Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2f7e_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N GLU 3.A OE1 no hydrogen 2.442 N/A VAL 1.A N GLU 3.A OE2 no hydrogen 2.919 N/A LEU 5.A N VAL 1.A O no hydrogen 2.959 N/A ALA 6.A N LYS 2.A O no hydrogen 3.115 N/A LYS 7.A N GLU 3.A O no hydrogen 3.308 N/A ALA 8.A N PHE 4.A O no hydrogen 2.902 N/A LYS 9.A N LEU 5.A O no hydrogen 2.767 N/A LYS 9.A NZ SER 145.A O no hydrogen 3.178 N/A LYS 9.A NZ ASP 147.A OD2 no hydrogen 2.829 N/A GLU 10.A N ALA 6.A O no hydrogen 3.295 N/A ASP 11.A N LYS 7.A O no hydrogen 3.168 N/A PHE 12.A N ALA 8.A O no hydrogen 3.006 N/A LEU 13.A N LYS 9.A O no hydrogen 3.000 N/A LYS 14.A N GLU 10.A O no hydrogen 3.377 N/A LYS 15.A N ASP 11.A O no hydrogen 3.340 N/A LYS 15.A NZ ASP 11.A OD2 no hydrogen 2.583 N/A TRP 16.A N PHE 12.A O no hydrogen 2.692 N/A GLU 17.A N LEU 13.A O no hydrogen 2.938 N/A ASN 18.A N LYS 15.A O no hydrogen 3.111 N/A ALA 20.A N GLN 82.A OE1 no hydrogen 2.937 N/A GLN 21.A NE2 SER 334.A O no hydrogen 3.409 N/A GLN 21.A NE2 PHE 336.A O no hydrogen 3.042 N/A THR 23.A N SER 95.A O no hydrogen 2.962 N/A THR 23.A OG1 SER 95.A O no hydrogen 3.558 N/A HIS 25.A N GLN 28.A OE1 no hydrogen 2.874 N/A ASP 27.A N HIS 25.A ND1 no hydrogen 3.416 N/A GLN 28.A N HIS 25.A O no hydrogen 3.083 N/A PHE 29.A N LEU 26.A O no hydrogen 3.096 N/A GLU 30.A N LYS 47.A O no hydrogen 2.917 N/A ILE 32.A N LEU 45.A O no hydrogen 3.046 N/A LYS 33.A NZ THR 34.A O no hydrogen 3.335 N/A LYS 33.A NZ ASP 314.A O no hydrogen 3.238 N/A THR 34.A N GLU 318.A OE2 no hydrogen 2.972 N/A THR 34.A OG1 GLU 318.A OE1 no hydrogen 2.834 N/A THR 34.A OG1 GLU 318.A OE2 no hydrogen 3.353 N/A LEU 35.A N VAL 43.A O no hydrogen 2.713 N/A GLY 36.A N VAL 43.A O no hydrogen 3.333 N/A GLY 38.A N GLY 41.A O no hydrogen 2.717 N/A GLY 41.A N GLY 38.A O no hydrogen 3.347 N/A ARG 42.A N ILE 59.A O no hydrogen 2.965 N/A ARG 42.A NH2 THR 34.A OG1 no hydrogen 2.901 N/A ARG 42.A NH2 GLU 317.A O no hydrogen 2.945 N/A VAL 43.A N GLY 36.A O no hydrogen 2.867 N/A MET 44.A N MET 57.A O no hydrogen 2.839 N/A LEU 45.A N LYS 33.A O no hydrogen 2.644 N/A VAL 46.A N TYR 55.A O no hydrogen 2.864 N/A LYS 47.A N GLU 30.A O no hydrogen 2.999 N/A HIS 48.A N ASN 53.A O no hydrogen 2.545 N/A MET 49.A N GLN 28.A O no hydrogen 3.320 N/A THR 51.A N HIS 48.A O no hydrogen 3.236 N/A THR 51.A OG1 HIS 48.A O no hydrogen 3.476 N/A GLY 52.A N HIS 48.A O no hydrogen 2.536 N/A ASN 53.A N THR 51.A OG1 no hydrogen 3.259 N/A TYR 55.A N VAL 46.A O no hydrogen 2.959 N/A ALA 56.A N MET 106.A O no hydrogen 2.767 N/A MET 57.A N MET 44.A O no hydrogen 2.733 N/A LYS 58.A N MET 104.A O no hydrogen 2.751 N/A LYS 58.A NZ GLU 77.A OE1 no hydrogen 2.820 N/A LYS 58.A NZ GLU 77.A OE2 no hydrogen 2.572 N/A ILE 59.A N ARG 42.A O no hydrogen 2.711 N/A LEU 60.A N LEU 102.A O no hydrogen 2.877 N/A ASP 61.A N PHE 40.A O no hydrogen 3.031 N/A LYS 62.A N SER 100.A O no hydrogen 3.113 N/A LYS 62.A NZ ASP 98.A O no hydrogen 2.675 N/A LYS 62.A NZ ASN 99.A O no hydrogen 2.999 N/A LYS 64.A N ASP 61.A OD1 no hydrogen 3.178 N/A VAL 65.A N ASP 61.A O no hydrogen 2.910 N/A VAL 66.A N LYS 62.A O no hydrogen 2.994 N/A LYS 67.A N GLN 63.A O no hydrogen 2.926 N/A LEU 68.A N LYS 64.A O no hydrogen 2.916 N/A LYS 69.A N VAL 66.A O no hydrogen 2.890 N/A GLN 70.A N VAL 65.A O no hydrogen 2.902 N/A GLN 70.A NE2 LEU 68.A O no hydrogen 3.018 N/A HIS 73.A ND1 GLN 70.A OE1 no hydrogen 2.802 N/A THR 74.A N GLN 70.A O no hydrogen 2.812 N/A THR 74.A OG1 GLN 70.A O no hydrogen 2.978 N/A LEU 75.A N ILE 71.A O no hydrogen 3.020 N/A ASN 76.A N GLU 72.A O no hydrogen 2.812 N/A GLU 77.A N HIS 73.A O no hydrogen 3.043 N/A LYS 78.A N THR 74.A O no hydrogen 3.394 N/A LYS 78.A NZ ALA 20.A O no hydrogen 2.962 N/A LYS 78.A NZ GLU 335.A O no hydrogen 3.427 N/A LYS 78.A NZ PHE 336.A OXT no hydrogen 2.819 N/A ARG 79.A N LEU 75.A O no hydrogen 3.100 N/A ARG 79.A NE TRP 16.A O no hydrogen 3.161 N/A ARG 79.A NH2 TRP 16.A O no hydrogen 3.224 N/A ILE 80.A N ASN 76.A O no hydrogen 2.932 N/A LEU 81.A N GLU 77.A O no hydrogen 2.907 N/A GLN 82.A N LYS 78.A O no hydrogen 3.008 N/A GLN 82.A NE2 LYS 15.A O no hydrogen 3.093 N/A GLN 82.A NE2 ARG 79.A O no hydrogen 2.640 N/A ALA 83.A N ILE 80.A O no hydrogen 2.868 N/A VAL 84.A N ILE 80.A O no hydrogen 3.013 N/A ASN 85.A N TYR 142.A OH no hydrogen 2.884 N/A LEU 89.A N PHE 86.A O no hydrogen 3.240 N/A VAL 90.A N VAL 168.A O no hydrogen 3.058 N/A LYS 91.A NZ GLU 93.A OE2 no hydrogen 3.550 N/A LYS 91.A NZ GLU 107.A OE1 no hydrogen 2.829 N/A LYS 91.A NZ GLU 107.A OE2 no hydrogen 2.892 N/A GLU 93.A N VAL 105.A O no hydrogen 2.661 N/A PHE 94.A N VAL 105.A O no hydrogen 3.198 N/A SER 95.A N THR 23.A OG1 no hydrogen 3.140 N/A PHE 96.A N TYR 103.A O no hydrogen 3.110 N/A LYS 97.A NZ PHE 333.A O no hydrogen 2.745 N/A LYS 97.A NZ PHE 336.A O no hydrogen 2.921 N/A ASP 98.A N ASN 101.A O no hydrogen 2.977 N/A SER 100.A N ASP 98.A OD1 no hydrogen 2.958 N/A ASN 101.A N ASP 98.A OD1 no hydrogen 2.818 N/A ASN 101.A ND2 TYR 103.A OH no hydrogen 3.214 N/A LEU 102.A N LEU 60.A O no hydrogen 2.842 N/A TYR 103.A N PHE 96.A O no hydrogen 2.754 N/A TYR 103.A OH ASP 98.A OD2 no hydrogen 2.468 N/A MET 104.A N LYS 58.A O no hydrogen 2.944 N/A VAL 105.A N PHE 94.A O no hydrogen 2.801 N/A MET 106.A N ALA 56.A O no hydrogen 2.874 N/A GLU 107.A N LYS 91.A O no hydrogen 3.002 N/A TYR 108.A OH ASP 309.A O no hydrogen 2.615 N/A MET 114.A N LEU 158.A O no hydrogen 2.754 N/A PHE 115.A N PRO 155.A O no hydrogen 3.232 N/A HIS 117.A N GLU 113.A O no hydrogen 3.342 N/A HIS 117.A NE2 GLY 111.A O no hydrogen 2.986 N/A LEU 118.A N MET 114.A O no hydrogen 2.665 N/A ARG 119.A N PHE 115.A O no hydrogen 2.785 N/A ARG 119.A NH1 GLU 216.A OE2 no hydrogen 3.028 N/A ARG 119.A NH2 GLU 216.A OE2 no hydrogen 3.050 N/A ARG 120.A N SER 116.A O no hydrogen 3.034 N/A ARG 120.A NH2 HIS 117.A ND1 no hydrogen 2.756 N/A ILE 121.A N HIS 117.A O no hydrogen 2.993 N/A GLY 122.A N LEU 118.A O no hydrogen 2.748 N/A PHE 124.A N MET 217.A O no hydrogen 2.776 N/A HIS 128.A NE2 TYR 132.A OH no hydrogen 2.695 N/A ALA 129.A N SER 125.A O no hydrogen 3.092 N/A ARG 130.A N GLU 126.A O no hydrogen 2.929 N/A ARG 130.A NE TRP 282.A O no hydrogen 2.748 N/A ARG 130.A NH2 TRP 282.A O no hydrogen 2.978 N/A PHE 131.A N PRO 127.A O no hydrogen 3.011 N/A PHE 131.A N HIS 128.A O no hydrogen 3.162 N/A TYR 132.A N HIS 128.A O no hydrogen 3.345 N/A TYR 132.A OH HIS 128.A NE2 no hydrogen 2.695 N/A ALA 133.A N ALA 129.A O no hydrogen 2.858 N/A ALA 134.A N ARG 130.A O no hydrogen 2.945 N/A GLN 135.A NE2 PHE 131.A O no hydrogen 2.923 N/A ILE 136.A N TYR 132.A O no hydrogen 3.169 N/A VAL 137.A N ALA 133.A O no hydrogen 2.922 N/A LEU 138.A N ALA 134.A O no hydrogen 3.096 N/A THR 139.A N GLN 135.A O no hydrogen 3.121 N/A THR 139.A OG1 GLN 135.A O no hydrogen 2.570 N/A PHE 140.A N ILE 136.A O no hydrogen 2.829 N/A GLU 141.A N VAL 137.A O no hydrogen 3.105 N/A TYR 142.A N LEU 138.A O no hydrogen 2.901 N/A LEU 143.A N THR 139.A O no hydrogen 2.822 N/A HIS 144.A N PHE 140.A O no hydrogen 2.836 N/A HIS 144.A ND1 LEU 148.A O no hydrogen 3.046 N/A SER 145.A N GLU 141.A O no hydrogen 2.977 N/A SER 145.A OG TYR 142.A O no hydrogen 2.463 N/A LEU 146.A N TYR 142.A O no hydrogen 3.271 N/A LEU 146.A N LEU 143.A O no hydrogen 2.753 N/A ASP 147.A N HIS 144.A O no hydrogen 2.856 N/A LEU 148.A N LEU 143.A O no hydrogen 3.160 N/A ILE 149.A N LYS 175.A O no hydrogen 3.036 N/A TYR 150.A N ASP 206.A OD2 no hydrogen 2.954 N/A TYR 150.A OH ASP 152.A O no hydrogen 3.322 N/A TYR 150.A OH THR 169.A O no hydrogen 2.593 N/A TYR 150.A OH ASP 170.A O no hydrogen 3.316 N/A ARG 151.A N ASP 206.A OD1 no hydrogen 2.911 N/A LYS 154.A NZ THR 187.A OG1 no hydrogen 2.809 N/A GLU 156.A N GLU 156.A OE1 no hydrogen 2.711 N/A ASN 157.A N LYS 154.A O no hydrogen 2.909 N/A ASN 157.A ND2 ASP 152.A O no hydrogen 2.806 N/A ASN 157.A ND2 ASP 152.A OD2 no hydrogen 2.977 N/A LEU 158.A N PRO 155.A O no hydrogen 3.286 N/A LEU 159.A N GLN 167.A O no hydrogen 2.986 N/A ILE 160.A N GLY 112.A O no hydrogen 2.979 N/A ASP 161.A N TYR 165.A O no hydrogen 2.856 N/A GLN 163.A N ASP 161.A OD1 no hydrogen 2.621 N/A GLY 164.A N ASP 161.A O no hydrogen 3.021 N/A TYR 165.A N ASP 161.A OD1 no hydrogen 3.016 N/A TYR 165.A OH VAL 296.A O no hydrogen 2.649 N/A ILE 166.A N GLN 135.A OE1 no hydrogen 2.765 N/A GLN 167.A N LEU 159.A O no hydrogen 3.012 N/A GLN 167.A NE2 PRO 87.A O no hydrogen 2.824 N/A GLN 167.A NE2 ILE 166.A O no hydrogen 2.943 N/A VAL 168.A N PHE 88.A O no hydrogen 2.718 N/A THR 169.A N ASN 157.A O no hydrogen 2.997 N/A THR 169.A OG1 ASN 157.A O no hydrogen 3.198 N/A PHE 171.A N GLU 77.A OE2 no hydrogen 3.028 N/A GLY 172.A N ASP 170.A OD1 no hydrogen 3.153 N/A ALA 174.A N PHE 171.A O no hydrogen 3.174 N/A LYS 175.A N ILE 149.A O no hydrogen 3.063 N/A LYS 175.A NZ THR 181.A OG1 no hydrogen 3.086 N/A ARG 176.A NE LEU 146.A O no hydrogen 3.169 N/A ARG 176.A NH2 ASP 147.A OD2 no hydrogen 3.458 N/A VAL 177.A N ASP 147.A O no hydrogen 2.815 N/A THR 181.A N TYR 201.A O no hydrogen 3.110 N/A CYS 185.A SG LEU 184.A O no hydrogen 3.300 N/A THR 187.A OG1 ASP 152.A OD1 no hydrogen 3.130 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.494 N/A TYR 190.A N THR 187.A O no hydrogen 2.888 N/A TYR 190.A OH GLU 216.A OE1 no hydrogen 2.855 N/A LEU 191.A N PRO 188.A O no hydrogen 3.351 N/A GLU 194.A N GLU 194.A OE2 no hydrogen 2.777 N/A ILE 195.A N ALA 192.A O no hydrogen 3.023 N/A ILE 196.A N ALA 192.A O no hydrogen 3.363 N/A LEU 197.A N PRO 193.A O no hydrogen 3.006 N/A SER 198.A N ILE 195.A O no hydrogen 3.003 N/A LYS 199.A N GLU 194.A O no hydrogen 3.184 N/A TYR 201.A N THR 181.A O no hydrogen 2.904 N/A TYR 201.A OH THR 183.A O no hydrogen 2.317 N/A LYS 203.A NZ VAL 177.A O no hydrogen 2.769 N/A ALA 204.A N ASN 202.A OD1 no hydrogen 2.899 N/A VAL 205.A N ASN 202.A O no hydrogen 3.124 N/A ASP 206.A N LYS 203.A O no hydrogen 2.804 N/A TRP 208.A N ALA 204.A O no hydrogen 3.144 N/A ALA 209.A N VAL 205.A O no hydrogen 3.117 N/A LEU 210.A N ASP 206.A O no hydrogen 2.949 N/A GLY 211.A N TRP 207.A O no hydrogen 3.207 N/A VAL 212.A N TRP 208.A O no hydrogen 3.102 N/A LEU 213.A N ALA 209.A O no hydrogen 2.839 N/A ILE 214.A N LEU 210.A O no hydrogen 2.940 N/A TYR 215.A N GLY 211.A O no hydrogen 3.201 N/A TYR 215.A OH ARG 242.A O no hydrogen 2.513 N/A GLU 216.A N VAL 212.A O no hydrogen 2.884 N/A MET 217.A N LEU 213.A O no hydrogen 2.760 N/A ALA 218.A N ILE 214.A O no hydrogen 2.908 N/A ALA 219.A N TYR 215.A O no hydrogen 2.783 N/A GLY 220.A N GLU 216.A O no hydrogen 2.856 N/A GLN 228.A N GLN 231.A OE1 no hydrogen 3.068 N/A GLN 231.A N GLN 228.A O no hydrogen 2.917 N/A ILE 232.A N GLN 228.A O no hydrogen 3.279 N/A TYR 233.A N PRO 229.A O no hydrogen 2.783 N/A GLU 234.A N ILE 230.A O no hydrogen 3.041 N/A LYS 235.A N GLN 231.A O no hydrogen 3.316 N/A ILE 236.A N ILE 232.A O no hydrogen 3.209 N/A VAL 237.A N TYR 233.A O no hydrogen 3.277 N/A SER 238.A OG LYS 235.A O no hydrogen 2.501 N/A PHE 247.A N PRO 244.A O no hydrogen 3.259 N/A SER 248.A N GLU 126.A OE2 no hydrogen 3.022 N/A SER 248.A OG GLU 126.A OE1 no hydrogen 2.684 N/A LEU 251.A N SER 248.A OG no hydrogen 2.986 N/A LYS 252.A N SER 248.A O no hydrogen 3.146 N/A ASP 253.A N SER 249.A O no hydrogen 3.022 N/A LEU 254.A N ASP 250.A O no hydrogen 2.949 N/A LEU 255.A N LEU 251.A O no hydrogen 3.148 N/A ARG 256.A N LYS 252.A O no hydrogen 3.024 N/A ASN 257.A N ASP 253.A O no hydrogen 3.252 N/A LEU 258.A N LEU 255.A O no hydrogen 3.086 N/A LEU 259.A N LEU 255.A O no hydrogen 2.704 N/A ASP 262.A N GLN 260.A OE1 no hydrogen 3.116 N/A THR 264.A N ASP 262.A O no hydrogen 2.530 N/A THR 264.A OG1 ASP 262.A OD1 no hydrogen 2.794 N/A LYS 265.A N ASP 262.A O no hydrogen 2.787 N/A ARG 266.A N ASP 262.A O no hydrogen 3.280 N/A ARG 266.A NE GLN 260.A O no hydrogen 2.613 N/A ARG 266.A NH1 GLU 194.A OE1 no hydrogen 2.848 N/A ARG 266.A NH1 GLU 194.A OE2 no hydrogen 3.321 N/A ARG 266.A NH1 ALA 204.A O no hydrogen 3.103 N/A ARG 266.A NH2 GLU 194.A OE2 no hydrogen 2.563 N/A ARG 266.A NH2 GLN 260.A O no hydrogen 2.824 N/A PHE 267.A N ASN 257.A O no hydrogen 2.906 N/A ASN 269.A N ARG 266.A O no hydrogen 3.030 N/A ASN 269.A ND2 LEU 263.A O no hydrogen 2.627 N/A ASN 272.A ND2 ASP 276.A OD1 no hydrogen 3.516 N/A GLY 273.A N LEU 270.A O no hydrogen 2.895 N/A ASN 275.A N ASN 272.A O no hydrogen 3.125 N/A ASP 276.A N GLY 273.A O no hydrogen 3.161 N/A ILE 277.A N VAL 274.A O no hydrogen 2.729 N/A LYS 278.A N VAL 274.A O no hydrogen 2.951 N/A LYS 278.A NZ GLU 141.A OE1 no hydrogen 2.470 N/A LYS 278.A NZ GLU 141.A OE2 no hydrogen 3.094 N/A ASN 279.A N ASN 275.A O no hydrogen 2.845 N/A HIS 280.A N ILE 277.A O no hydrogen 3.106 N/A HIS 280.A NE2 ASP 253.A OD2 no hydrogen 2.452 N/A LYS 281.A NZ ASP 253.A OD2 no hydrogen 3.418 N/A TRP 282.A N HIS 280.A ND1 no hydrogen 3.172 N/A TRP 282.A NE1 GLU 126.A OE1 no hydrogen 3.216 N/A PHE 283.A N HIS 280.A O no hydrogen 2.652 N/A ALA 284.A N LYS 281.A O no hydrogen 2.807 N/A THR 286.A N PHE 283.A O no hydrogen 2.966 N/A TRP 288.A NE1 LYS 278.A O no hydrogen 3.106 N/A ALA 290.A N ASP 287.A OD1 no hydrogen 2.939 N/A ILE 291.A N ASP 287.A O no hydrogen 3.035 N/A TYR 292.A N TRP 288.A O no hydrogen 3.293 N/A GLN 293.A N ILE 289.A O no hydrogen 3.326 N/A ARG 294.A N ILE 291.A O no hydrogen 3.152 N/A ARG 294.A NH1 GLN 163.A OE1 no hydrogen 2.770 N/A LYS 295.A N ALA 290.A O no hydrogen 3.134 N/A LYS 303.A N ILE 301.A O no hydrogen 2.801 N/A LYS 305.A N ASP 309.A OD2 no hydrogen 3.319 N/A ASP 309.A N GLY 306.A O no hydrogen 3.238 N/A SER 311.A N ASP 309.A OD1 no hydrogen 3.304 N/A ASN 312.A ND2 PRO 110.A O no hydrogen 3.001 N/A PHE 313.A N THR 310.A O no hydrogen 3.009 N/A SER 324.A N SER 100.A OG no hydrogen 2.900 N/A LYS 328.A N ASN 99.A O no hydrogen 3.116 N/A GLU 332.A N GLU 332.A OE1 no hydrogen 2.611 N/A PHE 333.A N CYS 329.A O no hydrogen 3.306 N/A PHE 333.A N GLY 330.A O no hydrogen 3.040 N/A SER 334.A N LYS 331.A O no hydrogen 3.282 N/A SER 334.A OG LYS 331.A O no hydrogen 3.046 N/A PHE 336.A N PHE 333.A O no hydrogen 2.973 N/A