Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3k6x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ASN 6.A OD1 no hydrogen 2.967 N/A THR 3.A OG1 ASN 6.A OD1 no hydrogen 3.071 N/A LEU 7.A N THR 3.A O no hydrogen 3.062 N/A TYR 8.A N THR 4.A O no hydrogen 2.812 N/A LEU 13.A N ASP 40.A O no hydrogen 3.261 N/A THR 14.A N ASP 63.A OD2 no hydrogen 2.907 N/A VAL 15.A N GLN 42.A O no hydrogen 2.988 N/A PHE 16.A N VAL 64.A O no hydrogen 2.875 N/A HIS 17.A N GLU 44.A O no hydrogen 3.092 N/A HIS 17.A ND1 ALA 18.A O no hydrogen 2.725 N/A ALA 18.A N ALA 66.A O no hydrogen 3.130 N/A SER 20.A OG TYR 264.A OH no hydrogen 2.600 N/A LEU 21.A N ALA 18.A O no hydrogen 3.106 N/A SER 22.A N GLY 19.A O no hydrogen 3.210 N/A SER 22.A OG GLY 19.A O no hydrogen 2.777 N/A PHE 25.A N LEU 21.A O no hydrogen 2.990 N/A GLU 26.A N VAL 23.A O no hydrogen 3.254 N/A GLU 27.A N VAL 23.A O no hydrogen 3.360 N/A LEU 28.A N PRO 24.A O no hydrogen 2.927 N/A GLU 29.A N PHE 25.A O no hydrogen 2.860 N/A ALA 30.A N GLU 26.A O no hydrogen 3.302 N/A GLU 31.A N GLU 27.A O no hydrogen 3.251 N/A PHE 32.A N LEU 28.A O no hydrogen 3.072 N/A GLU 33.A N GLU 29.A O no hydrogen 2.934 N/A ALA 34.A N ALA 30.A O no hydrogen 3.168 N/A GLN 35.A N GLU 31.A O no hydrogen 3.196 N/A GLN 35.A NE2 GLU 31.A OE2 no hydrogen 3.152 N/A HIS 36.A N PHE 32.A O no hydrogen 3.038 N/A HIS 36.A ND1 PHE 32.A O no hydrogen 3.276 N/A VAL 39.A N HIS 36.A O no hydrogen 3.422 N/A ASP 40.A N GLU 11.A O no hydrogen 3.039 N/A VAL 41.A N GLU 33.A OE2 no hydrogen 3.158 N/A GLN 42.A N LEU 13.A O no hydrogen 2.789 N/A GLN 42.A NE2 ASP 40.A OD2 no hydrogen 3.355 N/A ARG 43.A NE GLU 29.A OE1 no hydrogen 2.738 N/A ARG 43.A NH1 HIS 17.A NE2 no hydrogen 2.943 N/A ARG 43.A NH2 GLU 29.A OE1 no hydrogen 3.164 N/A GLU 44.A N VAL 15.A O no hydrogen 2.937 N/A ALA 46.A N HIS 17.A O no hydrogen 3.205 N/A ALA 49.A N ASP 130.A O no hydrogen 3.109 N/A GLN 50.A N ASP 130.A O no hydrogen 3.464 N/A SER 51.A N GLY 47.A O no hydrogen 2.892 N/A SER 51.A OG ALA 46.A O no hydrogen 3.514 N/A SER 51.A OG GLY 47.A O no hydrogen 3.072 N/A VAL 52.A N SER 48.A O no hydrogen 3.063 N/A ARG 53.A N ALA 49.A O no hydrogen 3.003 N/A ARG 53.A NE GLN 50.A OE1 no hydrogen 3.263 N/A ARG 53.A NH1 ASN 129.A O no hydrogen 3.002 N/A ARG 53.A NH2 ASN 129.A O no hydrogen 2.833 N/A LYS 54.A N GLN 50.A O no hydrogen 3.163 N/A LYS 54.A NZ GLU 44.A OE1 no hydrogen 2.842 N/A ILE 55.A N VAL 52.A O no hydrogen 2.975 N/A THR 56.A N VAL 52.A O no hydrogen 2.993 N/A THR 56.A OG1 VAL 52.A O no hydrogen 3.244 N/A GLU 57.A N ARG 53.A O no hydrogen 2.913 N/A LEU 58.A N ARG 53.A O no hydrogen 3.088 N/A LYS 60.A N LYS 54.A O no hydrogen 2.870 N/A LYS 61.A NZ ASN 271.A OD1 no hydrogen 3.056 N/A ASP 63.A N THR 14.A O no hydrogen 2.772 N/A VAL 64.A N THR 14.A O no hydrogen 3.148 N/A LEU 65.A N THR 267.A O no hydrogen 2.955 N/A ALA 66.A N PHE 16.A O no hydrogen 2.988 N/A SER 67.A N GLY 265.A O no hydrogen 2.754 N/A SER 67.A OG ASP 69.A O no hydrogen 2.677 N/A ALA 68.A N SER 48.A OG no hydrogen 2.841 N/A ASP 69.A N SER 67.A OG no hydrogen 2.968 N/A TYR 70.A N VAL 263.A O no hydrogen 2.876 N/A ALA 71.A N ASP 69.A OD1 no hydrogen 3.340 N/A LEU 72.A N ASP 69.A O no hydrogen 3.243 N/A ILE 73.A N TYR 70.A O no hydrogen 3.103 N/A SER 75.A N ALA 71.A O no hydrogen 3.201 N/A SER 75.A OG ALA 71.A O no hydrogen 2.796 N/A LEU 76.A N LEU 72.A O no hydrogen 3.092 N/A MET 77.A N ILE 73.A O no hydrogen 2.848 N/A VAL 78.A N ILE 73.A O no hydrogen 3.069 N/A TYR 81.A N MET 77.A O no hydrogen 2.861 N/A TYR 85.A N GLU 308.A O no hydrogen 3.280 N/A ALA 86.A N VAL 266.A O no hydrogen 2.926 N/A ALA 87.A N ILE 306.A O no hydrogen 2.667 N/A PHE 88.A N TYR 264.A O no hydrogen 3.004 N/A ARG 90.A N PRO 300.A O no hydrogen 2.772 N/A ASN 91.A ND2 SER 217.A OG no hydrogen 2.785 N/A ASN 91.A ND2 TYR 264.A OH no hydrogen 3.022 N/A GLN 92.A N ASN 91.A OD1 no hydrogen 2.843 N/A MET 93.A N ASP 234.A O no hydrogen 3.080 N/A ILE 94.A N ILE 214.A O no hydrogen 2.893 N/A ALA 96.A N LEU 212.A O no hydrogen 2.834 N/A TYR 97.A N GLU 225.A O no hydrogen 2.692 N/A THR 98.A N SER 101.A OG no hydrogen 3.310 N/A SER 101.A N THR 98.A O no hydrogen 3.262 N/A SER 101.A OG THR 98.A O no hydrogen 3.501 N/A SER 101.A OG ASP 210.A O no hydrogen 2.741 N/A TYR 103.A OH ASP 120.A OD2 no hydrogen 2.838 N/A ASN 108.A N ASN 111.A OD1 no hydrogen 2.826 N/A THR 109.A OG1 ALA 228.A O no hydrogen 2.977 N/A ASP 110.A N ASN 108.A OD1 no hydrogen 3.239 N/A ASN 111.A ND2 GLU 106.A O no hydrogen 3.305 N/A TRP 112.A NE1 TYR 148.A OH no hydrogen 2.849 N/A ILE 115.A N ASN 111.A O no hydrogen 3.056 N/A LEU 116.A N TRP 112.A O no hydrogen 3.116 N/A ARG 117.A N TYR 113.A O no hydrogen 3.036 N/A ARG 117.A NH1 ASP 150.A OD2 no hydrogen 2.894 N/A ARG 117.A NH2 ASP 150.A OD1 no hydrogen 3.122 N/A ARG 117.A NH2 ASP 150.A OD2 no hydrogen 2.896 N/A ARG 118.A N ILE 115.A O no hydrogen 3.223 N/A ARG 118.A NE ASP 120.A OD1 no hydrogen 3.428 N/A VAL 121.A N ARG 118.A O no hydrogen 3.093 N/A ARG 122.A N ASP 210.A OD2 no hydrogen 2.891 N/A TYR 123.A N LYS 190.A O no hydrogen 2.938 N/A TYR 123.A OH LEU 157.A O no hydrogen 2.714 N/A GLY 124.A N TYR 211.A O no hydrogen 2.911 N/A PHE 125.A N MET 192.A O no hydrogen 3.386 N/A SER 126.A OG ASP 131.A OD2 no hydrogen 2.597 N/A ASN 127.A N ARG 194.A O no hydrogen 2.755 N/A ASN 127.A ND2 SER 181.A OG no hydrogen 3.166 N/A ASN 129.A N ASN 127.A OD1 no hydrogen 3.025 N/A ASN 129.A ND2 PRO 179.A O no hydrogen 2.903 N/A ASN 129.A ND2 SER 181.A OG no hydrogen 3.198 N/A ASP 130.A N ASN 127.A O no hydrogen 3.128 N/A ASP 131.A N ASN 127.A O no hydrogen 2.755 N/A GLY 134.A N ASP 131.A O no hydrogen 2.948 N/A TYR 135.A N ASP 131.A O no hydrogen 3.187 N/A TYR 135.A OH ASP 69.A OD2 no hydrogen 2.742 N/A ARG 136.A N PRO 132.A O no hydrogen 2.799 N/A ARG 136.A NH1 ALA 68.A O no hydrogen 3.134 N/A ARG 136.A NH1 TYR 215.A OH no hydrogen 2.775 N/A ARG 136.A NH2 ALA 68.A O no hydrogen 2.778 N/A SER 137.A OG GLY 134.A O no hydrogen 2.597 N/A GLN 138.A N TYR 135.A O no hydrogen 3.221 N/A GLN 138.A NE2 SER 137.A OG no hydrogen 3.281 N/A MET 139.A N TYR 135.A O no hydrogen 3.113 N/A VAL 140.A N ARG 136.A O no hydrogen 2.930 N/A THR 141.A N SER 137.A O no hydrogen 3.344 N/A THR 141.A OG1 SER 137.A O no hydrogen 2.703 N/A THR 141.A OG1 TYR 213.A OH no hydrogen 3.167 N/A GLN 142.A N GLN 138.A O no hydrogen 3.031 N/A LEU 143.A N MET 139.A O no hydrogen 3.020 N/A ALA 144.A N VAL 140.A O no hydrogen 3.157 N/A GLU 145.A N GLN 142.A O no hydrogen 3.180 N/A TYR 148.A N ALA 144.A O no hydrogen 3.065 N/A TYR 148.A OH THR 109.A O no hydrogen 2.672 N/A ASP 150.A N GLU 145.A O no hydrogen 2.960 N/A MET 152.A N ASP 150.A OD1 no hydrogen 3.182 N/A TYR 154.A N GLU 145.A OE2 no hydrogen 2.958 N/A TYR 154.A OH GLN 138.A OE1 no hydrogen 2.555 N/A ASP 156.A N MET 152.A O no hydrogen 2.942 N/A LEU 157.A N ILE 153.A O no hydrogen 3.217 N/A MET 158.A N TYR 154.A O no hydrogen 2.991 N/A LEU 159.A N TYR 154.A O no hydrogen 3.129 N/A ALA 160.A N ASP 155.A O no hydrogen 2.887 N/A ASN 161.A N MET 158.A O no hydrogen 3.197 N/A ASN 161.A ND2 TYR 123.A OH no hydrogen 3.376 N/A ASN 161.A ND2 LEU 157.A O no hydrogen 3.303 N/A THR 162.A OG1 MET 158.A O no hydrogen 2.638 N/A MET 164.A N THR 162.A OG1 no hydrogen 3.253 N/A THR 165.A N HIS 177.A O no hydrogen 3.125 N/A THR 167.A N LEU 175.A O no hydrogen 2.941 N/A THR 167.A OG1 HIS 177.A NE2 no hydrogen 3.061 N/A GLU 169.A N THR 173.A O no hydrogen 2.831 N/A GLY 172.A N GLU 169.A O no hydrogen 3.143 N/A THR 173.A N ASN 171.A OD1 no hydrogen 3.453 N/A ALA 174.A N LYS 246.A O no hydrogen 3.007 N/A LEU 175.A N THR 167.A O no hydrogen 2.859 N/A ILE 176.A N GLN 248.A O no hydrogen 2.826 N/A HIS 177.A N THR 165.A O no hydrogen 2.799 N/A HIS 177.A NE2 THR 167.A OG1 no hydrogen 3.061 N/A VAL 178.A N GLU 250.A O no hydrogen 3.003 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 2.694 N/A GLU 183.A N ALA 180.A O no hydrogen 2.822 N/A SER 185.A OG GLU 182.A O no hydrogen 3.440 N/A ASN 187.A N ASN 161.A O no hydrogen 2.839 N/A ASN 187.A ND2 ASN 161.A OD1 no hydrogen 3.301 N/A SER 189.A N ASN 187.A OD1 no hydrogen 3.439 N/A LYS 190.A N ASN 187.A O no hydrogen 2.908 N/A LYS 190.A NZ LEU 116.A O no hydrogen 2.653 N/A LYS 190.A NZ ARG 118.A O no hydrogen 2.524 N/A LYS 190.A NZ VAL 121.A O no hydrogen 2.914 N/A ILE 191.A N ASN 187.A O no hydrogen 2.656 N/A MET 192.A N TYR 123.A O no hydrogen 3.212 N/A ARG 194.A NH1 LEU 193.A O no hydrogen 2.923 N/A SER 195.A OG ASP 130.A OD2 no hydrogen 3.538 N/A GLU 197.A N ASP 131.A OD2 no hydrogen 2.892 N/A VAL 198.A N GLU 197.A OE2 no hydrogen 2.994 N/A GLU 199.A N MET 196.A O no hydrogen 3.471 N/A LEU 200.A N GLU 197.A O no hydrogen 3.269 N/A SER 201.A N VAL 198.A O no hydrogen 3.454 N/A SER 201.A OG VAL 198.A O no hydrogen 3.251 N/A LEU 204.A N LEU 200.A O no hydrogen 3.281 N/A GLU 205.A N SER 201.A O no hydrogen 3.139 N/A THR 206.A N SER 202.A O no hydrogen 3.387 N/A THR 206.A OG1 SER 202.A O no hydrogen 3.509 N/A THR 206.A OG1 ALA 203.A O no hydrogen 3.296 N/A GLY 207.A N ALA 203.A O no hydrogen 3.226 N/A GLU 208.A N ALA 203.A O no hydrogen 2.853 N/A ILE 209.A N ALA 203.A O no hydrogen 3.390 N/A ASP 210.A N ARG 122.A O no hydrogen 2.801 N/A TYR 211.A N ARG 122.A O no hydrogen 3.289 N/A TYR 211.A OH LYS 102.A O no hydrogen 2.726 N/A LEU 212.A N ALA 96.A O no hydrogen 2.899 N/A TYR 213.A N GLY 124.A O no hydrogen 3.014 N/A TYR 213.A OH THR 141.A OG1 no hydrogen 3.167 N/A ILE 214.A N ILE 94.A O no hydrogen 3.277 N/A ARG 216.A N GLN 92.A O no hydrogen 2.760 N/A ARG 216.A NE TYR 226.A OH no hydrogen 2.992 N/A ARG 216.A NH1 GLN 92.A OE1 no hydrogen 3.143 N/A SER 217.A N ASN 91.A OD1 no hydrogen 3.405 N/A ALA 219.A N TYR 215.A O no hydrogen 3.287 N/A GLU 220.A N ARG 216.A O no hydrogen 3.015 N/A GLN 221.A N SER 217.A O no hydrogen 2.814 N/A GLN 221.A NE2 ASN 297.A O no hydrogen 2.915 N/A HIS 222.A N VAL 218.A O no hydrogen 3.028 N/A HIS 222.A ND1 VAL 218.A O no hydrogen 2.912 N/A GLY 223.A N ALA 219.A O no hydrogen 2.878 N/A PHE 224.A N ALA 219.A O no hydrogen 2.788 N/A GLU 225.A N TYR 97.A O no hydrogen 2.868 N/A VAL 227.A N LEU 95.A O no hydrogen 2.970 N/A ILE 233.A N PRO 230.A O no hydrogen 2.916 N/A ASP 234.A N PRO 230.A O no hydrogen 3.025 N/A SER 236.A N ASP 234.A OD1 no hydrogen 3.232 N/A SER 236.A OG ASP 234.A OD1 no hydrogen 2.694 N/A SER 236.A OG ASP 234.A OD2 no hydrogen 3.116 N/A SER 237.A N TYR 244.A OH no hydrogen 3.031 N/A GLU 239.A N SER 237.A OG no hydrogen 3.329 N/A ASN 243.A N TYR 240.A O no hydrogen 3.111 N/A ASN 243.A ND2 ALA 232.A O no hydrogen 2.637 N/A TYR 244.A N TYR 240.A O no hydrogen 3.028 N/A TYR 244.A OH PRO 231.A O no hydrogen 2.472 N/A TYR 244.A OH SER 237.A O no hydrogen 3.400 N/A SER 245.A N ALA 241.A O no hydrogen 3.149 N/A SER 245.A OG ALA 241.A O no hydrogen 3.450 N/A SER 245.A OG ASP 242.A O no hydrogen 2.703 N/A LYS 246.A N ASN 243.A O no hydrogen 3.339 N/A VAL 247.A N TYR 244.A O no hydrogen 3.375 N/A GLN 248.A N ALA 174.A O no hydrogen 2.829 N/A VAL 249.A N VAL 257.A O no hydrogen 2.949 N/A GLU 250.A N ILE 176.A O no hydrogen 2.714 N/A MET 251.A N GLU 255.A O no hydrogen 2.785 N/A VAL 252.A N ASN 129.A OD1 no hydrogen 3.088 N/A GLY 254.A N MET 251.A O no hydrogen 3.047 N/A GLU 255.A N ASN 253.A OD1 no hydrogen 3.379 N/A VAL 257.A N VAL 249.A O no hydrogen 2.922 N/A THR 258.A OG1 GLN 248.A OE1 no hydrogen 2.859 N/A GLY 259.A N VAL 247.A O no hydrogen 3.079 N/A SER 260.A OG THR 258.A O no hydrogen 3.380 N/A ILE 262.A N LEU 235.A O no hydrogen 2.802 N/A TYR 264.A N ALA 89.A O no hydrogen 2.910 N/A TYR 264.A OH SER 20.A OG no hydrogen 2.600 N/A GLY 265.A N SER 67.A O no hydrogen 2.932 N/A VAL 266.A N ALA 86.A O no hydrogen 2.937 N/A THR 267.A N LEU 65.A O no hydrogen 2.948 N/A THR 267.A OG1 TRP 84.A O no hydrogen 2.648 N/A ASN 270.A N TYR 81.A O no hydrogen 2.812 N/A ASN 270.A ND2 GLU 80.A O no hydrogen 3.407 N/A ASN 270.A ND2 ASP 83.A OD1 no hydrogen 3.058 N/A ALA 272.A N PRO 269.A O no hydrogen 3.319 N/A ASN 274.A N ASP 63.A OD1 no hydrogen 3.035 N/A ALA 278.A N ASN 274.A O no hydrogen 2.868 N/A THR 279.A N SER 275.A O no hydrogen 3.139 N/A THR 279.A OG1 SER 275.A O no hydrogen 2.725 N/A PHE 281.A N LEU 277.A O no hydrogen 3.244 N/A VAL 282.A N ALA 278.A O no hydrogen 2.961 N/A ALA 283.A N THR 279.A O no hydrogen 2.878 N/A LEU 284.A N GLU 280.A O no hydrogen 3.145 N/A LEU 285.A N PHE 281.A O no hydrogen 3.004 N/A LEU 286.A N VAL 282.A O no hydrogen 2.817 N/A GLU 288.A N GLU 288.A OE1 no hydrogen 2.889 N/A GLN 291.A N GLY 287.A O no hydrogen 3.230 N/A GLN 291.A NE2 LEU 286.A O no hydrogen 3.102 N/A GLN 292.A N GLU 288.A O no hydrogen 3.169 N/A ILE 293.A N THR 289.A O no hydrogen 3.278 N/A PHE 294.A N GLY 290.A O no hydrogen 3.213 N/A ILE 295.A N GLN 291.A O no hydrogen 3.182 N/A GLU 296.A N GLN 292.A O no hydrogen 3.097 N/A ASN 297.A N PHE 294.A O no hydrogen 3.149 N/A ASN 297.A ND2 GLU 27.A OE2 no hydrogen 3.543 N/A GLY 298.A N ILE 295.A O no hydrogen 3.317 N/A GLN 299.A N PHE 294.A O no hydrogen 2.900 N/A ILE 302.A N PHE 88.A O no hydrogen 2.684 N/A ILE 306.A N ALA 87.A O no hydrogen 3.105 N/A ALA 307.A N VAL 322.A O no hydrogen 2.849 N/A GLU 308.A N TYR 85.A O no hydrogen 2.963 N/A LYS 310.A NZ VAL 322.A OXT no hydrogen 3.132 N/A SER 312.A N GLY 309.A O no hydrogen 3.150 N/A MET 313.A N LYS 310.A O no hydrogen 3.310 N/A LEU 317.A N PRO 314.A O no hydrogen 3.043 N/A GLN 318.A NE2 MET 313.A O no hydrogen 2.809 N/A LEU 320.A N LEU 317.A O no hydrogen 3.074 N/A VAL 322.A N ALA 305.A O no hydrogen 2.795 N/A