Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tnq_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N PHE 2.A O no hydrogen 3.369 N/A LYS 5.A NZ GLU 8.A OE2 no hydrogen 3.441 N/A GLU 8.A N ALA 4.A O no hydrogen 3.472 N/A ASP 9.A N LYS 5.A O no hydrogen 2.693 N/A PHE 10.A N ALA 6.A O no hydrogen 2.824 N/A LEU 11.A N LYS 7.A O no hydrogen 2.820 N/A LYS 12.A N GLU 8.A O no hydrogen 3.053 N/A TRP 14.A N PHE 10.A O no hydrogen 2.776 N/A GLU 15.A N LEU 11.A O no hydrogen 3.076 N/A THR 16.A N LYS 12.A O no hydrogen 3.413 N/A THR 16.A OG1 LYS 12.A O no hydrogen 3.205 N/A THR 21.A N SER 93.A O no hydrogen 2.921 N/A GLN 23.A NE2 ASP 25.A OD1 no hydrogen 3.182 N/A GLN 26.A N GLN 23.A O no hydrogen 3.191 N/A PHE 27.A N LEU 24.A O no hydrogen 3.388 N/A ASP 28.A N LYS 45.A O no hydrogen 2.392 N/A ILE 30.A N LEU 43.A O no hydrogen 2.966 N/A LYS 31.A N LEU 43.A O no hydrogen 3.438 N/A THR 32.A N GLU 314.A OE2 no hydrogen 2.729 N/A THR 32.A OG1 GLU 314.A OE1 no hydrogen 2.335 N/A THR 32.A OG1 GLU 314.A OE2 no hydrogen 2.831 N/A LEU 33.A N VAL 41.A O no hydrogen 2.564 N/A GLY 34.A N VAL 41.A O no hydrogen 3.330 N/A GLY 39.A N ILE 57.A O no hydrogen 2.590 N/A MET 42.A N MET 55.A O no hydrogen 3.218 N/A LEU 43.A N LYS 31.A O no hydrogen 2.712 N/A VAL 44.A N TYR 53.A O no hydrogen 2.842 N/A LYS 45.A N ASP 28.A O no hydrogen 2.950 N/A HIS 46.A N ASN 51.A O no hydrogen 2.999 N/A HIS 46.A ND1 SER 49.A OG no hydrogen 2.369 N/A LYS 47.A N GLN 26.A O no hydrogen 2.694 N/A LYS 47.A NZ ASP 25.A O no hydrogen 2.470 N/A SER 49.A N HIS 46.A ND1 no hydrogen 3.244 N/A SER 49.A OG HIS 46.A ND1 no hydrogen 2.369 N/A ASN 51.A N SER 49.A OG no hydrogen 2.798 N/A ASN 51.A ND2 TYR 53.A OH no hydrogen 3.285 N/A HIS 52.A ND1 VAL 44.A O no hydrogen 2.914 N/A TYR 53.A N VAL 44.A O no hydrogen 3.197 N/A ALA 54.A N MET 104.A O no hydrogen 3.126 N/A MET 55.A N MET 42.A O no hydrogen 2.956 N/A LYS 56.A N MET 102.A O no hydrogen 2.727 N/A LYS 56.A NZ GLU 75.A OE1 no hydrogen 3.295 N/A LEU 58.A N LEU 100.A O no hydrogen 2.834 N/A ASP 59.A N PHE 38.A O no hydrogen 2.439 N/A LYS 60.A N SER 98.A O no hydrogen 3.054 N/A LYS 60.A NZ ASP 96.A O no hydrogen 3.198 N/A LYS 60.A NZ LYS 323.A O no hydrogen 2.655 N/A GLN 61.A N ASP 59.A OD2 no hydrogen 3.306 N/A LYS 62.A N ASP 59.A O no hydrogen 2.907 N/A VAL 64.A N LYS 60.A O no hydrogen 2.973 N/A LYS 65.A N GLN 61.A O no hydrogen 2.809 N/A LEU 66.A N LYS 62.A O no hydrogen 2.588 N/A LEU 66.A N VAL 63.A O no hydrogen 2.639 N/A LYS 67.A N VAL 64.A O no hydrogen 3.315 N/A HIS 71.A ND1 GLN 68.A OE1 no hydrogen 3.268 N/A THR 72.A N ILE 69.A O no hydrogen 2.871 N/A THR 72.A OG1 GLN 68.A O no hydrogen 2.579 N/A LEU 73.A N ILE 69.A O no hydrogen 3.262 N/A ASN 74.A N GLU 70.A O no hydrogen 3.005 N/A GLU 75.A N HIS 71.A O no hydrogen 2.947 N/A LYS 76.A N THR 72.A O no hydrogen 3.238 N/A LYS 76.A NZ SER 18.A O no hydrogen 2.838 N/A LYS 76.A NZ PHE 331.A O no hydrogen 2.493 N/A ARG 77.A N LEU 73.A O no hydrogen 2.724 N/A LEU 79.A N GLU 75.A O no hydrogen 2.948 N/A GLN 80.A N ARG 77.A O no hydrogen 3.328 N/A GLN 80.A NE2 LYS 13.A O no hydrogen 3.384 N/A ALA 81.A N ILE 78.A O no hydrogen 2.645 N/A ASN 83.A N TYR 139.A OH no hydrogen 3.041 N/A ASN 83.A ND2 VAL 82.A O no hydrogen 3.547 N/A LEU 87.A N PHE 84.A O no hydrogen 3.061 N/A GLU 91.A N VAL 103.A O no hydrogen 2.600 N/A PHE 92.A N VAL 103.A O no hydrogen 3.349 N/A SER 93.A OG GLN 19.A O no hydrogen 3.140 N/A PHE 94.A N TYR 101.A O no hydrogen 3.162 N/A LYS 95.A NZ PHE 328.A O no hydrogen 2.615 N/A ASP 96.A N ASN 99.A O no hydrogen 3.121 N/A ASN 99.A N ASP 96.A OD1 no hydrogen 2.716 N/A ASN 99.A ND2 TYR 101.A OH no hydrogen 2.841 N/A ASN 99.A ND2 ARG 318.A O no hydrogen 3.675 N/A LEU 100.A N LEU 58.A O no hydrogen 2.545 N/A TYR 101.A N PHE 94.A O no hydrogen 3.019 N/A TYR 101.A OH ASP 96.A OD2 no hydrogen 2.489 N/A MET 102.A N LYS 56.A O no hydrogen 3.091 N/A VAL 103.A N PHE 92.A O no hydrogen 2.743 N/A MET 104.A N ALA 54.A O no hydrogen 2.793 N/A GLU 105.A N LYS 89.A O no hydrogen 2.801 N/A TYR 106.A OH ASP 305.A O no hydrogen 2.731 N/A MET 112.A N LEU 155.A O no hydrogen 2.896 N/A PHE 113.A N PRO 152.A O no hydrogen 3.269 N/A HIS 115.A N GLU 111.A O no hydrogen 3.050 N/A LEU 116.A N MET 112.A O no hydrogen 2.952 N/A ARG 117.A N PHE 113.A O no hydrogen 3.029 N/A ARG 117.A NH1 GLU 212.A OE1 no hydrogen 3.284 N/A ARG 117.A NH2 GLU 212.A OE1 no hydrogen 2.781 N/A ARG 118.A N SER 114.A O no hydrogen 3.183 N/A ILE 119.A N HIS 115.A O no hydrogen 2.642 N/A GLY 120.A N LEU 116.A O no hydrogen 2.643 N/A PHE 122.A N MET 213.A O no hydrogen 2.817 N/A HIS 125.A NE2 TYR 129.A OH no hydrogen 2.703 N/A ARG 127.A N GLU 123.A O no hydrogen 2.607 N/A ARG 127.A NE TRP 278.A O no hydrogen 2.725 N/A PHE 128.A N PRO 124.A O no hydrogen 3.121 N/A PHE 128.A N HIS 125.A O no hydrogen 2.892 N/A TYR 129.A OH HIS 125.A NE2 no hydrogen 2.703 N/A ALA 130.A N ALA 126.A O no hydrogen 2.838 N/A ALA 131.A N ARG 127.A O no hydrogen 2.949 N/A GLN 132.A NE2 PHE 128.A O no hydrogen 2.420 N/A GLN 132.A NE2 TYR 129.A O no hydrogen 3.679 N/A ILE 133.A N TYR 129.A O no hydrogen 3.113 N/A VAL 134.A N ALA 130.A O no hydrogen 2.844 N/A LEU 135.A N ALA 131.A O no hydrogen 3.122 N/A THR 136.A N GLN 132.A O no hydrogen 3.092 N/A THR 136.A OG1 GLN 132.A O no hydrogen 2.864 N/A PHE 137.A N ILE 133.A O no hydrogen 2.999 N/A GLU 138.A N VAL 134.A O no hydrogen 2.999 N/A TYR 139.A N LEU 135.A O no hydrogen 2.959 N/A LEU 140.A N THR 136.A O no hydrogen 2.823 N/A HIS 141.A N PHE 137.A O no hydrogen 2.846 N/A HIS 141.A NE2 ASP 202.A OD2 no hydrogen 2.830 N/A SER 142.A N GLU 138.A O no hydrogen 2.966 N/A SER 142.A OG TYR 139.A O no hydrogen 2.085 N/A LEU 143.A N LEU 140.A O no hydrogen 2.899 N/A ASP 144.A N HIS 141.A O no hydrogen 2.727 N/A LEU 145.A N LEU 140.A O no hydrogen 3.038 N/A ILE 146.A N LYS 172.A O no hydrogen 3.015 N/A TYR 147.A N ASP 202.A OD2 no hydrogen 2.956 N/A ARG 148.A N ASP 202.A OD1 no hydrogen 2.978 N/A ARG 148.A NE PHE 170.A O no hydrogen 2.999 N/A ARG 148.A NH2 PHE 170.A O no hydrogen 3.088 N/A LYS 151.A NZ ASP 149.A OD1 no hydrogen 3.449 N/A LYS 151.A NZ THR 183.A OG1 no hydrogen 3.335 N/A GLU 153.A N GLU 153.A OE2 no hydrogen 2.675 N/A ASN 154.A N LYS 151.A O no hydrogen 2.810 N/A ASN 154.A ND2 ASP 149.A O no hydrogen 2.758 N/A LEU 155.A N PRO 152.A O no hydrogen 3.189 N/A LEU 156.A N GLN 164.A O no hydrogen 2.911 N/A ILE 157.A N GLY 110.A O no hydrogen 3.085 N/A ASP 158.A N TYR 162.A O no hydrogen 2.948 N/A GLN 160.A NE2 GLN 160.A O no hydrogen 3.309 N/A GLY 161.A N ASP 158.A O no hydrogen 2.644 N/A TYR 162.A N ASP 158.A OD1 no hydrogen 2.738 N/A TYR 162.A OH VAL 292.A O no hydrogen 2.536 N/A ILE 163.A N GLN 132.A OE1 no hydrogen 2.951 N/A GLN 164.A N LEU 156.A O no hydrogen 2.752 N/A GLN 164.A NE2 PRO 85.A O no hydrogen 2.553 N/A GLN 164.A NE2 ILE 163.A O no hydrogen 3.429 N/A VAL 165.A N PHE 86.A O no hydrogen 2.736 N/A THR 166.A N ASN 154.A O no hydrogen 2.903 N/A THR 166.A OG1 GLN 164.A O no hydrogen 3.189 N/A ASP 167.A N TYR 147.A OH no hydrogen 3.242 N/A GLY 169.A N ASP 167.A OD2 no hydrogen 3.038 N/A ALA 171.A N PHE 168.A O no hydrogen 2.975 N/A LYS 172.A N ILE 146.A O no hydrogen 3.053 N/A VAL 174.A N ASP 144.A O no hydrogen 2.934 N/A THR 178.A N TYR 197.A O no hydrogen 2.823 N/A TRP 179.A N THR 178.A OG1 no hydrogen 2.772 N/A THR 183.A OG1 ASP 149.A OD1 no hydrogen 2.906 N/A GLU 185.A N GLU 185.A OE2 no hydrogen 2.497 N/A TYR 186.A N THR 183.A O no hydrogen 2.597 N/A TYR 186.A OH GLU 212.A OE2 no hydrogen 2.244 N/A LEU 187.A N PRO 184.A O no hydrogen 3.187 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 2.905 N/A ILE 191.A N ALA 188.A O no hydrogen 2.868 N/A ILE 192.A N ALA 188.A O no hydrogen 3.209 N/A LEU 193.A N PRO 189.A O no hydrogen 3.121 N/A SER 194.A N ILE 191.A O no hydrogen 3.229 N/A LYS 195.A N GLU 190.A O no hydrogen 3.181 N/A TYR 197.A N THR 178.A O no hydrogen 2.856 N/A ASN 198.A ND2 VAL 174.A O no hydrogen 3.309 N/A ASN 198.A ND2 GLY 176.A O no hydrogen 3.117 N/A LYS 199.A NZ HIS 141.A O no hydrogen 2.775 N/A LYS 199.A NZ ASP 144.A OD1 no hydrogen 3.396 N/A VAL 201.A N ASN 198.A O no hydrogen 3.513 N/A ASP 202.A N LYS 199.A O no hydrogen 2.875 N/A TRP 204.A N ALA 200.A O no hydrogen 2.996 N/A ALA 205.A N VAL 201.A O no hydrogen 3.091 N/A LEU 206.A N ASP 202.A O no hydrogen 3.021 N/A GLY 207.A N TRP 203.A O no hydrogen 3.100 N/A VAL 208.A N TRP 204.A O no hydrogen 3.253 N/A LEU 209.A N ALA 205.A O no hydrogen 2.904 N/A ILE 210.A N LEU 206.A O no hydrogen 3.066 N/A TYR 211.A N GLY 207.A O no hydrogen 2.950 N/A TYR 211.A OH ARG 238.A O no hydrogen 2.707 N/A GLU 212.A N VAL 208.A O no hydrogen 2.875 N/A MET 213.A N LEU 209.A O no hydrogen 2.750 N/A ALA 214.A N ILE 210.A O no hydrogen 3.052 N/A ALA 215.A N TYR 211.A O no hydrogen 2.811 N/A GLY 216.A N GLU 212.A O no hydrogen 2.642 N/A GLN 227.A N GLN 224.A O no hydrogen 2.854 N/A ILE 228.A N GLN 224.A O no hydrogen 3.335 N/A TYR 229.A N PRO 225.A O no hydrogen 2.951 N/A GLU 230.A N ILE 226.A O no hydrogen 2.789 N/A LYS 231.A N GLN 227.A O no hydrogen 3.150 N/A LYS 231.A NZ PHE 221.A O no hydrogen 3.040 N/A ILE 232.A N ILE 228.A O no hydrogen 2.917 N/A VAL 233.A N TYR 229.A O no hydrogen 3.005 N/A SER 234.A N GLU 230.A O no hydrogen 3.302 N/A SER 234.A OG GLU 230.A O no hydrogen 3.503 N/A SER 234.A OG LYS 231.A O no hydrogen 2.839 N/A GLY 235.A N LYS 231.A O no hydrogen 3.218 N/A SER 244.A N GLU 123.A OE1 no hydrogen 2.623 N/A SER 244.A OG GLU 123.A OE1 no hydrogen 3.393 N/A SER 244.A OG GLU 123.A OE2 no hydrogen 2.538 N/A LEU 247.A N SER 244.A O no hydrogen 2.913 N/A LEU 247.A N SER 244.A OG no hydrogen 3.024 N/A LYS 248.A N SER 244.A O no hydrogen 3.179 N/A LYS 248.A NZ PHE 243.A O no hydrogen 2.481 N/A ASP 249.A N SER 245.A O no hydrogen 3.082 N/A LEU 250.A N ASP 246.A O no hydrogen 3.476 N/A LEU 251.A N LEU 247.A O no hydrogen 2.962 N/A ARG 252.A N LYS 248.A O no hydrogen 2.986 N/A ASN 253.A N ASP 249.A O no hydrogen 3.221 N/A ASN 253.A N LEU 250.A O no hydrogen 2.934 N/A ASN 253.A ND2 ASP 249.A O no hydrogen 2.755 N/A LEU 254.A N LEU 250.A O no hydrogen 3.079 N/A LEU 254.A N LEU 251.A O no hydrogen 2.875 N/A LEU 255.A N LEU 251.A O no hydrogen 2.771 N/A ASP 258.A N GLN 256.A OE1 no hydrogen 3.362 N/A THR 260.A N ASP 258.A OD2 no hydrogen 3.154 N/A THR 260.A OG1 ASP 258.A OD1 no hydrogen 3.223 N/A THR 260.A OG1 ASP 258.A OD2 no hydrogen 2.697 N/A LYS 261.A N ASP 258.A O no hydrogen 2.672 N/A ARG 262.A NE GLN 256.A O no hydrogen 2.790 N/A ARG 262.A NH1 GLU 190.A OE1 no hydrogen 3.343 N/A ARG 262.A NH1 GLU 190.A OE2 no hydrogen 3.057 N/A ARG 262.A NH1 ALA 200.A O no hydrogen 2.870 N/A ARG 262.A NH2 GLU 190.A OE1 no hydrogen 2.896 N/A ARG 262.A NH2 GLN 256.A O no hydrogen 2.956 N/A PHE 263.A N ASN 253.A O no hydrogen 2.603 N/A ASN 265.A N ARG 262.A O no hydrogen 3.065 N/A ASN 265.A ND2 LEU 259.A O no hydrogen 3.234 N/A GLY 269.A N LEU 266.A O no hydrogen 2.803 N/A ASN 271.A N ASN 268.A O no hydrogen 3.152 N/A ASP 272.A N GLY 269.A O no hydrogen 3.369 N/A ILE 273.A N VAL 270.A O no hydrogen 2.866 N/A LYS 274.A N VAL 270.A O no hydrogen 3.194 N/A LYS 274.A NZ GLU 138.A OE1 no hydrogen 3.071 N/A LYS 274.A NZ GLU 138.A OE2 no hydrogen 3.070 N/A ASN 275.A N ASN 271.A O no hydrogen 2.758 N/A HIS 276.A N ILE 273.A O no hydrogen 2.777 N/A HIS 276.A NE2 ASP 249.A OD1 no hydrogen 3.141 N/A TRP 278.A N HIS 276.A ND1 no hydrogen 2.843 N/A TRP 278.A NE1 GLU 123.A OE2 no hydrogen 3.048 N/A PHE 279.A N HIS 276.A O no hydrogen 3.103 N/A ALA 280.A N LYS 277.A O no hydrogen 3.037 N/A THR 282.A N PHE 279.A O no hydrogen 2.886 N/A ILE 287.A N ASP 283.A O no hydrogen 2.608 N/A TYR 288.A N TRP 284.A O no hydrogen 3.226 N/A GLN 289.A NE2 ILE 285.A O no hydrogen 2.878 N/A ARG 290.A N ILE 287.A O no hydrogen 2.710 N/A ARG 290.A NH2 ASP 158.A OD2 no hydrogen 3.193 N/A LYS 291.A N ALA 286.A O no hydrogen 2.901 N/A LYS 291.A NZ GLN 289.A OE1 no hydrogen 2.965 N/A LYS 301.A N ASP 305.A OD1 no hydrogen 3.366 N/A SER 307.A OG ASP 305.A OD1 no hydrogen 2.849 N/A PHE 309.A N THR 306.A O no hydrogen 3.215 N/A LYS 323.A N ASN 97.A O no hydrogen 2.745 N/A LYS 323.A NZ GLN 61.A OE1 no hydrogen 3.407 N/A LYS 326.A NZ LYS 326.A O no hydrogen 3.500 N/A GLU 327.A N GLU 327.A OE2 no hydrogen 3.107 N/A PHE 328.A N CYS 324.A O no hydrogen 3.412 N/A THR 329.A N LYS 326.A O no hydrogen 3.374 N/A THR 329.A OG1 LYS 326.A O no hydrogen 2.916 N/A PHE 331.A N PHE 328.A O no hydrogen 3.031 N/A