Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cfs_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N ASP 3.A OD1 no hydrogen 3.034 N/A GLU 6.A N ASP 3.A OD1 no hydrogen 3.286 N/A GLU 7.A N ASP 3.A O no hydrogen 2.841 N/A ARG 8.A N THR 4.A O no hydrogen 3.428 N/A VAL 9.A N VAL 5.A O no hydrogen 3.332 N/A ILE 10.A N GLU 6.A O no hydrogen 2.870 N/A ASN 11.A N GLU 7.A O no hydrogen 2.916 N/A GLU 12.A N ARG 8.A O no hydrogen 3.088 N/A GLU 13.A N VAL 9.A O no hydrogen 3.123 N/A TYR 14.A N ILE 10.A O no hydrogen 2.936 N/A LYS 15.A N ASN 11.A O no hydrogen 3.095 N/A LYS 15.A NZ GLU 12.A OE2 no hydrogen 3.347 N/A ILE 16.A N GLU 12.A O no hydrogen 3.391 N/A TRP 17.A N GLU 13.A O no hydrogen 2.971 N/A TRP 17.A NE1 TYR 25.A OH no hydrogen 3.008 N/A LYS 18.A N TYR 14.A O no hydrogen 2.776 N/A LYS 19.A N LYS 15.A O no hydrogen 3.368 N/A ASN 20.A N ILE 16.A O no hydrogen 3.297 N/A ASN 20.A N TRP 17.A O no hydrogen 3.007 N/A THR 21.A N LYS 18.A O no hydrogen 3.338 N/A THR 21.A OG1 LYS 18.A O no hydrogen 2.659 N/A PHE 23.A N ASN 20.A O no hydrogen 2.952 N/A LEU 24.A N THR 21.A O no hydrogen 3.059 N/A TYR 25.A N THR 21.A O no hydrogen 2.826 N/A TYR 25.A OH HIS 342.A ND1 no hydrogen 2.566 N/A ASP 26.A N GLN 375.A O no hydrogen 2.834 N/A LEU 27.A N GLN 375.A O no hydrogen 3.317 N/A MET 29.A N ILE 373.A O no hydrogen 2.802 N/A HIS 31.A N MET 371.A O no hydrogen 2.900 N/A LEU 33.A N ASN 369.A O no hydrogen 2.884 N/A SER 37.A OG THR 39.A O no hydrogen 2.562 N/A SER 37.A OG GLY 62.A O no hydrogen 3.355 N/A THR 39.A N SER 37.A OG no hydrogen 3.286 N/A VAL 40.A N ASP 351.A OD2 no hydrogen 3.146 N/A GLN 41.A N VAL 60.A O no hydrogen 3.209 N/A TRP 42.A N SER 353.A OG no hydrogen 3.334 N/A TRP 42.A NE1 SER 353.A O no hydrogen 2.882 N/A LEU 43.A N TRP 58.A O no hydrogen 2.752 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.991 N/A THR 47.A N LEU 56.A O no hydrogen 3.193 N/A LYS 52.A N PRO 49.A O no hydrogen 3.143 N/A ALA 55.A N ILE 79.A O no hydrogen 2.862 N/A LEU 56.A N THR 47.A O no hydrogen 2.729 N/A HIS 57.A N VAL 77.A O no hydrogen 3.007 N/A TRP 58.A NE1 GLU 90.A OE2 no hydrogen 3.043 N/A LEU 59.A N ALA 75.A O no hydrogen 2.852 N/A VAL 60.A N GLN 41.A O no hydrogen 2.694 N/A LEU 61.A N VAL 73.A O no hydrogen 2.624 N/A GLY 62.A N SER 37.A OG no hydrogen 3.049 N/A THR 65.A N ASN 70.A OD1 no hydrogen 2.891 N/A ASN 70.A ND2 THR 65.A O no hydrogen 3.062 N/A LEU 72.A N ILE 93.A O no hydrogen 2.814 N/A VAL 73.A N LEU 61.A O no hydrogen 3.040 N/A VAL 74.A N ILE 91.A O no hydrogen 3.100 N/A ALA 75.A N LEU 59.A O no hydrogen 2.763 N/A ARG 76.A N GLU 88.A O no hydrogen 2.763 N/A ARG 76.A NH1 GLU 90.A OE2 no hydrogen 2.528 N/A VAL 77.A N HIS 57.A O no hydrogen 2.874 N/A HIS 78.A N LYS 86.A O no hydrogen 2.825 N/A ILE 79.A N ALA 55.A O no hydrogen 2.848 N/A ASN 81.A N ASP 53.A O no hydrogen 2.966 N/A GLU 88.A N ARG 76.A O no hydrogen 2.795 N/A GLU 90.A N VAL 74.A O no hydrogen 2.918 N/A ILE 91.A N VAL 74.A O no hydrogen 3.336 N/A ILE 93.A N LEU 72.A O no hydrogen 2.950 N/A ASN 94.A ND2 ASP 134.A O no hydrogen 2.829 N/A HIS 95.A N ASN 70.A O no hydrogen 2.964 N/A GLU 98.A N GLU 98.A OE2 no hydrogen 2.740 N/A VAL 99.A N THR 63.A O no hydrogen 3.126 N/A ASN 100.A N LYS 115.A O no hydrogen 2.847 N/A ASN 100.A ND2 GLU 151.A OE1 no hydrogen 2.911 N/A ASN 100.A ND2 GLY 152.A O no hydrogen 2.927 N/A ALA 102.A N THR 39.A OG1 no hydrogen 3.171 N/A ARG 103.A N ALA 113.A O no hydrogen 2.883 N/A ARG 103.A NH2 ALA 102.A O no hydrogen 3.158 N/A ARG 103.A NH2 ASP 351.A OD2 no hydrogen 3.480 N/A TYR 104.A N GLN 41.A OE1 no hydrogen 3.008 N/A MET 105.A N ILE 111.A O no hydrogen 2.798 N/A GLN 107.A N GLN 107.A OE1 no hydrogen 2.689 N/A GLN 107.A NE2 ASN 158.A O no hydrogen 2.891 N/A ASN 108.A N MET 105.A O no hydrogen 3.050 N/A ILE 111.A N ASN 108.A O no hydrogen 2.907 N/A ILE 112.A N PHE 124.A O no hydrogen 2.726 N/A ALA 113.A N ARG 103.A O no hydrogen 2.879 N/A THR 114.A N LEU 122.A O no hydrogen 2.822 N/A LYS 115.A N ARG 101.A O no hydrogen 2.822 N/A LYS 115.A NZ SER 167.A OG no hydrogen 2.360 N/A LYS 115.A NZ ALA 168.A O no hydrogen 3.040 N/A THR 116.A OG1 ASP 120.A O no hydrogen 3.355 N/A VAL 121.A N LEU 145.A O no hydrogen 3.311 N/A LEU 122.A N THR 114.A O no hydrogen 3.026 N/A VAL 123.A N LEU 143.A O no hydrogen 2.948 N/A PHE 124.A N ILE 112.A O no hydrogen 2.742 N/A ASP 125.A N ASP 142.A OD1 no hydrogen 3.200 N/A TYR 126.A N HIS 110.A O no hydrogen 3.101 N/A THR 127.A N ASP 125.A OD2 no hydrogen 3.032 N/A THR 127.A OG1 ASP 125.A OD2 no hydrogen 2.598 N/A LYS 128.A N ASP 125.A O no hydrogen 2.851 N/A HIS 129.A NE2 ASP 142.A OD1 no hydrogen 2.914 N/A SER 136.A N ASP 134.A OD1 no hydrogen 2.824 N/A SER 136.A OG ASP 134.A OD1 no hydrogen 2.775 N/A SER 136.A OG GLU 138.A OE1 no hydrogen 3.456 N/A GLY 137.A N ASP 134.A O no hydrogen 2.900 N/A CYS 139.A SG ASN 94.A O no hydrogen 3.569 N/A ASP 142.A N VAL 123.A O no hydrogen 2.976 N/A LEU 143.A N VAL 123.A O no hydrogen 3.300 N/A ARG 144.A N LYS 187.A O no hydrogen 2.831 N/A ARG 144.A NE ASP 120.A OD2 no hydrogen 3.529 N/A LEU 145.A N VAL 121.A O no hydrogen 2.795 N/A ARG 146.A N VAL 189.A O no hydrogen 2.962 N/A ARG 146.A NE ASP 120.A OD1 no hydrogen 2.909 N/A ARG 146.A NE ASP 120.A OD2 no hydrogen 3.181 N/A ARG 146.A NH1 ASP 120.A OD2 no hydrogen 3.340 N/A GLN 149.A N ASP 171.A OD2 no hydrogen 2.912 N/A SER 156.A N LEU 166.A O no hydrogen 3.033 N/A TRP 157.A NE1 ARG 103.A O no hydrogen 2.976 N/A ASN 158.A N HIS 164.A O no hydrogen 2.850 N/A ASN 158.A ND2 GLU 212.A O no hydrogen 2.917 N/A ASN 160.A N ASN 158.A OD1 no hydrogen 2.877 N/A ASN 160.A ND2 LEU 209.A O no hydrogen 3.278 N/A HIS 164.A N LEU 161.A O no hydrogen 3.181 N/A LEU 165.A N TRP 177.A O no hydrogen 2.950 N/A LEU 166.A N SER 156.A O no hydrogen 2.815 N/A SER 167.A N CYS 175.A O no hydrogen 3.121 N/A ALA 168.A N GLY 154.A O no hydrogen 3.012 N/A SER 169.A N THR 173.A O no hydrogen 3.201 N/A SER 169.A OG LYS 150.A O no hydrogen 2.818 N/A SER 169.A OG GLU 151.A O no hydrogen 3.165 N/A ASP 170.A N GLU 151.A O no hydrogen 2.828 N/A ASP 171.A N SER 169.A OG no hydrogen 3.058 N/A HIS 172.A N SER 169.A O no hydrogen 3.341 N/A HIS 172.A ND1 ASP 170.A O no hydrogen 3.211 N/A THR 173.A N ASP 171.A OD1 no hydrogen 2.860 N/A THR 173.A OG1 ASP 171.A OD1 no hydrogen 2.519 N/A THR 173.A OG1 ASP 171.A OD2 no hydrogen 3.162 N/A VAL 174.A N PHE 195.A O no hydrogen 3.051 N/A CYS 175.A N SER 167.A O no hydrogen 2.966 N/A LEU 176.A N ALA 193.A O no hydrogen 2.901 N/A TRP 177.A N LEU 165.A O no hydrogen 3.013 N/A TRP 177.A NE1 ARG 146.A O no hydrogen 2.709 N/A ILE 179.A N GLY 163.A O no hydrogen 2.971 N/A ASN 180.A N ASP 178.A OD2 no hydrogen 3.198 N/A ALA 181.A N ASP 178.A O no hydrogen 3.170 N/A LYS 187.A NZ ASP 142.A O no hydrogen 3.362 N/A VAL 189.A N ARG 144.A O no hydrogen 3.178 N/A LYS 192.A N LEU 176.A O no hydrogen 2.761 N/A ALA 193.A N LEU 176.A O no hydrogen 3.455 N/A PHE 195.A N VAL 174.A O no hydrogen 2.782 N/A THR 196.A N THR 234.A O no hydrogen 2.916 N/A SER 199.A N ASP 221.A OD2 no hydrogen 3.205 N/A VAL 202.A N SER 169.A O no hydrogen 3.241 N/A GLU 203.A N VAL 218.A O no hydrogen 2.700 N/A ASP 204.A N VAL 218.A O no hydrogen 3.344 N/A VAL 205.A N ASP 204.A OD2 no hydrogen 2.832 N/A ALA 206.A N GLY 216.A O no hydrogen 2.964 N/A TRP 207.A N SER 156.A OG no hydrogen 3.318 N/A TRP 207.A NE1 SER 156.A O no hydrogen 3.064 N/A HIS 208.A N LEU 214.A O no hydrogen 2.880 N/A HIS 208.A NE2 GLU 258.A O no hydrogen 2.521 N/A LEU 210.A N HIS 208.A ND1 no hydrogen 3.025 N/A HIS 211.A N HIS 208.A ND1 no hydrogen 3.090 N/A GLU 212.A N GLU 212.A OE1 no hydrogen 2.603 N/A PHE 215.A N TRP 227.A O no hydrogen 3.159 N/A GLY 216.A N ALA 206.A O no hydrogen 2.831 N/A SER 217.A N MET 225.A O no hydrogen 2.777 N/A VAL 218.A N ASP 204.A O no hydrogen 3.164 N/A ASP 220.A N VAL 201.A O no hydrogen 2.875 N/A GLN 222.A N ALA 219.A O no hydrogen 3.253 N/A GLN 222.A NE2 HIS 244.A O no hydrogen 3.400 N/A LYS 223.A N ASP 221.A OD1 no hydrogen 3.014 N/A LEU 224.A N VAL 241.A O no hydrogen 2.897 N/A MET 225.A N SER 217.A O no hydrogen 2.866 N/A ILE 226.A N HIS 239.A O no hydrogen 2.976 N/A TRP 227.A N PHE 215.A O no hydrogen 2.748 N/A TRP 227.A NE1 SER 217.A OG no hydrogen 2.632 N/A THR 229.A N SER 213.A O no hydrogen 3.067 N/A THR 229.A OG1 SER 213.A O no hydrogen 3.494 N/A ARG 230.A N ASP 228.A OD1 no hydrogen 3.147 N/A ARG 230.A NH1 ASP 228.A OD1 no hydrogen 2.932 N/A SER 231.A OG ASP 228.A O no hydrogen 2.760 N/A THR 233.A OG1 SER 235.A OG no hydrogen 3.326 N/A THR 234.A OG1 ILE 194.A O no hydrogen 3.416 N/A SER 235.A N THR 233.A OG1 no hydrogen 3.299 N/A SER 235.A OG THR 233.A OG1 no hydrogen 3.326 N/A LYS 236.A N THR 233.A OG1 no hydrogen 3.335 N/A LYS 236.A NZ SER 235.A O no hydrogen 3.146 N/A SER 238.A N ILE 226.A O no hydrogen 2.726 N/A HIS 239.A N ILE 226.A O no hydrogen 3.198 N/A VAL 241.A N LEU 224.A O no hydrogen 2.837 N/A ALA 243.A N GLN 222.A O no hydrogen 3.305 N/A THR 245.A N ASP 267.A OD2 no hydrogen 3.238 N/A THR 245.A OG1 ASP 267.A OD2 no hydrogen 3.420 N/A VAL 248.A N ALA 219.A O no hydrogen 2.993 N/A ASN 249.A N GLY 264.A O no hydrogen 2.850 N/A ASN 249.A ND2 GLU 291.A OE1 no hydrogen 3.297 N/A ASN 249.A ND2 ILE 292.A O no hydrogen 2.908 N/A CYS 250.A N GLY 264.A O no hydrogen 3.383 N/A SER 252.A N ALA 262.A O no hydrogen 2.921 N/A ASN 254.A N ILE 260.A O no hydrogen 3.176 N/A ASN 254.A ND2 GLU 302.A O no hydrogen 2.914 N/A TYR 256.A N ASN 254.A OD1 no hydrogen 2.672 N/A TYR 256.A OH PRO 299.A O no hydrogen 2.802 N/A SER 257.A N ASN 254.A OD1 no hydrogen 2.963 N/A ILE 260.A N SER 257.A O no hydrogen 3.371 N/A LEU 261.A N TRP 273.A O no hydrogen 2.939 N/A ALA 262.A N SER 252.A O no hydrogen 2.837 N/A THR 263.A N ALA 271.A O no hydrogen 2.885 N/A GLY 264.A N CYS 250.A O no hydrogen 3.034 N/A SER 265.A N THR 269.A O no hydrogen 3.224 N/A SER 265.A OG GLU 247.A O no hydrogen 2.904 N/A ALA 266.A N GLU 247.A O no hydrogen 2.874 N/A ASP 267.A N SER 265.A OG no hydrogen 2.941 N/A LYS 268.A N SER 265.A O no hydrogen 3.295 N/A THR 269.A N ASP 267.A OD1 no hydrogen 3.101 N/A THR 269.A OG1 ASP 267.A OD1 no hydrogen 2.804 N/A VAL 270.A N PHE 285.A O no hydrogen 3.184 N/A ALA 271.A N THR 263.A O no hydrogen 2.734 N/A LEU 272.A N HIS 283.A O no hydrogen 2.901 N/A TRP 273.A N LEU 261.A O no hydrogen 2.842 N/A LEU 275.A N PHE 259.A O no hydrogen 2.684 N/A ARG 276.A N ASP 274.A OD2 no hydrogen 2.912 N/A ARG 276.A NH1 ASP 274.A OD1 no hydrogen 2.911 N/A ASN 277.A N ASP 274.A O no hydrogen 3.165 N/A LYS 281.A NZ ALA 243.A O no hydrogen 2.826 N/A LEU 282.A N LEU 272.A O no hydrogen 2.884 N/A HIS 283.A NE2 GLU 337.A OE2 no hydrogen 2.939 N/A PHE 285.A N VAL 270.A O no hydrogen 2.804 N/A LYS 289.A N ASP 311.A OD2 no hydrogen 3.312 N/A GLU 291.A N ASP 290.A OD1 no hydrogen 2.706 N/A ILE 292.A N SER 265.A O no hydrogen 3.228 N/A PHE 293.A N SER 308.A O no hydrogen 2.885 N/A GLN 294.A N SER 308.A O no hydrogen 3.334 N/A GLN 294.A NE2 VAL 295.A O no hydrogen 3.461 N/A HIS 296.A N ALA 306.A O no hydrogen 2.875 N/A TRP 297.A NE1 SER 252.A O no hydrogen 2.793 N/A SER 298.A N ILE 304.A O no hydrogen 2.862 N/A HIS 300.A N SER 298.A OG no hydrogen 3.235 N/A ASN 301.A N SER 298.A OG no hydrogen 3.210 N/A THR 303.A OG1 ASP 318.A OD1 no hydrogen 3.127 N/A ILE 304.A N ASN 301.A O no hydrogen 3.162 N/A LEU 305.A N TRP 317.A O no hydrogen 3.058 N/A ALA 306.A N HIS 296.A O no hydrogen 2.894 N/A SER 307.A N ASN 315.A O no hydrogen 2.912 N/A SER 308.A N GLN 294.A O no hydrogen 2.951 N/A THR 310.A N GLU 291.A O no hydrogen 3.016 N/A ARG 313.A N ASP 311.A OD1 no hydrogen 3.354 N/A ARG 313.A NH1 GLU 13.A OE1 no hydrogen 3.481 N/A LEU 314.A N HIS 342.A O no hydrogen 3.355 N/A ASN 315.A N SER 307.A O no hydrogen 2.798 N/A VAL 316.A N PHE 340.A O no hydrogen 2.806 N/A TRP 317.A N LEU 305.A O no hydrogen 2.646 N/A TRP 317.A NE1 SER 307.A OG no hydrogen 2.860 N/A ASP 318.A N GLU 337.A O no hydrogen 2.717 N/A LEU 319.A N THR 303.A O no hydrogen 2.781 N/A SER 320.A N ASP 318.A OD1 no hydrogen 3.168 N/A SER 320.A OG ASP 318.A OD1 no hydrogen 2.815 N/A SER 320.A OG ASP 318.A OD2 no hydrogen 3.405 N/A LYS 321.A N ASP 318.A O no hydrogen 3.179 N/A LYS 321.A NZ ASP 383.A OD2 no hydrogen 3.328 N/A ILE 322.A N LEU 319.A O no hydrogen 3.251 N/A GLU 324.A N LYS 321.A O no hydrogen 3.261 N/A GLN 326.A NE2 GLY 334.A O no hydrogen 2.898 N/A ASP 330.A N SER 327.A OG no hydrogen 3.270 N/A ALA 331.A N SER 327.A O no hydrogen 3.041 N/A GLU 332.A N GLU 329.A O no hydrogen 3.391 N/A ASP 333.A N ASP 330.A O no hydrogen 3.309 N/A GLY 334.A N ALA 331.A O no hydrogen 3.341 N/A GLU 337.A N GLU 337.A OE1 no hydrogen 2.748 N/A LEU 338.A N PRO 335.A O no hydrogen 3.086 N/A LEU 339.A N VAL 316.A O no hydrogen 2.807 N/A PHE 340.A N VAL 316.A O no hydrogen 3.240 N/A HIS 342.A N LEU 314.A O no hydrogen 2.835 N/A HIS 342.A ND1 TYR 25.A OH no hydrogen 2.566 N/A HIS 345.A NE2 SER 364.A OG no hydrogen 2.791 N/A THR 346.A OG1 ASP 368.A OD2 no hydrogen 2.541 N/A SER 350.A N VAL 365.A O no hydrogen 2.857 N/A PHE 352.A N ASP 351.A OD1 no hydrogen 2.938 N/A SER 353.A N CYS 363.A O no hydrogen 2.734 N/A TRP 354.A NE1 HIS 296.A O no hydrogen 3.079 N/A ASN 355.A N VAL 361.A O no hydrogen 2.787 N/A ASN 355.A ND2 HIS 57.A ND1 no hydrogen 3.179 N/A ASN 357.A N ASN 355.A OD1 no hydrogen 2.790 N/A GLU 358.A N ASN 355.A OD1 no hydrogen 2.693 N/A VAL 361.A N GLU 358.A O no hydrogen 3.164 N/A ILE 362.A N TRP 374.A O no hydrogen 2.784 N/A CYS 363.A N SER 353.A O no hydrogen 2.908 N/A CYS 363.A SG GLN 372.A O no hydrogen 3.843 N/A SER 364.A N GLN 372.A O no hydrogen 3.002 N/A SER 364.A OG HIS 345.A NE2 no hydrogen 2.791 N/A VAL 365.A N ASP 351.A O no hydrogen 2.966 N/A SER 366.A N ILE 370.A O no hydrogen 2.912 N/A SER 366.A OG HIS 345.A ND1 no hydrogen 3.233 N/A SER 366.A OG ASP 368.A OD1 no hydrogen 2.507 N/A SER 366.A OG ILE 370.A O no hydrogen 3.425 N/A GLU 367.A N LYS 348.A O no hydrogen 2.925 N/A ASN 369.A ND2 LEU 33.A O no hydrogen 2.858 N/A MET 371.A N HIS 31.A O no hydrogen 2.899 N/A GLN 372.A N SER 364.A O no hydrogen 2.901 N/A ILE 373.A N MET 29.A O no hydrogen 2.801 N/A TRP 374.A N ILE 362.A O no hydrogen 2.881 N/A TRP 374.A NE1 SER 364.A OG no hydrogen 3.150 N/A GLN 375.A N LEU 27.A O no hydrogen 2.993 N/A GLN 375.A NE2 PRO 359.A O no hydrogen 2.801 N/A ALA 377.A N LEU 24.A O no hydrogen 2.676 N/A GLU 378.A N ASP 26.A OD2 no hydrogen 3.250 N/A ILE 380.A N ALA 377.A O no hydrogen 3.037 N/A ASN 382.A N GLU 378.A O no hydrogen 2.821 N/A ASP 383.A N TYR 381.A O no hydrogen 3.071 N/A