Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5j40_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 VAL 4.A O no hydrogen 3.209 N/A SER 5.A N ASN 59.A OD1 no hydrogen 2.795 N/A LEU 8.A N SER 5.A OG no hydrogen 3.092 N/A VAL 9.A N SER 5.A O no hydrogen 3.313 N/A THR 10.A N TRP 6.A O no hydrogen 2.956 N/A THR 10.A OG1 TRP 6.A O no hydrogen 3.152 N/A GLN 11.A N LYS 7.A O no hydrogen 2.896 N/A GLN 11.A NE2 GLN 11.A O no hydrogen 3.342 N/A GLN 11.A NE2 ASP 15.A OD1 no hydrogen 2.816 N/A TYR 12.A N LEU 8.A O no hydrogen 3.199 N/A TYR 12.A OH ASN 48.A O no hydrogen 2.719 N/A ALA 13.A N VAL 9.A O no hydrogen 3.080 N/A LEU 14.A N THR 10.A O no hydrogen 2.816 N/A ASP 15.A N GLN 11.A O no hydrogen 2.811 N/A THR 16.A N TYR 12.A O no hydrogen 3.018 N/A THR 16.A OG1 TYR 12.A O no hydrogen 2.714 N/A LYS 17.A N LEU 14.A O no hydrogen 3.192 N/A CYS 18.A N ALA 13.A O no hydrogen 2.817 N/A CYS 18.A SG ASP 20.A O no hydrogen 3.411 N/A PHE 22.A N ASP 20.A OD1 no hydrogen 3.169 N/A LEU 23.A N ASP 20.A OD1 no hydrogen 3.349 N/A LEU 24.A N ASP 20.A O no hydrogen 2.996 N/A MET 25.A N VAL 21.A O no hydrogen 3.090 N/A GLY 26.A N PHE 22.A O no hydrogen 2.997 N/A MET 27.A N LEU 23.A O no hydrogen 2.920 N/A TYR 28.A N LEU 24.A O no hydrogen 2.826 N/A TYR 28.A OH HIS 56.A ND1 no hydrogen 2.686 N/A LEU 29.A N MET 25.A O no hydrogen 3.012 N/A ASN 30.A N GLY 26.A O no hydrogen 3.211 N/A PHE 31.A N TYR 28.A O no hydrogen 3.135 N/A GLN 32.A N LEU 29.A O no hydrogen 3.126 N/A ALA 37.A N ALA 34.A O no hydrogen 3.373 N/A CYS 38.A N PRO 35.A O no hydrogen 3.049 N/A CYS 38.A SG HIS 49.A NE2 no hydrogen 3.491 N/A CYS 38.A SG HIS 53.A ND1 no hydrogen 3.474 N/A CYS 41.A SG HIS 49.A NE2 no hydrogen 3.602 N/A CYS 41.A SG HIS 53.A ND1 no hydrogen 3.316 N/A ALA 42.A N CYS 38.A O no hydrogen 3.187 N/A ALA 43.A N ALA 39.A O no hydrogen 2.865 N/A ALA 44.A N ALA 40.A O no hydrogen 3.162 N/A ALA 44.A N CYS 41.A O no hydrogen 3.243 N/A HIS 49.A N GLN 46.A O no hydrogen 2.853 N/A HIS 49.A NE2 HIS 53.A ND1 no hydrogen 2.920 N/A PHE 50.A N GLN 46.A O no hydrogen 3.069 N/A ASN 51.A N PRO 47.A O no hydrogen 3.073 N/A ASN 51.A ND2 PRO 47.A O no hydrogen 3.562 N/A HIS 52.A N HIS 49.A O no hydrogen 3.153 N/A HIS 53.A N HIS 49.A O no hydrogen 2.932 N/A HIS 53.A NE2 GLU 33.A O no hydrogen 2.724 N/A HIS 56.A N HIS 52.A O no hydrogen 3.001 N/A HIS 56.A ND1 TYR 28.A OH no hydrogen 2.686 N/A ASN 59.A ND2 SER 5.A O no hydrogen 3.087 N/A ASN 59.A ND2 TYR 28.A OH no hydrogen 2.789 N/A ALA 60.A N HIS 56.A O no hydrogen 2.843 N/A GLN 61.A N TYR 57.A O no hydrogen 3.064 N/A ILE 62.A N TYR 58.A O no hydrogen 3.339 N/A PHE 63.A N ASN 59.A O no hydrogen 2.800 N/A ALA 64.A N ALA 60.A O no hydrogen 2.934 N/A ALA 64.A N GLN 61.A O no hydrogen 3.176 N/A ASP 65.A N ILE 62.A O no hydrogen 3.049 N/A SER 66.A N PHE 63.A O no hydrogen 3.132 N/A ASN 68.A N SER 66.A OG no hydrogen 3.091 N/A GLN 69.A NE2 PHE 63.A O no hydrogen 2.814 N/A ILE 72.A N ASN 68.A O no hydrogen 3.251 N/A CYS 73.A N GLN 69.A O no hydrogen 3.157 N/A CYS 73.A SG GLN 69.A O no hydrogen 3.414 N/A GLN 74.A N LYS 70.A O no hydrogen 2.884 N/A GLN 74.A NE2 GLN 74.A O no hydrogen 3.439 N/A GLN 74.A NE2 ASP 78.A OD1 no hydrogen 3.065 N/A GLN 75.A N SER 71.A O no hydrogen 3.055 N/A ALA 76.A N ILE 72.A O no hydrogen 3.211 N/A VAL 77.A N CYS 73.A O no hydrogen 2.912 N/A ASP 78.A N GLN 74.A O no hydrogen 2.903 N/A THR 79.A N GLN 75.A O no hydrogen 3.040 N/A THR 79.A OG1 GLN 75.A O no hydrogen 2.900 N/A VAL 80.A N ALA 76.A O no hydrogen 3.257 N/A ALA 81.A N VAL 77.A O no hydrogen 3.137 N/A ALA 82.A N ASP 78.A O no hydrogen 2.829 N/A LYS 83.A N THR 79.A O no hydrogen 2.939 N/A LYS 83.A NZ ASP 87.A OD2 no hydrogen 3.016 N/A GLN 84.A N VAL 80.A O no hydrogen 3.001 N/A GLN 84.A NE2 VAL 80.A O no hydrogen 2.839 N/A ARG 85.A N ALA 81.A O no hydrogen 2.973 N/A VAL 86.A N ALA 82.A O no hydrogen 3.068 N/A ASP 87.A N LYS 83.A O no hydrogen 2.862 N/A SER 88.A N GLN 84.A O no hydrogen 2.878 N/A SER 88.A OG GLN 84.A O no hydrogen 3.110 N/A SER 88.A OG ARG 85.A O no hydrogen 2.702 N/A SER 88.A OG ASP 202.A OD1 no hydrogen 3.536 N/A LEU 89.A N VAL 86.A O no hydrogen 3.110 N/A HIS 90.A N VAL 86.A O no hydrogen 2.929 N/A MET 91.A N ASP 87.A O no hydrogen 2.815 N/A THR 92.A N GLU 95.A OE2 no hydrogen 2.933 N/A THR 92.A OG1 GLU 95.A OE2 no hydrogen 3.336 N/A ARG 93.A NE ILE 148.A O no hydrogen 2.980 N/A ARG 93.A NH2 ILE 148.A O no hydrogen 2.934 N/A ARG 93.A NH2 PHE 204.A O no hydrogen 2.925 N/A GLU 95.A N THR 92.A OG1 no hydrogen 3.358 N/A MET 96.A N THR 92.A O no hydrogen 3.066 N/A LEU 97.A N ARG 93.A O no hydrogen 2.992 N/A VAL 98.A N GLU 94.A O no hydrogen 2.931 N/A GLU 99.A N GLU 95.A O no hydrogen 3.047 N/A ARG 100.A N MET 96.A O no hydrogen 3.113 N/A ARG 100.A NE ASP 177.A O no hydrogen 2.925 N/A ARG 100.A NH2 ASP 177.A O no hydrogen 2.737 N/A PHE 101.A N LEU 97.A O no hydrogen 2.831 N/A ASN 102.A N VAL 98.A O no hydrogen 2.810 N/A PHE 103.A N GLU 99.A O no hydrogen 3.148 N/A LEU 104.A N ARG 100.A O no hydrogen 3.010 N/A LEU 105.A N PHE 101.A O no hydrogen 2.948 N/A ASP 106.A N ASN 102.A O no hydrogen 3.066 N/A LYS 107.A N PHE 103.A O no hydrogen 3.346 N/A MET 108.A N LEU 104.A O no hydrogen 2.993 N/A ASP 109.A N LEU 105.A O no hydrogen 2.853 N/A LEU 110.A N ASP 106.A O no hydrogen 3.180 N/A ILE 111.A N LYS 107.A O no hydrogen 2.877 N/A PHE 112.A N MET 108.A O no hydrogen 3.136 N/A GLY 113.A N LEU 110.A O no hydrogen 3.245 N/A GLY 116.A N GLY 113.A O no hydrogen 3.093 N/A ALA 118.A N ILE 111.A O no hydrogen 3.097 N/A GLN 122.A N VAL 119.A O no hydrogen 3.164 N/A MET 124.A N LEU 120.A O no hydrogen 2.967 N/A ALA 125.A N GLU 121.A O no hydrogen 2.883 N/A GLY 126.A N GLN 122.A O no hydrogen 3.068 N/A VAL 127.A N TYR 123.A O no hydrogen 2.862 N/A ALA 128.A N MET 124.A O no hydrogen 2.992 N/A TRP 129.A N ALA 125.A O no hydrogen 3.082 N/A TRP 129.A NE1 LEU 284.A O no hydrogen 2.809 N/A ILE 130.A N GLY 126.A O no hydrogen 2.929 N/A HIS 131.A N VAL 127.A O no hydrogen 2.763 N/A HIS 131.A NE2 ASP 138.A OD1 no hydrogen 2.892 N/A CYS 132.A N TRP 129.A O no hydrogen 3.018 N/A CYS 132.A SG ALA 128.A O no hydrogen 3.407 N/A CYS 132.A SG LYS 347.A O no hydrogen 3.856 N/A LEU 133.A N ILE 130.A O no hydrogen 3.039 N/A VAL 140.A N GLN 136.A O no hydrogen 2.888 N/A ILE 141.A N MET 137.A O no hydrogen 2.911 N/A TYR 142.A N ASP 138.A O no hydrogen 2.984 N/A TYR 142.A OH ASP 318.A O no hydrogen 2.633 N/A GLU 143.A N THR 139.A O no hydrogen 2.725 N/A PHE 144.A N VAL 140.A O no hydrogen 2.997 N/A LEU 145.A N ILE 141.A O no hydrogen 2.992 N/A LYS 146.A N TYR 142.A O no hydrogen 3.112 N/A CYS 147.A N GLU 143.A O no hydrogen 3.072 N/A CYS 147.A SG LYS 155.A O no hydrogen 3.566 N/A ILE 148.A N PHE 144.A O no hydrogen 2.986 N/A VAL 149.A N LEU 145.A O no hydrogen 2.973 N/A LEU 150.A N LYS 146.A O no hydrogen 2.810 N/A ASN 151.A N CYS 147.A O no hydrogen 3.028 N/A LYS 154.A N ASP 238.A O no hydrogen 2.877 N/A LYS 154.A NZ ASP 238.A OD2 no hydrogen 2.899 N/A LYS 155.A N ILE 152.A O no hydrogen 3.114 N/A ARG 156.A NE ASN 151.A OD1 no hydrogen 2.855 N/A ARG 156.A NH1 LEU 237.A O no hydrogen 3.276 N/A ARG 156.A NH1 PHE 252.A O no hydrogen 3.044 N/A ARG 156.A NH2 ASN 151.A OD1 no hydrogen 2.742 N/A ARG 156.A NH2 PHE 252.A O no hydrogen 2.614 N/A TYR 157.A OH PRO 253.A O no hydrogen 2.705 N/A TRP 158.A N GLY 255.A O no hydrogen 3.182 N/A LEU 159.A N ARG 274.A O no hydrogen 2.876 N/A PHE 160.A N VAL 257.A O no hydrogen 2.788 N/A LYS 161.A N ILE 276.A O no hydrogen 2.907 N/A LYS 161.A NZ TYR 262.A O no hydrogen 3.090 N/A GLY 162.A N MET 259.A O no hydrogen 3.136 N/A SER 166.A OG PRO 163.A O no hydrogen 2.750 N/A LYS 168.A NZ GLY 162.A O no hydrogen 2.775 N/A LYS 168.A NZ PRO 163.A O no hydrogen 3.350 N/A THR 169.A OG1 GLU 209.A OE1 no hydrogen 2.713 N/A LEU 171.A N GLY 167.A O no hydrogen 3.082 N/A ALA 172.A N LYS 168.A O no hydrogen 3.117 N/A ALA 173.A N THR 169.A O no hydrogen 2.954 N/A ALA 174.A N THR 170.A O no hydrogen 2.940 N/A LEU 175.A N LEU 171.A O no hydrogen 2.868 N/A LEU 176.A N ALA 172.A O no hydrogen 2.937 N/A ASP 177.A N ALA 173.A O no hydrogen 2.942 N/A LEU 178.A N ALA 174.A O no hydrogen 2.970 N/A CYS 179.A N LEU 175.A O no hydrogen 3.088 N/A CYS 179.A SG LEU 175.A O no hydrogen 3.427 N/A GLY 180.A N LEU 176.A O no hydrogen 2.701 N/A LYS 182.A N MET 205.A O no hydrogen 3.373 N/A LYS 182.A NZ GLY 181.A O no hydrogen 3.337 N/A LEU 184.A N VAL 207.A O no hydrogen 2.717 N/A ASN 185.A N GLU 196.A OE2 no hydrogen 2.798 N/A ASN 187.A N ASN 185.A OD1 no hydrogen 3.187 N/A ARG 192.A N PRO 189.A O no hydrogen 3.079 N/A GLU 196.A N LEU 193.A O no hydrogen 3.090 N/A LEU 197.A N LEU 193.A O no hydrogen 2.846 N/A GLY 198.A N ASN 194.A O no hydrogen 3.065 N/A VAL 199.A N GLU 196.A O no hydrogen 3.037 N/A GLY 200.A N LEU 197.A O no hydrogen 3.306 N/A ILE 201.A N GLY 198.A O no hydrogen 3.207 N/A ASP 202.A N GLN 250.A OE1 no hydrogen 2.877 N/A GLN 203.A N GLY 200.A O no hydrogen 3.242 N/A GLN 203.A NE2 ILE 201.A O no hydrogen 3.123 N/A VAL 206.A N PRO 254.A O no hydrogen 2.986 N/A VAL 207.A N LYS 182.A O no hydrogen 3.060 N/A PHE 208.A N ILE 256.A O no hydrogen 2.909 N/A GLU 209.A N LEU 184.A O no hydrogen 3.202 N/A ASP 210.A N THR 258.A OG1 no hydrogen 2.894 N/A VAL 211.A N THR 258.A O no hydrogen 2.964 N/A ARG 219.A N ALA 216.A O no hydrogen 3.048 N/A ASP 220.A N GLU 217.A O no hydrogen 3.022 N/A LEU 221.A N ALA 216.A O no hydrogen 3.076 N/A GLY 224.A N GLY 213.A O no hydrogen 3.116 N/A ILE 227.A N LYS 212.A O no hydrogen 2.876 N/A ASN 229.A N HIS 225.A O no hydrogen 2.964 N/A ASN 229.A ND2 VAL 186.A O no hydrogen 2.803 N/A ASN 229.A ND2 MET 188.A O no hydrogen 2.816 N/A LEU 230.A N GLY 226.A O no hydrogen 3.035 N/A ASP 231.A N ILE 227.A O no hydrogen 3.070 N/A CYS 232.A N ASN 229.A O no hydrogen 3.135 N/A CYS 232.A SG SER 228.A O no hydrogen 3.370 N/A LEU 233.A N LEU 230.A O no hydrogen 3.124 N/A TYR 236.A N ASP 235.A OD1 no hydrogen 3.221 N/A LEU 237.A N LEU 233.A O no hydrogen 2.908 N/A ASP 238.A N ARG 234.A O no hydrogen 2.714 N/A GLY 239.A N ASP 235.A O no hydrogen 3.356 N/A VAL 243.A N GLN 250.A O no hydrogen 2.738 N/A ASN 244.A ND2 THR 249.A OG1 no hydrogen 2.956 N/A LEU 245.A N ARG 248.A O no hydrogen 2.790 N/A ARG 248.A NH1 GLN 250.A OE1 no hydrogen 2.803 N/A GLN 250.A N VAL 243.A O no hydrogen 3.078 N/A GLN 250.A NE2 VAL 251.A O no hydrogen 2.892 N/A GLY 255.A N ARG 156.A O no hydrogen 3.230 N/A ILE 256.A N VAL 206.A O no hydrogen 3.151 N/A VAL 257.A N TRP 158.A O no hydrogen 3.015 N/A THR 258.A N PHE 208.A O no hydrogen 2.947 N/A THR 258.A OG1 GLU 209.A OE2 no hydrogen 2.737 N/A MET 259.A N PHE 160.A O no hydrogen 3.056 N/A GLU 261.A N ASN 260.A OD1 no hydrogen 2.781 N/A TYR 262.A N ASN 260.A O no hydrogen 2.842 N/A TYR 262.A OH PRO 222.A O no hydrogen 2.673 N/A THR 267.A OG1 ASP 231.A OD1 no hydrogen 2.713 N/A THR 267.A OG1 ASP 231.A OD2 no hydrogen 3.364 N/A GLN 269.A N PRO 265.A O no hydrogen 2.897 N/A GLN 269.A NE2 GLN 275.A OE1 no hydrogen 2.791 N/A ALA 270.A N ARG 266.A O no hydrogen 3.242 N/A ARG 271.A N LEU 268.A O no hydrogen 3.010 N/A PHE 272.A N GLN 269.A O no hydrogen 3.148 N/A VAL 273.A N TYR 157.A O no hydrogen 3.055 N/A GLN 275.A NE2 ASP 277.A OD1 no hydrogen 2.803 N/A ILE 276.A N LEU 159.A O no hydrogen 2.911 N/A PHE 278.A N LYS 161.A O no hydrogen 2.781 N/A ARG 285.A N LYS 281.A O no hydrogen 3.349 N/A LYS 286.A N ALA 282.A O no hydrogen 2.912 N/A SER 287.A N TYR 283.A O no hydrogen 2.881 N/A SER 287.A OG ALA 354.A O no hydrogen 2.826 N/A LEU 288.A N LEU 284.A O no hydrogen 3.124 N/A SER 289.A N ARG 285.A O no hydrogen 2.975 N/A CYS 290.A N LYS 286.A O no hydrogen 3.076 N/A CYS 290.A SG LYS 286.A O no hydrogen 3.559 N/A CYS 290.A SG GLY 353.A O no hydrogen 3.940 N/A SER 291.A N LEU 288.A O no hydrogen 3.025 N/A SER 291.A OG SER 287.A O no hydrogen 2.865 N/A LEU 294.A N SER 291.A O no hydrogen 3.018 N/A GLU 296.A N GLU 292.A O no hydrogen 2.963 N/A LYS 297.A N TYR 293.A O no hydrogen 2.812 N/A LYS 297.A NZ GLN 122.A OE1 no hydrogen 3.190 N/A ARG 298.A N LEU 295.A O no hydrogen 3.241 N/A ILE 299.A N LEU 294.A O no hydrogen 2.939 N/A SER 302.A N ILE 299.A O no hydrogen 3.230 N/A GLY 303.A N ASP 177.A OD2 no hydrogen 2.751 N/A MET 304.A N SER 302.A OG no hydrogen 3.268 N/A THR 305.A N SER 302.A O no hydrogen 3.260 N/A THR 305.A OG1 ILE 299.A O no hydrogen 2.722 N/A LEU 307.A N GLY 303.A O no hydrogen 2.912 N/A LEU 308.A N MET 304.A O no hydrogen 2.780 N/A LEU 309.A N THR 305.A O no hydrogen 2.825 N/A LEU 310.A N LEU 306.A O no hydrogen 3.005 N/A ILE 311.A N LEU 307.A O no hydrogen 2.819 N/A TRP 312.A N LEU 308.A O no hydrogen 2.918 N/A PHE 313.A N LEU 309.A O no hydrogen 3.035 N/A ARG 314.A N LEU 310.A O no hydrogen 2.915 N/A ARG 314.A NE ASP 138.A OD2 no hydrogen 3.053 N/A ARG 314.A NH1 ASP 318.A OD2 no hydrogen 2.929 N/A ARG 314.A NH2 THR 139.A OG1 no hydrogen 3.184 N/A ASP 318.A N PRO 315.A O no hydrogen 2.973 N/A PHE 319.A N VAL 316.A O no hydrogen 3.132 N/A ILE 323.A N ALA 320.A O no hydrogen 3.103 N/A HIS 324.A N ALA 321.A O no hydrogen 3.267 N/A HIS 324.A NE2 PHE 319.A O no hydrogen 2.799 N/A ARG 326.A N ILE 323.A O no hydrogen 3.170 N/A ARG 326.A NH1 ASN 102.A O no hydrogen 3.152 N/A ARG 326.A NH1 ASN 102.A OD1 no hydrogen 3.074 N/A ARG 326.A NH1 ASP 106.A OD1 no hydrogen 3.008 N/A ARG 326.A NH2 ASP 106.A OD1 no hydrogen 2.813 N/A ARG 326.A NH2 ASP 109.A OD2 no hydrogen 2.843 N/A ILE 327.A N ILE 323.A O no hydrogen 3.118 N/A VAL 328.A N HIS 324.A O no hydrogen 3.069 N/A GLN 329.A N GLU 325.A O no hydrogen 3.209 N/A TRP 330.A N ARG 326.A O no hydrogen 3.052 N/A TRP 330.A NE1 ASP 109.A OD1 no hydrogen 3.035 N/A LYS 331.A N ILE 327.A O no hydrogen 2.794 N/A LYS 331.A NZ ILE 311.A O no hydrogen 2.755 N/A LYS 331.A NZ ARG 314.A O no hydrogen 2.790 N/A GLU 332.A N VAL 328.A O no hydrogen 3.091 N/A ARG 333.A N GLN 329.A O no hydrogen 3.129 N/A ARG 333.A NH1 PHE 112.A O no hydrogen 2.941 N/A ARG 333.A NH2 PHE 112.A O no hydrogen 2.760 N/A LEU 334.A N TRP 330.A O no hydrogen 3.001 N/A ASP 335.A N LYS 331.A O no hydrogen 2.982 N/A LEU 336.A N GLU 332.A O no hydrogen 3.364 N/A GLU 337.A N LEU 334.A O no hydrogen 3.163 N/A ILE 338.A N LEU 334.A O no hydrogen 2.883 N/A SER 339.A N THR 342.A OG1 no hydrogen 2.952 N/A THR 342.A N SER 339.A OG no hydrogen 3.177 N/A THR 342.A OG1 SER 339.A O no hydrogen 3.289 N/A PHE 343.A N SER 339.A O no hydrogen 2.832 N/A SER 344.A N MET 340.A O no hydrogen 3.017 N/A THR 345.A N TYR 341.A O no hydrogen 3.089 N/A THR 345.A OG1 TYR 341.A O no hydrogen 3.188 N/A MET 346.A N THR 342.A O no hydrogen 3.050 N/A LYS 347.A N PHE 343.A O no hydrogen 3.181 N/A LYS 347.A NZ HIS 131.A ND1 no hydrogen 2.791 N/A ALA 348.A N SER 344.A O no hydrogen 3.044 N/A ASN 349.A N THR 345.A O no hydrogen 2.947 N/A ASN 349.A ND2 ILE 356.A O no hydrogen 3.218 N/A ASN 349.A ND2 ASP 358.A OD1 no hydrogen 3.284 N/A ASN 349.A ND2 ASP 358.A OD2 no hydrogen 2.999 N/A VAL 350.A N MET 346.A O no hydrogen 3.032 N/A GLY 351.A N LYS 347.A O no hydrogen 2.969 N/A MET 352.A N ALA 348.A O no hydrogen 3.053 N/A MET 352.A N ASN 349.A O no hydrogen 3.192 N/A GLY 353.A N VAL 350.A O no hydrogen 2.935 N/A ALA 354.A N ASN 349.A O no hydrogen 2.938 N/A ILE 356.A N SER 291.A OG no hydrogen 3.100 N/A