogen 2.925 N/A VAL 115.A N TYR 95.A O no hydrogen 2.952 N/A LYS 116.A N VAL 123.A O no hydrogen 2.992 N/A LYS 116.A NZ GLU 114.A OE1 no hydrogen 3.332 N/A PHE 117.A N PRO 92.A O no hydrogen 3.444 N/A GLU 118.A N THR 121.A O no hydrogen 2.853 N/A THR 121.A N GLU 118.A O no hydrogen 3.176 N/A LEU 122.A N PRO 19.A O no hydrogen 2.857 N/A VAL 123.A N LYS 116.A O no hydrogen 2.801 N/A ASN 124.A N LEU 21.A O.A no hydrogen 2.814 N/A ASN 124.A N LEU 21.A O.B no hydrogen 2.826 N/A ASN 124.A ND2 THR 69.A O no hydrogen 3.605 N/A ASN 124.A ND2 LEU 70.A O no hydrogen 3.091 N/A ARG 125.A N GLU 114.A O no hydrogen 3.035 N/A ILE 126.A N GLU 23.A O no hydrogen 2.820 N/A GLU 127.A N ARG 112.A O no hydrogen 2.846 N/A LEU 128.A N ASP 25.A O no hydrogen 2.875 N/A LYS 129.A N LYS 110.A O no hydrogen 2.846 N/A GLY 130.A N ASP 27.A O no hydrogen 2.694 N/A ILE 131.A N ASN 108.A O no hydrogen 3.051 N/A PHE 133.A N ASN 29.A OD1 no hydrogen 3.138 N/A LYS 134.A N ASP 106.A OD1 no hydrogen 2.838 N/A LYS 134.A NZ ASP 105.A O no hydrogen 2.627 N/A GLY 137.A N LYS 134.A O no hydrogen 3.086 N/A ASN 138.A ND2 GLN 180.A OE1 no hydrogen 2.818 N/A GLY 141.A N GLY 137.A O no hydrogen 2.900 N/A HIS 142.A N ILE 139.A O no hydrogen 2.995 N/A LYS 143.A N ASN 138.A O no hydrogen 2.944 N/A LYS 143.A NZ ASP 136.A O no hydrogen 2.794 N/A GLU 145.A N ASN 173.A O no hydrogen 2.815 N/A TYR 146.A OH SER 211.A O no hydrogen 2.721 N/A ASN 147.A ND2 GLU 145.A OE1 no hydrogen 3.088 N/A TYR 148.A OH HIS 151.A NE2 no hydrogen 2.977 N/A ASN 149.A ND2 ARG 171.A O no hydrogen 2.888 N/A ASN 149.A ND2 ASN 173.A OD1 no hydrogen 3.066 N/A HIS 151.A N THR 206.A O no hydrogen 3.107 N/A HIS 151.A NE2 TYR 148.A OH no hydrogen 2.977 N/A VAL 153.A N LEU 204.A O no hydrogen 2.850 N/A ILE 155.A N HIS 202.A O no hydrogen 2.802 N/A MET 156.A N LYS 165.A O no hydrogen 3.052 N/A ASP 158.A N GLY 163.A O no hydrogen 2.765 N/A LYS 161.A N ASP 158.A O no hydrogen 3.102 N/A LYS 161.A NZ GLN 187.A OE1 no hydrogen 3.329 N/A ASN 162.A N LYS 159.A O no hydrogen 3.054 N/A GLY 163.A N ASP 158.A O no hydrogen 3.125 N/A ILE 164.A N ASN 188.A O no hydrogen 3.085 N/A LYS 165.A N MET 156.A O no hydrogen 2.882 N/A SER 166.A N GLN 186.A O no hydrogen 2.916 N/A SER 166.A OG TYR 154.A O no hydrogen 2.639 N/A ASN 167.A ND2.B HIS 184.A O no hydrogen 3.127 N/A PHE 168.A N HIS 184.A O no hydrogen 2.911 N/A ILE 170.A N ALA 182.A O no hydrogen 2.887 N/A HIS 172.A N GLN 180.A O no hydrogen 2.868 N/A ASN 173.A ND2 ASN 147.A OD1 no hydrogen 3.045 N/A ASN 173.A ND2 ASN 149.A OD1 no hydrogen 3.005 N/A ILE 174.A N SER 178.A O no hydrogen 2.945 N/A GLU 175.A N LYS 143.A O no hydrogen 2.832 N/A GLY 177.A N ILE 174.A O no hydrogen 2.982 N/A SER 178.A N ASP 176.A OD1 no hydrogen 2.870 N/A VAL 179.A N SER 178.A OG no hydrogen 2.735 N/A GLN 180.A N HIS 172.A O no hydrogen 2.688 N/A GLN 180.A NE2 LYS 104.A O no hydrogen 2.995 N/A GLN 180.A NE2 LEU 181.A O no hydrogen 3.095 N/A ALA 182.A N ILE 170.A O no hydrogen 2.740 N/A ASP 183.A N PHE 102.A O no hydrogen 2.801 N/A HIS 184.A N PHE 168.A O no hydrogen 2.686 N/A HIS 184.A ND1 ALA 182.A O no hydrogen 3.009 N/A HIS 184.A NE2 THR 68.A OG1 no hydrogen 2.802 N/A TYR 185.A N THR 100.A O no hydrogen 2.950 N/A GLN 186.A N SER 166.A O no hydrogen 2.683 N/A GLN 186.A NE2 ASN 188.A OD1 no hydrogen 2.773 N/A GLN 187.A N GLU 98.A O no hydrogen 2.943 N/A GLN 187.A NE2 GLU 98.A OE1 no hydrogen 3.038 N/A ASN 188.A N ILE 164.A O no hydrogen 3.016 N/A ASN 188.A ND2 GLN 97.A OE1 no hydrogen 2.970 N/A THR 189.A N VAL 96.A O no hydrogen 3.042 N/A ILE 191.A N GLY 94.A O no hydrogen 2.932 N/A LEU 197.A N SER 89.A OG no hydrogen 2.858 N/A ASP 200.A N HIS 84.A ND1 no hydrogen 2.931 N/A HIS 202.A N ILE 155.A O no hydrogen 3.232 N/A HIS 202.A ND1 ASP 200.A O no hydrogen 2.765 N/A HIS 202.A NE2 TYR 77.A OH no hydrogen 2.789 N/A TYR 203.A N.A ALA 230.A O no hydrogen 2.913 N/A TYR 203.A N.B ALA 230.A O no hydrogen 2.945 N/A LEU 204.A N VAL 153.A O no hydrogen 2.852 N/A SER 205.A N THR 228.A O no hydrogen 2.686 N/A SER 205.A OG ASN 152.A OD1 no hydrogen 3.155 N/A THR 206.A N HIS 151.A O no hydrogen 2.934 N/A THR 206.A OG1 HIS 151.A O no hydrogen 3.194 N/A GLN 207.A N PHE 226.A O no hydrogen 3.074 N/A LYS 209.A N LEU 224.A O no hydrogen 2.853 N/A SER 211.A N VAL 222.A O no hydrogen 2.878 N/A LYS 212.A NZ HIS 220.A O no hydrogen 2.680 N/A ASP 213.A N HIS 220.A NE2 no hydrogen 2.716 N/A ASN 215.A N ASP 213.A OD1 no hydrogen 2.972 N/A GLU 216.A N ASP 213.A O no hydrogen 2.940 N/A ARG 218.A N GLU 216.A OE2 no hydrogen 2.906 N/A ARG 218.A NE GLU 216.A OE2 no hydrogen 2.721 N/A ARG 218.A NH2 GLU 216.A OE1 no hydrogen 2.979 N/A ARG 218.A NH2 GLU 216.A OE2 no hydrogen 3.519 N/A HIS 220.A ND1 ARG 218.A O no hydrogen 2.944 N/A MET 221.A N PHE 52.A O no hydrogen 2.957 N/A VAL 222.A N SER 211.A O no hydrogen 2.930 N/A LEU 223.A N LEU 50.A O no hydrogen 2.743 N/A LEU 224.A N LYS 209.A O no hydrogen 3.034 N/A GLU 225.A N LEU 48.A O no hydrogen 2.988 N/A PHE 226.A N GLN 207.A O no hydrogen 2.898 N/A VAL 227.A N GLY 46.A O no hydrogen 2.916 N/A THR 228.A N SER 205.A O no hydrogen 2.921 N/A ALA 229.A N ARG 76.A O no hydrogen 2.832 N/A ALA 230.A N TYR 203.A O.A no hydrogen 2.897 N/A ALA 230.A N TYR 203.A O.B no hydrogen 2.753 N/A