Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qu1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 7.A N SER 4.A OG no hydrogen 2.972 N/A GLU 8.A N LYS 5.A O no hydrogen 3.296 N/A LEU 9.A N GLY 6.A O no hydrogen 2.915 N/A PHE 10.A N GLU 7.A O no hydrogen 3.124 N/A THR 11.A OG1 GLU 8.A O no hydrogen 3.494 N/A VAL 14.A N GLY 37.A O no hydrogen 2.922 N/A ILE 16.A N GLY 35.A O no hydrogen 2.919 N/A LEU 17.A N LEU 116.A O no hydrogen 2.924 N/A VAL 18.A N GLY 33.A O no hydrogen 2.921 N/A GLU 19.A N ASN 118.A O no hydrogen 2.903 N/A LEU 20.A N VAL 31.A O no hydrogen 2.952 N/A ASP 21.A N ILE 120.A O no hydrogen 2.991 N/A GLY 22.A N PHE 29.A O no hydrogen 2.905 N/A ASP 23.A N LEU 122.A O no hydrogen 3.038 N/A VAL 24.A N HIS 27.A O no hydrogen 2.830 N/A ASN 25.A N GLY 124.A O no hydrogen 2.910 N/A ASN 25.A ND2 PHE 127.A O no hydrogen 2.925 N/A GLY 26.A N ASP 23.A OD1 no hydrogen 2.840 N/A HIS 27.A N VAL 24.A O no hydrogen 2.839 N/A LYS 28.A NZ.A ASP 23.A OD2 no hydrogen 2.715 N/A PHE 29.A N GLY 22.A O no hydrogen 2.974 N/A SER 30.A N THR 52.A OG1 no hydrogen 2.936 N/A SER 30.A OG ASP 21.A OD2 no hydrogen 2.851 N/A VAL 31.A N LEU 20.A O no hydrogen 2.931 N/A SER 32.A N ILE 49.A O.A no hydrogen 2.898 N/A SER 32.A N ILE 49.A O.B no hydrogen 2.872 N/A SER 32.A OG GLU 19.A OE1 no hydrogen 3.242 N/A SER 32.A OG GLU 19.A OE2 no hydrogen 2.800 N/A GLY 33.A N VAL 18.A O no hydrogen 2.691 N/A GLU 34.A N LYS 47.A O no hydrogen 3.051 N/A GLY 35.A N ILE 16.A O no hydrogen 3.175 N/A GLU 36.A N.A THR 45.A O no hydrogen 2.946 N/A GLU 36.A N.B THR 45.A O no hydrogen 2.939 N/A GLY 37.A N VAL 14.A O no hydrogen 2.857 N/A ASP 38.A N LYS 43.A O no hydrogen 2.776 N/A THR 40.A OG1 THR 11.A O no hydrogen 3.237 N/A TYR 41.A N ASP 38.A O no hydrogen 2.990 N/A GLY 42.A N ALA 39.A O no hydrogen 2.986 N/A LYS 43.A N ASP 38.A O no hydrogen 3.035 N/A LEU 44.A N GLU 218.A O no hydrogen 2.901 N/A THR 45.A N GLU 36.A O.A no hydrogen 3.007 N/A THR 45.A N GLU 36.A O.B no hydrogen 3.005 N/A LEU 46.A N LEU 216.A O no hydrogen 3.044 N/A LYS 47.A N GLU 34.A O no hydrogen 2.916 N/A LYS 47.A NZ ASP 207.A OD2 no hydrogen 2.716 N/A LYS 47.A NZ GLU 210.A OE1 no hydrogen 2.957 N/A ILE 49.A N.A SER 32.A O no hydrogen 2.798 N/A ILE 49.A N.B SER 32.A O no hydrogen 2.777 N/A CYS 50.A N ASP 213.A O no hydrogen 2.872 N/A CYS 50.A SG SER 30.A O no hydrogen 3.607 N/A CYS 50.A SG THR 52.A OG1 no hydrogen 3.415 N/A CYS 50.A SG GLY 53.A O no hydrogen 3.218 N/A THR 51.A N SER 30.A O no hydrogen 3.038 N/A LEU 55.A N ASP 213.A OD2 no hydrogen 2.852 N/A TRP 59.A NE1 ASP 213.A OD1 no hydrogen 2.899 N/A THR 61.A N PRO 58.A O no hydrogen 2.979 N/A THR 61.A OG1 PRO 58.A O no hydrogen 2.780 N/A THR 61.A OG1 TYR 103.A OH no hydrogen 2.844 N/A LEU 62.A N TRP 59.A O no hydrogen 2.827 N/A VAL 63.A N PRO 60.A O no hydrogen 3.231 N/A THR 64.A OG1 HIS 178.A NE2 no hydrogen 2.707 N/A LEU 66.A N LEU 62.A O no hydrogen 2.963 N/A PHE 70.A N VAL 67.A O no hydrogen 2.915 N/A SER 71.A N GLN 68.A O no hydrogen 3.198 N/A SER 71.A OG GLN 68.A O no hydrogen 2.920 N/A ARG 72.A N VAL 220.A O no hydrogen 2.881 N/A TYR 73.A OH HIS 196.A NE2 no hydrogen 2.766 N/A HIS 76.A NE2 ILE 225.A O no hydrogen 2.761 N/A LYS 77.A NZ.A TYR 73.A O no hydrogen 3.145 N/A GLN 78.A N GLN 78.A OE1 no hydrogen 2.922 N/A PHE 81.A N HIS 79.A O no hydrogen 3.248 N/A LYS 83.A N ASP 80.A OD1 no hydrogen 3.227 N/A LYS 83.A NZ CYS 69.A O no hydrogen 2.967 N/A LYS 83.A NZ SER 71.A O no hydrogen 2.816 N/A LYS 83.A NZ ASP 80.A OD2 no hydrogen 2.797 N/A SER 84.A OG PHE 81.A O no hydrogen 2.760 N/A ALA 85.A N PHE 81.A O no hydrogen 3.248 N/A GLU 87.A N GLU 87.A OE2 no hydrogen 2.750 N/A GLY 88.A N ALA 85.A O no hydrogen 2.747 N/A TYR 89.A N VAL 109.A O no hydrogen 2.919 N/A VAL 90.A N THR 183.A O no hydrogen 2.777 N/A GLN 91.A N ALA 107.A O no hydrogen 2.878 N/A GLU 92.A N GLN 181.A O no hydrogen 2.803 N/A ARG 93.A N THR 105.A O no hydrogen 3.152 N/A ARG 93.A NE GLN 180.A OE1 no hydrogen 2.844 N/A ARG 93.A NH1 THR 64.A O no hydrogen 2.789 N/A ARG 93.A NH2 GLN 180.A OE1 no hydrogen 2.866 N/A THR 94.A N TYR 179.A O no hydrogen 3.007 N/A ILE 95.A N TYR 103.A O no hydrogen 2.793 N/A SER 96.A N ASP 177.A O no hydrogen 2.901 N/A PHE 97.A N GLY 101.A O no hydrogen 2.961 N/A LYS 98.A N LEU 175.A O no hydrogen 2.919 N/A ASP 100.A N PHE 97.A O no hydrogen 2.909 N/A GLY 101.A N ASP 100.A OD1 no hydrogen 2.954 N/A ASN 102.A N ILE 125.A O no hydrogen 3.036 N/A TYR 103.A N ILE 95.A O no hydrogen 2.833 N/A TYR 103.A OH THR 61.A OG1 no hydrogen 2.844 N/A LYS 104.A N LYS 123.A O no hydrogen 2.745 N/A LYS 104.A NZ THR 94.A OG1 no hydrogen 2.797 N/A THR 105.A N ARG 93.A O no hydrogen 2.977 N/A ARG 106.A N GLU 121.A O no hydrogen 3.051 N/A ARG 106.A NH1 GLU 108.A OE2 no hydrogen 3.120 N/A ARG 106.A NH2 GLU 108.A OE2 no hydrogen 3.371 N/A ALA 107.A N GLN 91.A O no hydrogen 2.803 N/A GLU 108.A N ARG 119.A O no hydrogen 2.928 N/A VAL 109.A N TYR 89.A O no hydrogen 2.955 N/A LYS 110.A N VAL 117.A O no hydrogen 3.009 N/A PHE 111.A N PRO 86.A O no hydrogen 3.202 N/A GLU 112.A N THR 115.A O no hydrogen 2.837 N/A THR 115.A N GLU 112.A O no hydrogen 3.203 N/A LEU 116.A N PRO 15.A O no hydrogen 2.909 N/A VAL 117.A N LYS 110.A O no hydrogen 2.879 N/A ASN 118.A N LEU 17.A O no hydrogen 2.888 N/A ASN 118.A ND2 THR 65.A O no hydrogen 3.345 N/A ASN 118.A ND2 LEU 66.A O no hydrogen 2.820 N/A ARG 119.A N GLU 108.A O no hydrogen 2.990 N/A ILE 120.A N GLU 19.A O no hydrogen 2.795 N/A GLU 121.A N ARG 106.A O no hydrogen 2.950 N/A LEU 122.A N ASP 21.A O no hydrogen 2.851 N/A LYS 123.A N LYS 104.A O no hydrogen 2.845 N/A GLY 124.A N ASP 23.A O no hydrogen 2.750 N/A ILE 125.A N ASN 102.A O no hydrogen 3.061 N/A PHE 127.A N ASN 25.A OD1 no hydrogen 3.014 N/A LYS 128.A N ASP 100.A OD1 no hydrogen 2.770 N/A LYS 128.A NZ ASP 99.A O no hydrogen 2.818 N/A LYS 128.A NZ ASP 99.A OD1.B no hydrogen 2.996 N/A GLY 131.A N LYS 128.A O no hydrogen 3.036 N/A ASN 132.A ND2 GLN 174.A OE1 no hydrogen 2.888 N/A GLY 135.A N GLY 131.A O no hydrogen 2.983 N/A HIS 136.A N ILE 133.A O no hydrogen 2.913 N/A LYS 137.A N ASN 132.A O no hydrogen 2.923 N/A LYS 137.A NZ ASP 130.A O no hydrogen 2.945 N/A LYS 137.A NZ ASP 130.A OD1 no hydrogen 2.898 N/A GLU 139.A N ASN 167.A O no hydrogen 2.950 N/A TYR 140.A OH SER 205.A O no hydrogen 2.743 N/A ASN 141.A ND2 GLU 139.A OE1 no hydrogen 2.885 N/A ASN 143.A ND2 ARG 165.A O no hydrogen 2.887 N/A ASN 143.A ND2 ASN 167.A OD1 no hydrogen 3.128 N/A SER 144.A OG.C THR 200.A O no hydrogen 2.519 N/A HIS 145.A N THR 200.A O no hydrogen 3.299 N/A HIS 145.A N THR 200.A OG1 no hydrogen 3.133 N/A ASN 146.A ND2 TYR 148.A OH no hydrogen 3.368 N/A VAL 147.A N LEU 198.A O no hydrogen 2.735 N/A TYR 148.A N ASN 161.A O no hydrogen 3.185 N/A ILE 149.A N HIS 196.A O no hydrogen 2.810 N/A THR 150.A N LYS 159.A O no hydrogen 2.948 N/A ASP 152.A N GLY 157.A O no hydrogen 2.717 N/A LYS 155.A NZ GLN 181.A OE1.A no hydrogen 3.523 N/A ASN 156.A N LYS 153.A O no hydrogen 3.001 N/A GLY 157.A N ASP 152.A O no hydrogen 2.957 N/A ILE 158.A N ASN 182.A O no hydrogen 3.081 N/A LYS 159.A N THR 150.A O no hydrogen 2.914 N/A ALA 160.A N GLN 180.A O no hydrogen 2.947 N/A ASN 161.A N TYR 148.A O no hydrogen 2.916 N/A PHE 162.A N HIS 178.A O no hydrogen 3.228 N/A LYS 163.A NZ ASP 177.A OD1 no hydrogen 2.623 N/A ILE 164.A N ALA 176.A O no hydrogen 2.905 N/A ARG 165.A N HIS 145.A NE2 no hydrogen 3.072 N/A ARG 165.A NH1 SER 144.A O no hydrogen 3.129 N/A HIS 166.A N GLN 174.A O no hydrogen 2.871 N/A ILE 168.A N SER 172.A O no hydrogen 2.913 N/A GLU 169.A N LYS 137.A O no hydrogen 2.863 N/A GLY 171.A N ILE 168.A O no hydrogen 2.905 N/A SER 172.A N ASP 170.A OD1 no hydrogen 2.875 N/A VAL 173.A N SER 172.A OG no hydrogen 2.732 N/A GLN 174.A N HIS 166.A O no hydrogen 2.782 N/A GLN 174.A NE2 LYS 98.A O no hydrogen 2.877 N/A GLN 174.A NE2 LEU 175.A O no hydrogen 3.065 N/A ALA 176.A N ILE 164.A O no hydrogen 2.826 N/A ASP 177.A N SER 96.A O no hydrogen 2.935 N/A HIS 178.A N PHE 162.A O no hydrogen 2.816 N/A HIS 178.A ND1 ALA 176.A O no hydrogen 2.945 N/A HIS 178.A NE2 THR 64.A OG1 no hydrogen 2.707 N/A TYR 179.A N THR 94.A O no hydrogen 3.052 N/A GLN 180.A N ALA 160.A O no hydrogen 2.976 N/A GLN 180.A NE2 GLN 68.A OE1 no hydrogen 2.921 N/A GLN 180.A NE2 ASN 182.A OD1 no hydrogen 2.854 N/A GLN 181.A N GLU 92.A O no hydrogen 2.828 N/A GLN 181.A NE2.A GLU 92.A OE2 no hydrogen 3.518 N/A ASN 182.A N ILE 158.A O no hydrogen 3.024 N/A ASN 182.A ND2 GLN 91.A OE1 no hydrogen 2.921 N/A THR 183.A N VAL 90.A O no hydrogen 2.965 N/A ILE 185.A N GLY 88.A O no hydrogen 2.897 N/A LEU 191.A N SER 84.A OG no hydrogen 2.810 N/A ASP 194.A N HIS 79.A ND1 no hydrogen 3.089 N/A HIS 196.A N ILE 149.A O no hydrogen 3.291 N/A HIS 196.A ND1 ASP 194.A O no hydrogen 2.857 N/A HIS 196.A NE2 TYR 73.A OH no hydrogen 2.766 N/A TYR 197.A N ALA 223.A O no hydrogen 3.067 N/A LEU 198.A N VAL 147.A O no hydrogen 2.860 N/A SER 199.A N THR 221.A O no hydrogen 2.828 N/A THR 200.A N HIS 145.A O no hydrogen 2.795 N/A THR 200.A OG1 HIS 145.A O no hydrogen 3.194 N/A GLN 201.A N PHE 219.A O no hydrogen 2.995 N/A SER 202.A OG GLU 218.A OE1 no hydrogen 3.053 N/A ALA 203.A N LEU 217.A O no hydrogen 2.792 N/A SER 205.A N VAL 215.A O no hydrogen 2.859 N/A LYS 206.A NZ HIS 214.A O no hydrogen 2.831 N/A ASP 207.A N HIS 214.A NE2 no hydrogen 2.806 N/A ASN 209.A N ASP 207.A OD1 no hydrogen 3.128 N/A GLU 210.A N ASP 207.A O no hydrogen 3.034 N/A ARG 212.A N GLU 210.A OE2 no hydrogen 2.881 N/A ARG 212.A NE GLU 210.A OE2 no hydrogen 2.804 N/A ARG 212.A NH2 GLU 210.A OE1 no hydrogen 3.013 N/A HIS 214.A ND1 ARG 212.A O no hydrogen 2.962 N/A LEU 216.A N LEU 46.A O no hydrogen 2.850 N/A LEU 217.A N ALA 203.A O no hydrogen 2.981 N/A GLU 218.A N LEU 44.A O no hydrogen 2.968 N/A PHE 219.A N GLN 201.A O no hydrogen 2.873 N/A VAL 220.A N GLY 42.A O no hydrogen 2.901 N/A THR 221.A N SER 199.A O no hydrogen 3.039 N/A ALA 222.A N ARG 72.A O no hydrogen 2.783 N/A ALA 223.A N TYR 197.A O no hydrogen 2.813 N/A