Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6e9l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 2.A N GLU 1.A OE2 no hydrogen 3.257 N/A ALA 6.A N PHE 2.A O no hydrogen 2.990 N/A LYS 7.A N LEU 3.A O no hydrogen 3.098 N/A LYS 7.A NZ ASP 145.A OD2 no hydrogen 2.736 N/A GLU 8.A N ALA 4.A O no hydrogen 3.240 N/A ASP 9.A N LYS 5.A O no hydrogen 3.334 N/A PHE 10.A N ALA 6.A O no hydrogen 3.038 N/A LEU 11.A N LYS 7.A O no hydrogen 3.017 N/A LYS 12.A N GLU 8.A O no hydrogen 3.319 N/A LYS 13.A N ASP 9.A O no hydrogen 3.408 N/A TRP 14.A N PHE 10.A O no hydrogen 2.787 N/A GLU 15.A N LEU 11.A O no hydrogen 3.025 N/A ASN 16.A N LYS 12.A O no hydrogen 3.145 N/A ALA 18.A N GLN 80.A OE1 no hydrogen 2.906 N/A THR 21.A N SER 93.A O no hydrogen 2.947 N/A THR 21.A OG1 SER 93.A O no hydrogen 3.081 N/A GLN 26.A N HIS 23.A O no hydrogen 3.263 N/A PHE 27.A N LEU 24.A O no hydrogen 2.878 N/A GLU 28.A N LYS 45.A O no hydrogen 2.772 N/A ARG 29.A NH2 PHE 27.A O no hydrogen 2.766 N/A ILE 30.A N LEU 43.A O no hydrogen 2.831 N/A LYS 31.A N LEU 43.A O no hydrogen 3.296 N/A LYS 31.A NZ ASP 312.A OD1 no hydrogen 2.939 N/A THR 32.A N GLU 315.A OE2 no hydrogen 3.009 N/A THR 32.A OG1 GLU 315.A OE1 no hydrogen 2.772 N/A LEU 33.A N VAL 41.A O no hydrogen 2.936 N/A GLY 39.A N GLY 36.A O no hydrogen 3.329 N/A ARG 40.A N ILE 57.A O no hydrogen 3.199 N/A VAL 41.A N GLY 34.A O no hydrogen 2.827 N/A MET 42.A N MET 55.A O no hydrogen 2.845 N/A LEU 43.A N LYS 31.A O no hydrogen 2.612 N/A VAL 44.A N TYR 53.A O no hydrogen 3.013 N/A LYS 45.A N GLU 28.A O no hydrogen 2.820 N/A HIS 46.A N ASN 51.A O no hydrogen 2.842 N/A MET 47.A N GLN 26.A O no hydrogen 3.323 N/A THR 49.A OG1 HIS 46.A O no hydrogen 3.371 N/A GLY 50.A N HIS 46.A O no hydrogen 2.778 N/A ASN 51.A N THR 49.A OG1 no hydrogen 2.972 N/A TYR 53.A N VAL 44.A O no hydrogen 3.085 N/A ALA 54.A N MET 104.A O no hydrogen 2.727 N/A MET 55.A N MET 42.A O no hydrogen 2.833 N/A LYS 56.A N MET 102.A O no hydrogen 2.803 N/A LYS 56.A NZ GLU 75.A OE1 no hydrogen 3.226 N/A LYS 56.A NZ GLU 75.A OE2 no hydrogen 2.766 N/A ILE 57.A N ARG 40.A O no hydrogen 2.961 N/A LEU 58.A N LEU 100.A O no hydrogen 2.860 N/A ASP 59.A N PHE 38.A O no hydrogen 2.774 N/A LYS 60.A N SER 98.A O no hydrogen 3.329 N/A LYS 60.A NZ ASP 96.A O no hydrogen 3.099 N/A LYS 60.A NZ ASN 97.A O no hydrogen 3.448 N/A LYS 60.A NZ LYS 324.A O no hydrogen 2.966 N/A GLN 61.A N ASP 59.A OD1 no hydrogen 3.059 N/A LYS 62.A N ASP 59.A OD1 no hydrogen 3.441 N/A VAL 63.A N ASP 59.A O no hydrogen 2.812 N/A VAL 64.A N LYS 60.A O no hydrogen 2.899 N/A LYS 65.A N GLN 61.A O no hydrogen 2.811 N/A LEU 66.A N LYS 62.A O no hydrogen 3.319 N/A LEU 66.A N VAL 63.A O no hydrogen 3.322 N/A LYS 67.A N VAL 64.A O no hydrogen 3.016 N/A GLN 68.A N VAL 63.A O no hydrogen 3.015 N/A GLN 68.A NE2 LEU 66.A O no hydrogen 2.906 N/A HIS 71.A ND1 GLN 68.A OE1 no hydrogen 3.024 N/A THR 72.A N GLN 68.A O no hydrogen 3.175 N/A THR 72.A OG1 GLN 68.A O no hydrogen 3.223 N/A LEU 73.A N ILE 69.A O no hydrogen 3.426 N/A ASN 74.A N GLU 70.A O no hydrogen 2.933 N/A ASN 74.A ND2 ALA 172.A O no hydrogen 3.607 N/A GLU 75.A N HIS 71.A O no hydrogen 2.904 N/A LYS 76.A N THR 72.A O no hydrogen 3.139 N/A LYS 76.A NZ ALA 18.A O no hydrogen 3.253 N/A ARG 77.A N LEU 73.A O no hydrogen 3.114 N/A ARG 77.A NE TRP 14.A O no hydrogen 2.958 N/A ARG 77.A NH2 TRP 14.A O no hydrogen 2.915 N/A ILE 78.A N ASN 74.A O no hydrogen 3.052 N/A LEU 79.A N GLU 75.A O no hydrogen 2.906 N/A GLN 80.A N LYS 76.A O no hydrogen 2.866 N/A GLN 80.A NE2 LYS 13.A O no hydrogen 3.233 N/A GLN 80.A NE2 ARG 77.A O no hydrogen 2.713 N/A ALA 81.A N ILE 78.A O no hydrogen 3.134 N/A VAL 82.A N ILE 78.A O no hydrogen 3.103 N/A ASN 83.A N TYR 140.A OH no hydrogen 2.806 N/A LEU 87.A N PHE 84.A O no hydrogen 3.471 N/A VAL 88.A N VAL 166.A O no hydrogen 3.272 N/A LYS 89.A NZ GLU 91.A OE2 no hydrogen 2.810 N/A GLU 91.A N VAL 103.A O no hydrogen 2.838 N/A PHE 92.A N VAL 103.A O no hydrogen 3.071 N/A SER 93.A N THR 21.A OG1 no hydrogen 2.842 N/A PHE 94.A N TYR 101.A O no hydrogen 3.092 N/A LYS 95.A NZ PHE 329.A O no hydrogen 2.986 N/A LYS 95.A NZ SER 330.A O no hydrogen 3.063 N/A ASP 96.A N ASN 99.A O no hydrogen 3.050 N/A ASN 99.A N ASP 96.A OD1 no hydrogen 3.008 N/A ASN 99.A ND2 TYR 101.A OH no hydrogen 2.806 N/A LEU 100.A N LEU 58.A O no hydrogen 2.840 N/A TYR 101.A N PHE 94.A O no hydrogen 2.748 N/A TYR 101.A OH ASP 96.A OD1 no hydrogen 3.091 N/A TYR 101.A OH ASP 96.A OD2 no hydrogen 2.723 N/A MET 102.A N LYS 56.A O no hydrogen 3.211 N/A VAL 103.A N PHE 92.A O no hydrogen 2.811 N/A MET 104.A N ALA 54.A O no hydrogen 2.810 N/A GLU 105.A N LYS 89.A O no hydrogen 2.818 N/A TYR 106.A N HIS 52.A O no hydrogen 3.413 N/A TYR 106.A OH ASP 306.A O no hydrogen 2.670 N/A MET 112.A N LEU 156.A O no hydrogen 2.743 N/A PHE 113.A N PRO 153.A O no hydrogen 3.420 N/A SER 114.A OG GLU 111.A O no hydrogen 3.533 N/A HIS 115.A NE2 GLY 109.A O no hydrogen 2.958 N/A LEU 116.A N MET 112.A O no hydrogen 2.822 N/A ARG 117.A N PHE 113.A O no hydrogen 2.990 N/A ARG 118.A N SER 114.A O no hydrogen 2.988 N/A ILE 119.A N HIS 115.A O no hydrogen 2.807 N/A GLY 120.A N LEU 116.A O no hydrogen 2.868 N/A PHE 122.A N MET 214.A O no hydrogen 2.833 N/A HIS 126.A NE2 TYR 130.A OH no hydrogen 2.777 N/A ALA 127.A N SER 123.A O no hydrogen 2.858 N/A ARG 128.A N GLU 124.A O no hydrogen 2.722 N/A PHE 129.A N PRO 125.A O no hydrogen 2.997 N/A TYR 130.A OH HIS 126.A NE2 no hydrogen 2.777 N/A ALA 131.A N ALA 127.A O no hydrogen 2.992 N/A ALA 132.A N ARG 128.A O no hydrogen 3.071 N/A GLN 133.A N TYR 130.A O no hydrogen 2.768 N/A GLN 133.A NE2 PHE 129.A O no hydrogen 3.013 N/A ILE 134.A N TYR 130.A O no hydrogen 3.159 N/A VAL 135.A N ALA 131.A O no hydrogen 2.783 N/A LEU 136.A N ALA 132.A O no hydrogen 3.011 N/A THR 137.A N GLN 133.A O no hydrogen 2.967 N/A THR 137.A OG1 GLN 133.A O no hydrogen 2.852 N/A PHE 138.A N ILE 134.A O no hydrogen 2.754 N/A GLU 139.A N VAL 135.A O no hydrogen 3.202 N/A TYR 140.A N LEU 136.A O no hydrogen 2.941 N/A LEU 141.A N THR 137.A O no hydrogen 2.738 N/A HIS 142.A N PHE 138.A O no hydrogen 2.754 N/A HIS 142.A ND1 LEU 146.A O no hydrogen 3.102 N/A SER 143.A N GLU 139.A O no hydrogen 3.029 N/A SER 143.A OG TYR 140.A O no hydrogen 2.734 N/A LEU 144.A N TYR 140.A O no hydrogen 3.354 N/A LEU 144.A N LEU 141.A O no hydrogen 3.042 N/A ASP 145.A N HIS 142.A O no hydrogen 3.003 N/A LEU 146.A N LEU 141.A O no hydrogen 3.031 N/A ILE 147.A N LYS 173.A O no hydrogen 3.036 N/A TYR 148.A N ASP 203.A OD2 no hydrogen 2.986 N/A TYR 148.A OH ASP 150.A O no hydrogen 3.383 N/A TYR 148.A OH THR 167.A O no hydrogen 2.750 N/A ARG 149.A N ASP 203.A OD1 no hydrogen 2.984 N/A ARG 149.A NE PHE 171.A O no hydrogen 2.807 N/A ARG 149.A NH1 TYR 198.A OH no hydrogen 3.006 N/A ARG 149.A NH2 PHE 171.A O no hydrogen 2.961 N/A LYS 152.A NZ THR 184.A OG1 no hydrogen 2.997 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.753 N/A ASN 155.A N LYS 152.A O no hydrogen 3.039 N/A ASN 155.A ND2 TYR 148.A OH no hydrogen 3.553 N/A ASN 155.A ND2 ASP 150.A O no hydrogen 2.814 N/A LEU 156.A N PRO 153.A O no hydrogen 3.183 N/A LEU 157.A N GLN 165.A O no hydrogen 2.924 N/A ILE 158.A N GLY 110.A O no hydrogen 3.008 N/A ASP 159.A N TYR 163.A O no hydrogen 2.752 N/A GLN 160.A NE2 PRO 299.A O no hydrogen 2.973 N/A GLN 161.A N ASP 159.A OD1 no hydrogen 3.156 N/A GLY 162.A N ASP 159.A O no hydrogen 2.816 N/A TYR 163.A N ASP 159.A OD1 no hydrogen 2.904 N/A TYR 163.A OH VAL 293.A O no hydrogen 2.697 N/A ILE 164.A N GLN 133.A OE1 no hydrogen 2.711 N/A GLN 165.A N LEU 157.A O no hydrogen 2.879 N/A VAL 166.A N PHE 86.A O no hydrogen 2.736 N/A THR 167.A N ASN 155.A O no hydrogen 2.820 N/A THR 167.A OG1 ASN 155.A O no hydrogen 2.849 N/A ALA 172.A N PHE 169.A O no hydrogen 2.880 N/A LYS 173.A N ILE 147.A O no hydrogen 3.122 N/A LYS 173.A NZ THR 179.A OG1 no hydrogen 2.815 N/A ARG 174.A NE LEU 144.A O no hydrogen 2.886 N/A VAL 175.A N ASP 145.A O no hydrogen 2.997 N/A THR 179.A N TYR 198.A O no hydrogen 2.953 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.884 N/A TYR 187.A N THR 184.A O no hydrogen 2.831 N/A TYR 187.A OH GLU 213.A OE1 no hydrogen 2.622 N/A LEU 188.A N PRO 185.A O no hydrogen 3.300 N/A GLU 191.A N GLU 191.A OE1 no hydrogen 2.818 N/A ILE 192.A N ALA 189.A O no hydrogen 2.984 N/A ILE 193.A N ALA 189.A O no hydrogen 3.392 N/A LEU 194.A N PRO 190.A O no hydrogen 3.018 N/A SER 195.A N ILE 192.A O no hydrogen 3.195 N/A LYS 196.A N GLU 191.A O no hydrogen 2.918 N/A TYR 198.A N THR 179.A O no hydrogen 2.787 N/A LYS 200.A NZ VAL 175.A O no hydrogen 3.083 N/A ALA 201.A N ASN 199.A OD1 no hydrogen 3.102 N/A VAL 202.A N ASN 199.A O no hydrogen 3.316 N/A ASP 203.A N LYS 200.A O no hydrogen 2.783 N/A TRP 204.A N LYS 200.A O no hydrogen 3.434 N/A TRP 205.A N ALA 201.A O no hydrogen 3.083 N/A ALA 206.A N VAL 202.A O no hydrogen 3.057 N/A LEU 207.A N ASP 203.A O no hydrogen 3.143 N/A GLY 208.A N TRP 204.A O no hydrogen 3.186 N/A VAL 209.A N TRP 205.A O no hydrogen 3.177 N/A LEU 210.A N ALA 206.A O no hydrogen 2.912 N/A ILE 211.A N LEU 207.A O no hydrogen 2.783 N/A TYR 212.A N GLY 208.A O no hydrogen 3.078 N/A TYR 212.A OH ARG 239.A O no hydrogen 2.659 N/A GLU 213.A N VAL 209.A O no hydrogen 2.971 N/A MET 214.A N LEU 210.A O no hydrogen 2.815 N/A ALA 215.A N ILE 211.A O no hydrogen 3.025 N/A ALA 216.A N TYR 212.A O no hydrogen 2.667 N/A GLY 217.A N GLU 213.A O no hydrogen 2.979 N/A GLN 225.A N GLN 228.A OE1 no hydrogen 3.145 N/A ILE 229.A N GLN 225.A O no hydrogen 3.143 N/A TYR 230.A N PRO 226.A O no hydrogen 2.818 N/A GLU 231.A N ILE 227.A O no hydrogen 3.131 N/A LYS 232.A N ILE 229.A O no hydrogen 3.294 N/A ILE 233.A N ILE 229.A O no hydrogen 3.203 N/A VAL 234.A N TYR 230.A O no hydrogen 2.970 N/A SER 235.A OG LYS 232.A O no hydrogen 2.954 N/A PHE 244.A N PRO 241.A O no hydrogen 3.226 N/A SER 245.A N GLU 124.A OE2 no hydrogen 2.907 N/A SER 245.A OG GLU 124.A OE1 no hydrogen 2.679 N/A LEU 248.A N SER 245.A OG no hydrogen 3.249 N/A LYS 249.A N SER 245.A O no hydrogen 2.986 N/A LYS 249.A NZ PRO 241.A O no hydrogen 2.867 N/A LYS 249.A NZ PHE 244.A O no hydrogen 2.900 N/A ASP 250.A N SER 246.A O no hydrogen 3.005 N/A LEU 251.A N ASP 247.A O no hydrogen 3.043 N/A LEU 252.A N LEU 248.A O no hydrogen 3.016 N/A ARG 253.A N LYS 249.A O no hydrogen 3.040 N/A ASN 254.A N ASP 250.A O no hydrogen 3.114 N/A ASN 254.A N LEU 251.A O no hydrogen 3.156 N/A LEU 255.A N LEU 251.A O no hydrogen 2.788 N/A LEU 256.A N LEU 252.A O no hydrogen 2.715 N/A ASP 259.A N GLN 257.A OE1 no hydrogen 3.188 N/A THR 261.A OG1 ASP 259.A OD1 no hydrogen 2.654 N/A LYS 262.A N ASP 259.A O no hydrogen 2.864 N/A ARG 263.A NE GLN 257.A O no hydrogen 2.815 N/A ARG 263.A NH1 GLU 191.A OE2 no hydrogen 3.081 N/A ARG 263.A NH1 ALA 201.A O no hydrogen 2.756 N/A ARG 263.A NH2 GLU 191.A OE1 no hydrogen 2.785 N/A ARG 263.A NH2 GLN 257.A O no hydrogen 3.139 N/A PHE 264.A N ASN 254.A O no hydrogen 3.336 N/A ASN 266.A N ARG 263.A O no hydrogen 3.077 N/A ASN 266.A ND2 LEU 260.A O no hydrogen 2.767 N/A ASN 269.A ND2 ASP 273.A OD1 no hydrogen 2.771 N/A GLY 270.A N LEU 267.A O no hydrogen 3.156 N/A ASN 272.A N ASN 269.A O no hydrogen 3.084 N/A ASP 273.A N GLY 270.A O no hydrogen 3.344 N/A ILE 274.A N VAL 271.A O no hydrogen 3.269 N/A LYS 275.A N VAL 271.A O no hydrogen 3.052 N/A LYS 275.A NZ GLU 139.A OE1 no hydrogen 3.124 N/A LYS 275.A NZ GLU 139.A OE2 no hydrogen 3.350 N/A ASN 276.A N ASN 272.A O no hydrogen 2.799 N/A HIS 277.A N ILE 274.A O no hydrogen 2.970 N/A HIS 277.A NE2 ASP 250.A OD2 no hydrogen 2.796 N/A LYS 278.A NZ ASP 250.A OD2 no hydrogen 3.336 N/A TRP 279.A N HIS 277.A ND1 no hydrogen 2.840 N/A TRP 279.A NE1 GLU 124.A OE1 no hydrogen 3.025 N/A PHE 280.A N HIS 277.A O no hydrogen 3.117 N/A ALA 281.A N LYS 278.A O no hydrogen 3.439 N/A THR 283.A N PHE 280.A O no hydrogen 3.351 N/A TRP 285.A NE1 LYS 275.A O no hydrogen 2.995 N/A ILE 288.A N ASP 284.A O no hydrogen 3.057 N/A GLN 290.A N ILE 286.A O no hydrogen 3.249 N/A GLN 290.A NE2 ILE 286.A O no hydrogen 2.829 N/A ARG 291.A N ILE 288.A O no hydrogen 3.227 N/A ARG 291.A NH1 ASP 159.A OD1 no hydrogen 3.101 N/A ARG 291.A NH1 ASP 159.A OD2 no hydrogen 3.015 N/A ARG 291.A NH2 PRO 85.A O no hydrogen 3.218 N/A ARG 291.A NH2 ASP 159.A OD2 no hydrogen 2.757 N/A LYS 292.A N ALA 287.A O no hydrogen 2.954 N/A VAL 293.A N ALA 287.A O no hydrogen 3.370 N/A ASP 306.A N GLY 303.A O no hydrogen 3.371 N/A SER 308.A N ASP 306.A OD1 no hydrogen 3.333 N/A SER 308.A OG ASP 306.A OD2 no hydrogen 2.715 N/A ASN 309.A ND2 PRO 108.A O no hydrogen 3.552 N/A PHE 310.A N THR 307.A O no hydrogen 2.876 N/A GLU 314.A N GLU 314.A OE1 no hydrogen 3.092 N/A LYS 324.A N ASN 97.A O no hydrogen 2.814 N/A GLU 328.A N GLU 328.A OE1 no hydrogen 2.890 N/A PHE 329.A N CYS 325.A O no hydrogen 3.368 N/A PHE 329.A N GLY 326.A O no hydrogen 3.122 N/A SER 330.A N LYS 327.A O no hydrogen 3.352 N/A