Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6q4e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A N ARG 23.A O no hydrogen 2.728 N/A GLU 9.A N LYS 21.A O no hydrogen 2.788 N/A LYS 10.A NZ GLU 13.A OE2 no hydrogen 2.807 N/A ILE 11.A N VAL 19.A O no hydrogen 2.764 N/A GLY 12.A N VAL 19.A O no hydrogen 3.304 N/A GLY 14.A N GLY 17.A O no hydrogen 2.927 N/A THR 15.A OG1 ASP 121.A OD2 no hydrogen 3.493 N/A VAL 19.A N GLY 12.A O no hydrogen 2.858 N/A TYR 20.A N LEU 33.A O.A no hydrogen 2.777 N/A TYR 20.A N LEU 33.A O.B no hydrogen 2.764 N/A LYS 21.A N GLU 9.A O no hydrogen 2.677 N/A ALA 22.A N VAL 31.A O no hydrogen 2.951 N/A ARG 23.A N GLN 6.A O no hydrogen 2.799 N/A ARG 23.A NH2 GLY 28.A O no hydrogen 2.792 N/A ASN 24.A N GLU 29.A O.A no hydrogen 2.820 N/A ASN 24.A N GLU 29.A O.B no hydrogen 2.825 N/A LYS 25.A N ASN 4.A O no hydrogen 3.002 N/A LYS 25.A NZ GLN 6.A OE1 no hydrogen 3.506 N/A THR 27.A N ASN 24.A OD1 no hydrogen 2.990 N/A THR 27.A OG1 GLU 29.A OE1.A no hydrogen 2.770 N/A GLY 28.A N ASN 24.A O no hydrogen 2.821 N/A GLU 29.A N.A THR 27.A OG1 no hydrogen 3.202 N/A GLU 29.A N.B THR 27.A OG1 no hydrogen 3.218 N/A VAL 30.A N GLU 29.A OE2.B no hydrogen 2.748 N/A VAL 31.A N ALA 22.A O no hydrogen 2.820 N/A ALA 32.A N PHE 74.A O no hydrogen 2.873 N/A LEU 33.A N.A TYR 20.A O no hydrogen 2.817 N/A LEU 33.A N.B TYR 20.A O no hydrogen 2.803 N/A LYS 34.A N LEU 72.A O no hydrogen 2.811 N/A LYS 34.A NZ ASP 139.A OD1 no hydrogen 2.711 N/A LYS 34.A NZ ASP 139.A OD2 no hydrogen 3.314 N/A LYS 35.A N VAL 18.A O no hydrogen 3.007 N/A ILE 36.A N LEU 70.A O no hydrogen 2.936 N/A ARG 37.A N TYR 16.A O no hydrogen 2.588 N/A ARG 44.A N SER 40.A O no hydrogen 3.402 N/A GLU 45.A N.A THR 41.A O no hydrogen 3.284 N/A GLU 45.A N.B THR 41.A O no hydrogen 3.249 N/A ILE 46.A N ALA 42.A O no hydrogen 2.814 N/A SER 47.A N ILE 43.A O no hydrogen 2.936 N/A SER 47.A OG ILE 43.A O no hydrogen 2.676 N/A LEU 48.A N ARG 44.A O no hydrogen 3.116 N/A LEU 48.A N GLU 45.A O.A no hydrogen 3.241 N/A LEU 48.A N GLU 45.A O.B no hydrogen 3.256 N/A LEU 49.A N ILE 46.A O no hydrogen 2.889 N/A LYS 50.A N SER 47.A O no hydrogen 3.037 N/A GLU 51.A N LEU 48.A O no hydrogen 3.146 N/A LEU 52.A N.A LEU 49.A O no hydrogen 3.084 N/A LEU 52.A N.B LEU 49.A O no hydrogen 3.046 N/A ASN 53.A ND2 LYS 50.A O no hydrogen 3.624 N/A ASN 56.A N HIS 54.A ND1 no hydrogen 2.880 N/A ASN 56.A ND2 GLN 104.A OE1 no hydrogen 3.049 N/A ASN 56.A ND2 ILE 135.A O no hydrogen 2.883 N/A ILE 57.A N HIS 54.A O no hydrogen 3.056 N/A VAL 58.A N LEU 137.A O no hydrogen 2.885 N/A LYS 59.A N GLU 75.A OE2 no hydrogen 3.265 N/A LYS 59.A NZ LYS 50.A O no hydrogen 3.072 N/A LYS 59.A NZ LEU 60.A O no hydrogen 2.718 N/A LEU 61.A N VAL 73.A O no hydrogen 2.748 N/A ASP 62.A N VAL 73.A O no hydrogen 3.259 N/A ILE 64.A N TYR 71.A O no hydrogen 2.876 N/A THR 66.A N LYS 69.A O no hydrogen 3.051 N/A LYS 69.A N THR 66.A O no hydrogen 2.928 N/A TYR 71.A N ILE 64.A O no hydrogen 2.870 N/A LEU 72.A N LYS 34.A O no hydrogen 2.850 N/A VAL 73.A N ASP 62.A O no hydrogen 2.927 N/A PHE 74.A N ALA 32.A O no hydrogen 2.787 N/A GLU 75.A N LYS 59.A O no hydrogen 3.003 N/A GLN 79.A NE2 ARG 283.A O no hydrogen 3.299 N/A LEU 81.A N LEU 127.A O no hydrogen 2.841 N/A LYS 82.A NZ ASP 86.A OD1 no hydrogen 2.970 N/A LYS 82.A NZ ASP 86.A OD2 no hydrogen 2.911 N/A LYS 83.A N ASP 80.A OD1 no hydrogen 2.720 N/A PHE 84.A N ASP 80.A O no hydrogen 3.021 N/A MET 85.A N.A LEU 81.A O no hydrogen 2.831 N/A MET 85.A N.B LEU 81.A O no hydrogen 2.748 N/A ASP 86.A N LYS 82.A O no hydrogen 2.991 N/A ALA 87.A N LYS 83.A O no hydrogen 2.829 N/A SER 88.A N MET 85.A O.B no hydrogen 2.913 N/A SER 88.A OG PHE 84.A O no hydrogen 2.831 N/A ALA 89.A N ASP 86.A O no hydrogen 3.296 N/A THR 91.A OG1 SER 88.A O no hydrogen 3.366 N/A THR 91.A OG1 GLY 92.A O no hydrogen 3.361 N/A GLY 92.A N SER 88.A O no hydrogen 2.577 N/A ILE 98.A N PRO 94.A O no hydrogen 2.984 N/A LYS 99.A N LEU 95.A O no hydrogen 2.888 N/A LYS 99.A NZ PHE 271.A O no hydrogen 2.884 N/A LYS 99.A NZ ASP 274.A OD1 no hydrogen 2.614 N/A SER 100.A N PRO 96.A O no hydrogen 2.990 N/A TYR 101.A N LEU 97.A O no hydrogen 2.831 N/A LEU 102.A N ILE 98.A O no hydrogen 2.884 N/A PHE 103.A N LYS 99.A O no hydrogen 2.917 N/A GLN 104.A N SER 100.A O no hydrogen 2.918 N/A GLN 104.A NE2 SER 100.A O no hydrogen 3.471 N/A GLN 104.A NE2 SER 100.A OG no hydrogen 3.011 N/A GLN 104.A NE2 GLY 133.A O no hydrogen 2.964 N/A LEU 105.A N TYR 101.A O no hydrogen 2.854 N/A LEU 106.A N LEU 102.A O no hydrogen 2.902 N/A GLN 107.A N PHE 103.A O no hydrogen 2.967 N/A GLN 107.A NE2 PHE 103.A O no hydrogen 3.606 N/A GLY 108.A N GLN 104.A O no hydrogen 2.963 N/A LEU 109.A N.A LEU 105.A O no hydrogen 2.906 N/A LEU 109.A N.B LEU 105.A O no hydrogen 2.903 N/A ALA 110.A N LEU 106.A O no hydrogen 2.804 N/A PHE 111.A N GLN 107.A O no hydrogen 3.020 N/A CYS 112.A N GLY 108.A O no hydrogen 2.995 N/A CYS 112.A SG GLY 108.A O no hydrogen 3.544 N/A HIS 113.A N LEU 109.A O.A no hydrogen 2.817 N/A HIS 113.A N LEU 109.A O.B no hydrogen 2.819 N/A HIS 113.A NE2 ASP 171.A OD2 no hydrogen 2.816 N/A SER 114.A N ALA 110.A O no hydrogen 2.979 N/A SER 114.A OG PHE 111.A O no hydrogen 2.776 N/A HIS 115.A N PHE 111.A O no hydrogen 3.245 N/A HIS 115.A N CYS 112.A O no hydrogen 2.995 N/A ARG 116.A N HIS 113.A O no hydrogen 2.987 N/A VAL 117.A N CYS 112.A O no hydrogen 2.920 N/A HIS 119.A N ASP 171.A OD2 no hydrogen 2.875 N/A HIS 119.A NE2 ALA 138.A O no hydrogen 2.763 N/A ARG 120.A N.A ASP 171.A OD1 no hydrogen 2.793 N/A ARG 120.A N.C ASP 171.A OD1 no hydrogen 2.798 N/A ASP 121.A N HIS 119.A ND1 no hydrogen 2.923 N/A LYS 123.A N ASN 126.A OD1 no hydrogen 2.995 N/A LYS 123.A NZ THR 15.A OG1 no hydrogen 3.351 N/A LYS 123.A NZ ASP 121.A OD2 no hydrogen 2.985 N/A ASN 126.A N LYS 123.A O no hydrogen 2.916 N/A ASN 126.A ND2 ASP 121.A O no hydrogen 2.918 N/A LEU 127.A N PRO 124.A O no hydrogen 3.242 N/A LEU 128.A N.A LYS 136.A O no hydrogen 2.868 N/A LEU 128.A N.B LYS 136.A O no hydrogen 2.863 N/A ILE 129.A N GLN 79.A O no hydrogen 2.874 N/A ASN 130.A N ALA 134.A O no hydrogen 3.235 N/A GLU 132.A N ASN 130.A OD1 no hydrogen 3.086 N/A GLY 133.A N ASN 130.A O no hydrogen 3.499 N/A ALA 134.A N ASN 130.A OD1 no hydrogen 3.075 N/A ILE 135.A N GLN 104.A OE1 no hydrogen 3.126 N/A LYS 136.A N LEU 128.A O.A no hydrogen 2.831 N/A LYS 136.A N LEU 128.A O.B no hydrogen 2.832 N/A LYS 136.A NZ GLU 75.A OE1 no hydrogen 2.711 N/A LYS 136.A NZ GLU 75.A OE2 no hydrogen 3.340 N/A LEU 137.A N ASN 56.A O no hydrogen 2.902 N/A ALA 138.A N ASN 126.A O no hydrogen 2.814 N/A GLY 141.A N LEU 118.A O no hydrogen 2.883 N/A LEU 142.A N ASP 139.A O no hydrogen 3.337 N/A ARG 144.A NH1 GLU 45.A OE2.B no hydrogen 2.895 N/A ALA 145.A N GLY 141.A O no hydrogen 3.438 N/A PHE 146.A N LEU 142.A O no hydrogen 2.856 N/A GLY 147.A N ALA 143.A O no hydrogen 2.910 N/A TYR 154.A OH GLU 181.A OE1 no hydrogen 2.572 N/A ARG 155.A N LEU 152.A O no hydrogen 3.104 N/A ARG 155.A NH2 ASP 121.A OD1 no hydrogen 2.966 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 2.678 N/A ILE 159.A N.B ALA 156.A O no hydrogen 3.045 N/A LEU 160.A N ALA 156.A O no hydrogen 3.213 N/A LEU 161.A N PRO 157.A O no hydrogen 2.846 N/A GLY 162.A N ILE 159.A O.A no hydrogen 2.951 N/A GLY 162.A N ILE 159.A O.B no hydrogen 2.963 N/A CYS 163.A N GLU 158.A O no hydrogen 3.010 N/A CYS 163.A SG.A TYR 165.A OH.B no hydrogen 3.370 N/A CYS 163.A SG.C TYR 165.A O.A no hydrogen 3.806 N/A CYS 163.A SG.C TYR 165.A O.B no hydrogen 3.596 N/A ALA 169.A N SER 167.A OG no hydrogen 3.162 N/A VAL 170.A N SER 167.A O no hydrogen 3.003 N/A ASP 171.A N THR 168.A O no hydrogen 3.057 N/A TRP 173.A N ALA 169.A O no hydrogen 3.066 N/A SER 174.A N VAL 170.A O no hydrogen 3.234 N/A SER 174.A OG TYR 154.A O no hydrogen 2.717 N/A SER 174.A OG VAL 170.A O no hydrogen 3.123 N/A LEU 175.A N ASP 171.A O no hydrogen 2.932 N/A GLY 176.A N ILE 172.A O no hydrogen 2.872 N/A CYS 177.A N TRP 173.A O no hydrogen 3.013 N/A CYS 177.A SG TRP 173.A O no hydrogen 3.551 N/A ILE 178.A N SER 174.A O no hydrogen 3.035 N/A PHE 179.A N LEU 175.A O no hydrogen 2.810 N/A ALA 180.A N GLY 176.A O no hydrogen 3.023 N/A GLU 181.A N CYS 177.A O no hydrogen 3.099 N/A MET 182.A N ILE 178.A O no hydrogen 2.898 N/A VAL 183.A N PHE 179.A O no hydrogen 3.213 N/A THR 184.A N ALA 180.A O no hydrogen 2.960 N/A THR 184.A OG1 ALA 180.A O no hydrogen 3.025 N/A ARG 185.A N GLU 181.A O no hydrogen 2.877 N/A ARG 185.A NH2 ALA 89.A O no hydrogen 3.210 N/A ARG 186.A N THR 184.A OG1 no hydrogen 3.377 N/A GLY 191.A N PHE 189.A O no hydrogen 2.948 N/A GLY 191.A N GLN 197.A OE1 no hydrogen 2.864 N/A ASP 192.A N.A ASP 196.A OD2 no hydrogen 3.179 N/A ASP 192.A N.B ASP 196.A OD2 no hydrogen 3.007 N/A ASP 196.A N SER 193.A OG no hydrogen 3.044 N/A GLN 197.A N SER 193.A O no hydrogen 2.856 N/A GLN 197.A NE2 TRP 153.A O no hydrogen 3.287 N/A GLN 197.A NE2 PHE 189.A O no hydrogen 2.910 N/A LEU 198.A N GLU 194.A O no hydrogen 3.016 N/A PHE 199.A N ILE 195.A O no hydrogen 2.933 N/A ARG 200.A N ASP 196.A O no hydrogen 2.857 N/A ARG 200.A NE ASP 196.A OD2 no hydrogen 2.994 N/A ILE 201.A N GLN 197.A O no hydrogen 3.135 N/A PHE 202.A N LEU 198.A O no hydrogen 2.900 N/A ARG 203.A N.A PHE 199.A O no hydrogen 2.820 N/A ARG 203.A N.B PHE 199.A O no hydrogen 2.827 N/A THR 204.A N ARG 200.A O no hydrogen 3.314 N/A THR 204.A N ILE 201.A O no hydrogen 3.125 N/A THR 204.A OG1 ARG 200.A O no hydrogen 3.383 N/A LEU 205.A N ILE 201.A O no hydrogen 2.844 N/A THR 207.A N TRP 229.A O no hydrogen 2.908 N/A THR 207.A OG1 PRO 227.A O no hydrogen 2.681 N/A VAL 212.A N ASP 209.A OD1 no hydrogen 3.015 N/A TRP 213.A N ASP 209.A O no hydrogen 2.878 N/A GLY 215.A N GLU 210.A OE1 no hydrogen 2.752 N/A VAL 216.A N TRP 213.A O no hydrogen 2.934 N/A THR 217.A N GLU 210.A OE2 no hydrogen 2.971 N/A THR 217.A OG1 GLU 210.A OE2 no hydrogen 2.636 N/A SER 218.A N GLY 215.A O no hydrogen 3.185 N/A MET 219.A N VAL 216.A O no hydrogen 3.013 N/A ASP 221.A N LEU 161.A O no hydrogen 2.775 N/A TYR 222.A N MET 219.A O no hydrogen 3.267 N/A PHE 226.A N LYS 223.A O no hydrogen 2.997 N/A TRP 229.A N THR 207.A OG1 no hydrogen 2.884 N/A ARG 231.A NH1 LEU 205.A O no hydrogen 3.094 N/A GLN 232.A N THR 204.A O no hydrogen 2.817 N/A LYS 236.A N ASP 233.A O no hydrogen 2.890 N/A VAL 238.A N PHE 234.A O no hydrogen 2.933 N/A LEU 241.A N VAL 238.A O no hydrogen 2.940 N/A GLY 245.A N ASP 242.A OD1 no hydrogen 2.903 N/A ARG 246.A N ASP 242.A O no hydrogen 2.879 N/A ARG 246.A NH1 LEU 241.A O no hydrogen 2.802 N/A SER 247.A N GLU 243.A O.A no hydrogen 3.027 N/A SER 247.A N GLU 243.A O.B no hydrogen 3.030 N/A LEU 248.A N ASP 244.A O no hydrogen 3.037 N/A LEU 249.A N GLY 245.A O no hydrogen 2.880 N/A SER 250.A N ARG 246.A O no hydrogen 2.917 N/A SER 250.A OG.B ARG 246.A O no hydrogen 3.513 N/A SER 250.A OG.B SER 247.A O no hydrogen 2.680 N/A GLN 251.A N SER 247.A O no hydrogen 3.149 N/A MET 252.A N LEU 248.A O no hydrogen 3.037 N/A LEU 253.A N SER 250.A O no hydrogen 3.332 N/A TYR 255.A OH GLY 206.A O no hydrogen 2.622 N/A ASN 258.A N ASP 256.A OD1 no hydrogen 3.014 N/A LYS 259.A N.A ASP 256.A O no hydrogen 2.873 N/A LYS 259.A N.B ASP 256.A O no hydrogen 2.873 N/A LYS 259.A NZ.B VAL 212.A O no hydrogen 2.913 N/A LYS 259.A NZ.B ASP 256.A OD2 no hydrogen 3.134 N/A ARG 260.A N ASP 256.A O no hydrogen 3.361 N/A ARG 260.A N PRO 257.A O no hydrogen 3.207 N/A ARG 260.A NE HIS 254.A O no hydrogen 2.692 N/A ARG 260.A NH1 GLU 158.A OE2 no hydrogen 2.783 N/A ARG 260.A NH1 ALA 169.A O no hydrogen 2.999 N/A ARG 260.A NH2 GLU 158.A OE1 no hydrogen 2.495 N/A ARG 260.A NH2 GLU 158.A OE2 no hydrogen 3.489 N/A ARG 260.A NH2 TYR 255.A O no hydrogen 3.050 N/A ILE 261.A N GLN 251.A O no hydrogen 2.971 N/A ALA 265.A N SER 262.A OG no hydrogen 2.960 N/A ALA 266.A N SER 262.A O no hydrogen 2.911 N/A LEU 267.A N ALA 263.A O no hydrogen 3.136 N/A LEU 267.A N LYS 264.A O no hydrogen 3.262 N/A ALA 268.A N ALA 265.A O no hydrogen 3.078 N/A HIS 269.A N ALA 266.A O no hydrogen 3.005 N/A PHE 271.A N HIS 269.A ND1 no hydrogen 2.888 N/A PHE 272.A N HIS 269.A O no hydrogen 2.961 N/A GLN 273.A N PRO 270.A O no hydrogen 3.033 N/A VAL 275.A N PHE 272.A O no hydrogen 3.082 N/A