Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5d1b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N VAL 112.A O no hydrogen 2.966 N/A TYR 5.A N ARG 42.A O no hydrogen 3.021 N/A TYR 5.A OH HIS 29.A ND1 no hydrogen 3.107 N/A ILE 6.A N ILE 114.A O no hydrogen 2.984 N/A TYR 7.A N VAL 44.A O no hydrogen 3.095 N/A TYR 11.A OH ASN 115.A OD1 no hydrogen 2.974 N/A VAL 12.A N SER 8.A O no hydrogen 2.877 N/A SER 13.A N PRO 9.A O no hydrogen 3.264 N/A MET 14.A N GLU 10.A O no hydrogen 3.046 N/A CYS 15.A N TYR 11.A O no hydrogen 3.016 N/A CYS 15.A SG TYR 11.A O no hydrogen 3.192 N/A CYS 15.A SG SER 117.A OG no hydrogen 3.622 N/A ASP 16.A N VAL 12.A O no hydrogen 2.766 N/A SER 17.A N MET 14.A O no hydrogen 3.188 N/A SER 17.A OG TYR 90.A OH no hydrogen 3.280 N/A LEU 18.A N CYS 15.A O no hydrogen 3.233 N/A LYS 23.A N ASP 16.A O no hydrogen 3.206 N/A ARG 24.A N ILE 21.A O no hydrogen 3.306 N/A ARG 24.A NH1 GLY 282.A O no hydrogen 2.880 N/A ARG 24.A NH1 GLY 284.A O no hydrogen 3.157 N/A ARG 24.A NH2 GLY 282.A O no hydrogen 3.164 N/A SER 26.A N ASP 16.A OD2 no hydrogen 2.911 N/A SER 26.A OG ASP 16.A OD1 no hydrogen 2.311 N/A SER 26.A OG ASP 16.A OD2 no hydrogen 3.242 N/A MET 27.A N LYS 23.A O no hydrogen 2.975 N/A VAL 28.A N ARG 24.A O no hydrogen 3.026 N/A HIS 29.A N ALA 25.A O no hydrogen 3.064 N/A HIS 29.A ND1 TYR 5.A OH no hydrogen 3.107 N/A SER 30.A N SER 26.A O no hydrogen 2.656 N/A LEU 31.A N MET 27.A O no hydrogen 3.149 N/A ILE 32.A N VAL 28.A O no hydrogen 2.931 N/A GLU 33.A N HIS 29.A O no hydrogen 2.664 N/A ALA 34.A N SER 30.A O no hydrogen 2.815 N/A TYR 35.A N LEU 31.A O no hydrogen 3.240 N/A TYR 35.A N ILE 32.A O no hydrogen 3.170 N/A TYR 35.A OH SER 307.A O no hydrogen 2.716 N/A ALA 36.A N GLU 33.A O no hydrogen 2.743 N/A LEU 37.A N ILE 32.A O no hydrogen 3.253 N/A GLN 40.A N LEU 37.A O no hydrogen 3.069 N/A MET 41.A N HIS 38.A O no hydrogen 3.392 N/A ARG 42.A N PRO 3.A O no hydrogen 2.872 N/A VAL 44.A N TYR 5.A O no hydrogen 3.169 N/A LYS 45.A NZ SER 8.A OG no hydrogen 3.189 N/A LYS 45.A NZ GLU 10.A OE1 no hydrogen 3.460 N/A LYS 47.A N THR 100.A OG1 no hydrogen 3.014 N/A GLU 53.A N SER 50.A OG no hydrogen 3.371 N/A ALA 55.A N MET 51.A O no hydrogen 3.269 N/A THR 56.A OG1 GLU 53.A O no hydrogen 3.097 N/A PHE 57.A N MET 54.A O no hydrogen 3.432 N/A HIS 58.A N MET 54.A O no hydrogen 3.210 N/A HIS 58.A ND1 LYS 125.A O no hydrogen 3.160 N/A THR 59.A N LYS 125.A O no hydrogen 3.126 N/A TYR 62.A N THR 59.A OG1 no hydrogen 3.067 N/A TYR 62.A OH TYR 133.A O no hydrogen 2.712 N/A LEU 63.A N THR 59.A O no hydrogen 3.082 N/A GLN 64.A N ASP 60.A O no hydrogen 2.839 N/A HIS 65.A N ALA 61.A O no hydrogen 3.394 N/A LEU 66.A N TYR 62.A O no hydrogen 2.890 N/A GLN 67.A N LEU 63.A O no hydrogen 3.071 N/A LYS 68.A N GLN 64.A O no hydrogen 2.772 N/A VAL 69.A N HIS 65.A O no hydrogen 2.987 N/A GLN 71.A N GLN 67.A O no hydrogen 3.021 N/A GLN 71.A N LYS 68.A O no hydrogen 2.976 N/A GLN 71.A NE2 GLN 67.A O no hydrogen 3.624 N/A GLU 72.A N LYS 68.A O no hydrogen 3.222 N/A LEU 77.A N GLU 74.A O no hydrogen 2.960 N/A CYS 81.A N GLY 78.A O no hydrogen 2.887 N/A CYS 81.A SG CYS 132.A O no hydrogen 3.789 N/A GLU 85.A N GLU 85.A OE2 no hydrogen 2.982 N/A GLY 86.A N SER 70.A O no hydrogen 3.253 N/A ILE 87.A N THR 84.A O no hydrogen 3.442 N/A PHE 88.A N SER 70.A OG no hydrogen 3.241 N/A TYR 90.A N GLY 86.A O no hydrogen 3.076 N/A TYR 90.A OH SER 17.A OG no hydrogen 3.280 N/A ALA 91.A N ILE 87.A O no hydrogen 2.885 N/A ALA 92.A N PHE 88.A O no hydrogen 2.645 N/A ALA 93.A N ASP 89.A O no hydrogen 3.013 N/A ILE 94.A N TYR 90.A O no hydrogen 3.201 N/A GLY 95.A N ALA 91.A O no hydrogen 2.969 N/A GLU 96.A N ALA 92.A O no hydrogen 2.794 N/A ALA 97.A N ALA 93.A O no hydrogen 2.870 N/A THR 98.A N ILE 94.A O no hydrogen 2.998 N/A THR 98.A OG1 ILE 94.A O no hydrogen 3.304 N/A THR 98.A OG1 ASP 136.A OD2 no hydrogen 2.866 N/A ILE 99.A N GLY 95.A O no hydrogen 3.260 N/A THR 100.A N GLU 96.A O no hydrogen 2.780 N/A THR 100.A OG1 GLU 96.A O no hydrogen 2.846 N/A ALA 101.A N ALA 97.A O no hydrogen 3.158 N/A ALA 102.A N THR 98.A O no hydrogen 2.941 N/A GLN 103.A N ILE 99.A O no hydrogen 2.849 N/A GLN 103.A NE2 GLN 103.A O no hydrogen 3.296 N/A GLN 103.A NE2 ASP 107.A OD1 no hydrogen 3.098 N/A CYS 104.A N THR 100.A O no hydrogen 3.111 N/A CYS 104.A SG THR 100.A O no hydrogen 3.280 N/A LEU 105.A N ALA 101.A O no hydrogen 3.398 N/A ILE 106.A N ALA 102.A O no hydrogen 3.319 N/A ILE 106.A N GLN 103.A O no hydrogen 3.050 N/A ASP 107.A N GLN 103.A O no hydrogen 3.096 N/A MET 109.A N CYS 104.A O no hydrogen 3.112 N/A CYS 110.A SG VAL 112.A O no hydrogen 3.611 N/A LYS 111.A NZ GLN 274.A O no hydrogen 2.574 N/A ALA 113.A N THR 277.A O no hydrogen 3.020 N/A ILE 114.A N VAL 4.A O no hydrogen 2.790 N/A ASN 115.A N ILE 279.A O no hydrogen 3.003 N/A ASN 115.A ND2 THR 98.A OG1 no hydrogen 2.974 N/A GLY 118.A N ASN 115.A O no hydrogen 3.101 N/A GLY 119.A N ASP 136.A OD1 no hydrogen 3.224 N/A GLY 119.A N ASP 136.A OD2 no hydrogen 2.822 N/A TRP 120.A N ASP 136.A OD1 no hydrogen 2.850 N/A TRP 120.A NE1 SER 117.A O no hydrogen 2.979 N/A HIS 121.A ND1 ASP 155.A OD2 no hydrogen 2.402 N/A HIS 122.A ND1 ASP 162.A OD2 no hydrogen 2.655 N/A LYS 124.A N GLU 127.A O no hydrogen 2.972 N/A LYS 124.A NZ HIS 122.A O no hydrogen 3.186 N/A LYS 124.A NZ ASP 162.A OD1 no hydrogen 2.918 N/A ALA 128.A N TYR 75.A O no hydrogen 3.022 N/A SER 129.A N CYS 132.A O no hydrogen 2.845 N/A CYS 132.A N SER 129.A O no hydrogen 2.873 N/A CYS 132.A SG GLY 130.A O no hydrogen 3.380 N/A TYR 133.A OH PRO 82.A O no hydrogen 3.184 N/A ASN 135.A N HIS 58.A NE2 no hydrogen 3.029 N/A ASN 135.A ND2 ALA 123.A O no hydrogen 2.802 N/A VAL 138.A N ASN 135.A OD1 no hydrogen 3.207 N/A LEU 139.A N ASN 135.A O no hydrogen 3.322 N/A GLY 140.A N ASP 136.A O no hydrogen 2.974 N/A ILE 141.A N ALA 137.A O no hydrogen 2.996 N/A LEU 142.A N VAL 138.A O no hydrogen 2.834 N/A ARG 143.A N LEU 139.A O no hydrogen 3.129 N/A ARG 143.A NH1 GLU 53.A OE2 no hydrogen 2.544 N/A ARG 143.A NH2 GLN 103.A OE1 no hydrogen 2.567 N/A LEU 144.A N GLY 140.A O no hydrogen 2.935 N/A ARG 145.A N ILE 141.A O no hydrogen 2.885 N/A ARG 146.A N ARG 143.A O no hydrogen 3.268 N/A LYS 147.A N LEU 144.A O no hydrogen 3.145 N/A PHE 148.A N LEU 144.A O no hydrogen 2.957 N/A ILE 151.A N LYS 173.A O no hydrogen 2.969 N/A LEU 152.A N ALA 238.A O no hydrogen 3.020 N/A TYR 153.A N MET 175.A O no hydrogen 2.787 N/A TYR 153.A OH ASP 155.A OD2 no hydrogen 2.382 N/A VAL 154.A N VAL 240.A O no hydrogen 3.011 N/A ASP 155.A N VAL 177.A O no hydrogen 2.714 N/A LEU 156.A N GLN 242.A O no hydrogen 2.926 N/A ASP 157.A N ASP 155.A OD1 no hydrogen 3.198 N/A LEU 158.A N ASP 246.A OD1 no hydrogen 2.916 N/A HIS 159.A N ASP 157.A OD2 no hydrogen 2.789 N/A HIS 160.A ND1 THR 190.A OG1 no hydrogen 2.703 N/A ASP 162.A N HIS 160.A O no hydrogen 2.778 N/A GLU 165.A N GLY 161.A O no hydrogen 3.167 N/A ASP 166.A N ASP 162.A O no hydrogen 2.765 N/A ALA 167.A N GLY 163.A O no hydrogen 3.091 N/A PHE 168.A N GLU 165.A O no hydrogen 3.263 N/A SER 169.A OG ASP 166.A O no hydrogen 3.112 N/A THR 171.A N PHE 168.A O no hydrogen 3.438 N/A LYS 173.A N THR 171.A OG1 no hydrogen 3.123 N/A MET 175.A N ILE 151.A O no hydrogen 2.878 N/A THR 176.A N TYR 204.A O no hydrogen 3.389 N/A VAL 177.A N TYR 153.A O no hydrogen 2.647 N/A SER 178.A N VAL 206.A O no hydrogen 2.836 N/A SER 178.A OG HIS 180.A ND1 no hydrogen 2.798 N/A LEU 179.A N ASP 155.A O no hydrogen 3.024 N/A HIS 180.A N VAL 208.A O no hydrogen 3.286 N/A HIS 180.A ND1 SER 178.A OG no hydrogen 2.798 N/A HIS 180.A NE2 GLY 191.A O no hydrogen 2.569 N/A LYS 181.A N LEU 158.A O no hydrogen 2.914 N/A LYS 181.A NZ ASP 212.A OD1 no hydrogen 3.003 N/A LYS 181.A NZ ASP 212.A OD2 no hydrogen 3.261 N/A PHE 182.A N ILE 210.A O no hydrogen 3.155 N/A PHE 186.A N SER 183.A O no hydrogen 2.784 N/A THR 190.A OG1 HIS 160.A ND1 no hydrogen 2.703 N/A VAL 193.A N ASP 192.A OD2 no hydrogen 2.504 N/A ASP 195.A N ASP 192.A O no hydrogen 3.098 N/A LEU 198.A N SER 169.A O no hydrogen 2.895 N/A LYS 200.A NZ SER 172.A OG no hydrogen 3.183 N/A GLY 201.A N LEU 198.A O no hydrogen 2.856 N/A ARG 202.A N GLY 199.A O no hydrogen 3.451 N/A ARG 202.A NH2 TYR 203.A OH no hydrogen 3.083 N/A TYR 204.A N GLY 201.A O no hydrogen 3.090 N/A SER 205.A N VAL 196.A O no hydrogen 3.351 N/A VAL 206.A N THR 176.A O no hydrogen 2.816 N/A ASN 207.A ND2 GLU 165.A OE1 no hydrogen 2.880 N/A ASN 207.A ND2 GLU 165.A OE2 no hydrogen 3.415 N/A ASN 207.A ND2 ASP 195.A O no hydrogen 3.133 N/A VAL 208.A N SER 178.A O no hydrogen 2.848 N/A ILE 210.A N HIS 180.A O no hydrogen 2.869 N/A GLN 211.A N ASN 336.A OD1 no hydrogen 2.730 N/A GLN 211.A NE2 PHE 182.A O no hydrogen 2.848 N/A GLY 213.A N SER 255.A O no hydrogen 2.824 N/A LYS 218.A NZ ASP 334.A OD2 no hydrogen 3.276 N/A TYR 219.A N GLN 215.A O no hydrogen 2.992 N/A TYR 220.A N ASP 216.A O no hydrogen 2.904 N/A GLN 221.A N GLU 217.A O no hydrogen 3.263 N/A ILE 222.A N LYS 218.A O no hydrogen 3.097 N/A CYS 223.A N TYR 219.A O no hydrogen 2.856 N/A GLU 224.A N TYR 220.A O no hydrogen 2.665 N/A SER 225.A N GLN 221.A O no hydrogen 3.293 N/A VAL 226.A N ILE 222.A O no hydrogen 3.285 N/A LEU 227.A N CYS 223.A O no hydrogen 2.990 N/A LYS 228.A N GLU 224.A O no hydrogen 2.899 N/A VAL 230.A N VAL 226.A O no hydrogen 2.825 N/A TYR 231.A N LEU 227.A O no hydrogen 3.023 N/A GLN 232.A N LYS 228.A O no hydrogen 3.293 N/A ALA 233.A N GLU 229.A O no hydrogen 3.116 N/A PHE 234.A N VAL 230.A O no hydrogen 2.845 N/A ASN 235.A N TYR 231.A O no hydrogen 3.260 N/A LYS 237.A N ARG 150.A O no hydrogen 2.978 N/A ALA 238.A N ARG 150.A O no hydrogen 3.348 N/A VAL 239.A N ALA 276.A O no hydrogen 2.760 N/A VAL 240.A N LEU 152.A O no hydrogen 2.782 N/A LEU 241.A N LEU 278.A O no hydrogen 2.726 N/A GLN 242.A N VAL 154.A O no hydrogen 2.937 N/A GLN 242.A NE2 GLY 119.A O no hydrogen 2.782 N/A LEU 243.A N LEU 280.A O no hydrogen 2.698 N/A GLY 244.A N GLN 242.A OE1 no hydrogen 2.965 N/A ALA 245.A N GLY 283.A O no hydrogen 2.825 N/A ILE 248.A N ALA 245.A O no hydrogen 3.437 N/A ALA 249.A N MET 258.A O no hydrogen 2.840 N/A ASP 251.A N ILE 248.A O no hydrogen 3.279 N/A MET 253.A N ASP 251.A OD2 no hydrogen 3.148 N/A CYS 254.A N ASP 251.A O no hydrogen 2.828 N/A SER 255.A OG MET 253.A O no hydrogen 3.065 N/A ASN 257.A N ILE 214.A O no hydrogen 2.846 N/A ASN 257.A ND2 SER 330.A O no hydrogen 2.746 N/A MET 258.A N THR 247.A O no hydrogen 3.042 N/A THR 259.A N ASP 216.A OD1 no hydrogen 2.874 N/A THR 259.A OG1 ASP 216.A OD1 no hydrogen 3.433 N/A THR 259.A OG1 ASP 216.A OD2 no hydrogen 2.444 N/A GLY 262.A N THR 259.A O no hydrogen 2.897 N/A GLY 264.A N PRO 260.A O no hydrogen 2.887 N/A LYS 265.A N VAL 261.A O no hydrogen 3.144 N/A CYS 266.A SG GLY 262.A O no hydrogen 3.800 N/A LEU 267.A N ILE 263.A O no hydrogen 2.902 N/A LYS 268.A N GLY 264.A O no hydrogen 2.686 N/A TYR 269.A N LYS 265.A O no hydrogen 3.098 N/A ILE 270.A N CYS 266.A O no hydrogen 3.221 N/A ILE 270.A N LEU 267.A O no hydrogen 3.136 N/A LEU 271.A N LEU 267.A O no hydrogen 2.877 N/A GLN 272.A N LYS 268.A O no hydrogen 3.186 N/A TRP 273.A N ILE 270.A O no hydrogen 3.122 N/A GLN 274.A N LEU 271.A O no hydrogen 2.973 N/A THR 277.A N LYS 111.A O no hydrogen 2.724 N/A THR 277.A OG1 LEU 275.A O no hydrogen 3.014 N/A LEU 278.A N VAL 239.A O no hydrogen 2.759 N/A ILE 279.A N ALA 113.A O no hydrogen 2.794 N/A LEU 280.A N LEU 241.A O no hydrogen 2.633 N/A GLY 283.A N ASP 157.A OD1 no hydrogen 2.869 N/A TYR 285.A N ASP 251.A OD1 no hydrogen 3.039 N/A ASN 286.A ND2 GLY 250.A O no hydrogen 2.568 N/A ASN 289.A N ASN 286.A OD1 no hydrogen 3.177 N/A ASN 289.A ND2 ALA 249.A O no hydrogen 2.829 N/A THR 290.A N ASN 286.A O no hydrogen 2.754 N/A THR 290.A OG1 ASN 286.A O no hydrogen 2.974 N/A ALA 291.A N LEU 287.A O no hydrogen 3.110 N/A ARG 292.A N ALA 288.A O no hydrogen 2.849 N/A ARG 292.A NE VAL 324.A O no hydrogen 2.904 N/A ARG 292.A NH2 ASN 289.A OD1 no hydrogen 2.655 N/A CYS 293.A N ASN 289.A O no hydrogen 2.887 N/A TRP 294.A N THR 290.A O no hydrogen 3.198 N/A TRP 294.A NE1 LEU 243.A O no hydrogen 2.867 N/A THR 295.A N ALA 291.A O no hydrogen 3.133 N/A THR 295.A OG1 ALA 291.A O no hydrogen 2.797 N/A TYR 296.A N ARG 292.A O no hydrogen 3.231 N/A LEU 297.A N CYS 293.A O no hydrogen 2.870 N/A THR 298.A N TRP 294.A O no hydrogen 2.881 N/A THR 298.A OG1 TRP 294.A O no hydrogen 2.579 N/A GLY 299.A N THR 295.A O no hydrogen 3.060 N/A VAL 300.A N TYR 296.A O no hydrogen 2.976 N/A ILE 301.A N LEU 297.A O no hydrogen 3.084 N/A LEU 302.A N THR 298.A O no hydrogen 3.030 N/A GLY 303.A N VAL 300.A O no hydrogen 3.213 N/A LYS 304.A N GLY 299.A O no hydrogen 2.862 N/A SER 308.A OG GLU 326.A OE1 no hydrogen 3.475 N/A SER 308.A OG GLU 326.A OE2 no hydrogen 2.638 N/A ILE 310.A N TYR 323.A O no hydrogen 3.108 N/A HIS 313.A ND1 PRO 311.A O no hydrogen 2.923 N/A PHE 316.A N HIS 313.A O no hydrogen 3.316 N/A ALA 318.A N PHE 315.A O no hydrogen 3.037 N/A TYR 319.A N PHE 316.A O no hydrogen 3.255 N/A TYR 323.A N TYR 319.A O no hydrogen 2.911 N/A LEU 325.A N SER 308.A O no hydrogen 2.872 N/A GLU 326.A N GLU 326.A OE2 no hydrogen 2.748 N/A SER 330.A N ASN 257.A OD1 no hydrogen 2.879 N/A ARG 332.A N SER 330.A O no hydrogen 2.957 N/A ARG 332.A NH1 SER 255.A O no hydrogen 2.908 N/A ARG 332.A NH2 PHE 256.A O no hydrogen 2.996 N/A ARG 335.A N ASP 212.A O no hydrogen 2.745 N/A ASN 336.A N ASP 334.A OD1 no hydrogen 3.238 N/A ASN 336.A ND2 GLN 211.A O no hydrogen 3.067 N/A ASN 336.A ND2 ASP 334.A OD1 no hydrogen 2.793 N/A ILE 341.A N GLU 337.A O no hydrogen 3.210 N/A GLN 342.A N PRO 338.A O no hydrogen 3.132 N/A GLN 343.A N HIS 339.A O no hydrogen 2.884 N/A ILE 344.A N ARG 340.A O no hydrogen 2.977 N/A LEU 345.A N ILE 341.A O no hydrogen 3.180 N/A ASN 346.A N GLN 342.A O no hydrogen 3.138 N/A ASN 346.A ND2 GLN 342.A O no hydrogen 2.986 N/A TYR 347.A N GLN 343.A O no hydrogen 3.042 N/A ILE 348.A N ILE 344.A O no hydrogen 2.973 N/A LYS 349.A N LEU 345.A O no hydrogen 2.870 N/A GLY 350.A N ASN 346.A O no hydrogen 2.982 N/A ASN 351.A N TYR 347.A O no hydrogen 3.259 N/A LEU 352.A N ILE 348.A O no hydrogen 2.903 N/A LYS 353.A N GLY 350.A O no hydrogen 3.111 N/A HIS 354.A N ASN 351.A O no hydrogen 3.231 N/A VAL 355.A N LEU 352.A O no hydrogen 3.299 N/A