Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2fwq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N GLU 4.A OE1 no hydrogen 2.841 N/A LYS 1.A NZ GLU 4.A OE1 no hydrogen 2.669 N/A GLU 4.A N LYS 1.A O no hydrogen 3.162 N/A LEU 5.A N GLY 2.A O no hydrogen 2.953 N/A PHE 6.A N GLU 3.A O no hydrogen 3.003 N/A THR 7.A OG1 GLU 4.A O no hydrogen 3.484 N/A VAL 10.A N GLY 33.A O no hydrogen 2.947 N/A ILE 12.A N GLY 31.A O no hydrogen 2.857 N/A LEU 13.A N LEU 114.A O no hydrogen 3.011 N/A VAL 14.A N GLY 29.A O no hydrogen 2.957 N/A GLU 15.A N ASN 116.A O no hydrogen 2.914 N/A LEU 16.A N VAL 27.A O no hydrogen 2.898 N/A ASP 17.A N ILE 118.A O no hydrogen 3.026 N/A GLY 18.A N PHE 25.A O no hydrogen 2.691 N/A ASP 19.A N LEU 120.A O no hydrogen 3.040 N/A VAL 20.A N HIS 23.A O no hydrogen 2.965 N/A ASN 21.A N GLY 122.A O no hydrogen 2.992 N/A ASN 21.A ND2 PHE 125.A O no hydrogen 2.943 N/A GLY 22.A N ASP 19.A OD1 no hydrogen 2.809 N/A HIS 23.A N VAL 20.A O no hydrogen 2.771 N/A LYS 24.A NZ ASP 19.A OD2 no hydrogen 2.897 N/A PHE 25.A N GLY 18.A O no hydrogen 2.960 N/A SER 26.A OG ASP 17.A OD1.A no hydrogen 2.663 N/A SER 26.A OG ASP 17.A OD2.B no hydrogen 3.454 N/A VAL 27.A N LEU 16.A O no hydrogen 2.968 N/A SER 28.A N ILE 45.A O no hydrogen 2.997 N/A SER 28.A OG GLU 15.A OE1 no hydrogen 2.645 N/A SER 28.A OG GLU 15.A OE2 no hydrogen 3.012 N/A GLY 29.A N VAL 14.A O no hydrogen 2.739 N/A GLU 30.A N LYS 43.A O no hydrogen 3.019 N/A GLY 31.A N ILE 12.A O no hydrogen 3.212 N/A GLU 32.A N THR 41.A O no hydrogen 2.993 N/A GLY 33.A N VAL 10.A O no hydrogen 2.964 N/A ASP 34.A N LYS 39.A O no hydrogen 2.820 N/A THR 36.A OG1 THR 7.A O no hydrogen 3.382 N/A TYR 37.A N ASP 34.A O no hydrogen 3.031 N/A GLY 38.A N ALA 35.A O no hydrogen 3.032 N/A LYS 39.A N ASP 34.A O no hydrogen 3.183 N/A LEU 40.A N GLU 217.A O no hydrogen 2.896 N/A THR 41.A N GLU 32.A O no hydrogen 3.071 N/A THR 41.A OG1 GLU 32.A O no hydrogen 3.463 N/A LEU 42.A N LEU 215.A O no hydrogen 2.926 N/A LYS 43.A N GLU 30.A O no hydrogen 2.970 N/A LYS 43.A NZ ASP 205.A OD2 no hydrogen 2.843 N/A LYS 43.A NZ GLU 208.A OE1 no hydrogen 2.778 N/A PHE 44.A N MET 213.A O no hydrogen 2.788 N/A ILE 45.A N SER 28.A O no hydrogen 2.835 N/A CYS 46.A N ASP 211.A O no hydrogen 2.829 N/A CYS 46.A SG SER 26.A O no hydrogen 3.606 N/A CYS 46.A SG THR 48.A OG1 no hydrogen 3.380 N/A CYS 46.A SG GLY 49.A O no hydrogen 3.196 N/A THR 47.A N SER 26.A O no hydrogen 3.003 N/A THR 47.A OG1 SER 26.A O no hydrogen 3.504 N/A LEU 51.A N ASP 211.A OD2 no hydrogen 2.818 N/A TRP 55.A NE1 ASP 211.A OD1 no hydrogen 2.852 N/A THR 57.A N PRO 54.A O no hydrogen 2.931 N/A THR 57.A OG1 PRO 54.A O no hydrogen 2.808 N/A THR 57.A OG1 TYR 101.A OH no hydrogen 2.844 N/A LEU 58.A N TRP 55.A O no hydrogen 3.009 N/A VAL 59.A N PRO 56.A O no hydrogen 3.354 N/A THR 60.A OG1 HIS 176.A NE2 no hydrogen 2.698 N/A LEU 62.A N LEU 58.A O no hydrogen 2.868 N/A GLN 64.A NE2 GLN 178.A OE1 no hydrogen 3.647 N/A PHE 66.A N VAL 63.A O no hydrogen 3.013 N/A SER 67.A N GLN 64.A O no hydrogen 3.207 N/A SER 67.A OG GLN 64.A O no hydrogen 2.877 N/A ARG 68.A N VAL 219.A O no hydrogen 2.951 N/A TYR 69.A OH HIS 194.A NE2 no hydrogen 2.728 N/A MET 73.A N PRO 70.A O no hydrogen 2.799 N/A LYS 74.A N ASP 71.A O no hydrogen 3.237 N/A LYS 74.A NZ ASP 71.A O no hydrogen 3.120 N/A LYS 74.A NZ ASP 71.A OD1 no hydrogen 3.358 N/A LYS 74.A NZ ASP 71.A OD2 no hydrogen 3.493 N/A GLN 75.A N GLN 75.A OE1 no hydrogen 2.726 N/A HIS 76.A N MET 73.A O no hydrogen 2.924 N/A ASP 77.A N LYS 74.A O no hydrogen 3.311 N/A PHE 78.A N HIS 76.A O no hydrogen 3.267 N/A LYS 80.A N ASP 77.A OD1 no hydrogen 3.229 N/A LYS 80.A NZ CYS 65.A O no hydrogen 2.914 N/A LYS 80.A NZ SER 67.A O no hydrogen 2.801 N/A LYS 80.A NZ ASP 77.A OD2 no hydrogen 2.784 N/A SER 81.A N ASP 77.A O no hydrogen 3.387 N/A SER 81.A OG PHE 78.A O no hydrogen 2.779 N/A ALA 82.A N PHE 78.A O no hydrogen 3.175 N/A MET 83.A N LYS 80.A O no hydrogen 3.083 N/A GLU 85.A N GLU 85.A OE2 no hydrogen 2.759 N/A GLY 86.A N ALA 82.A O no hydrogen 2.750 N/A TYR 87.A N VAL 107.A O no hydrogen 2.979 N/A VAL 88.A N THR 181.A O no hydrogen 2.809 N/A GLN 89.A N ALA 105.A O no hydrogen 2.867 N/A GLU 90.A N GLN 179.A O no hydrogen 2.886 N/A ARG 91.A N THR 103.A O no hydrogen 3.051 N/A ARG 91.A NE GLN 178.A OE1 no hydrogen 2.885 N/A ARG 91.A NH1 THR 60.A O no hydrogen 2.821 N/A ARG 91.A NH2 GLN 178.A OE1 no hydrogen 2.846 N/A THR 92.A N TYR 177.A O no hydrogen 2.984 N/A ILE 93.A N TYR 101.A O no hydrogen 2.809 N/A SER 94.A N ASP 175.A O no hydrogen 2.815 N/A PHE 95.A N GLY 99.A O no hydrogen 2.936 N/A LYS 96.A N LEU 173.A O no hydrogen 2.955 N/A ASP 98.A N PHE 95.A O no hydrogen 2.954 N/A GLY 99.A N ASP 98.A OD1 no hydrogen 2.829 N/A ASN 100.A N ILE 123.A O no hydrogen 3.072 N/A TYR 101.A N ILE 93.A O no hydrogen 2.885 N/A TYR 101.A OH THR 57.A OG1 no hydrogen 2.844 N/A LYS 102.A N LYS 121.A O no hydrogen 2.743 N/A LYS 102.A NZ THR 92.A OG1 no hydrogen 3.046 N/A THR 103.A N ARG 91.A O no hydrogen 2.947 N/A ARG 104.A N GLU 119.A O no hydrogen 2.979 N/A ARG 104.A NH1 GLU 106.A OE2 no hydrogen 3.214 N/A ALA 105.A N GLN 89.A O no hydrogen 2.900 N/A GLU 106.A N ARG 117.A O no hydrogen 2.861 N/A VAL 107.A N TYR 87.A O no hydrogen 2.998 N/A LYS 108.A N VAL 115.A O no hydrogen 2.987 N/A PHE 109.A N PRO 84.A O no hydrogen 3.248 N/A GLU 110.A N THR 113.A O no hydrogen 2.835 N/A THR 113.A N GLU 110.A O no hydrogen 3.153 N/A LEU 114.A N PRO 11.A O no hydrogen 2.973 N/A VAL 115.A N LYS 108.A O no hydrogen 2.914 N/A ASN 116.A N LEU 13.A O no hydrogen 2.939 N/A ASN 116.A ND2 THR 61.A O no hydrogen 3.335 N/A ASN 116.A ND2 LEU 62.A O no hydrogen 2.928 N/A ARG 117.A N GLU 106.A O no hydrogen 3.033 N/A ILE 118.A N GLU 15.A O no hydrogen 2.860 N/A GLU 119.A N ARG 104.A O no hydrogen 2.880 N/A LEU 120.A N ASP 17.A O no hydrogen 2.965 N/A LYS 121.A N LYS 102.A O no hydrogen 2.847 N/A GLY 122.A N ASP 19.A O no hydrogen 2.739 N/A ILE 123.A N ASN 100.A O no hydrogen 2.997 N/A PHE 125.A N ASN 21.A OD1 no hydrogen 3.152 N/A LYS 126.A N ASP 98.A OD1 no hydrogen 2.849 N/A LYS 126.A NZ ASP 97.A O no hydrogen 2.484 N/A GLY 129.A N LYS 126.A O no hydrogen 3.014 N/A ASN 130.A ND2 GLN 172.A OE1 no hydrogen 2.932 N/A GLY 133.A N GLY 129.A O no hydrogen 2.789 N/A HIS 134.A N ILE 131.A O no hydrogen 3.039 N/A LYS 135.A N ASN 130.A O no hydrogen 3.000 N/A LYS 135.A NZ ASP 128.A O no hydrogen 2.997 N/A LYS 135.A NZ ASP 128.A OD1 no hydrogen 3.415 N/A GLU 137.A N ASN 165.A O no hydrogen 2.957 N/A TYR 138.A OH SER 203.A O no hydrogen 2.697 N/A ASN 139.A ND2 GLU 137.A OE1 no hydrogen 2.884 N/A ASN 141.A ND2 ARG 163.A O no hydrogen 2.821 N/A ASN 141.A ND2 ASN 165.A OD1 no hydrogen 2.976 N/A GLY 143.A N THR 198.A O no hydrogen 3.246 N/A ASN 144.A ND2 TYR 146.A OH no hydrogen 3.171 N/A VAL 145.A N LEU 196.A O no hydrogen 2.859 N/A ILE 147.A N HIS 194.A O no hydrogen 2.862 N/A THR 148.A N LYS 157.A O no hydrogen 2.977 N/A THR 148.A OG1.A LYS 157.A O no hydrogen 3.540 N/A THR 148.A OG1.B ASN 193.A OD1 no hydrogen 2.867 N/A ASP 150.A N GLY 155.A O no hydrogen 2.860 N/A LYS 153.A N ASP 150.A O no hydrogen 3.115 N/A LYS 153.A N ASP 150.A OD2 no hydrogen 3.303 N/A ASN 154.A N LYS 151.A O no hydrogen 2.907 N/A GLY 155.A N ASP 150.A O no hydrogen 3.080 N/A ILE 156.A N ASN 180.A O no hydrogen 3.149 N/A LYS 157.A N THR 148.A O no hydrogen 2.874 N/A ALA 158.A N GLN 178.A O no hydrogen 2.868 N/A ASN 159.A N TYR 146.A O no hydrogen 3.079 N/A PHE 160.A N HIS 176.A O no hydrogen 3.130 N/A LYS 161.A NZ ASP 175.A OD1 no hydrogen 2.925 N/A ILE 162.A N ALA 174.A O no hydrogen 2.961 N/A HIS 164.A N GLN 172.A O no hydrogen 2.902 N/A ASN 165.A ND2 ASN 139.A OD1 no hydrogen 3.263 N/A ASN 165.A ND2 ASN 141.A OD1 no hydrogen 3.671 N/A ILE 166.A N SER 170.A O no hydrogen 2.922 N/A GLU 167.A N LYS 135.A O no hydrogen 2.934 N/A GLY 169.A N ILE 166.A O no hydrogen 3.066 N/A SER 170.A N ASP 168.A OD1 no hydrogen 2.978 N/A VAL 171.A N SER 170.A OG no hydrogen 2.751 N/A GLN 172.A N HIS 164.A O no hydrogen 2.826 N/A GLN 172.A NE2 LYS 96.A O no hydrogen 2.912 N/A GLN 172.A NE2 LEU 173.A O no hydrogen 2.990 N/A ALA 174.A N ILE 162.A O no hydrogen 2.800 N/A ASP 175.A N SER 94.A O no hydrogen 2.956 N/A HIS 176.A N PHE 160.A O no hydrogen 2.779 N/A HIS 176.A ND1 ALA 174.A O no hydrogen 2.896 N/A HIS 176.A NE2 THR 60.A OG1 no hydrogen 2.698 N/A TYR 177.A N THR 92.A O no hydrogen 3.074 N/A GLN 178.A N ALA 158.A O no hydrogen 2.857 N/A GLN 178.A NE2 GLN 64.A OE1 no hydrogen 2.792 N/A GLN 178.A NE2 ASN 180.A OD1 no hydrogen 2.889 N/A GLN 179.A N GLU 90.A O no hydrogen 2.929 N/A GLN 179.A NE2 ASP 150.A OD1 no hydrogen 3.396 N/A ASN 180.A N ILE 156.A O no hydrogen 2.841 N/A ASN 180.A ND2 GLN 89.A OE1 no hydrogen 2.879 N/A THR 181.A N VAL 88.A O no hydrogen 2.961 N/A THR 181.A OG1.B LYS 153.A O no hydrogen 3.097 N/A ILE 183.A N GLY 86.A O no hydrogen 2.811 N/A LEU 189.A N SER 81.A OG no hydrogen 2.895 N/A ASP 192.A N HIS 76.A ND1 no hydrogen 3.050 N/A HIS 194.A N ILE 147.A O no hydrogen 3.233 N/A HIS 194.A ND1 ASP 192.A O no hydrogen 2.797 N/A HIS 194.A NE2 TYR 69.A OH no hydrogen 2.728 N/A TYR 195.A N ALA 222.A O no hydrogen 3.014 N/A LEU 196.A N VAL 145.A O no hydrogen 2.871 N/A SER 197.A N THR 220.A O no hydrogen 2.790 N/A SER 197.A OG.B ASN 144.A OD1 no hydrogen 2.983 N/A THR 198.A N GLY 143.A O no hydrogen 2.865 N/A THR 198.A OG1 GLY 143.A O no hydrogen 3.143 N/A GLN 199.A N PHE 218.A O no hydrogen 2.977 N/A SER 200.A OG GLU 217.A OE2 no hydrogen 2.644 N/A ALA 201.A N LEU 216.A O no hydrogen 2.846 N/A SER 203.A N VAL 214.A O no hydrogen 2.906 N/A LYS 204.A NZ HIS 212.A O no hydrogen 2.777 N/A ASP 205.A N HIS 212.A NE2 no hydrogen 2.808 N/A ASN 207.A N ASP 205.A OD1 no hydrogen 2.988 N/A GLU 208.A N ASP 205.A O no hydrogen 3.020 N/A ARG 210.A N GLU 208.A OE2 no hydrogen 2.854 N/A ARG 210.A NE GLU 208.A OE2 no hydrogen 2.868 N/A ARG 210.A NH2 GLU 208.A OE1 no hydrogen 2.961 N/A ARG 210.A NH2 GLU 208.A OE2 no hydrogen 3.557 N/A HIS 212.A ND1 ARG 210.A O no hydrogen 2.735 N/A MET 213.A N PHE 44.A O no hydrogen 2.869 N/A VAL 214.A N SER 203.A O no hydrogen 3.012 N/A LEU 215.A N LEU 42.A O no hydrogen 2.863 N/A LEU 216.A N ALA 201.A O no hydrogen 3.048 N/A GLU 217.A N LEU 40.A O no hydrogen 2.998 N/A PHE 218.A N GLN 199.A O no hydrogen 2.964 N/A VAL 219.A N GLY 38.A O no hydrogen 2.869 N/A THR 220.A N SER 197.A O no hydrogen 2.957 N/A ALA 221.A N ARG 68.A O no hydrogen 2.835 N/A ALA 222.A N TYR 195.A O no hydrogen 2.821 N/A MET 228.A N HIS 226.A ND1 no hydrogen 2.761 N/A GLU 230.A N GLY 227.A O no hydrogen 3.410 N/A LEU 231.A N MET 228.A O no hydrogen 2.922 N/A TYR 232.A N ASP 229.A O no hydrogen 3.342 N/A