Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7a8i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N GLU 3.A OE2 no hydrogen 2.708 N/A GLU 3.A N GLU 3.A OE2 no hydrogen 2.998 N/A GLU 4.A N.A LYS 1.A O no hydrogen 3.203 N/A GLU 4.A N.B LYS 1.A O no hydrogen 3.187 N/A LEU 5.A N GLY 2.A O no hydrogen 3.209 N/A PHE 6.A N GLU 3.A O no hydrogen 3.307 N/A VAL 10.A N GLY 33.A O no hydrogen 2.923 N/A ILE 12.A N GLY 31.A O no hydrogen 2.917 N/A LEU 13.A N LEU 114.A O no hydrogen 2.951 N/A VAL 14.A N GLY 29.A O no hydrogen 2.826 N/A GLU 15.A N ASN 116.A O no hydrogen 2.958 N/A LEU 16.A N.A VAL 27.A O no hydrogen 2.946 N/A LEU 16.A N.B VAL 27.A O no hydrogen 2.958 N/A ASP 17.A N ILE 118.A O no hydrogen 3.078 N/A GLY 18.A N PHE 25.A O no hydrogen 2.880 N/A ASP 19.A N LEU 120.A O no hydrogen 3.014 N/A VAL 20.A N HIS 23.A O no hydrogen 3.028 N/A ASN 21.A N GLY 122.A O no hydrogen 3.014 N/A ASN 21.A ND2 PHE 125.A O no hydrogen 2.829 N/A ASN 21.A ND2 GLU 127.A OE1 no hydrogen 3.415 N/A GLY 22.A N ASP 19.A OD2 no hydrogen 2.914 N/A HIS 23.A N VAL 20.A O no hydrogen 2.816 N/A LYS 24.A NZ ASP 19.A OD1 no hydrogen 2.981 N/A PHE 25.A N GLY 18.A O no hydrogen 2.981 N/A SER 26.A N THR 48.A OG1 no hydrogen 3.114 N/A SER 26.A OG ASP 17.A OD1 no hydrogen 2.659 N/A VAL 27.A N LEU 16.A O.A no hydrogen 2.911 N/A VAL 27.A N LEU 16.A O.B no hydrogen 2.852 N/A ARG 28.A N.A ILE 45.A O no hydrogen 3.022 N/A ARG 28.A N.B ILE 45.A O no hydrogen 3.025 N/A ARG 28.A NE.A GLU 30.A OE2.B no hydrogen 3.526 N/A ARG 28.A NE.B GLU 30.A OE2.A no hydrogen 3.416 N/A ARG 28.A NH1.A GLU 30.A OE2.B no hydrogen 3.140 N/A GLY 29.A N VAL 14.A O no hydrogen 2.830 N/A GLU 30.A N.A LYS 43.A O no hydrogen 3.139 N/A GLU 30.A N.B LYS 43.A O no hydrogen 3.140 N/A GLY 31.A N ILE 12.A O no hydrogen 3.178 N/A GLU 32.A N THR 41.A O no hydrogen 3.030 N/A GLY 33.A N VAL 10.A O no hydrogen 2.918 N/A ASP 34.A N LYS 39.A O no hydrogen 2.814 N/A ASN 37.A N ASP 34.A O no hydrogen 3.084 N/A ASN 37.A N ASP 34.A OD1 no hydrogen 3.451 N/A ASN 37.A ND2 ASP 34.A OD2 no hydrogen 2.739 N/A GLY 38.A N ALA 35.A O no hydrogen 3.071 N/A LYS 39.A N ASP 34.A O no hydrogen 3.045 N/A LEU 40.A N GLU 217.A O no hydrogen 2.848 N/A THR 41.A N GLU 32.A O no hydrogen 3.101 N/A LEU 42.A N LEU 215.A O no hydrogen 3.041 N/A LYS 43.A N GLU 30.A O.A no hydrogen 3.057 N/A LYS 43.A N GLU 30.A O.B no hydrogen 3.057 N/A LYS 43.A NZ ASP 205.A OD2 no hydrogen 3.292 N/A LYS 43.A NZ GLU 208.A OE2 no hydrogen 2.701 N/A PHE 44.A N MET 213.A O no hydrogen 2.807 N/A ILE 45.A N ARG 28.A O.A no hydrogen 2.833 N/A ILE 45.A N ARG 28.A O.B no hydrogen 2.848 N/A CYS 46.A N ASP 211.A O no hydrogen 2.960 N/A CYS 46.A SG SER 26.A O no hydrogen 3.611 N/A CYS 46.A SG THR 48.A OG1 no hydrogen 3.266 N/A CYS 46.A SG GLY 49.A O no hydrogen 3.532 N/A THR 47.A N SER 26.A O no hydrogen 3.025 N/A THR 47.A OG1 SER 26.A O no hydrogen 3.487 N/A LYS 50.A NZ LEU 51.A O no hydrogen 2.938 N/A LYS 50.A NZ ASP 211.A OD2 no hydrogen 3.002 N/A LEU 51.A N ASP 211.A OD2 no hydrogen 2.849 N/A TRP 55.A NE1 ASP 211.A OD1 no hydrogen 2.973 N/A THR 57.A N PRO 54.A O no hydrogen 3.055 N/A THR 57.A OG1 PRO 54.A O no hydrogen 2.780 N/A THR 57.A OG1 TYR 101.A OH no hydrogen 2.857 N/A LEU 58.A N TRP 55.A O no hydrogen 2.991 N/A VAL 59.A N PRO 56.A O no hydrogen 3.430 N/A THR 60.A OG1 HIS 176.A NE2 no hydrogen 2.851 N/A LEU 62.A N LEU 58.A O no hydrogen 2.898 N/A PHE 66.A N VAL 63.A O no hydrogen 3.078 N/A ALA 67.A N LEU 64.A O no hydrogen 3.145 N/A ARG 68.A N VAL 219.A O no hydrogen 2.938 N/A TYR 69.A OH HIS 194.A NE2 no hydrogen 2.780 N/A MET 73.A N PRO 70.A O no hydrogen 2.748 N/A LYS 74.A N ASP 71.A O no hydrogen 3.274 N/A HIS 76.A N MET 73.A O no hydrogen 2.837 N/A LYS 80.A N ASP 77.A OD1 no hydrogen 3.275 N/A LYS 80.A NZ CYS 65.A O no hydrogen 3.023 N/A LYS 80.A NZ ALA 67.A O no hydrogen 2.833 N/A LYS 80.A NZ ASP 77.A OD2 no hydrogen 2.850 N/A SER 81.A N ASP 77.A O no hydrogen 3.435 N/A SER 81.A OG ASP 77.A O no hydrogen 3.565 N/A SER 81.A OG PHE 78.A O no hydrogen 2.686 N/A ALA 82.A N PHE 78.A O no hydrogen 3.177 N/A MET 83.A N LYS 80.A O no hydrogen 2.928 N/A GLY 86.A N ALA 82.A O no hydrogen 2.863 N/A TYR 87.A N VAL 107.A O no hydrogen 3.015 N/A VAL 88.A N THR 181.A O no hydrogen 2.787 N/A GLN 89.A N ALA 105.A O no hydrogen 2.977 N/A GLU 90.A N GLN 179.A O no hydrogen 2.952 N/A ARG 91.A N THR 103.A O no hydrogen 3.059 N/A ARG 91.A NE GLN 178.A OE1 no hydrogen 2.932 N/A ARG 91.A NH1 THR 60.A O no hydrogen 2.937 N/A ARG 91.A NH2 GLN 178.A OE1 no hydrogen 2.856 N/A THR 92.A N TYR 177.A O.A no hydrogen 2.970 N/A THR 92.A N TYR 177.A O.B no hydrogen 2.989 N/A ILE 93.A N TYR 101.A O no hydrogen 2.882 N/A SER 94.A N ASP 175.A O no hydrogen 2.970 N/A PHE 95.A N GLY 99.A O no hydrogen 2.973 N/A LYS 96.A N LEU 173.A O no hydrogen 3.014 N/A LYS 96.A NZ ASP 97.A OD2 no hydrogen 2.965 N/A ASP 98.A N PHE 95.A O no hydrogen 2.939 N/A GLY 99.A N ASP 98.A OD1 no hydrogen 2.908 N/A TYR 100.A N ILE 123.A O no hydrogen 3.049 N/A TYR 101.A N ILE 93.A O no hydrogen 2.792 N/A TYR 101.A OH THR 57.A OG1 no hydrogen 2.857 N/A LYS 102.A N LYS 121.A O no hydrogen 2.769 N/A LYS 102.A NZ THR 92.A OG1 no hydrogen 2.617 N/A THR 103.A N ARG 91.A O no hydrogen 2.988 N/A ARG 104.A N GLU 119.A O no hydrogen 3.018 N/A ARG 104.A NH1 GLU 106.A OE2 no hydrogen 3.433 N/A ARG 104.A NH2 GLU 106.A OE2 no hydrogen 3.165 N/A ALA 105.A N GLN 89.A O no hydrogen 2.889 N/A GLU 106.A N ARG 117.A O.A no hydrogen 2.959 N/A GLU 106.A N ARG 117.A O.B no hydrogen 2.943 N/A VAL 107.A N TYR 87.A O no hydrogen 3.011 N/A LYS 108.A N VAL 115.A O no hydrogen 3.069 N/A LYS 108.A NZ GLU 110.A OE2 no hydrogen 3.313 N/A PHE 109.A N PRO 84.A O no hydrogen 3.247 N/A GLU 110.A N THR 113.A O no hydrogen 2.837 N/A THR 113.A N GLU 110.A O no hydrogen 3.179 N/A LEU 114.A N PRO 11.A O no hydrogen 3.014 N/A VAL 115.A N LYS 108.A O no hydrogen 2.859 N/A ASN 116.A N LEU 13.A O no hydrogen 2.856 N/A ASN 116.A ND2 THR 61.A O no hydrogen 3.387 N/A ASN 116.A ND2 LEU 62.A O no hydrogen 3.123 N/A ARG 117.A N.A GLU 106.A O no hydrogen 2.985 N/A ARG 117.A N.B GLU 106.A O no hydrogen 2.989 N/A ARG 117.A NE.B GLU 110.A OE2 no hydrogen 3.015 N/A ARG 117.A NH1.A GLU 110.A OE2 no hydrogen 2.687 N/A ARG 117.A NH2.A GLU 110.A OE1 no hydrogen 3.179 N/A ARG 117.A NH2.A GLU 110.A OE2 no hydrogen 3.062 N/A ARG 117.A NH2.B GLU 110.A OE1 no hydrogen 2.878 N/A ILE 118.A N GLU 15.A O no hydrogen 2.786 N/A GLU 119.A N ARG 104.A O no hydrogen 2.928 N/A LEU 120.A N ASP 17.A O no hydrogen 2.869 N/A LYS 121.A N LYS 102.A O no hydrogen 2.871 N/A GLY 122.A N ASP 19.A O no hydrogen 2.717 N/A ILE 123.A N TYR 100.A O no hydrogen 3.040 N/A PHE 125.A N ASN 21.A OD1 no hydrogen 3.097 N/A LYS 126.A N ASP 98.A OD1 no hydrogen 2.866 N/A LYS 126.A NZ ASP 97.A O no hydrogen 2.869 N/A GLY 129.A N LYS 126.A O no hydrogen 2.924 N/A ASN 130.A ND2 GLN 172.A OE1 no hydrogen 3.024 N/A GLY 133.A N GLY 129.A O no hydrogen 2.881 N/A HIS 134.A N ILE 131.A O no hydrogen 3.107 N/A LYS 135.A N ASN 130.A O no hydrogen 3.008 N/A LYS 135.A NZ ASP 128.A O no hydrogen 2.665 N/A GLU 137.A N.A ASN 165.A O no hydrogen 2.861 N/A GLU 137.A N.B ASN 165.A O no hydrogen 2.847 N/A TYR 138.A OH SER 203.A O no hydrogen 2.772 N/A ASN 139.A N GLU 137.A O.A no hydrogen 3.047 N/A ASN 139.A ND2 GLU 137.A OE1.B no hydrogen 2.810 N/A ASN 141.A ND2 ARG 163.A O no hydrogen 2.861 N/A ASN 141.A ND2 ASN 165.A OD1 no hydrogen 3.289 N/A SER 143.A N THR 198.A O.A no hydrogen 3.112 N/A SER 143.A N THR 198.A O.B no hydrogen 3.125 N/A SER 143.A OG THR 198.A OG1.B no hydrogen 2.454 N/A ALA 145.A N LEU 196.A O no hydrogen 3.010 N/A ILE 147.A N HIS 194.A O no hydrogen 2.665 N/A THR 148.A N LYS 157.A O no hydrogen 3.060 N/A ASP 150.A N GLY 155.A O no hydrogen 2.747 N/A LYS 153.A NZ ASP 150.A OD2 no hydrogen 2.991 N/A LYS 153.A NZ GLN 179.A OE1 no hydrogen 3.299 N/A ASN 154.A N LYS 151.A O no hydrogen 3.227 N/A GLY 155.A N ASP 150.A O no hydrogen 3.244 N/A ILE 156.A N ASN 180.A O no hydrogen 3.061 N/A LYS 157.A N THR 148.A O no hydrogen 2.881 N/A SER 158.A N GLN 178.A O no hydrogen 2.955 N/A SER 158.A OG TYR 146.A O.A no hydrogen 2.555 N/A SER 158.A OG TYR 146.A O.B no hydrogen 2.598 N/A PHE 160.A N HIS 176.A O no hydrogen 3.049 N/A LYS 161.A NZ ASP 175.A OD2 no hydrogen 2.954 N/A ILE 162.A N ALA 174.A O no hydrogen 2.927 N/A HIS 164.A N GLN 172.A O no hydrogen 2.880 N/A ASN 165.A ND2 GLU 137.A OE1.B no hydrogen 3.399 N/A VAL 166.A N SER 170.A O no hydrogen 2.914 N/A GLU 167.A N LYS 135.A O no hydrogen 2.892 N/A GLY 169.A N VAL 166.A O no hydrogen 3.039 N/A SER 170.A N ASP 168.A OD2 no hydrogen 2.984 N/A SER 170.A OG ASP 168.A OD2 no hydrogen 2.744 N/A GLN 172.A N HIS 164.A O no hydrogen 2.716 N/A GLN 172.A NE2 LYS 96.A O no hydrogen 3.074 N/A GLN 172.A NE2 LEU 173.A O no hydrogen 3.077 N/A ALA 174.A N ILE 162.A O no hydrogen 2.843 N/A ASP 175.A N SER 94.A O no hydrogen 2.945 N/A HIS 176.A N PHE 160.A O no hydrogen 2.738 N/A HIS 176.A ND1 ALA 174.A O no hydrogen 2.965 N/A HIS 176.A NE2 THR 60.A OG1 no hydrogen 2.851 N/A TYR 177.A N.A THR 92.A O no hydrogen 2.943 N/A TYR 177.A N.B THR 92.A O no hydrogen 2.926 N/A TYR 177.A OH.B GLN 179.A OE1 no hydrogen 2.737 N/A GLN 178.A N SER 158.A O no hydrogen 2.654 N/A GLN 178.A NE2 ASN 180.A OD1 no hydrogen 2.780 N/A GLN 179.A N GLU 90.A O no hydrogen 2.916 N/A GLN 179.A NE2 GLU 90.A OE1 no hydrogen 2.917 N/A ASN 180.A N ILE 156.A O no hydrogen 2.926 N/A ASN 180.A ND2 GLN 89.A OE1 no hydrogen 2.923 N/A THR 181.A N VAL 88.A O no hydrogen 3.036 N/A ILE 183.A N GLY 86.A O no hydrogen 2.920 N/A LEU 189.A N SER 81.A OG no hydrogen 3.033 N/A ASP 192.A N HIS 76.A ND1 no hydrogen 3.172 N/A HIS 194.A N ILE 147.A O no hydrogen 3.121 N/A HIS 194.A ND1 ASP 192.A O no hydrogen 2.929 N/A HIS 194.A NE2 TYR 69.A OH no hydrogen 2.780 N/A TYR 195.A N.A ALA 222.A O no hydrogen 3.015 N/A TYR 195.A N.B ALA 222.A O no hydrogen 3.041 N/A LEU 196.A N ALA 145.A O no hydrogen 2.948 N/A SER 197.A N THR 220.A O no hydrogen 2.706 N/A THR 198.A N.A SER 143.A O no hydrogen 2.961 N/A THR 198.A N.B SER 143.A O no hydrogen 2.962 N/A THR 198.A OG1.B SER 143.A O no hydrogen 3.460 N/A THR 198.A OG1.B SER 143.A OG no hydrogen 2.454 N/A GLN 199.A N PHE 218.A O no hydrogen 2.932 N/A ALA 201.A N LEU 216.A O no hydrogen 2.914 N/A SER 203.A N VAL 214.A O no hydrogen 2.991 N/A LYS 204.A NZ HIS 212.A O no hydrogen 2.761 N/A ASP 205.A N HIS 212.A NE2 no hydrogen 2.885 N/A ASN 207.A N ASP 205.A OD1 no hydrogen 3.308 N/A GLU 208.A N ASP 205.A O no hydrogen 3.236 N/A ARG 210.A N GLU 208.A OE1 no hydrogen 2.830 N/A ARG 210.A NE GLU 208.A OE1 no hydrogen 2.931 N/A ARG 210.A NH1 GLU 208.A OE2 no hydrogen 3.142 N/A HIS 212.A ND1 ARG 210.A O no hydrogen 2.805 N/A MET 213.A N PHE 44.A O no hydrogen 2.943 N/A VAL 214.A N SER 203.A O no hydrogen 3.125 N/A LEU 215.A N LEU 42.A O no hydrogen 2.861 N/A LEU 216.A N ALA 201.A O no hydrogen 3.013 N/A GLU 217.A N LEU 40.A O no hydrogen 2.931 N/A PHE 218.A N GLN 199.A O no hydrogen 2.898 N/A VAL 219.A N GLY 38.A O no hydrogen 2.851 N/A THR 220.A N SER 197.A O no hydrogen 2.882 N/A ALA 221.A N ARG 68.A O no hydrogen 2.930 N/A ALA 222.A N TYR 195.A O.A no hydrogen 2.903 N/A ALA 222.A N TYR 195.A O.B no hydrogen 2.785 N/A