Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kr8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A N ASN 8.A O no hydrogen 3.391 N/A ASN 5.A ND2 ASN 5.A O no hydrogen 2.662 N/A LYS 9.A NZ ASP 11.A OD1 no hydrogen 2.542 N/A ASP 11.A N LYS 41.A O no hydrogen 3.024 N/A TYR 13.A N GLY 39.A O no hydrogen 3.069 N/A GLY 14.A N PHE 340.A O no hydrogen 3.029 N/A LYS 15.A N GLN 37.A O no hydrogen 2.865 N/A LYS 15.A NZ TYR 35.A OH no hydrogen 3.372 N/A ALA 16.A N TYR 338.A O no hydrogen 2.942 N/A VAL 17.A N TYR 35.A O no hydrogen 2.802 N/A GLY 18.A N ILE 336.A O no hydrogen 2.983 N/A ARG 19.A NE GLN 33.A O no hydrogen 3.380 N/A VAL 21.A N ALA 31.A O no hydrogen 2.643 N/A TRP 22.A N ALA 332.A O no hydrogen 3.057 N/A THR 24.A N ASP 330.A O no hydrogen 2.915 N/A THR 24.A OG1 TYR 311.A OH no hydrogen 3.359 N/A THR 25.A N ASP 330.A O no hydrogen 3.438 N/A ALA 31.A N VAL 21.A O no hydrogen 2.696 N/A GLN 33.A N ARG 19.A O no hydrogen 2.738 N/A THR 34.A OG1 ASP 32.A OD1 no hydrogen 2.451 N/A THR 34.A OG1 ASP 32.A OD2 no hydrogen 3.190 N/A TYR 35.A N VAL 17.A O no hydrogen 2.943 N/A ALA 36.A N THR 60.A O no hydrogen 3.091 N/A GLN 37.A N LYS 15.A O no hydrogen 2.863 N/A ILE 38.A N TYR 58.A O no hydrogen 2.800 N/A PHE 40.A N TRP 56.A O no hydrogen 2.899 N/A LYS 41.A N ASP 11.A O no hydrogen 2.903 N/A GLY 42.A N GLY 54.A O no hydrogen 2.898 N/A GLU 43.A N LYS 9.A O no hydrogen 3.228 N/A THR 44.A N GLY 52.A O no hydrogen 2.796 N/A GLN 45.A NE2 ASN 47.A O no hydrogen 3.125 N/A GLN 45.A NE2 THR 48.A O no hydrogen 3.628 N/A ILE 46.A N THR 44.A O no hydrogen 3.137 N/A ASN 47.A N LEU 50.A O no hydrogen 3.242 N/A THR 51.A N LYS 83.A O no hydrogen 3.044 N/A PHE 53.A N GLY 81.A O no hydrogen 3.213 N/A GLY 54.A N GLY 42.A O no hydrogen 3.020 N/A GLN 55.A N PHE 79.A O no hydrogen 2.843 N/A TRP 56.A N PHE 40.A O no hydrogen 3.421 N/A GLU 57.A N LEU 77.A O no hydrogen 2.714 N/A TYR 58.A N ILE 38.A O no hydrogen 2.876 N/A ARG 59.A N LEU 74.A O no hydrogen 2.942 N/A ARG 59.A NH2 TYR 35.A OH no hydrogen 2.939 N/A THR 60.A N ALA 36.A O no hydrogen 3.256 N/A LYS 61.A N SER 72.A O no hydrogen 3.095 N/A LYS 61.A NZ ASN 71.A O no hydrogen 3.395 N/A GLU 68.A N ALA 65.A O no hydrogen 3.256 N/A LEU 74.A N ARG 59.A O no hydrogen 3.121 N/A LEU 74.A N SER 72.A O no hydrogen 2.970 N/A ARG 76.A N GLU 57.A O no hydrogen 2.701 N/A ARG 76.A NH2 GLU 57.A OE2 no hydrogen 3.368 N/A LEU 77.A N GLU 57.A O no hydrogen 2.910 N/A ALA 78.A N ARG 94.A O no hydrogen 2.978 N/A PHE 79.A N GLN 55.A O no hydrogen 2.862 N/A ALA 80.A N TYR 92.A O no hydrogen 3.409 N/A LEU 82.A N ILE 90.A O no hydrogen 2.795 N/A LYS 83.A N THR 51.A O no hydrogen 3.213 N/A TYR 84.A N GLY 88.A O no hydrogen 2.764 N/A ALA 85.A N ASP 49.A O no hydrogen 2.982 N/A SER 89.A N ARG 137.A O no hydrogen 3.152 N/A SER 89.A OG SER 89.A O no hydrogen 2.461 N/A SER 89.A OG ARG 137.A O no hydrogen 3.474 N/A ASP 91.A N THR 135.A O no hydrogen 2.922 N/A GLY 93.A N LEU 133.A O no hydrogen 2.904 N/A ARG 94.A N ALA 78.A O no hydrogen 2.661 N/A ARG 94.A NH1 ARG 76.A O no hydrogen 3.178 N/A ARG 94.A NH2 ASP 123.A OD2 no hydrogen 2.774 N/A TYR 96.A N ASN 95.A OD1 no hydrogen 3.029 N/A GLY 97.A N SER 128.A O no hydrogen 2.866 N/A TYR 100.A N GLY 97.A O no hydrogen 3.218 N/A TYR 100.A OH ASP 107.A OD2 no hydrogen 2.868 N/A ASP 101.A N ILE 98.A O no hydrogen 3.053 N/A SER 104.A N TYR 100.A O no hydrogen 3.060 N/A SER 104.A N ASP 101.A O no hydrogen 3.330 N/A SER 104.A OG ASP 101.A O no hydrogen 2.805 N/A THR 106.A OG1 GLU 255.A O no hydrogen 3.082 N/A ASP 107.A N GLU 103.A O no hydrogen 2.954 N/A ALA 109.A N SER 113.A OG no hydrogen 2.716 N/A TYR 111.A N ASP 310.A OD2 no hydrogen 3.387 N/A SER 113.A OG ASP 107.A OD1 no hydrogen 2.555 N/A TYR 121.A OH SER 324.A OG no hydrogen 3.021 N/A TYR 125.A N ASP 123.A O no hydrogen 2.752 N/A THR 127.A N ASN 124.A O no hydrogen 3.168 N/A THR 127.A OG1 TRP 117.A O no hydrogen 2.931 N/A THR 127.A OG1 ASN 124.A O no hydrogen 2.991 N/A SER 128.A OG THR 122.A O no hydrogen 3.393 N/A ARG 129.A N THR 122.A O no hydrogen 3.187 N/A ALA 130.A N ASN 95.A O no hydrogen 2.959 N/A LEU 133.A N GLY 93.A O no hydrogen 2.688 N/A LEU 134.A N TYR 154.A O no hydrogen 2.701 N/A THR 135.A N ASP 91.A O no hydrogen 2.756 N/A TYR 136.A OH VAL 87.A O no hydrogen 2.536 N/A ARG 137.A N SER 89.A O no hydrogen 3.270 N/A ARG 137.A NH1 ASP 101.A OD2 no hydrogen 3.253 N/A ARG 137.A NH2 ASP 101.A OD1 no hydrogen 2.517 N/A ASN 138.A N PHE 150.A O no hydrogen 2.716 N/A SER 139.A OG ASP 140.A OD1 no hydrogen 3.481 N/A PHE 142.A N ASN 138.A OD1 no hydrogen 2.604 N/A LEU 144.A N ASP 140.A O no hydrogen 2.912 N/A LEU 144.A N PHE 141.A O no hydrogen 3.101 N/A VAL 145.A N ASP 140.A O no hydrogen 2.794 N/A LEU 148.A N VAL 145.A O no hydrogen 2.750 N/A SER 149.A N ALA 177.A O no hydrogen 2.647 N/A SER 149.A OG ALA 177.A O no hydrogen 3.477 N/A PHE 150.A N ASN 138.A O no hydrogen 2.660 N/A GLY 151.A N THR 175.A O no hydrogen 3.355 N/A GLN 153.A N GLY 173.A O no hydrogen 2.778 N/A GLN 153.A NE2 TYR 96.A O no hydrogen 3.471 N/A GLN 153.A NE2 THR 135.A OG1 no hydrogen 2.972 N/A GLN 155.A N GLY 171.A O no hydrogen 3.067 N/A ASN 158.A N ASN 168.A O no hydrogen 2.372 N/A ASN 158.A ND2 GLY 156.A O no hydrogen 3.067 N/A GLN 159.A NE2 GLN 167.A OE1 no hydrogen 3.314 N/A SER 166.A N SER 163.A O no hydrogen 3.321 N/A GLN 167.A NE2 ASP 197.A OD2 no hydrogen 3.265 N/A ASN 168.A N ASN 158.A O no hydrogen 2.832 N/A ASN 168.A ND2 ASP 123.A O no hydrogen 3.070 N/A GLY 171.A N GLN 155.A O no hydrogen 3.089 N/A VAL 172.A N ASN 191.A O no hydrogen 2.791 N/A GLY 173.A N GLN 153.A O no hydrogen 3.163 N/A TYR 174.A N TYR 189.A O no hydrogen 2.639 N/A THR 175.A N GLY 151.A O no hydrogen 2.949 N/A THR 175.A OG1 ASP 101.A OD2 no hydrogen 2.952 N/A ALA 177.A N SER 149.A O no hydrogen 2.533 N/A TYR 178.A N VAL 185.A O no hydrogen 3.239 N/A GLU 179.A N GLY 147.A O no hydrogen 3.182 N/A PHE 180.A N PHE 183.A O no hydrogen 2.785 N/A GLY 184.A N LYS 216.A O no hydrogen 2.775 N/A VAL 185.A N TYR 178.A O no hydrogen 2.868 N/A THR 186.A N GLY 214.A O no hydrogen 2.865 N/A ALA 187.A N MET 176.A O no hydrogen 3.232 N/A ALA 188.A N ALA 212.A O no hydrogen 2.903 N/A TYR 189.A N TYR 174.A O no hydrogen 2.771 N/A SER 190.A N SER 210.A O no hydrogen 2.755 N/A SER 190.A OG SER 210.A O no hydrogen 2.894 N/A ASN 191.A N VAL 172.A O no hydrogen 3.055 N/A SER 192.A N ALA 208.A O no hydrogen 2.918 N/A SER 192.A OG GLY 169.A O no hydrogen 2.589 N/A LYS 193.A N ASP 170.A O no hydrogen 3.094 N/A ARG 194.A NH1 GLY 205.A O no hydrogen 2.748 N/A ARG 194.A NH2 ARG 201.A O no hydrogen 2.781 N/A GLN 198.A N THR 195.A O no hydrogen 2.659 N/A GLN 199.A N ASN 196.A O no hydrogen 3.148 N/A GLY 203.A N ARG 201.A O no hydrogen 2.723 N/A ASN 204.A N ASN 249.A OD1 no hydrogen 2.764 N/A ARG 207.A NE ASP 206.A OD1 no hydrogen 3.371 N/A ARG 207.A NH1 ASP 206.A OD1 no hydrogen 3.170 N/A SER 210.A N SER 190.A O no hydrogen 2.806 N/A SER 210.A OG GLU 209.A O no hydrogen 2.814 N/A SER 210.A OG GLU 230.A O no hydrogen 3.109 N/A ARG 211.A N GLU 230.A O no hydrogen 3.468 N/A ALA 212.A N ALA 188.A O no hydrogen 2.884 N/A VAL 213.A N TYR 228.A O no hydrogen 3.031 N/A GLY 214.A N THR 186.A O no hydrogen 2.806 N/A ALA 215.A N ALA 226.A O no hydrogen 2.629 N/A LYS 216.A N GLY 184.A O no hydrogen 2.825 N/A TYR 217.A N LEU 224.A O no hydrogen 3.043 N/A ALA 219.A N VAL 222.A O no hydrogen 3.414 N/A VAL 222.A N ALA 219.A O no hydrogen 2.574 N/A TYR 223.A N GLN 259.A O no hydrogen 2.901 N/A ALA 225.A N VAL 257.A O no hydrogen 2.647 N/A ALA 226.A N ALA 215.A O no hydrogen 2.695 N/A VAL 227.A N GLU 255.A O no hydrogen 3.128 N/A TYR 228.A N VAL 213.A O no hydrogen 2.868 N/A ALA 229.A N ASN 253.A O no hydrogen 2.415 N/A GLU 230.A N ARG 211.A O no hydrogen 3.367 N/A THR 231.A N THR 251.A O no hydrogen 3.106 N/A THR 231.A OG1 SER 235.A OG no hydrogen 3.373 N/A ARG 232.A N GLU 209.A O no hydrogen 2.775 N/A ARG 232.A N SER 210.A OG no hydrogen 3.118 N/A ASN 233.A ND2 ARG 207.A O no hydrogen 2.927 N/A SER 235.A N ASN 233.A O no hydrogen 2.996 N/A SER 235.A OG THR 231.A OG1 no hydrogen 3.373 N/A SER 235.A OG THR 251.A OG1 no hydrogen 3.409 N/A SER 235.A OG TYR 325.A OH no hydrogen 3.148 N/A VAL 237.A N GLU 246.A O no hydrogen 3.096 N/A ASN 239.A N THR 244.A O no hydrogen 2.691 N/A THR 240.A N ASP 320.A O no hydrogen 3.225 N/A THR 242.A OG1 ASN 239.A OD1 no hydrogen 2.963 N/A THR 244.A N ASN 239.A O no hydrogen 2.939 N/A GLU 246.A N VAL 237.A O no hydrogen 3.102 N/A ALA 248.A N SER 235.A O no hydrogen 2.656 N/A THR 251.A N THR 231.A O no hydrogen 3.121 N/A THR 251.A OG1 SER 235.A OG no hydrogen 3.409 N/A LEU 254.A N GLN 274.A O no hydrogen 2.984 N/A GLU 255.A N VAL 227.A O no hydrogen 3.048 N/A VAL 256.A N TYR 272.A O no hydrogen 2.723 N/A VAL 257.A N ALA 225.A O no hydrogen 2.678 N/A ALA 258.A N ILE 270.A O no hydrogen 2.901 N/A GLN 259.A N TYR 223.A O no hydrogen 2.669 N/A TYR 260.A N PRO 268.A O no hydrogen 3.166 N/A GLN 261.A N ASN 221.A O no hydrogen 3.082 N/A PHE 262.A N LEU 266.A O no hydrogen 3.011 N/A GLY 265.A N PHE 262.A O no hydrogen 2.521 N/A ARG 267.A N THR 298.A O no hydrogen 2.664 N/A ARG 267.A NH1 GLN 261.A OE1 no hydrogen 2.458 N/A ALA 269.A N GLY 296.A O no hydrogen 2.906 N/A ILE 270.A N ALA 258.A O no hydrogen 2.814 N/A SER 271.A N GLN 294.A O no hydrogen 3.114 N/A SER 271.A OG GLN 294.A OE1 no hydrogen 2.381 N/A TYR 272.A N VAL 256.A O no hydrogen 2.694 N/A VAL 273.A N TYR 292.A O no hydrogen 2.951 N/A GLN 274.A N LEU 254.A O no hydrogen 2.955 N/A SER 275.A N ALA 290.A O no hydrogen 2.553 N/A GLY 277.A N ALA 287.A O no hydrogen 2.883 N/A LYS 278.A N LYS 250.A O no hydrogen 2.712 N/A LEU 280.A N GLY 285.A O no hydrogen 2.474 N/A SER 286.A OG GLY 277.A O no hydrogen 2.938 N/A ALA 287.A N GLY 277.A O no hydrogen 2.941 N/A LEU 289.A N SER 275.A O no hydrogen 2.471 N/A ALA 290.A N SER 275.A O no hydrogen 3.304 N/A TYR 292.A OH PHE 112.A O no hydrogen 2.694 N/A ILE 293.A N PHE 313.A O no hydrogen 2.783 N/A GLN 294.A N SER 271.A O no hydrogen 3.288 N/A GLN 294.A NE2 ALA 295.A O no hydrogen 2.844 N/A ALA 295.A N TYR 311.A O no hydrogen 3.142 N/A ALA 297.A N VAL 309.A O no hydrogen 3.038 N/A THR 298.A N ARG 267.A O no hydrogen 2.762 N/A TYR 299.A N VAL 307.A O no hydrogen 3.332 N/A PHE 301.A N MET 305.A O no hydrogen 2.956 N/A ASN 302.A N MET 305.A O no hydrogen 3.287 N/A ASN 304.A N ASN 302.A OD1 no hydrogen 3.455 N/A ASN 304.A ND2 ASN 302.A OD1 no hydrogen 3.245 N/A ASN 306.A N THR 337.A O no hydrogen 3.202 N/A VAL 309.A N ALA 297.A O no hydrogen 3.335 N/A ASP 310.A N ALA 333.A O no hydrogen 2.899 N/A TYR 311.A OH THR 24.A OG1 no hydrogen 3.359 N/A TYR 311.A OH ASP 330.A OD1 no hydrogen 3.173 N/A ARG 312.A N GLN 331.A O no hydrogen 3.077 N/A ARG 312.A NE GLN 331.A OE1 no hydrogen 3.060 N/A ARG 312.A NH1 GLU 115.A OE1 no hydrogen 2.546 N/A ARG 312.A NH2 GLU 115.A OE1 no hydrogen 3.166 N/A ARG 312.A NH2 GLU 115.A OE2 no hydrogen 2.764 N/A PHE 313.A N ILE 293.A O no hydrogen 2.767 N/A ASN 314.A N ASP 330.A OD2 no hydrogen 2.794 N/A TYR 321.A OH GLU 246.A OE1 no hydrogen 3.004 N/A TYR 321.A OH GLU 246.A OE2 no hydrogen 2.673 N/A SER 322.A N ASN 319.A O no hydrogen 3.134 N/A SER 322.A OG ASP 288.A O no hydrogen 3.388 N/A SER 323.A OG ASP 320.A O no hydrogen 3.387 N/A SER 324.A N TYR 321.A O no hydrogen 3.016 N/A SER 324.A OG TYR 121.A OH no hydrogen 3.021 N/A SER 324.A OG ILE 236.A O no hydrogen 3.016 N/A VAL 326.A N SER 324.A O no hydrogen 2.958 N/A ASP 330.A N THR 25.A OG1 no hydrogen 3.202 N/A ALA 332.A N TRP 22.A O no hydrogen 3.157 N/A ALA 333.A N ASP 310.A O no hydrogen 2.637 N/A GLY 335.A N TRP 308.A O no hydrogen 3.235 N/A ILE 336.A N GLY 18.A O no hydrogen 3.053 N/A THR 337.A N ASN 306.A O no hydrogen 2.925 N/A TYR 338.A N ALA 16.A O no hydrogen 3.142 N/A PHE 340.A N GLY 14.A O no hydrogen 2.879 N/A