Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jfj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 2.A N GLN 31.A O no hydrogen 3.097 N/A PHE 3.A N GLN 31.A OE1 no hydrogen 3.224 N/A LEU 4.A N GLN 31.A O no hydrogen 2.959 N/A LYS 5.A N GLY 2.A O no hydrogen 3.170 N/A GLY 6.A N GLY 32.A O no hydrogen 2.958 N/A LYS 7.A N LEU 4.A O no hydrogen 2.768 N/A LYS 8.A N ASP 86.A OD2 no hydrogen 2.903 N/A LYS 8.A NZ LEU 82.A O no hydrogen 2.656 N/A GLY 9.A N THR 34.A O no hydrogen 2.934 N/A LEU 10.A N PHE 87.A O no hydrogen 2.954 N/A ILE 11.A N ALA 36.A O no hydrogen 2.813 N/A VAL 12.A N VAL 89.A O no hydrogen 2.874 N/A ALA 15.A N SER 19.A OG no hydrogen 2.665 N/A ASN 16.A N SER 19.A OG no hydrogen 3.159 N/A LYS 18.A N ASN 16.A OD1 no hydrogen 2.791 N/A SER 19.A N ASN 16.A O no hydrogen 2.999 N/A SER 19.A OG ASN 16.A O no hydrogen 3.324 N/A TYR 22.A N SER 19.A O no hydrogen 2.970 N/A TYR 22.A OH GLU 54.A OE1 no hydrogen 2.686 N/A GLY 23.A N SER 19.A O no hydrogen 3.161 N/A ILE 24.A N ILE 20.A O no hydrogen 2.982 N/A ALA 25.A N ALA 21.A O no hydrogen 2.868 N/A GLN 26.A N TYR 22.A O no hydrogen 2.859 N/A SER 27.A N GLY 23.A O no hydrogen 3.072 N/A SER 27.A OG ASN 226.A OD1 no hydrogen 2.714 N/A CYS 28.A N ILE 24.A O no hydrogen 2.921 N/A CYS 28.A SG ILE 24.A O no hydrogen 3.291 N/A PHE 29.A N ALA 25.A O no hydrogen 2.815 N/A ASN 30.A N GLN 26.A O no hydrogen 3.025 N/A GLN 31.A N SER 27.A O no hydrogen 3.185 N/A GLN 31.A N CYS 28.A O no hydrogen 3.026 N/A GLY 32.A N PHE 29.A O no hydrogen 2.975 N/A ALA 33.A N CYS 28.A O no hydrogen 3.071 N/A THR 34.A N LYS 7.A O no hydrogen 2.845 N/A ALA 36.A N GLY 9.A O no hydrogen 2.858 N/A PHE 37.A N TYR 59.A O no hydrogen 2.877 N/A THR 38.A N ILE 11.A O no hydrogen 3.145 N/A TYR 39.A N TYR 61.A O no hydrogen 2.865 N/A LEU 44.A N ASN 41.A OD1 no hydrogen 2.880 N/A GLU 45.A N ASN 41.A O no hydrogen 2.579 N/A LYS 46.A N GLU 42.A O no hydrogen 3.211 N/A LYS 46.A N SER 43.A O no hydrogen 3.197 N/A ARG 49.A N GLU 45.A O no hydrogen 3.051 N/A ARG 49.A NE GLU 45.A OE1 no hydrogen 2.665 N/A ARG 49.A NH2 GLU 45.A OE1 no hydrogen 3.036 N/A ALA 52.A N VAL 48.A O no hydrogen 2.870 N/A GLN 53.A N ARG 49.A O no hydrogen 2.895 N/A GLU 54.A N PRO 50.A O no hydrogen 2.862 N/A LEU 55.A N ILE 51.A O no hydrogen 2.962 N/A ASN 56.A N GLN 53.A O no hydrogen 3.218 N/A SER 57.A N ALA 52.A O no hydrogen 2.739 N/A SER 57.A OG LEU 35.A O no hydrogen 2.580 N/A SER 57.A OG TYR 59.A O no hydrogen 3.458 N/A TYR 59.A N SER 57.A OG no hydrogen 3.202 N/A TYR 61.A N PHE 37.A O no hydrogen 2.847 N/A TYR 61.A OH ASP 81.A OD2 no hydrogen 2.598 N/A LEU 63.A N TYR 39.A O no hydrogen 2.910 N/A ASP 64.A N HIS 70.A ND1 no hydrogen 2.941 N/A SER 66.A N ASP 64.A OD1 no hydrogen 2.983 N/A SER 66.A OG ASP 64.A OD1 no hydrogen 2.661 N/A LYS 67.A N ASP 64.A O no hydrogen 2.867 N/A HIS 70.A N LYS 67.A O no hydrogen 3.214 N/A PHE 71.A N GLU 68.A O no hydrogen 3.299 N/A LEU 74.A N HIS 70.A O no hydrogen 3.323 N/A TYR 75.A N PHE 71.A O no hydrogen 2.881 N/A ASP 76.A N LYS 72.A O no hydrogen 2.940 N/A SER 77.A N PRO 73.A O no hydrogen 2.554 N/A SER 77.A OG PRO 73.A O no hydrogen 2.910 N/A VAL 78.A N LEU 74.A O no hydrogen 2.795 N/A LYS 79.A N TYR 75.A O no hydrogen 2.836 N/A LYS 80.A N ASP 76.A O no hydrogen 2.957 N/A ASP 81.A N SER 77.A O no hydrogen 2.702 N/A LEU 82.A N VAL 78.A O no hydrogen 2.786 N/A GLY 83.A N VAL 78.A O no hydrogen 2.935 N/A LEU 85.A N LEU 133.A O no hydrogen 2.842 N/A ASP 86.A N LYS 8.A O no hydrogen 2.630 N/A PHE 87.A N LYS 8.A O no hydrogen 2.958 N/A ILE 88.A N SER 139.A O no hydrogen 2.994 N/A VAL 89.A N LEU 10.A O no hydrogen 2.882 N/A HIS 90.A N LEU 141.A O no hydrogen 2.813 N/A HIS 90.A ND1 THR 142.A OG1 no hydrogen 2.861 N/A HIS 90.A NE2 SER 122.A OG no hydrogen 2.867 N/A SER 91.A N VAL 12.A O no hydrogen 2.953 N/A PHE 94.A N SER 119.A OG no hydrogen 3.035 N/A ALA 99.A N PRO 96.A O no hydrogen 2.895 N/A LEU 100.A N LYS 97.A O no hydrogen 2.966 N/A GLU 101.A N GLU 98.A O no hydrogen 3.113 N/A SER 103.A N GLU 106.A OE1 no hydrogen 3.360 N/A GLU 106.A N SER 103.A O no hydrogen 3.193 N/A THR 107.A N LEU 104.A O no hydrogen 2.988 N/A THR 107.A OG1 LEU 104.A O no hydrogen 2.658 N/A SER 108.A OG SER 110.A OG no hydrogen 3.355 N/A SER 110.A OG SER 108.A OG no hydrogen 3.355 N/A ALA 111.A N SER 108.A OG no hydrogen 2.996 N/A PHE 112.A N SER 108.A O no hydrogen 2.897 N/A ASN 113.A N LYS 109.A O no hydrogen 2.924 N/A THR 114.A N SER 110.A O no hydrogen 2.928 N/A THR 114.A OG1 SER 110.A O no hydrogen 3.060 N/A ALA 115.A N ALA 111.A O no hydrogen 2.949 N/A MET 116.A N PHE 112.A O no hydrogen 2.974 N/A GLU 117.A N ASN 113.A O no hydrogen 2.822 N/A ILE 118.A N THR 114.A O no hydrogen 2.967 N/A SER 119.A N ALA 115.A O no hydrogen 2.924 N/A SER 119.A OG PHE 94.A O no hydrogen 3.151 N/A SER 119.A OG ALA 115.A O no hydrogen 3.069 N/A VAL 120.A N MET 116.A O no hydrogen 2.952 N/A TYR 121.A N MET 116.A O no hydrogen 3.071 N/A SER 122.A N GLU 117.A O no hydrogen 3.117 N/A SER 122.A OG HIS 90.A NE2 no hydrogen 2.867 N/A SER 122.A OG ILE 118.A O no hydrogen 2.599 N/A LEU 123.A N VAL 120.A O no hydrogen 3.008 N/A GLU 125.A N TYR 121.A O no hydrogen 2.929 N/A LEU 126.A N SER 122.A O no hydrogen 2.865 N/A THR 127.A N LEU 123.A O no hydrogen 2.937 N/A THR 127.A OG1 LEU 123.A O no hydrogen 2.828 N/A ASN 128.A N ILE 124.A O no hydrogen 2.838 N/A THR 129.A N GLU 125.A O no hydrogen 2.892 N/A THR 129.A OG1 GLU 125.A O no hydrogen 2.791 N/A LEU 130.A N LEU 126.A O no hydrogen 2.982 N/A LYS 131.A NZ ASN 128.A OD1 no hydrogen 3.151 N/A LEU 133.A N LEU 130.A O no hydrogen 2.953 N/A LEU 134.A N LYS 131.A O no hydrogen 3.214 N/A ASN 135.A N LEU 85.A O no hydrogen 2.910 N/A ASN 135.A ND2 SER 84.A OG no hydrogen 2.860 N/A ASN 135.A ND2 ASP 86.A OD1 no hydrogen 2.841 N/A GLY 137.A N ASN 180.A O no hydrogen 2.826 N/A ALA 138.A N ASN 135.A O no hydrogen 3.062 N/A SER 139.A N ASP 86.A O no hydrogen 3.024 N/A SER 139.A OG LEU 231.A O no hydrogen 2.867 N/A VAL 140.A N ARG 182.A O no hydrogen 2.854 N/A LEU 141.A N ILE 88.A O no hydrogen 2.902 N/A THR 142.A N ASN 184.A O no hydrogen 2.944 N/A THR 142.A OG1 HIS 90.A ND1 no hydrogen 2.861 N/A THR 142.A OG1 HIS 90.A O no hydrogen 3.286 N/A SER 144.A N LEU 186.A O no hydrogen 2.847 N/A SER 144.A OG GLU 166.A OE1 no hydrogen 2.560 N/A SER 148.A N TYR 145.A O no hydrogen 3.010 N/A SER 148.A OG TYR 145.A O no hydrogen 3.118 N/A SER 148.A OG GLU 166.A OE1 no hydrogen 2.579 N/A THR 149.A N LEU 146.A O no hydrogen 2.999 N/A THR 149.A OG1 LEU 146.A O no hydrogen 3.494 N/A LYS 150.A N LEU 146.A O no hydrogen 3.043 N/A ASN 156.A ND2 ALA 99.A O no hydrogen 3.264 N/A ASN 156.A ND2 GLY 102.A O no hydrogen 2.986 N/A MET 158.A N TYR 155.A O no hydrogen 2.986 N/A GLY 159.A N ASN 156.A O no hydrogen 2.923 N/A ALA 161.A N VAL 157.A O no hydrogen 2.968 N/A LYS 162.A N MET 158.A O no hydrogen 2.896 N/A LYS 162.A NZ LEU 143.A O no hydrogen 2.679 N/A ALA 163.A N GLY 159.A O no hydrogen 3.134 N/A ALA 164.A N LEU 160.A O no hydrogen 2.971 N/A LEU 165.A N ALA 161.A O no hydrogen 2.727 N/A GLU 166.A N LYS 162.A O no hydrogen 2.871 N/A SER 167.A N ALA 163.A O no hydrogen 2.994 N/A ALA 168.A N ALA 164.A O no hydrogen 2.721 N/A VAL 169.A N LEU 165.A O no hydrogen 2.891 N/A ARG 170.A N GLU 166.A O no hydrogen 3.211 N/A TYR 171.A N SER 167.A O no hydrogen 3.049 N/A LEU 172.A N ALA 168.A O no hydrogen 2.709 N/A ALA 173.A N VAL 169.A O no hydrogen 2.739 N/A VAL 174.A N ARG 170.A O no hydrogen 3.121 N/A ASP 175.A N TYR 171.A O no hydrogen 2.901 N/A LEU 176.A N LEU 172.A O no hydrogen 2.725 N/A GLY 177.A N ALA 173.A O no hydrogen 2.927 N/A HIS 179.A N LEU 176.A O no hydrogen 2.937 N/A ASN 180.A N GLY 177.A O no hydrogen 2.788 N/A ILE 181.A N LEU 176.A O no hydrogen 3.196 N/A ARG 182.A N ALA 138.A O no hydrogen 2.872 N/A ARG 182.A NH1 LEU 231.A O no hydrogen 3.201 N/A ARG 182.A NH1 VAL 239.A O no hydrogen 3.012 N/A ARG 182.A NH2 LEU 231.A O no hydrogen 3.082 N/A VAL 183.A N SER 240.A OG no hydrogen 3.201 N/A ASN 184.A N VAL 140.A O no hydrogen 2.926 N/A ASN 184.A ND2 VAL 239.A O no hydrogen 3.245 N/A ALA 185.A N GLU 242.A O no hydrogen 2.880 N/A LEU 186.A N THR 142.A O no hydrogen 2.904 N/A SER 187.A N HIS 244.A O no hydrogen 2.803 N/A ALA 188.A N SER 144.A O no hydrogen 3.038 N/A GLY 189.A N VAL 246.A O no hydrogen 3.018 N/A THR 193.A OG1 SER 196.A OG no hydrogen 3.103 N/A SER 196.A N THR 193.A OG1 no hydrogen 2.943 N/A SER 196.A OG THR 193.A OG1 no hydrogen 3.103 N/A SER 197.A N THR 193.A O no hydrogen 2.869 N/A SER 197.A OG LEU 194.A O no hydrogen 2.520 N/A GLY 198.A N ALA 195.A O no hydrogen 2.863 N/A ILE 199.A N SER 196.A O no hydrogen 3.045 N/A ARG 203.A N ILE 199.A O no hydrogen 3.105 N/A ARG 203.A NE SER 197.A O no hydrogen 2.946 N/A MET 204.A N ALA 200.A O no hydrogen 3.218 N/A ILE 205.A N ASP 201.A O no hydrogen 3.422 N/A LEU 206.A N PHE 202.A O no hydrogen 2.973 N/A LYS 207.A N ARG 203.A O no hydrogen 2.985 N/A LYS 207.A NZ GLU 210.A OE1 no hydrogen 2.865 N/A TRP 208.A N MET 204.A O no hydrogen 2.843 N/A TRP 208.A NE1 TYR 250.A OH no hydrogen 2.918 N/A ASN 209.A N ILE 205.A O no hydrogen 3.076 N/A ASN 209.A ND2 ILE 205.A O no hydrogen 2.829 N/A GLU 210.A N LEU 206.A O no hydrogen 2.990 N/A ILE 211.A N LYS 207.A O no hydrogen 2.933 N/A ASN 212.A N TRP 208.A O no hydrogen 2.960 N/A ASN 212.A ND2 TRP 208.A O no hydrogen 2.959 N/A ALA 213.A N ASN 209.A O no hydrogen 2.807 N/A LEU 215.A N ALA 248.A O no hydrogen 3.264 N/A ARG 216.A N ALA 213.A O no hydrogen 2.838 N/A LYS 217.A NZ GLU 223.A OE2 no hydrogen 2.803 N/A ASN 218.A ND2 LEU 206.A O no hydrogen 3.150 N/A SER 220.A N GLU 223.A OE1 no hydrogen 2.995 N/A GLU 223.A N SER 220.A OG no hydrogen 2.958 N/A VAL 224.A N SER 220.A O no hydrogen 3.137 N/A GLY 225.A N LEU 221.A O no hydrogen 2.848 N/A ASN 226.A N GLU 222.A O no hydrogen 2.870 N/A ALA 227.A N GLU 223.A O no hydrogen 3.026 N/A GLY 228.A N VAL 224.A O no hydrogen 2.919 N/A MET 229.A N GLY 225.A O no hydrogen 2.867 N/A TYR 230.A N ASN 226.A O no hydrogen 2.930 N/A LEU 231.A N ALA 227.A O no hydrogen 3.039 N/A LEU 232.A N GLY 228.A O no hydrogen 2.918 N/A SER 233.A N TYR 230.A O no hydrogen 3.193 N/A SER 233.A OG TYR 230.A O no hydrogen 2.982 N/A LEU 235.A N SER 233.A OG no hydrogen 3.191 N/A SER 236.A N SER 233.A O no hydrogen 3.235 N/A SER 236.A OG TYR 230.A O no hydrogen 2.732 N/A SER 236.A OG LEU 231.A O no hydrogen 2.895 N/A SER 236.A OG SER 233.A O no hydrogen 2.986 N/A SER 237.A N SER 234.A O no hydrogen 3.072 N/A SER 237.A OG SER 234.A O no hydrogen 3.230 N/A VAL 239.A N SER 236.A O no hydrogen 2.788 N/A GLY 241.A N VAL 183.A O no hydrogen 2.715 N/A GLU 242.A N ASN 184.A OD1 no hydrogen 2.874 N/A HIS 244.A N ALA 185.A O no hydrogen 2.854 N/A VAL 246.A N SER 187.A O no hydrogen 2.878 N/A GLY 249.A N ASP 247.A OD1 no hydrogen 2.986 N/A TYR 250.A N ASP 247.A O no hydrogen 3.067 N/A HIS 251.A N ASP 247.A OD2 no hydrogen 2.839 N/A HIS 251.A ND1 ASP 247.A OD1 no hydrogen 3.098 N/A HIS 251.A ND1 ASP 247.A OD2 no hydrogen 3.048 N/A VAL 252.A N GLY 249.A O no hydrogen 3.043 N/A MET 253.A N TYR 250.A O no hydrogen 3.039 N/A ALA 257.A N ASN 212.A OD1 no hydrogen 2.774 N/A GLU 259.A N THR 266.A O no hydrogen 2.944 N/A ASN 263.A ND2 ASN 263.A O no hydrogen 2.173 N/A LYS 264.A N LYS 261.A O no hydrogen 2.747 N/A ALA 265.A N GLU 260.A OE2 no hydrogen 2.592 N/A THR 266.A N GLU 259.A O no hydrogen 3.226 N/A LEU 268.A N ALA 257.A O no hydrogen 2.972 N/A ASP 270.A N LEU 267.A O no hydrogen 3.095 N/A LEU 271.A N LEU 267.A O no hydrogen 3.348 N/A HIS 272.A N LEU 268.A O no hydrogen 3.223 N/A LYS 273.A N TRP 269.A O no hydrogen 3.497 N/A