Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8wak_2.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 7.A NH1 HIS 183.A O no hydrogen 3.502 N/A ARG 7.A NH1 SER 185.A O no hydrogen 2.708 N/A ARG 7.A NH2 HIS 183.A O no hydrogen 3.361 N/A HIS 8.A N SER 112.A O no hydrogen 2.894 N/A LEU 9.A N GLN 51.A O no hydrogen 2.982 N/A TYR 10.A N GLU 114.A O no hydrogen 2.900 N/A VAL 11.A N GLY 53.A O no hydrogen 2.900 N/A VAL 12.A N LEU 116.A O no hydrogen 2.899 N/A VAL 13.A N ILE 55.A O no hydrogen 2.906 N/A GLY 15.A N THR 57.A O no hydrogen 2.507 N/A ARG 17.A NE GLY 89.A O no hydrogen 3.053 N/A MET 19.A N SER 16.A O no hydrogen 3.268 N/A GLU 20.A N ARG 17.A O no hydrogen 2.998 N/A ASP 21.A N THR 18.A O no hydrogen 2.982 N/A THR 30.A OG1 ASN 27.A O no hydrogen 2.623 N/A CYS 31.A N ASN 27.A O no hydrogen 2.885 N/A CYS 31.A SG GLU 173.A OE1 no hydrogen 3.087 N/A THR 32.A N ARG 28.A O no hydrogen 2.915 N/A THR 32.A OG1 ARG 28.A O no hydrogen 3.003 N/A THR 32.A OG1 LEU 29.A O no hydrogen 2.556 N/A LEU 33.A N LEU 29.A O no hydrogen 2.909 N/A LYS 34.A N THR 30.A O no hydrogen 2.867 N/A LEU 35.A N CYS 31.A O no hydrogen 2.939 N/A LEU 36.A N THR 32.A O no hydrogen 2.818 N/A GLU 37.A N LEU 33.A O no hydrogen 2.929 N/A PHE 39.A N LEU 35.A O no hydrogen 2.899 N/A VAL 40.A N LEU 36.A O no hydrogen 2.821 N/A GLU 41.A N GLU 37.A O no hydrogen 2.983 N/A GLU 42.A N TYR 38.A O no hydrogen 2.882 N/A TYR 43.A N PHE 39.A O no hydrogen 2.820 N/A PHE 44.A N VAL 40.A O no hydrogen 2.969 N/A ASP 45.A N GLU 41.A O no hydrogen 2.894 N/A GLN 46.A N TYR 43.A O no hydrogen 3.265 N/A GLN 46.A NE2 HIS 265.A NE2 no hydrogen 3.609 N/A GLN 46.A NE2 HIS 266.A NE2 no hydrogen 3.390 N/A ASN 47.A ND2 MET 5.A O no hydrogen 2.946 N/A SER 50.A N ASN 47.A O no hydrogen 3.033 N/A SER 50.A OG ASN 47.A O no hydrogen 2.569 N/A GLN 51.A N ARG 7.A O no hydrogen 3.364 N/A GLN 51.A NE2 HIS 8.A NE2 no hydrogen 3.149 N/A GLY 53.A N LEU 9.A O no hydrogen 2.898 N/A ILE 54.A N THR 66.A O no hydrogen 3.284 N/A VAL 56.A N GLU 63.A O no hydrogen 2.910 N/A THR 57.A N VAL 13.A O no hydrogen 2.909 N/A THR 57.A OG1 SER 96.A OG no hydrogen 2.055 N/A LYS 58.A N ARG 61.A O no hydrogen 2.840 N/A SER 59.A OG HIS 88.A O no hydrogen 2.923 N/A LYS 60.A N GLU 90.A O no hydrogen 2.414 N/A ARG 61.A N LYS 58.A O no hydrogen 2.992 N/A GLU 63.A N VAL 56.A O no hydrogen 2.894 N/A LYS 64.A NZ TYR 10.A OH no hydrogen 3.114 N/A THR 66.A N ILE 54.A O no hydrogen 3.317 N/A GLU 67.A N GLU 67.A OE1 no hydrogen 2.787 N/A SER 69.A OG HIS 75.A NE2 no hydrogen 2.394 N/A ILE 76.A N PRO 72.A O no hydrogen 2.897 N/A THR 77.A N ARG 73.A O no hydrogen 2.884 N/A THR 77.A OG1 ARG 73.A O no hydrogen 2.976 N/A SER 78.A N LYS 74.A O no hydrogen 2.950 N/A SER 78.A OG THR 66.A OG1 no hydrogen 3.159 N/A SER 78.A OG HIS 75.A O no hydrogen 2.501 N/A LEU 79.A N HIS 75.A O no hydrogen 2.886 N/A LYS 80.A N ILE 76.A O no hydrogen 2.935 N/A LYS 80.A NZ GLU 37.A OE1 no hydrogen 3.139 N/A LYS 80.A NZ GLU 37.A OE2 no hydrogen 2.423 N/A LYS 81.A N THR 77.A O no hydrogen 2.900 N/A ALA 82.A N SER 78.A O no hydrogen 2.892 N/A VAL 83.A N LEU 79.A O no hydrogen 2.964 N/A VAL 83.A N LYS 80.A O no hydrogen 3.332 N/A ASP 84.A N LYS 81.A O no hydrogen 3.345 N/A MET 85.A N ALA 82.A O no hydrogen 2.842 N/A CYS 87.A SG SER 16.A O no hydrogen 2.936 N/A SER 92.A OG CYS 125.A O no hydrogen 3.310 N/A ASN 95.A N SER 92.A OG no hydrogen 3.135 N/A SER 96.A N SER 92.A O no hydrogen 2.960 N/A SER 96.A OG THR 57.A OG1 no hydrogen 2.055 N/A SER 96.A OG SER 92.A O no hydrogen 3.261 N/A LEU 97.A N LEU 93.A O no hydrogen 2.854 N/A SER 98.A N TYR 94.A O no hydrogen 2.839 N/A SER 98.A OG TYR 94.A O no hydrogen 2.634 N/A SER 98.A OG ASN 95.A O no hydrogen 2.559 N/A ILE 99.A N ASN 95.A O no hydrogen 2.950 N/A ALA 100.A N SER 96.A O no hydrogen 2.966 N/A MET 101.A N LEU 97.A O no hydrogen 2.806 N/A GLN 102.A N SER 98.A O no hydrogen 2.840 N/A THR 103.A N ILE 99.A O no hydrogen 3.016 N/A THR 103.A OG1 ILE 99.A O no hydrogen 2.978 N/A LEU 104.A N ALA 100.A O no hydrogen 2.859 N/A MET 107.A N LEU 104.A O no hydrogen 3.217 N/A THR 111.A OG1 MET 6.A O no hydrogen 2.894 N/A SER 112.A N MET 6.A O no hydrogen 2.939 N/A SER 112.A OG GLU 114.A OE2 no hydrogen 2.929 N/A GLU 114.A N HIS 8.A O no hydrogen 2.926 N/A VAL 115.A N ARG 143.A O no hydrogen 2.842 N/A LEU 116.A N TYR 10.A O no hydrogen 2.871 N/A ILE 118.A N VAL 12.A O no hydrogen 2.914 N/A PHE 119.A N ILE 147.A O no hydrogen 2.923 N/A THR 124.A OG1 THR 123.A O no hydrogen 3.043 N/A CYS 125.A SG PRO 91.A O no hydrogen 3.293 N/A SER 128.A OG ASN 129.A O no hydrogen 3.501 N/A SER 128.A OG ASN 129.A OD1 no hydrogen 3.145 N/A ILE 134.A N ILE 130.A O no hydrogen 2.927 N/A LYS 135.A N ASP 132.A O no hydrogen 3.107 N/A LEU 137.A N LEU 133.A O no hydrogen 2.908 N/A LYS 138.A N ILE 134.A O no hydrogen 2.922 N/A LYS 138.A NZ GLU 162.A O no hydrogen 3.427 N/A ALA 139.A N LYS 135.A O no hydrogen 2.925 N/A ALA 140.A N THR 136.A O no hydrogen 2.875 N/A LYS 141.A N LYS 138.A O no hydrogen 3.214 N/A ILE 142.A N LEU 137.A O no hydrogen 3.355 N/A ARG 143.A N ARG 113.A O no hydrogen 2.934 N/A ARG 143.A NH2 GLU 114.A OE1 no hydrogen 3.493 N/A SER 145.A N VAL 115.A O no hydrogen 2.913 N/A SER 145.A OG VAL 115.A O no hydrogen 3.447 N/A SER 145.A OG HIS 183.A NE2 no hydrogen 3.295 N/A ILE 147.A N ILE 117.A O no hydrogen 2.891 N/A GLY 148.A N HIS 168.A O no hydrogen 2.736 N/A VAL 153.A N TYR 167.A OH no hydrogen 2.686 N/A THR 157.A N VAL 153.A O no hydrogen 2.898 N/A THR 157.A OG1 VAL 153.A O no hydrogen 2.656 N/A VAL 158.A N ARG 154.A O no hydrogen 2.959 N/A LEU 159.A N VAL 155.A O no hydrogen 2.881 N/A ALA 160.A N CYS 156.A O no hydrogen 2.873 N/A ARG 161.A N THR 157.A O no hydrogen 2.989 N/A GLU 162.A N VAL 158.A O no hydrogen 2.877 N/A THR 163.A N LEU 159.A O no hydrogen 2.913 N/A THR 163.A OG1 LEU 159.A O no hydrogen 2.660 N/A THR 163.A OG1 GLU 162.A OE1 no hydrogen 3.279 N/A TYR 167.A OH ALA 151.A O no hydrogen 3.024 N/A ILE 170.A N GLY 148.A O no hydrogen 3.307 N/A SER 174.A OG ASP 172.A OD2 no hydrogen 2.448 N/A TYR 176.A N ASP 172.A O no hydrogen 2.879 N/A LYS 177.A N GLU 173.A O no hydrogen 2.976 N/A GLU 178.A N SER 174.A O no hydrogen 3.184 N/A LEU 179.A N HIS 175.A O no hydrogen 2.861 N/A LEU 180.A N TYR 176.A O no hydrogen 3.013 N/A THR 181.A N LYS 177.A O no hydrogen 2.911 N/A THR 181.A OG1 LYS 177.A O no hydrogen 3.117 N/A HIS 182.A N GLU 178.A O no hydrogen 2.871 N/A HIS 183.A N LEU 179.A O no hydrogen 2.937 N/A HIS 183.A ND1 LEU 179.A O no hydrogen 3.220 N/A VAL 184.A N LEU 180.A O no hydrogen 2.936 N/A VAL 184.A N THR 181.A O no hydrogen 3.249 N/A SER 185.A N HIS 182.A O no hydrogen 3.279 N/A SER 185.A OG PRO 186.A O no hydrogen 3.258 N/A ALA 189.A N ARG 2.A O no hydrogen 2.524 N/A SER 193.A OG SER 190.A O no hydrogen 2.166 N/A SER 196.A OG LEU 197.A O no hydrogen 3.350 N/A GLY 201.A N THR 253.A O no hydrogen 3.046 N/A THR 206.A N GLY 230.A O no hydrogen 2.913 N/A THR 206.A OG1 GLN 204.A O no hydrogen 3.217 N/A SER 209.A OG GLN 213.A O no hydrogen 2.225 N/A SER 211.A OG LEU 210.A O no hydrogen 2.486 N/A GLN 213.A N LEU 210.A O no hydrogen 2.992 N/A SER 218.A OG PRO 217.A O no hydrogen 2.416 N/A THR 227.A N SER 218.A O no hydrogen 2.784 N/A THR 227.A OG1 SER 218.A O no hydrogen 2.435 N/A GLY 230.A N THR 206.A O no hydrogen 2.892 N/A TYR 231.A N TYR 240.A O no hydrogen 3.280 N/A LYS 239.A NZ THR 227.A O no hydrogen 2.454 N/A LYS 239.A NZ THR 227.A OG1 no hydrogen 2.766 N/A TYR 240.A N TYR 231.A O no hydrogen 3.018 N/A CYS 241.A SG SER 220.A OG no hydrogen 3.286 N/A VAL 245.A N LEU 254.A O no hydrogen 2.952 N/A CYS 247.A N LEU 252.A O no hydrogen 2.902 N/A CYS 247.A SG LEU 252.A O no hydrogen 3.150 N/A LYS 248.A N TYR 240.A OH no hydrogen 2.744 N/A CYS 250.A SG GLN 235.A OE1 no hydrogen 3.492 N/A THR 253.A OG1 GLU 246.A OE1 no hydrogen 2.456 N/A THR 253.A OG1 GLU 246.A OE2 no hydrogen 3.401 N/A LEU 254.A N VAL 245.A O no hydrogen 2.879 N/A VAL 255.A N GLY 201.A O no hydrogen 3.068 N/A LEU 260.A N SER 256.A O no hydrogen 3.458 N/A ALA 261.A N ALA 257.A O no hydrogen 2.909 N/A ARG 262.A N PRO 258.A O no hydrogen 2.899 N/A ARG 262.A N HIS 259.A O no hydrogen 3.324 N/A SER 263.A N LEU 260.A O no hydrogen 3.055 N/A TYR 264.A N ALA 261.A O no hydrogen 3.261 N/A HIS 266.A N SER 263.A O no hydrogen 3.292 N/A PHE 268.A N TYR 264.A O no hydrogen 2.938 N/A GLN 274.A N GLN 274.A OE1 no hydrogen 2.598 N/A ILE 276.A N VAL 299.A O no hydrogen 2.921 N/A ASN 282.A N GLU 279.A O no hydrogen 3.325 N/A ASN 282.A ND2 GLU 279.A O no hydrogen 2.380 N/A GLU 284.A N GLU 284.A OE1 no hydrogen 2.735 N/A ARG 285.A NH1 GLY 283.A O no hydrogen 3.301 N/A CYS 287.A N GLY 292.A O no hydrogen 2.517 N/A CYS 287.A SG VAL 308.A O no hydrogen 3.929 N/A GLN 291.A N CYS 287.A O no hydrogen 2.360 N/A LEU 294.A N ARG 285.A O no hydrogen 3.189 N/A HIS 298.A N ASP 296.A O no hydrogen 2.901 N/A TYR 300.A N PHE 309.A O no hydrogen 2.983 N/A PHE 309.A N TYR 300.A O no hydrogen 3.030 N/A ASP 314.A N CYS 310.A O no hydrogen 2.916 N/A VAL 315.A N VAL 311.A O no hydrogen 2.917 N/A PHE 316.A N ASP 312.A O no hydrogen 2.908 N/A VAL 317.A N CYS 313.A O no hydrogen 2.900 N/A HIS 318.A N ASP 314.A O no hydrogen 2.943 N/A HIS 318.A ND1 ASP 314.A OD1 no hydrogen 3.245 N/A HIS 318.A NE2 ASP 271.A O no hydrogen 3.204 N/A ASP 319.A N VAL 315.A O no hydrogen 2.887 N/A ASP 319.A N PHE 316.A O no hydrogen 3.179 N/A SER 320.A N PHE 316.A O no hydrogen 2.916 N/A LEU 321.A N PHE 316.A O no hydrogen 3.358 N/A HIS 322.A N VAL 317.A O no hydrogen 2.740 N/A CYS 323.A SG CYS 324.A O no hydrogen 3.986 N/A ILE 328.A N CYS 324.A O no hydrogen 2.951 N/A ILE 328.A N PRO 325.A O no hydrogen 3.196 N/A HIS 329.A N GLY 326.A O no hydrogen 3.001 N/A