Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kbu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 GLU 5.A OE1 no hydrogen 2.561 N/A GLU 5.A N THR 2.A O no hydrogen 2.906 N/A GLU 5.A N THR 2.A OG1 no hydrogen 3.328 N/A VAL 6.A N THR 2.A O no hydrogen 3.006 N/A ARG 7.A N SER 3.A O no hydrogen 3.013 N/A LYS 8.A N ASP 4.A O no hydrogen 3.087 N/A LYS 8.A NZ ASP 12.A OD1 no hydrogen 2.840 N/A LYS 8.A NZ ASP 12.A OD2 no hydrogen 3.376 N/A ASN 9.A N GLU 5.A O no hydrogen 2.792 N/A ASN 9.A ND2 SER 85.A O no hydrogen 2.293 N/A LEU 10.A N VAL 6.A O no hydrogen 2.767 N/A MET 11.A N ARG 7.A O no hydrogen 3.150 N/A ASP 12.A N LYS 8.A O no hydrogen 2.929 N/A MET 13.A N ASN 9.A O no hydrogen 2.993 N/A PHE 14.A N LEU 10.A O no hydrogen 3.066 N/A ARG 15.A N MET 11.A O no hydrogen 2.832 N/A ASP 16.A N ASP 12.A O no hydrogen 3.087 N/A ARG 17.A NH1 PHE 14.A O no hydrogen 2.866 N/A ALA 19.A N ASP 16.A O no hydrogen 3.303 N/A PHE 20.A N ARG 17.A O no hydrogen 3.106 N/A SER 21.A OG THR 24.A OG1 no hydrogen 2.299 N/A THR 24.A N SER 21.A O no hydrogen 3.096 N/A THR 24.A N SER 21.A OG no hydrogen 3.086 N/A THR 24.A OG1 SER 21.A O no hydrogen 3.403 N/A THR 24.A OG1 SER 21.A OG no hydrogen 2.299 N/A TRP 25.A N SER 21.A O no hydrogen 3.234 N/A TRP 25.A NE1 ARG 17.A O no hydrogen 2.679 N/A LYS 26.A N GLU 22.A O no hydrogen 2.910 N/A MET 27.A N HIS 23.A O no hydrogen 3.005 N/A LEU 28.A N THR 24.A O no hydrogen 2.869 N/A LEU 29.A N TRP 25.A O no hydrogen 2.770 N/A SER 30.A N LYS 26.A O no hydrogen 2.962 N/A VAL 31.A N MET 27.A O no hydrogen 2.941 N/A CYS 32.A N LEU 28.A O no hydrogen 3.095 N/A CYS 32.A SG LEU 28.A O no hydrogen 3.336 N/A ARG 33.A N LEU 29.A O no hydrogen 2.936 N/A SER 34.A N SER 30.A O no hydrogen 3.076 N/A SER 34.A OG TYR 57.A OH no hydrogen 2.308 N/A TRP 35.A N VAL 31.A O no hydrogen 2.756 N/A TRP 35.A NE1 TRP 46.A O no hydrogen 2.832 N/A ALA 36.A N CYS 32.A O no hydrogen 2.643 N/A ALA 37.A N ARG 33.A O no hydrogen 3.027 N/A TRP 38.A N SER 34.A O no hydrogen 3.258 N/A CYS 39.A N TRP 35.A O no hydrogen 3.037 N/A CYS 39.A SG TRP 35.A O no hydrogen 3.229 N/A CYS 39.A SG LYS 45.A O no hydrogen 3.880 N/A LYS 40.A N ALA 36.A O no hydrogen 2.941 N/A LEU 41.A N ALA 37.A O no hydrogen 2.919 N/A ASN 42.A N TRP 38.A O no hydrogen 2.811 N/A ASN 42.A ND2 TRP 38.A O no hydrogen 2.600 N/A ASN 43.A N LYS 40.A O no hydrogen 2.733 N/A ARG 44.A N CYS 39.A O no hydrogen 2.588 N/A ARG 44.A NE ASN 42.A O no hydrogen 3.286 N/A ARG 44.A NH1 ASP 53.A OD1 no hydrogen 2.525 N/A ARG 44.A NH1 ASP 56.A OD2 no hydrogen 3.140 N/A ARG 44.A NH2 ASP 56.A OD2 no hydrogen 3.359 N/A ALA 49.A N HIS 82.A NE2 no hydrogen 2.913 N/A VAL 54.A N GLU 50.A O no hydrogen 2.804 N/A ARG 55.A N PRO 51.A O no hydrogen 2.862 N/A ASP 56.A N GLU 52.A O no hydrogen 3.059 N/A TYR 57.A N ASP 53.A O no hydrogen 3.125 N/A TYR 57.A OH SER 34.A OG no hydrogen 2.308 N/A TYR 57.A OH HIS 74.A ND1 no hydrogen 2.511 N/A LEU 58.A N VAL 54.A O no hydrogen 2.985 N/A LEU 59.A N ARG 55.A O no hydrogen 3.141 N/A TYR 60.A N ASP 56.A O no hydrogen 3.041 N/A LEU 61.A N TYR 57.A O no hydrogen 2.865 N/A GLN 62.A N LEU 58.A O no hydrogen 3.073 N/A GLN 62.A NE2 GLU 106.A OE1 no hydrogen 3.560 N/A GLN 62.A NE2 ASN 107.A OD1 no hydrogen 3.033 N/A ALA 63.A N LEU 59.A O no hydrogen 2.818 N/A ARG 64.A N TYR 60.A O no hydrogen 2.985 N/A ARG 64.A N LEU 61.A O no hydrogen 3.232 N/A GLY 65.A N GLN 62.A O no hydrogen 2.695 N/A LEU 66.A N LEU 61.A O no hydrogen 3.266 N/A VAL 68.A N GLU 112.A OE2 no hydrogen 2.470 N/A THR 70.A N ALA 67.A O no hydrogen 2.524 N/A ILE 71.A N ALA 67.A O no hydrogen 3.001 N/A GLN 72.A N VAL 68.A O no hydrogen 3.184 N/A GLN 73.A N LYS 69.A O no hydrogen 3.259 N/A GLN 73.A NE2 GLN 73.A O no hydrogen 3.662 N/A HIS 74.A N THR 70.A O no hydrogen 3.109 N/A HIS 74.A ND1 TYR 57.A OH no hydrogen 2.511 N/A LEU 75.A N ILE 71.A O no hydrogen 3.093 N/A GLY 76.A N GLN 72.A O no hydrogen 2.691 N/A GLN 77.A N GLN 73.A O no hydrogen 2.772 N/A LEU 78.A N HIS 74.A O no hydrogen 2.922 N/A ASN 79.A N LEU 75.A O no hydrogen 2.709 N/A ASN 79.A ND2 SER 91.A OG no hydrogen 2.290 N/A MET 80.A N GLY 76.A O no hydrogen 3.085 N/A LEU 81.A N GLN 77.A O no hydrogen 2.776 N/A HIS 82.A N LEU 78.A O no hydrogen 2.990 N/A ARG 83.A N ASN 79.A O no hydrogen 2.935 N/A ARG 84.A N MET 80.A O no hydrogen 2.813 N/A SER 85.A N HIS 82.A O no hydrogen 3.283 N/A SER 85.A OG LEU 81.A O no hydrogen 3.120 N/A SER 85.A OG HIS 82.A O no hydrogen 3.428 N/A GLY 86.A N HIS 82.A O no hydrogen 3.069 N/A LEU 87.A N HIS 82.A O no hydrogen 2.874 N/A SER 91.A N ASN 79.A OD1 no hydrogen 2.944 N/A ASP 92.A N ARG 89.A O no hydrogen 3.161 N/A SER 93.A N PRO 90.A O no hydrogen 2.925 N/A SER 93.A OG PRO 90.A O no hydrogen 2.374 N/A SER 97.A N SER 93.A O no hydrogen 2.887 N/A SER 97.A OG SER 91.A O no hydrogen 3.182 N/A SER 97.A OG SER 93.A O no hydrogen 2.733 N/A LEU 98.A N ASN 94.A O no hydrogen 2.785 N/A VAL 99.A N ALA 95.A O no hydrogen 3.177 N/A MET 100.A N VAL 96.A O no hydrogen 3.283 N/A ARG 101.A N SER 97.A O no hydrogen 3.251 N/A ARG 102.A N LEU 98.A O no hydrogen 2.966 N/A ARG 102.A NE GLU 106.A OE1 no hydrogen 3.480 N/A ILE 103.A N VAL 99.A O no hydrogen 2.826 N/A ARG 104.A N MET 100.A O no hydrogen 2.787 N/A ARG 104.A NH2 GLN 72.A OE1 no hydrogen 3.331 N/A LYS 105.A N ARG 101.A O no hydrogen 2.839 N/A GLU 106.A N ARG 102.A O no hydrogen 2.581 N/A ASN 107.A N ILE 103.A O no hydrogen 3.010 N/A ASN 107.A ND2 LEU 66.A O no hydrogen 3.630 N/A ASN 107.A ND2 GLU 112.A OE1 no hydrogen 3.199 N/A VAL 108.A N ARG 104.A O no hydrogen 3.180 N/A ALA 110.A N ASN 107.A O no hydrogen 3.025 N/A GLU 112.A N ASN 107.A O no hydrogen 3.068 N/A ARG 113.A NH1 GLY 111.A O no hydrogen 3.536 N/A LYS 115.A NZ ARG 265.A O no hydrogen 3.547 N/A PHE 120.A N SER 273.A O no hydrogen 3.166 N/A GLU 121.A N ASP 124.A OD2 no hydrogen 3.121 N/A ARG 122.A N ASP 281.A OD2 no hydrogen 2.990 N/A ASP 124.A N GLU 121.A O no hydrogen 2.528 N/A PHE 125.A N GLU 121.A O no hydrogen 2.946 N/A ASP 126.A N ARG 122.A O no hydrogen 2.835 N/A GLN 127.A N THR 123.A O no hydrogen 3.358 N/A VAL 128.A N ASP 124.A O no hydrogen 2.969 N/A ARG 129.A N PHE 125.A O no hydrogen 2.539 N/A SER 130.A N ASP 126.A O no hydrogen 2.512 N/A SER 130.A OG GLN 127.A O no hydrogen 3.439 N/A LEU 131.A N GLN 127.A O no hydrogen 3.108 N/A MET 132.A N ARG 129.A O no hydrogen 3.339 N/A GLU 133.A N ARG 129.A O no hydrogen 2.976 N/A SER 135.A N MET 132.A O no hydrogen 2.462 N/A ARG 137.A N SER 135.A OG no hydrogen 3.196 N/A ARG 137.A NE ASP 140.A OD1 no hydrogen 3.189 N/A ARG 137.A NH2 ASP 140.A OD1 no hydrogen 2.921 N/A ILE 141.A N ARG 137.A O no hydrogen 2.735 N/A ARG 142.A N CYS 138.A O no hydrogen 2.997 N/A ARG 142.A NE ASN 143.A OD1 no hydrogen 3.007 N/A ARG 142.A NH1 CYS 223.A O no hydrogen 2.874 N/A ARG 142.A NH2 ASN 143.A OD1 no hydrogen 2.845 N/A ASN 143.A N GLN 139.A O no hydrogen 3.088 N/A LEU 144.A N ILE 141.A O no hydrogen 3.100 N/A ALA 145.A N ILE 141.A O no hydrogen 3.397 N/A PHE 146.A N ARG 142.A O no hydrogen 3.207 N/A LEU 147.A N ASN 143.A O no hydrogen 3.505 N/A GLY 148.A N LEU 144.A O no hydrogen 2.923 N/A ILE 149.A N ALA 145.A O no hydrogen 2.789 N/A TYR 151.A N LEU 147.A O no hydrogen 3.034 N/A TYR 151.A OH ASP 281.A OD2 no hydrogen 2.298 N/A ASN 152.A N GLY 148.A O no hydrogen 2.801 N/A ASN 152.A ND2 ALA 195.A O no hydrogen 2.450 N/A THR 153.A OG1 ILE 149.A O no hydrogen 2.532 N/A LEU 154.A N ALA 150.A O no hydrogen 2.771 N/A ARG 156.A N GLU 159.A OE1 no hydrogen 3.308 N/A ARG 156.A NH1 GLU 159.A OE2 no hydrogen 3.201 N/A ARG 156.A NH1 ARG 182.A O no hydrogen 3.437 N/A GLU 159.A N ARG 156.A O no hydrogen 2.690 N/A ILE 160.A N ARG 156.A O no hydrogen 2.908 N/A ALA 161.A N ILE 157.A O no hydrogen 3.300 N/A ILE 163.A N ILE 160.A O no hydrogen 3.230 N/A ARG 164.A N ASP 167.A OD2 no hydrogen 3.187 N/A ARG 164.A NH1 ASN 218.A O no hydrogen 2.382 N/A ARG 164.A NH1 ALA 235.A O no hydrogen 3.227 N/A ARG 164.A NH2 ALA 235.A O no hydrogen 3.188 N/A VAL 165.A N ASN 219.A O no hydrogen 3.300 N/A ILE 168.A N VAL 165.A O no hydrogen 3.363 N/A SER 169.A N LEU 177.A O no hydrogen 2.987 N/A SER 169.A OG LEU 177.A O no hydrogen 3.136 N/A SER 169.A OG GLU 193.A OE2 no hydrogen 3.389 N/A ARG 170.A NH2 GLU 205.A OE2 no hydrogen 2.722 N/A THR 171.A OG1 ASP 172.A OD1 no hydrogen 3.546 N/A ILE 178.A N LYS 194.A O no hydrogen 2.795 N/A HIS 179.A N ASP 167.A O no hydrogen 3.141 N/A ILE 180.A N VAL 192.A O no hydrogen 2.709 N/A THR 183.A OG1 THR 189.A O no hydrogen 3.034 N/A THR 183.A OG1 THR 189.A OG1 no hydrogen 2.544 N/A LYS 184.A NZ THR 183.A O no hydrogen 2.553 N/A THR 189.A OG1 THR 183.A OG1 no hydrogen 2.544 N/A LYS 194.A N ILE 178.A O no hydrogen 3.315 N/A LYS 194.A NZ THR 153.A O no hydrogen 3.108 N/A LYS 194.A NZ ALA 295.A O no hydrogen 2.624 N/A SER 197.A OG ASN 152.A OD1 no hydrogen 2.828 N/A THR 201.A OG1 GLY 174.A O no hydrogen 3.124 N/A THR 201.A OG1 ARG 175.A O no hydrogen 2.326 N/A VAL 204.A N VAL 200.A O no hydrogen 2.835 N/A GLU 205.A N LYS 202.A O no hydrogen 2.290 N/A ARG 206.A N LYS 202.A O no hydrogen 3.181 N/A ARG 206.A NH1 GLU 133.A O no hydrogen 2.531 N/A ARG 206.A NH2 GLU 133.A O no hydrogen 3.483 N/A TRP 207.A N LEU 203.A O no hydrogen 3.054 N/A TRP 207.A NE1 LEU 221.A O no hydrogen 3.155 N/A ILE 208.A N GLU 205.A O no hydrogen 2.804 N/A SER 209.A N GLU 205.A O no hydrogen 3.071 N/A SER 209.A OG ARG 206.A O no hydrogen 2.975 N/A VAL 210.A N ARG 206.A O no hydrogen 3.188 N/A SER 211.A N TRP 207.A O no hydrogen 2.710 N/A SER 211.A OG TRP 207.A O no hydrogen 2.419 N/A GLY 212.A N ILE 208.A O no hydrogen 2.962 N/A VAL 213.A N SER 211.A OG no hydrogen 3.047 N/A ASN 218.A N ASP 216.A OD1 no hydrogen 2.725 N/A ASN 218.A ND2 ASP 216.A OD1 no hydrogen 3.142 N/A ASN 219.A ND2 VAL 213.A O no hydrogen 3.422 N/A TYR 220.A N SER 234.A O no hydrogen 2.975 N/A LEU 221.A N ILE 163.A O no hydrogen 2.889 N/A CYS 223.A SG ARG 224.A O no hydrogen 3.874 N/A ARG 226.A N VAL 230.A O no hydrogen 3.099 N/A GLY 229.A N ARG 226.A O no hydrogen 2.871 N/A SER 237.A N SER 234.A OG no hydrogen 3.356 N/A ARG 242.A NH1 ARG 242.A O no hydrogen 3.569 N/A ALA 243.A N SER 240.A OG no hydrogen 2.614 N/A LEU 244.A N SER 240.A O no hydrogen 3.335 N/A GLU 245.A N THR 241.A O no hydrogen 2.856 N/A GLY 246.A N ARG 242.A O no hydrogen 2.772 N/A ILE 247.A N ALA 243.A O no hydrogen 2.937 N/A PHE 248.A N GLU 245.A O no hydrogen 3.119 N/A GLU 249.A N GLU 245.A O no hydrogen 3.005 N/A ALA 250.A N GLY 246.A O no hydrogen 2.621 N/A THR 251.A N ILE 247.A O no hydrogen 3.110 N/A THR 251.A OG1 ILE 247.A O no hydrogen 2.890 N/A HIS 252.A N PHE 248.A O no hydrogen 3.195 N/A HIS 252.A N GLU 249.A O no hydrogen 3.196 N/A ARG 253.A N GLU 249.A O no hydrogen 3.077 N/A ARG 253.A N ALA 250.A O no hydrogen 2.863 N/A LEU 254.A N ALA 250.A O no hydrogen 3.012 N/A TYR 256.A N HIS 252.A O no hydrogen 2.850 N/A GLY 257.A N ARG 253.A O no hydrogen 2.621 N/A SER 262.A N ASP 260.A O no hydrogen 2.857 N/A TRP 269.A NE1 ALA 119.A O no hydrogen 2.750 N/A SER 270.A N SER 273.A OG no hydrogen 2.854 N/A SER 273.A N SER 270.A O no hydrogen 2.964 N/A SER 273.A OG LEU 118.A O no hydrogen 2.615 N/A SER 273.A OG SER 270.A O no hydrogen 3.086 N/A ARG 275.A NH1 LEU 154.A O no hydrogen 2.859 N/A ARG 275.A NH1 GLY 296.A O no hydrogen 3.251 N/A ARG 275.A NH2 GLY 296.A O no hydrogen 3.473 N/A VAL 276.A N HIS 272.A O no hydrogen 3.048 N/A GLY 277.A N SER 273.A O no hydrogen 2.907 N/A ALA 278.A N ALA 274.A O no hydrogen 2.981 N/A ALA 279.A N ARG 275.A O no hydrogen 3.461 N/A ARG 280.A N VAL 276.A O no hydrogen 3.433 N/A ARG 280.A NH1 TYR 307.A O no hydrogen 3.196 N/A ARG 280.A NH1 ASN 310.A OD1 no hydrogen 2.307 N/A ASP 281.A N GLY 277.A O no hydrogen 2.918 N/A MET 282.A N ALA 278.A O no hydrogen 2.885 N/A ALA 283.A N ALA 279.A O no hydrogen 2.594 N/A ALA 283.A N ARG 280.A O no hydrogen 3.036 N/A ARG 284.A N ARG 280.A O no hydrogen 2.571 N/A ARG 284.A NH2 GLU 121.A OE1 no hydrogen 3.055 N/A ALA 285.A N ASP 281.A O no hydrogen 3.174 N/A GLY 286.A N ALA 283.A O no hydrogen 3.042 N/A ILE 292.A N PRO 290.A O no hydrogen 2.260 N/A MET 293.A N ILE 289.A O no hydrogen 2.979 N/A ASN 300.A N TRP 298.A O no hydrogen 2.338 N/A ASN 302.A ND2 ASN 302.A O no hydrogen 2.315 N/A ASN 302.A ND2 ASN 306.A OD1 no hydrogen 3.291 N/A ASN 306.A N ASN 302.A O no hydrogen 2.387 N/A ASN 306.A ND2 ASN 306.A O no hydrogen 3.164 N/A TYR 307.A N ILE 303.A O no hydrogen 3.210 N/A ILE 308.A N VAL 304.A O no hydrogen 3.252 N/A LEU 311.A N ILE 308.A O no hydrogen 3.325 N/A SER 313.A OG GLU 314.A OE2 no hydrogen 3.531 N/A ARG 320.A N GLY 316.A O no hydrogen 3.483 N/A LEU 321.A N ALA 317.A O no hydrogen 3.052 N/A LEU 322.A N MET 318.A O no hydrogen 2.793 N/A GLU 323.A N VAL 319.A O no hydrogen 2.883 N/A ASP 324.A N LEU 321.A O no hydrogen 3.067 N/A