Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5k6s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N ASP 1.A O no hydrogen 3.114 N/A LEU 5.A N ASP 1.A O no hydrogen 3.256 N/A PHE 6.A N GLN 2.A O no hydrogen 3.279 N/A ILE 7.A N GLU 3.A O no hydrogen 3.232 N/A GLN 8.A N LYS 4.A O no hydrogen 2.975 N/A LYS 9.A N LEU 5.A O no hydrogen 2.974 N/A LEU 10.A N PHE 6.A O no hydrogen 2.958 N/A ARG 11.A N ILE 7.A O no hydrogen 2.939 N/A ARG 11.A NE GLU 58.A OE1 no hydrogen 2.996 N/A ARG 11.A NH1 GLU 58.A OE2 no hydrogen 2.953 N/A GLN 12.A N GLN 8.A O no hydrogen 2.847 N/A CYS 13.A N LYS 9.A O no hydrogen 3.097 N/A CYS 13.A N LEU 10.A O no hydrogen 3.101 N/A CYS 13.A SG LYS 9.A O no hydrogen 3.259 N/A CYS 14.A N ARG 11.A O no hydrogen 3.001 N/A CYS 14.A SG LEU 10.A O no hydrogen 3.382 N/A CYS 14.A SG HIS 61.A ND1 no hydrogen 3.436 N/A SER 25.A N ASP 22.A OD1 no hydrogen 3.217 N/A SER 25.A OG ASP 22.A OD1 no hydrogen 3.302 N/A SER 25.A OG ASP 22.A OD2 no hydrogen 2.910 N/A ASP 26.A N ASP 22.A O no hydrogen 3.199 N/A LEU 27.A N PRO 23.A O no hydrogen 3.416 N/A LYS 28.A N LEU 24.A O no hydrogen 3.316 N/A TRP 29.A N SER 25.A O no hydrogen 3.064 N/A LYS 30.A N ASP 26.A O no hydrogen 3.030 N/A GLU 31.A N LEU 27.A O no hydrogen 2.916 N/A VAL 32.A N LYS 28.A O no hydrogen 2.936 N/A LYS 33.A N TRP 29.A O no hydrogen 2.950 N/A LYS 33.A NZ CYS 13.A O no hydrogen 3.265 N/A LYS 33.A NZ ASN 66.A OD1 no hydrogen 3.063 N/A ARG 34.A N LYS 30.A O no hydrogen 2.929 N/A ARG 34.A NE GLU 31.A OE1 no hydrogen 3.361 N/A ARG 34.A NE GLU 31.A OE2 no hydrogen 3.505 N/A ARG 34.A NH2 GLU 31.A OE2 no hydrogen 3.044 N/A ALA 35.A N GLU 31.A O no hydrogen 2.777 N/A ALA 36.A N VAL 32.A O no hydrogen 2.905 N/A LEU 37.A N LYS 33.A O no hydrogen 3.076 N/A SER 38.A N ARG 34.A O no hydrogen 3.121 N/A SER 38.A OG ARG 34.A O no hydrogen 2.996 N/A GLU 39.A N ALA 35.A O no hydrogen 2.833 N/A MET 40.A N ALA 36.A O no hydrogen 3.033 N/A VAL 41.A N LEU 37.A O no hydrogen 2.853 N/A GLU 42.A N SER 38.A O no hydrogen 3.072 N/A TYR 43.A N GLU 39.A O no hydrogen 3.030 N/A ILE 44.A N MET 40.A O no hydrogen 3.158 N/A THR 45.A OG1 VAL 41.A O no hydrogen 2.373 N/A HIS 46.A N GLU 42.A O no hydrogen 3.394 N/A HIS 46.A ND1 GLU 42.A O no hydrogen 3.273 N/A ASN 47.A N TYR 43.A O no hydrogen 3.171 N/A ASN 47.A ND2 TYR 43.A O no hydrogen 3.279 N/A ASN 49.A N ASP 95.A OD2 no hydrogen 2.572 N/A THR 52.A OG1 GLU 3.A OE1 no hydrogen 2.816 N/A ILE 55.A N THR 52.A O no hydrogen 3.229 N/A TYR 56.A N GLU 53.A O no hydrogen 3.283 N/A VAL 59.A N ILE 55.A O no hydrogen 2.879 N/A VAL 60.A N TYR 56.A O no hydrogen 3.275 N/A HIS 61.A N PRO 57.A O no hydrogen 2.979 N/A MET 62.A N GLU 58.A O no hydrogen 3.071 N/A PHE 63.A N VAL 59.A O no hydrogen 2.924 N/A ALA 64.A N VAL 60.A O no hydrogen 2.928 N/A VAL 65.A N HIS 61.A O no hydrogen 2.933 N/A ASN 66.A N MET 62.A O no hydrogen 3.286 N/A ASN 66.A ND2 CYS 13.A O no hydrogen 3.050 N/A ASN 66.A ND2 MET 62.A O no hydrogen 2.492 N/A MET 67.A N PHE 63.A O no hydrogen 2.806 N/A PHE 68.A N ALA 64.A O no hydrogen 3.100 N/A ARG 69.A NH1 MET 67.A O no hydrogen 2.718 N/A ARG 69.A NH2 GLU 124.A OE2 no hydrogen 2.485 N/A GLU 74.A N ASP 121.A OD2 no hydrogen 3.179 N/A HIS 79.A NE2 LYS 30.A O no hydrogen 2.785 N/A LEU 80.A N ALA 76.A O no hydrogen 3.278 N/A GLN 81.A N TRP 77.A O no hydrogen 2.762 N/A VAL 83.A N HIS 79.A O no hydrogen 3.101 N/A TYR 84.A N LEU 80.A O no hydrogen 3.041 N/A TYR 84.A OH GLU 124.A OE2 no hydrogen 2.894 N/A GLU 85.A N GLN 81.A O no hydrogen 2.878 N/A PHE 86.A N LEU 82.A O no hydrogen 2.694 N/A PHE 87.A N VAL 83.A O no hydrogen 2.959 N/A LEU 88.A N TYR 84.A O no hydrogen 2.976 N/A ARG 89.A N.A GLU 85.A O no hydrogen 3.018 N/A ARG 89.A N.B GLU 85.A O no hydrogen 3.024 N/A ARG 89.A NH1.A THR 45.A OG1 no hydrogen 3.010 N/A PHE 90.A N PHE 86.A O no hydrogen 2.976 N/A LEU 91.A N PHE 87.A O no hydrogen 3.037 N/A GLU 92.A N LEU 88.A O no hydrogen 2.872 N/A ASP 95.A N SER 93.A OG no hydrogen 3.368 N/A PHE 96.A N SER 93.A O no hydrogen 3.042 N/A GLN 97.A N TYR 56.A OH no hydrogen 2.860 N/A ILE 100.A N GLN 97.A O no hydrogen 2.853 N/A ALA 101.A N GLN 97.A O no hydrogen 3.090 N/A LYS 102.A N PRO 98.A O no hydrogen 2.803 N/A LYS 103.A NZ GLU 53.A OE2 no hydrogen 3.330 N/A TYR 104.A N ALA 101.A O no hydrogen 3.025 N/A ILE 105.A N ALA 101.A O no hydrogen 2.863 N/A PHE 109.A N ASP 106.A OD1 no hydrogen 3.146 N/A VAL 110.A N ASP 106.A O no hydrogen 3.102 N/A LEU 111.A N GLN 107.A O no hydrogen 2.783 N/A GLN 112.A N LYS 108.A O no hydrogen 2.953 N/A LEU 113.A N PHE 109.A O no hydrogen 2.821 N/A LEU 114.A N VAL 110.A O no hydrogen 3.026 N/A GLU 115.A N LEU 111.A O no hydrogen 3.230 N/A LEU 116.A N LEU 113.A O no hydrogen 3.258 N/A PHE 117.A N LEU 114.A O no hydrogen 3.145 N/A ASP 118.A N GLU 115.A O no hydrogen 3.344 N/A SER 119.A N LEU 116.A O no hydrogen 2.983 N/A SER 119.A OG GLU 124.A OE1 no hydrogen 2.852 N/A ASP 121.A N SER 119.A OG no hydrogen 3.021 N/A ARG 123.A N ASP 121.A OD1 no hydrogen 2.966 N/A ARG 123.A NE ASP 121.A OD1 no hydrogen 3.245 N/A ARG 123.A NH1 ASP 121.A OD2 no hydrogen 3.245 N/A ARG 125.A N ASP 121.A O no hydrogen 3.086 N/A ARG 125.A NE GLU 169.A OE1 no hydrogen 3.468 N/A ARG 125.A NE GLU 169.A OE2 no hydrogen 3.071 N/A ARG 125.A NH1 SER 119.A O no hydrogen 3.246 N/A ARG 125.A NH2 GLU 169.A OE2 no hydrogen 3.445 N/A ASP 126.A N PRO 122.A O no hydrogen 3.160 N/A PHE 127.A N ARG 123.A O no hydrogen 3.327 N/A LEU 128.A N GLU 124.A O no hydrogen 2.930 N/A LYS 129.A N ARG 125.A O no hydrogen 2.869 N/A LYS 129.A NZ ASP 126.A OD2 no hydrogen 2.978 N/A LYS 129.A NZ GLU 172.A OE1 no hydrogen 3.315 N/A LYS 129.A NZ GLU 172.A OE2 no hydrogen 3.275 N/A THR 130.A N ASP 126.A O no hydrogen 3.124 N/A THR 130.A OG1 ASP 126.A O no hydrogen 3.264 N/A THR 131.A N PHE 127.A O no hydrogen 2.867 N/A THR 131.A OG1 PHE 127.A O no hydrogen 2.799 N/A LEU 132.A N LEU 128.A O no hydrogen 2.910 N/A HIS 133.A N LYS 129.A O no hydrogen 3.106 N/A HIS 133.A NE2 SER 176.A OG no hydrogen 3.056 N/A ARG 134.A N THR 130.A O no hydrogen 3.027 N/A ARG 134.A N THR 131.A O no hydrogen 3.117 N/A ILE 135.A N THR 131.A O no hydrogen 3.069 N/A TYR 136.A N LEU 132.A O no hydrogen 3.082 N/A GLY 137.A N HIS 133.A O no hydrogen 3.314 N/A LYS 138.A N ARG 134.A O no hydrogen 2.994 N/A LYS 138.A NZ LEU 91.A O no hydrogen 2.692 N/A PHE 139.A N ILE 135.A O no hydrogen 2.929 N/A LEU 142.A N PHE 139.A O no hydrogen 3.014 N/A ARG 143.A NE TYR 136.A O no hydrogen 2.812 N/A ARG 143.A NH2 GLY 137.A O no hydrogen 2.927 N/A ILE 146.A N LEU 142.A O no hydrogen 2.883 N/A ARG 147.A N ARG 143.A O no hydrogen 3.211 N/A ARG 147.A NH1 TYR 136.A OH no hydrogen 2.800 N/A LYS 148.A N ALA 144.A O no hydrogen 3.179 N/A GLN 149.A N TYR 145.A O no hydrogen 3.070 N/A ILE 150.A N ILE 146.A O no hydrogen 2.960 N/A ASN 151.A N ARG 147.A O no hydrogen 2.974 N/A ASN 152.A N LYS 148.A O no hydrogen 3.173 N/A ILE 153.A N GLN 149.A O no hydrogen 3.260 N/A PHE 154.A N ILE 150.A O no hydrogen 3.194 N/A TYR 155.A N ASN 151.A O no hydrogen 3.184 N/A ARG 156.A N ASN 152.A O no hydrogen 3.071 N/A PHE 157.A N PHE 154.A O no hydrogen 2.854 N/A ILE 158.A N PHE 154.A O no hydrogen 2.774 N/A TYR 159.A N TYR 155.A O no hydrogen 3.035 N/A GLY 166.A N HIS 164.A ND1 no hydrogen 2.977 N/A GLU 169.A N GLU 169.A OE1 no hydrogen 2.636 N/A LEU 170.A N GLY 166.A O no hydrogen 3.089 N/A LEU 171.A N ILE 167.A O no hydrogen 3.091 N/A GLU 172.A N ALA 168.A O no hydrogen 2.975 N/A ILE 173.A N GLU 169.A O no hydrogen 3.232 N/A LEU 174.A N LEU 170.A O no hydrogen 3.000 N/A GLY 175.A N LEU 171.A O no hydrogen 2.941 N/A SER 176.A OG HIS 133.A NE2 no hydrogen 3.056 N/A ILE 177.A N ILE 173.A O no hydrogen 3.170 N/A ILE 177.A N LEU 174.A O no hydrogen 2.938 N/A ILE 178.A N LEU 174.A O no hydrogen 2.813 N/A ASN 179.A N GLY 175.A O no hydrogen 3.211 N/A ASN 179.A ND2 GLN 219.A OE1 no hydrogen 2.495 N/A GLY 180.A N ILE 177.A O no hydrogen 3.113 N/A PHE 181.A N ILE 178.A O no hydrogen 3.164 N/A HIS 189.A N LYS 186.A O no hydrogen 2.914 N/A LYS 190.A N LYS 186.A O no hydrogen 3.236 N/A ILE 191.A N GLU 187.A O no hydrogen 2.995 N/A PHE 192.A N GLU 188.A O no hydrogen 3.075 N/A LEU 193.A N HIS 189.A O no hydrogen 2.979 N/A LEU 194.A N LYS 190.A O no hydrogen 3.079 N/A LYS 195.A N ILE 191.A O no hydrogen 2.543 N/A VAL 196.A N PHE 192.A O no hydrogen 3.128 N/A LEU 197.A N PHE 192.A O no hydrogen 3.060 N/A LEU 198.A N LEU 193.A O no hydrogen 3.278 N/A LEU 200.A N LEU 197.A O no hydrogen 3.300 N/A HIS 201.A N LEU 198.A O no hydrogen 3.090 N/A HIS 201.A ND1 LEU 198.A O no hydrogen 2.754 N/A HIS 201.A NE2 GLU 253.A OE1 no hydrogen 2.732 N/A LYS 202.A N PRO 199.A O no hydrogen 3.134 N/A VAL 208.A N SER 205.A O no hydrogen 3.353 N/A TYR 209.A N LEU 206.A O no hydrogen 3.196 N/A TYR 209.A OH LEU 200.A O no hydrogen 2.703 N/A HIS 210.A NE2 GLU 253.A OE2 no hydrogen 2.859 N/A LEU 213.A N TYR 209.A O no hydrogen 2.928 N/A ALA 214.A N HIS 210.A O no hydrogen 2.886 N/A TYR 215.A N PRO 211.A O no hydrogen 3.299 N/A CYS 216.A N GLN 212.A O no hydrogen 3.200 N/A CYS 216.A SG LEU 171.A O no hydrogen 3.231 N/A CYS 216.A SG GLN 212.A O no hydrogen 3.538 N/A VAL 217.A N LEU 213.A O no hydrogen 3.113 N/A VAL 218.A N ALA 214.A O no hydrogen 2.966 N/A GLN 219.A N TYR 215.A O no hydrogen 2.942 N/A PHE 220.A N CYS 216.A O no hydrogen 3.070 N/A LEU 221.A N VAL 217.A O no hydrogen 3.333 N/A LEU 221.A N VAL 218.A O no hydrogen 3.010 N/A GLU 222.A N VAL 218.A O no hydrogen 2.985 N/A GLU 222.A N GLN 219.A O no hydrogen 3.231 N/A LYS 223.A N GLN 219.A O no hydrogen 3.251 N/A LYS 223.A NZ ASN 179.A O no hydrogen 3.137 N/A LYS 223.A NZ PHE 181.A O no hydrogen 3.239 N/A ASP 224.A N PHE 220.A O no hydrogen 3.281 N/A THR 226.A N ASP 224.A OD1 no hydrogen 3.481 N/A THR 226.A OG1 ASP 224.A OD1 no hydrogen 2.743 N/A THR 226.A OG1 ASP 224.A OD2 no hydrogen 3.486 N/A LEU 227.A N ASP 224.A O no hydrogen 3.374 N/A THR 228.A OG1 SER 225.A O no hydrogen 3.204 N/A VAL 231.A N LEU 227.A O no hydrogen 3.403 N/A VAL 232.A N THR 228.A O no hydrogen 3.071 N/A MET 233.A N GLU 229.A O no hydrogen 2.979 N/A ALA 234.A N PRO 230.A O no hydrogen 3.174 N/A LEU 235.A N VAL 231.A O no hydrogen 2.966 N/A LEU 236.A N VAL 232.A O no hydrogen 3.009 N/A LYS 237.A N MET 233.A O no hydrogen 3.055 N/A TYR 238.A N ALA 234.A O no hydrogen 2.749 N/A TRP 239.A NE1 GLU 247.A OE1 no hydrogen 3.155 N/A HIS 243.A ND1 GLU 247.A OE2 no hydrogen 2.958 N/A LYS 246.A NZ LYS 204.A O no hydrogen 3.092 N/A GLU 247.A N SER 244.A O no hydrogen 2.939 N/A VAL 248.A N PRO 245.A O no hydrogen 3.054 N/A MET 249.A N LYS 246.A O no hydrogen 3.173 N/A LEU 251.A N GLU 247.A O no hydrogen 2.823 N/A ASN 252.A N VAL 248.A O no hydrogen 2.993 N/A GLU 253.A N MET 249.A O no hydrogen 3.042 N/A LEU 254.A N PHE 250.A O no hydrogen 2.773 N/A GLU 255.A N LEU 251.A O no hydrogen 3.066 N/A GLU 256.A N ASN 252.A O no hydrogen 3.209 N/A ILE 257.A N GLU 253.A O no hydrogen 3.138 N/A LEU 258.A N LEU 254.A O no hydrogen 3.145 N/A ASP 259.A N GLU 255.A O no hydrogen 3.073 N/A VAL 260.A N ILE 257.A O no hydrogen 3.196 N/A GLU 265.A N GLU 262.A O no hydrogen 2.756 N/A PHE 266.A N GLU 262.A O no hydrogen 2.673 N/A LYS 268.A N GLU 265.A O no hydrogen 3.381 N/A ILE 269.A N PHE 266.A O no hydrogen 3.341 N/A LEU 273.A N ILE 269.A O no hydrogen 3.170 N/A PHE 274.A N MET 270.A O no hydrogen 3.202 N/A ARG 275.A N GLU 271.A O no hydrogen 3.034 N/A ARG 275.A NH2 GLU 271.A OE2 no hydrogen 2.957 N/A GLN 276.A N PRO 272.A O no hydrogen 3.450 N/A LEU 277.A N LEU 273.A O no hydrogen 2.882 N/A ALA 278.A N PHE 274.A O no hydrogen 2.858 N/A LYS 279.A N ARG 275.A O no hydrogen 3.405 N/A CYS 280.A N GLN 276.A O no hydrogen 3.056 N/A CYS 280.A SG GLU 247.A OE1 no hydrogen 3.464 N/A CYS 280.A SG GLN 276.A O no hydrogen 3.474 N/A VAL 281.A N LEU 277.A O no hydrogen 3.033 N/A SER 282.A N ALA 278.A O no hydrogen 3.132 N/A SER 282.A OG ALA 278.A O no hydrogen 3.074 N/A SER 283.A N CYS 280.A O no hydrogen 3.149 N/A SER 283.A OG HIS 243.A ND1 no hydrogen 3.318 N/A SER 283.A OG HIS 285.A O no hydrogen 3.491 N/A HIS 285.A N SER 283.A OG no hydrogen 3.082 N/A HIS 285.A NE2 HIS 243.A O no hydrogen 2.658 N/A VAL 288.A N HIS 285.A O no hydrogen 3.154 N/A ALA 289.A N HIS 285.A O no hydrogen 3.245 N/A GLU 290.A N PHE 286.A O no hydrogen 2.691 N/A ARG 291.A N GLN 287.A O no hydrogen 3.076 N/A ARG 291.A NE ASN 252.A OD1 no hydrogen 3.232 N/A ARG 291.A NH1 GLU 255.A OE1 no hydrogen 2.755 N/A ARG 291.A NH1 ARG 291.A O no hydrogen 2.922 N/A ARG 291.A NH2 GLU 255.A OE1 no hydrogen 2.460 N/A ALA 292.A N VAL 288.A O no hydrogen 2.954 N/A LEU 293.A N ALA 289.A O no hydrogen 2.874 N/A TYR 294.A N ARG 291.A O no hydrogen 3.229 N/A TYR 295.A N ALA 292.A O no hydrogen 3.218 N/A TYR 295.A OH LEU 251.A O no hydrogen 2.766 N/A TRP 296.A N LEU 293.A O no hydrogen 3.331 N/A ASN 297.A N TYR 294.A O no hydrogen 3.137 N/A ASN 298.A N TYR 295.A O no hydrogen 3.140 N/A ASN 298.A ND2 ASP 259.A OD1 no hydrogen 2.791 N/A TYR 300.A OH ILE 261.A O no hydrogen 2.553 N/A ILE 301.A N ASN 298.A OD1 no hydrogen 3.061 N/A MET 302.A N ASN 298.A O no hydrogen 3.183 N/A SER 303.A N GLU 299.A O no hydrogen 3.208 N/A LEU 304.A N TYR 300.A O no hydrogen 3.300 N/A ILE 305.A N ILE 301.A O no hydrogen 2.767 N/A SER 306.A N MET 302.A O no hydrogen 2.579 N/A ASP 307.A N SER 303.A O no hydrogen 3.118 N/A ASN 308.A N ILE 305.A O no hydrogen 2.915 N/A ASN 308.A ND2 LEU 304.A O no hydrogen 2.677 N/A LYS 311.A N ASN 308.A O no hydrogen 3.082 N/A ILE 312.A N ASN 308.A O no hydrogen 3.074 N/A LEU 313.A N ALA 309.A O no hydrogen 3.352 N/A ILE 315.A N ILE 312.A O no hydrogen 2.799 N/A MET 316.A N ILE 312.A O no hydrogen 3.077 N/A PHE 317.A N LEU 313.A O no hydrogen 3.052 N/A LEU 320.A N PHE 317.A O no hydrogen 3.105 N/A TYR 321.A N PHE 317.A O no hydrogen 3.145 N/A