Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6dq0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 4.A OE2 no hydrogen 2.953 N/A GLU 5.A N SER 1.A O no hydrogen 3.055 N/A GLU 5.A N LYS 2.A O no hydrogen 3.158 N/A LEU 6.A N GLY 3.A O no hydrogen 3.099 N/A PHE 7.A N GLU 4.A O no hydrogen 3.076 N/A THR 8.A OG1 GLU 5.A O no hydrogen 3.403 N/A THR 8.A OG1 GLU 5.A OE2 no hydrogen 3.359 N/A VAL 11.A N GLY 34.A O no hydrogen 2.876 N/A ILE 13.A N GLY 32.A O no hydrogen 2.901 N/A LEU 14.A N LEU 115.A O no hydrogen 2.959 N/A VAL 15.A N GLY 30.A O no hydrogen 2.891 N/A GLU 16.A N ASN 117.A O no hydrogen 2.901 N/A LEU 17.A N VAL 28.A O no hydrogen 2.963 N/A ASP 18.A N ILE 119.A O no hydrogen 2.990 N/A GLY 19.A N PHE 26.A O no hydrogen 2.788 N/A ASP 20.A N LEU 121.A O no hydrogen 2.922 N/A VAL 21.A N HIS 24.A O no hydrogen 3.018 N/A ASN 22.A N GLY 123.A O no hydrogen 2.902 N/A ASN 22.A ND2 PHE 126.A O no hydrogen 2.804 N/A ASN 22.A ND2 GLU 128.A OE1 no hydrogen 3.151 N/A GLY 23.A N ASP 20.A OD1 no hydrogen 3.009 N/A HIS 24.A N VAL 21.A O no hydrogen 2.833 N/A LYS 25.A NZ.B ASP 20.A OD2 no hydrogen 2.968 N/A PHE 26.A N GLY 19.A O no hydrogen 3.022 N/A SER 27.A N THR 49.A OG1 no hydrogen 3.199 N/A SER 27.A OG ASP 18.A OD1 no hydrogen 2.693 N/A VAL 28.A N LEU 17.A O no hydrogen 2.916 N/A ARG 29.A N ILE 46.A O no hydrogen 2.917 N/A ARG 29.A NE GLU 31.A OE1 no hydrogen 2.647 N/A ARG 29.A NH1 GLU 31.A OE1 no hydrogen 2.344 N/A GLY 30.A N VAL 15.A O no hydrogen 2.777 N/A GLU 31.A N LYS 44.A O no hydrogen 3.003 N/A GLY 32.A N ILE 13.A O no hydrogen 3.228 N/A GLU 33.A N THR 42.A O.A no hydrogen 2.953 N/A GLU 33.A N THR 42.A O.B no hydrogen 2.956 N/A GLY 34.A N VAL 11.A O no hydrogen 2.843 N/A ASP 35.A N LYS 40.A O no hydrogen 2.769 N/A THR 37.A OG1 THR 8.A O no hydrogen 3.328 N/A ASN 38.A N ASP 35.A O no hydrogen 2.996 N/A ASN 38.A ND2 ASP 35.A OD2 no hydrogen 2.736 N/A GLY 39.A N ALA 36.A O no hydrogen 2.962 N/A LYS 40.A N ASP 35.A O no hydrogen 3.113 N/A LEU 41.A N GLU 217.A O no hydrogen 3.036 N/A THR 42.A N.A GLU 33.A O no hydrogen 2.999 N/A THR 42.A N.B GLU 33.A O no hydrogen 3.006 N/A LEU 43.A N LEU 215.A O no hydrogen 3.030 N/A LYS 44.A N GLU 31.A O no hydrogen 2.930 N/A LYS 44.A NZ ASP 205.A OD2 no hydrogen 3.038 N/A LYS 44.A NZ GLU 208.A OE2 no hydrogen 2.603 N/A PHE 45.A N MET 213.A O no hydrogen 2.821 N/A ILE 46.A N ARG 29.A O no hydrogen 2.821 N/A CYS 47.A N ASP 211.A O no hydrogen 2.891 N/A CYS 47.A SG SER 27.A O no hydrogen 3.555 N/A CYS 47.A SG THR 49.A OG1 no hydrogen 3.367 N/A CYS 47.A SG GLY 50.A O no hydrogen 3.388 N/A THR 48.A N SER 27.A O no hydrogen 2.988 N/A THR 48.A OG1 SER 27.A O no hydrogen 3.454 N/A LEU 52.A N ASP 211.A OD2 no hydrogen 2.812 N/A TRP 56.A NE1 ASP 211.A OD1 no hydrogen 3.142 N/A THR 58.A N PRO 55.A O no hydrogen 2.967 N/A THR 58.A OG1 PRO 55.A O no hydrogen 2.765 N/A THR 58.A OG1 TYR 102.A OH no hydrogen 2.920 N/A LEU 59.A N TRP 56.A O no hydrogen 2.966 N/A VAL 60.A N PRO 57.A O no hydrogen 3.357 N/A THR 61.A OG1 HIS 176.A NE2 no hydrogen 2.729 N/A LEU 63.A N LEU 59.A O no hydrogen 2.867 N/A PHE 67.A N VAL 64.A O no hydrogen 2.981 N/A SER 68.A N GLN 65.A O no hydrogen 3.107 N/A SER 68.A OG GLN 65.A O no hydrogen 2.637 N/A ARG 69.A N VAL 219.A O no hydrogen 3.034 N/A TYR 70.A OH HIS 194.A NE2 no hydrogen 2.637 N/A HIS 73.A NE2 ILE 224.A O no hydrogen 2.830 N/A MET 74.A N PRO 71.A O no hydrogen 2.759 N/A LYS 75.A N ASP 72.A O no hydrogen 3.269 N/A LYS 75.A NZ TYR 70.A O no hydrogen 2.522 N/A HIS 77.A N MET 74.A O no hydrogen 2.677 N/A ASP 78.A N LYS 75.A O no hydrogen 3.491 N/A LYS 81.A N ASP 78.A OD1 no hydrogen 3.163 N/A LYS 81.A NZ CYS 66.A O no hydrogen 2.955 N/A LYS 81.A NZ SER 68.A O no hydrogen 2.792 N/A LYS 81.A NZ ASP 78.A OD2 no hydrogen 2.751 N/A SER 82.A N ASP 78.A O no hydrogen 3.409 N/A SER 82.A OG PHE 79.A O no hydrogen 2.882 N/A ALA 83.A N PHE 79.A O no hydrogen 3.175 N/A ALA 83.A N PHE 80.A O no hydrogen 3.417 N/A MET 84.A N LYS 81.A O no hydrogen 3.130 N/A GLU 86.A N GLU 86.A OE2 no hydrogen 2.829 N/A GLY 87.A N ALA 83.A O no hydrogen 2.767 N/A TYR 88.A N VAL 108.A O no hydrogen 2.927 N/A VAL 89.A N THR 181.A O no hydrogen 2.831 N/A GLN 90.A N ALA 106.A O no hydrogen 2.794 N/A GLU 91.A N GLN 179.A O no hydrogen 2.871 N/A ARG 92.A N THR 104.A O no hydrogen 3.027 N/A ARG 92.A NE GLN 178.A OE1 no hydrogen 2.837 N/A ARG 92.A NH1 THR 61.A O no hydrogen 2.829 N/A ARG 92.A NH2 GLN 178.A OE1 no hydrogen 2.807 N/A THR 93.A N TYR 177.A O no hydrogen 2.956 N/A ILE 94.A N TYR 102.A O no hydrogen 2.763 N/A SER 95.A N ASP 175.A O no hydrogen 2.924 N/A PHE 96.A N GLY 100.A O no hydrogen 2.970 N/A LYS 97.A N LEU 173.A O no hydrogen 2.949 N/A ASP 99.A N PHE 96.A O no hydrogen 3.000 N/A GLY 100.A N ASP 99.A OD1 no hydrogen 2.726 N/A THR 101.A N ILE 124.A O no hydrogen 3.035 N/A TYR 102.A N ILE 94.A O no hydrogen 2.824 N/A TYR 102.A OH THR 58.A OG1 no hydrogen 2.920 N/A LYS 103.A N LYS 122.A O no hydrogen 2.762 N/A THR 104.A N ARG 92.A O no hydrogen 2.883 N/A ARG 105.A N GLU 120.A O no hydrogen 2.863 N/A ALA 106.A N GLN 90.A O no hydrogen 2.877 N/A GLU 107.A N ARG 118.A O no hydrogen 2.952 N/A VAL 108.A N TYR 88.A O no hydrogen 2.891 N/A LYS 109.A N VAL 116.A O no hydrogen 3.037 N/A LYS 109.A NZ GLU 107.A OE1 no hydrogen 2.608 N/A PHE 110.A N PRO 85.A O no hydrogen 3.229 N/A GLU 111.A N THR 114.A O no hydrogen 2.826 N/A THR 114.A N GLU 111.A O no hydrogen 3.216 N/A LEU 115.A N PRO 12.A O no hydrogen 2.944 N/A VAL 116.A N LYS 109.A O no hydrogen 2.849 N/A ASN 117.A N LEU 14.A O no hydrogen 2.882 N/A ASN 117.A ND2 THR 62.A O no hydrogen 3.296 N/A ASN 117.A ND2 LEU 63.A O no hydrogen 2.984 N/A ARG 118.A N GLU 107.A O no hydrogen 3.035 N/A ARG 118.A NE GLU 111.A OE2 no hydrogen 2.907 N/A ARG 118.A NH1 GLU 16.A OE2 no hydrogen 2.569 N/A ARG 118.A NH2 GLU 111.A OE1 no hydrogen 2.713 N/A ILE 119.A N GLU 16.A O no hydrogen 2.752 N/A GLU 120.A N ARG 105.A O no hydrogen 2.735 N/A LEU 121.A N ASP 18.A O no hydrogen 2.945 N/A LYS 122.A N LYS 103.A O no hydrogen 2.851 N/A GLY 123.A N ASP 20.A O no hydrogen 2.681 N/A ILE 124.A N THR 101.A O no hydrogen 3.082 N/A PHE 126.A N ASN 22.A OD1 no hydrogen 3.183 N/A LYS 127.A N ASP 99.A OD1 no hydrogen 2.834 N/A LYS 127.A NZ ASP 98.A O no hydrogen 2.981 N/A ASN 130.A ND2 GLN 172.A OE1 no hydrogen 2.892 N/A GLY 133.A N GLY 129.A O no hydrogen 2.949 N/A HIS 134.A N ILE 131.A O no hydrogen 2.929 N/A LYS 135.A N ASN 130.A O no hydrogen 2.987 N/A GLU 137.A N ASN 165.A O no hydrogen 2.900 N/A TYR 138.A OH SER 203.A O no hydrogen 2.473 N/A ASN 139.A N GLU 137.A O no hydrogen 2.949 N/A ASN 139.A ND2 GLU 137.A OE1 no hydrogen 3.010 N/A ASN 141.A ND2 ARG 163.A O no hydrogen 3.394 N/A ASN 141.A ND2 ASN 165.A OD1 no hydrogen 3.261 N/A SER 142.A OG.B THR 198.A O no hydrogen 2.916 N/A HIS 143.A N THR 198.A O no hydrogen 3.318 N/A VAL 145.A N LEU 196.A O no hydrogen 2.869 N/A TYR 146.A N ASN 159.A O no hydrogen 3.469 N/A ILE 147.A N HIS 194.A O no hydrogen 2.749 N/A THR 148.A N LYS 157.A O no hydrogen 2.973 N/A THR 148.A OG1 ASN 193.A OD1 no hydrogen 2.735 N/A ASP 150.A N GLY 155.A O no hydrogen 2.853 N/A GLN 152.A N GLN 152.A OE1 no hydrogen 2.668 N/A LYS 153.A N ASP 150.A O no hydrogen 2.992 N/A LYS 153.A N ASP 150.A OD1 no hydrogen 3.390 N/A LYS 153.A NZ GLN 179.A OE1 no hydrogen 3.551 N/A ASN 154.A N LYS 151.A O no hydrogen 3.164 N/A GLY 155.A N ASP 150.A O no hydrogen 3.150 N/A ILE 156.A N ASN 180.A O no hydrogen 3.124 N/A LYS 157.A N THR 148.A O no hydrogen 2.793 N/A ALA 158.A N GLN 178.A O no hydrogen 2.895 N/A ASN 159.A N TYR 146.A O no hydrogen 3.308 N/A PHE 160.A N HIS 176.A O no hydrogen 3.198 N/A LYS 161.A NZ ASP 175.A OD1 no hydrogen 3.150 N/A ILE 162.A N ALA 174.A O no hydrogen 2.898 N/A ARG 163.A N HIS 143.A NE2 no hydrogen 2.993 N/A HIS 164.A N GLN 172.A O no hydrogen 2.957 N/A ASN 165.A ND2 GLU 137.A OE1 no hydrogen 3.277 N/A VAL 166.A N SER 170.A O no hydrogen 2.966 N/A GLU 167.A N LYS 135.A O no hydrogen 2.923 N/A GLY 169.A N VAL 166.A O no hydrogen 2.990 N/A SER 170.A N ASP 168.A OD1 no hydrogen 2.927 N/A SER 170.A OG ASP 168.A OD1 no hydrogen 2.493 N/A SER 170.A OG ASP 168.A OD2 no hydrogen 3.498 N/A GLN 172.A N HIS 164.A O no hydrogen 2.776 N/A GLN 172.A NE2 LYS 97.A O no hydrogen 2.932 N/A GLN 172.A NE2 LEU 173.A O no hydrogen 3.133 N/A ALA 174.A N ILE 162.A O no hydrogen 2.882 N/A ASP 175.A N SER 95.A O no hydrogen 2.964 N/A HIS 176.A N PHE 160.A O no hydrogen 2.771 N/A HIS 176.A ND1 ALA 174.A O no hydrogen 2.931 N/A HIS 176.A NE2 THR 61.A OG1 no hydrogen 2.729 N/A TYR 177.A N THR 93.A O no hydrogen 2.934 N/A GLN 178.A N ALA 158.A O no hydrogen 2.898 N/A GLN 178.A NE2 GLN 65.A OE1 no hydrogen 2.779 N/A GLN 178.A NE2 ASN 180.A OD1 no hydrogen 3.013 N/A GLN 179.A N GLU 91.A O no hydrogen 2.882 N/A ASN 180.A N ILE 156.A O no hydrogen 2.979 N/A ASN 180.A ND2 GLN 90.A OE1 no hydrogen 2.943 N/A THR 181.A N VAL 89.A O no hydrogen 3.027 N/A ILE 183.A N GLY 87.A O no hydrogen 2.795 N/A LEU 189.A N SER 82.A OG no hydrogen 2.986 N/A ASP 192.A N HIS 77.A ND1 no hydrogen 3.154 N/A HIS 194.A N ILE 147.A O no hydrogen 3.188 N/A HIS 194.A ND1 ASP 192.A O no hydrogen 2.966 N/A HIS 194.A NE2 TYR 70.A OH no hydrogen 2.637 N/A TYR 195.A N ALA 222.A O no hydrogen 2.959 N/A LEU 196.A N VAL 145.A O no hydrogen 2.827 N/A SER 197.A N THR 220.A O no hydrogen 2.735 N/A THR 198.A N HIS 143.A O no hydrogen 2.967 N/A THR 198.A OG1 HIS 143.A O no hydrogen 3.186 N/A GLN 199.A N PHE 218.A O no hydrogen 2.866 N/A SER 200.A OG GLU 217.A OE1 no hydrogen 3.399 N/A VAL 201.A N LEU 216.A O no hydrogen 2.738 N/A SER 203.A N VAL 214.A O no hydrogen 2.919 N/A LYS 204.A NZ TYR 138.A OH no hydrogen 3.531 N/A LYS 204.A NZ HIS 212.A O no hydrogen 2.677 N/A ASP 205.A N HIS 212.A NE2 no hydrogen 2.866 N/A ASN 207.A N ASP 205.A OD1 no hydrogen 3.083 N/A GLU 208.A N ASP 205.A O no hydrogen 3.144 N/A ARG 210.A N GLU 208.A OE1 no hydrogen 2.914 N/A ARG 210.A NE GLU 208.A OE1 no hydrogen 2.743 N/A ARG 210.A NH1 GLU 208.A OE1 no hydrogen 3.315 N/A ARG 210.A NH1 GLU 208.A OE2 no hydrogen 3.006 N/A HIS 212.A ND1 ARG 210.A O no hydrogen 2.839 N/A MET 213.A N PHE 45.A O no hydrogen 2.943 N/A VAL 214.A N SER 203.A O no hydrogen 3.069 N/A LEU 215.A N LEU 43.A O no hydrogen 2.836 N/A LEU 216.A N VAL 201.A O no hydrogen 2.950 N/A GLU 217.A N LEU 41.A O no hydrogen 3.082 N/A PHE 218.A N GLN 199.A O no hydrogen 2.753 N/A VAL 219.A N GLY 39.A O no hydrogen 2.866 N/A THR 220.A N SER 197.A O no hydrogen 3.024 N/A ALA 221.A N ARG 69.A O no hydrogen 2.958 N/A ALA 222.A N TYR 195.A O no hydrogen 2.907 N/A