Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6iik_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A SG GLY 5.A O no hydrogen 3.365 N/A CYS 4.A SG SER 67.A O no hydrogen 3.888 N/A GLY 5.A N SER 67.A O no hydrogen 3.213 N/A LEU 6.A N ASP 302.A O no hydrogen 2.948 N/A THR 7.A N ILE 69.A O no hydrogen 2.906 N/A ASN 8.A ND2 ASP 302.A OD2 no hydrogen 2.870 N/A LEU 9.A N THR 12.A OG1 no hydrogen 2.696 N/A GLY 10.A N ASN 8.A OD1 no hydrogen 2.869 N/A ASN 11.A ND2 TYR 94.A O no hydrogen 2.788 N/A THR 12.A N ASN 8.A OD1 no hydrogen 3.088 N/A THR 12.A OG1 ASN 8.A OD1 no hydrogen 3.519 N/A CYS 13.A SG HIS 285.A ND1 no hydrogen 3.261 N/A ASN 16.A N THR 12.A O no hydrogen 3.119 N/A ASN 16.A ND2 THR 7.A O no hydrogen 3.164 N/A ASN 16.A ND2 ASP 302.A OD1 no hydrogen 2.989 N/A ALA 17.A N CYS 13.A O no hydrogen 2.904 N/A THR 18.A N TYR 14.A O no hydrogen 3.127 N/A THR 18.A OG1 TYR 14.A O no hydrogen 2.744 N/A THR 18.A OG1 ALA 99.A O no hydrogen 3.371 N/A VAL 19.A N MET 15.A O no hydrogen 2.897 N/A GLN 20.A N ASN 16.A O no hydrogen 2.972 N/A GLN 20.A NE2 CYS 4.A O no hydrogen 3.028 N/A CYS 21.A N ALA 17.A O no hydrogen 3.079 N/A CYS 21.A SG ALA 17.A O no hydrogen 3.416 N/A ILE 22.A N THR 18.A O no hydrogen 2.952 N/A ARG 23.A N VAL 19.A O no hydrogen 2.942 N/A ARG 23.A NH1 PHE 59.A O no hydrogen 3.513 N/A ARG 23.A NH1 ASP 63.A OD1 no hydrogen 3.354 N/A ARG 23.A NH2 ASP 63.A OD1 no hydrogen 2.877 N/A SER 24.A N GLN 20.A O no hydrogen 3.167 N/A SER 24.A N CYS 21.A O no hydrogen 3.047 N/A SER 24.A OG CYS 21.A O no hydrogen 2.739 N/A VAL 25.A N ILE 22.A O no hydrogen 3.042 N/A GLU 27.A N GLU 27.A OE1 no hydrogen 2.679 N/A LYS 29.A N VAL 25.A O no hydrogen 3.020 N/A LYS 29.A NZ ASP 63.A OD2 no hydrogen 3.501 N/A ASP 30.A N PRO 26.A O no hydrogen 2.911 N/A ALA 31.A N GLU 27.A O no hydrogen 2.988 N/A LEU 32.A N LEU 28.A O no hydrogen 2.913 N/A LYS 33.A N LYS 29.A O no hydrogen 2.970 N/A ARG 34.A N ASP 30.A O no hydrogen 2.965 N/A TYR 35.A N LEU 32.A O no hydrogen 3.035 N/A ALA 46.A N GLY 43.A O no hydrogen 3.243 N/A GLN 49.A NE2 ALA 38.A O no hydrogen 3.084 N/A TYR 50.A N ALA 46.A O no hydrogen 2.884 N/A ILE 51.A N SER 47.A O no hydrogen 2.955 N/A THR 52.A N ALA 48.A O no hydrogen 2.977 N/A THR 52.A OG1 ALA 48.A O no hydrogen 2.691 N/A ALA 53.A N GLN 49.A O no hydrogen 2.865 N/A ALA 54.A N TYR 50.A O no hydrogen 2.891 N/A LEU 55.A N ILE 51.A O no hydrogen 2.891 N/A ARG 56.A N THR 52.A O no hydrogen 2.963 N/A ARG 56.A NE ASP 57.A OD1 no hydrogen 3.028 N/A ARG 56.A NH1 TYR 35.A O no hydrogen 2.893 N/A ARG 56.A NH1 GLY 37.A O no hydrogen 2.751 N/A ARG 56.A NH2 GLY 37.A O no hydrogen 3.324 N/A ARG 56.A NH2 ASP 57.A OD1 no hydrogen 3.236 N/A ASP 57.A N ALA 53.A O no hydrogen 2.917 N/A LEU 58.A N ALA 54.A O no hydrogen 2.897 N/A PHE 59.A N LEU 55.A O no hydrogen 2.932 N/A ASP 60.A N ARG 56.A O no hydrogen 2.913 N/A SER 61.A N ASP 57.A O no hydrogen 2.921 N/A SER 61.A OG ASP 57.A O no hydrogen 3.372 N/A MET 62.A N LEU 58.A O no hydrogen 2.852 N/A ASP 63.A N PHE 59.A O no hydrogen 2.927 N/A LYS 64.A N SER 61.A O no hydrogen 3.071 N/A THR 65.A N MET 62.A O no hydrogen 3.383 N/A SER 66.A OG LEU 2.A O no hydrogen 3.262 N/A SER 67.A N THR 65.A OG1 no hydrogen 3.053 N/A SER 67.A OG THR 65.A OG1 no hydrogen 3.365 N/A ILE 69.A N GLY 5.A O no hydrogen 3.102 N/A ILE 72.A N PRO 70.A O no hydrogen 2.832 N/A LEU 75.A N PRO 71.A O no hydrogen 3.040 N/A GLN 76.A N ILE 72.A O no hydrogen 2.946 N/A PHE 77.A N ILE 73.A O no hydrogen 2.918 N/A LEU 78.A N LEU 74.A O no hydrogen 2.881 N/A HIS 79.A N LEU 75.A O no hydrogen 2.945 N/A MET 80.A N GLN 76.A O no hydrogen 2.889 N/A ALA 81.A N PHE 77.A O no hydrogen 2.888 N/A PHE 82.A N LEU 78.A O no hydrogen 2.869 N/A GLN 84.A N GLN 84.A OE1 no hydrogen 2.700 N/A PHE 85.A N PHE 82.A O no hydrogen 2.927 N/A ALA 86.A N PRO 83.A O no hydrogen 2.908 N/A GLU 87.A N GLN 84.A O no hydrogen 3.283 N/A GLY 89.A N GLN 93.A O no hydrogen 2.822 N/A GLN 91.A N GLN 93.A OE1 no hydrogen 3.174 N/A GLY 92.A N GLY 89.A O no hydrogen 3.088 N/A GLN 93.A N GLN 93.A OE1 no hydrogen 2.663 N/A LEU 95.A N GLU 87.A O no hydrogen 3.442 N/A GLN 96.A NE2 GLY 284.A O no hydrogen 2.733 N/A GLN 97.A N GLN 96.A OE1 no hydrogen 3.078 N/A GLN 97.A NE2 LEU 95.A O no hydrogen 3.336 N/A ALA 99.A N TYR 286.A OH no hydrogen 3.260 N/A ASN 100.A N ASP 98.A OD1 no hydrogen 2.856 N/A ASN 100.A ND2 GLN 154.A OE1 no hydrogen 3.284 N/A CYS 102.A N ASP 98.A O no hydrogen 3.184 N/A TRP 103.A N ALA 99.A O no hydrogen 2.881 N/A ILE 104.A N ASN 100.A O no hydrogen 2.875 N/A GLN 105.A N GLU 101.A O no hydrogen 2.947 N/A MET 106.A N CYS 102.A O no hydrogen 2.967 N/A MET 107.A N TRP 103.A O no hydrogen 2.895 N/A ARG 108.A N ILE 104.A O no hydrogen 2.927 N/A VAL 109.A N GLN 105.A O no hydrogen 3.002 N/A LEU 110.A N MET 106.A O no hydrogen 2.939 N/A GLN 111.A N MET 107.A O no hydrogen 2.810 N/A GLN 111.A NE2 ASP 124.A OD1 no hydrogen 2.875 N/A GLN 111.A NE2 ASP 124.A OD2 no hydrogen 3.366 N/A GLN 112.A N ARG 108.A O no hydrogen 3.021 N/A LYS 113.A N VAL 109.A O no hydrogen 3.033 N/A LYS 113.A N LEU 110.A O no hydrogen 3.140 N/A LEU 114.A N LEU 110.A O no hydrogen 2.855 N/A ILE 117.A N GLN 125.A OE1 no hydrogen 2.769 N/A SER 121.A OG ASP 124.A OD2 no hydrogen 2.996 N/A LEU 122.A N LEU 114.A O no hydrogen 3.146 N/A ASP 124.A N SER 121.A OG no hydrogen 3.226 N/A GLN 125.A N SER 121.A O no hydrogen 3.108 N/A GLN 125.A NE2 ILE 117.A O no hydrogen 3.194 N/A PHE 126.A N LEU 122.A O no hydrogen 2.932 N/A PHE 127.A N ILE 123.A O no hydrogen 2.887 N/A GLY 128.A N ASP 124.A O no hydrogen 3.040 N/A VAL 129.A N GLN 152.A O no hydrogen 2.774 N/A GLU 130.A N ARG 199.A O no hydrogen 3.004 N/A PHE 131.A N GLU 150.A O no hydrogen 2.880 N/A GLU 132.A N LYS 196.A O no hydrogen 2.837 N/A THR 133.A N GLY 148.A O no hydrogen 2.844 N/A THR 134.A N SER 194.A O no hydrogen 2.804 N/A MET 135.A N THR 146.A O no hydrogen 2.867 N/A LYS 136.A N ILE 192.A O no hydrogen 2.981 N/A LYS 136.A NZ GLU 141.A OE1 no hydrogen 2.583 N/A THR 138.A N LEU 190.A O no hydrogen 2.869 N/A THR 138.A OG1 LEU 190.A O no hydrogen 2.724 N/A SER 140.A OG THR 184.A OG1 no hydrogen 3.359 N/A THR 146.A N MET 135.A O no hydrogen 2.979 N/A GLY 148.A N THR 133.A O no hydrogen 2.945 N/A GLU 150.A N PHE 131.A O no hydrogen 2.995 N/A GLN 152.A N VAL 129.A O no hydrogen 2.948 N/A GLN 152.A NE2 GLN 154.A O no hydrogen 2.690 N/A GLN 154.A NE2 ASN 100.A OD1 no hydrogen 2.796 N/A LEU 155.A N THR 205.A O no hydrogen 2.779 N/A CYS 157.A N GLN 207.A O no hydrogen 2.723 N/A CYS 157.A SG LEU 166.A O no hydrogen 3.610 N/A PHE 158.A N GLY 169.A O no hydrogen 3.276 N/A GLU 162.A N ASN 160.A OD1 no hydrogen 2.506 N/A LEU 166.A N LYS 221.A O no hydrogen 2.842 N/A GLY 169.A N TYR 165.A O no hydrogen 3.456 N/A LEU 170.A N LEU 166.A O no hydrogen 2.942 N/A LYS 171.A N PHE 167.A O no hydrogen 2.950 N/A LEU 172.A N THR 168.A O no hydrogen 2.915 N/A ARG 173.A N GLY 169.A O no hydrogen 2.975 N/A ARG 173.A NH2 GLN 152.A OE1 no hydrogen 3.202 N/A LEU 174.A N LEU 170.A O no hydrogen 3.098 N/A LEU 174.A N LYS 171.A O no hydrogen 3.005 N/A GLN 175.A N LEU 172.A O no hydrogen 3.265 N/A GLU 176.A N LYS 193.A O no hydrogen 2.887 N/A ILE 178.A N TYR 191.A O no hydrogen 2.919 N/A LYS 180.A N ALA 189.A O no hydrogen 2.984 N/A SER 182.A N ARG 187.A O no hydrogen 2.896 N/A SER 182.A OG GLU 143.A OE1 no hydrogen 2.803 N/A THR 184.A OG1 SER 140.A OG no hydrogen 3.359 N/A THR 184.A OG1 GLU 143.A OE1 no hydrogen 2.572 N/A THR 184.A OG1 SER 182.A OG no hydrogen 3.175 N/A LEU 185.A N SER 182.A OG no hydrogen 2.922 N/A GLN 186.A N SER 182.A O no hydrogen 2.765 N/A GLN 186.A NE2 PRO 183.A O no hydrogen 2.383 N/A ARG 187.A NH1 GLU 139.A OE1 no hydrogen 2.840 N/A ARG 187.A NH1 ASN 188.A O no hydrogen 2.927 N/A ARG 187.A NH2 GLU 139.A OE1 no hydrogen 2.806 N/A ALA 189.A N LYS 180.A O no hydrogen 2.900 N/A LEU 190.A N GLU 139.A OE2 no hydrogen 2.982 N/A TYR 191.A N ILE 178.A O no hydrogen 2.865 N/A TYR 191.A OH GLU 143.A OE2 no hydrogen 2.368 N/A ILE 192.A N LYS 136.A O no hydrogen 2.852 N/A LYS 193.A N GLU 176.A O no hydrogen 2.892 N/A LYS 193.A NZ GLU 150.A OE2 no hydrogen 2.328 N/A SER 194.A N THR 134.A O no hydrogen 2.793 N/A SER 194.A OG GLN 175.A OE1 no hydrogen 2.679 N/A SER 195.A N LEU 174.A O no hydrogen 2.952 N/A LYS 196.A N GLU 132.A O no hydrogen 2.920 N/A ILE 197.A N LEU 231.A O no hydrogen 2.852 N/A SER 198.A N GLU 130.A O no hydrogen 2.613 N/A SER 198.A OG GLU 130.A O no hydrogen 3.103 N/A ARG 199.A N GLU 130.A O no hydrogen 3.089 N/A ARG 199.A NE ASP 259.A OD2 no hydrogen 2.908 N/A ARG 199.A NH1 GLN 125.A O no hydrogen 2.975 N/A ARG 199.A NH1 GLY 128.A O no hydrogen 2.757 N/A ARG 199.A NH2 GLN 125.A O no hydrogen 2.797 N/A ARG 199.A NH2 ASP 259.A OD1 no hydrogen 3.075 N/A ALA 202.A N GLY 261.A O no hydrogen 2.780 N/A TYR 203.A N PHE 126.A O no hydrogen 3.002 N/A TYR 203.A OH GLU 27.A OE1 no hydrogen 2.768 N/A LEU 204.A N TYR 330.A O no hydrogen 2.889 N/A ILE 206.A N LEU 328.A O no hydrogen 2.893 N/A GLN 207.A N LEU 155.A O no hydrogen 2.734 N/A GLN 207.A NE2 TYR 326.A OH no hydrogen 3.128 N/A MET 208.A N TYR 326.A O no hydrogen 2.786 N/A VAL 209.A N CYS 157.A O no hydrogen 2.928 N/A ARG 210.A NH1 VAL 216.A O no hydrogen 2.882 N/A ARG 210.A NH1 LYS 218.A O no hydrogen 2.709 N/A ARG 210.A NH2 LYS 218.A O no hydrogen 2.774 N/A LYS 215.A NZ HIS 276.A ND1 no hydrogen 3.116 N/A LYS 215.A NZ HIS 276.A O no hydrogen 3.131 N/A LYS 215.A NZ GLY 278.A O no hydrogen 3.120 N/A LYS 218.A NZ VAL 163.A O no hydrogen 2.957 N/A LYS 218.A NZ ASP 219.A O no hydrogen 3.289 N/A VAL 220.A N SER 317.A O no hydrogen 2.925 N/A LYS 221.A N LYS 164.A O no hydrogen 3.050 N/A LYS 221.A NZ ASP 219.A OD2 no hydrogen 2.898 N/A LEU 226.A N TYR 268.A O no hydrogen 2.902 N/A MET 228.A N GLY 266.A O no hydrogen 2.921 N/A TYR 229.A N ASP 227.A OD1 no hydrogen 3.144 N/A LEU 231.A N MET 228.A O no hydrogen 2.979 N/A CYS 232.A N TYR 229.A O no hydrogen 3.232 N/A CYS 232.A SG MET 228.A O no hydrogen 3.489 N/A THR 233.A N ILE 197.A O no hydrogen 2.931 N/A LEU 236.A N THR 233.A OG1 no hydrogen 3.049 N/A GLN 237.A N THR 233.A O no hydrogen 2.836 N/A GLN 237.A NE2 TYR 229.A O no hydrogen 2.812 N/A GLU 238.A N PRO 234.A O no hydrogen 2.843 N/A LYS 239.A N GLU 235.A O no hydrogen 3.023 N/A LYS 239.A NZ ASP 258.A OD1 no hydrogen 3.064 N/A MET 240.A N LEU 236.A O no hydrogen 2.940 N/A VAL 241.A N GLU 238.A O no hydrogen 3.215 N/A PHE 243.A N MET 240.A O no hydrogen 3.062 N/A ARG 244.A N MET 240.A O no hydrogen 2.993 N/A ARG 244.A NH1 ASP 227.A OD1 no hydrogen 2.918 N/A ARG 244.A NH1 CYS 265.A O no hydrogen 2.789 N/A ARG 244.A NH2 ASP 227.A OD1 no hydrogen 3.455 N/A ARG 244.A NH2 ASP 227.A OD2 no hydrogen 2.920 N/A SER 245.A N VAL 241.A O no hydrogen 2.963 N/A SER 245.A OG VAL 241.A O no hydrogen 3.216 N/A LYS 246.A N PHE 243.A O no hydrogen 3.209 N/A LYS 246.A NZ GLU 252.A OE2 no hydrogen 3.328 N/A LYS 248.A N ARG 244.A O no hydrogen 2.995 N/A ASP 249.A N SER 245.A O no hydrogen 2.938 N/A LEU 250.A N LYS 246.A O no hydrogen 3.293 N/A SER 255.A OG SER 262.A O no hydrogen 2.711 N/A PHE 256.A N SER 262.A OG no hydrogen 2.834 N/A ASP 259.A N PHE 256.A O no hydrogen 3.232 N/A SER 262.A N ASP 259.A O no hydrogen 3.090 N/A SER 262.A OG ASP 259.A O no hydrogen 2.671 N/A ASN 263.A N LEU 200.A O no hydrogen 2.866 N/A ASN 263.A ND2 TYR 267.A O no hydrogen 2.841 N/A ASN 264.A N PHE 254.A O no hydrogen 2.870 N/A ASN 264.A ND2 PRO 253.A O no hydrogen 3.363 N/A ASN 264.A ND2 SER 255.A O no hydrogen 3.575 N/A CYS 265.A N ASN 263.A OD1 no hydrogen 2.916 N/A CYS 265.A SG ASN 263.A OD1 no hydrogen 3.430 N/A CYS 265.A SG TYR 267.A O no hydrogen 4.028 N/A GLY 266.A N ASN 263.A OD1 no hydrogen 3.045 N/A TYR 268.A N LEU 226.A O no hydrogen 2.870 N/A TYR 268.A OH PRO 201.A O no hydrogen 2.607 N/A ASP 269.A N GLY 331.A O no hydrogen 2.876 N/A LEU 270.A N LEU 224.A O no hydrogen 2.747 N/A GLN 271.A N LEU 329.A O no hydrogen 2.754 N/A GLN 271.A NE2 SER 24.A O no hydrogen 3.095 N/A GLN 271.A NE2 SER 24.A OG no hydrogen 3.069 N/A ALA 272.A N LEU 329.A O no hydrogen 3.074 N/A VAL 273.A N TRP 289.A O no hydrogen 2.878 N/A LEU 274.A N VAL 327.A O no hydrogen 2.861 N/A THR 275.A N VAL 287.A O no hydrogen 2.902 N/A THR 275.A OG1 VAL 287.A O no hydrogen 3.348 N/A HIS 276.A N ILE 324.A O no hydrogen 2.889 N/A HIS 276.A NE2 SER 283.A O no hydrogen 2.782 N/A GLN 277.A N HIS 285.A O no hydrogen 2.883 N/A GLN 277.A NE2 ASP 321.A O no hydrogen 3.063 N/A ARG 279.A NE ASP 321.A OD1 no hydrogen 3.450 N/A ARG 279.A NE ASP 321.A OD2 no hydrogen 3.010 N/A ARG 279.A NH2 ASP 321.A OD2 no hydrogen 2.918 N/A SER 281.A OG ASN 213.A O no hydrogen 2.713 N/A SER 282.A N SER 280.A OG no hydrogen 3.008 N/A SER 282.A OG SER 280.A OG no hydrogen 3.374 N/A HIS 285.A N GLN 277.A O no hydrogen 3.094 N/A HIS 285.A NE2 ASP 301.A OD1 no hydrogen 2.509 N/A TYR 286.A OH GLN 97.A O no hydrogen 2.815 N/A VAL 287.A N THR 275.A O no hydrogen 3.109 N/A SER 288.A N PHE 300.A O no hydrogen 3.060 N/A SER 288.A OG PHE 300.A O no hydrogen 3.481 N/A TRP 289.A N VAL 273.A O no hydrogen 2.845 N/A TRP 289.A NE1 THR 275.A OG1 no hydrogen 2.965 N/A VAL 290.A N ILE 298.A O no hydrogen 2.864 N/A LYS 291.A N GLN 271.A O no hydrogen 2.944 N/A ARG 292.A N GLU 296.A O no hydrogen 2.828 N/A ARG 292.A NE GLU 296.A OE2 no hydrogen 2.665 N/A ARG 292.A NH1 GLU 1.A O no hydrogen 3.447 N/A ARG 292.A NH2 GLU 296.A OE2 no hydrogen 2.584 N/A LYS 293.A N GLU 296.A O no hydrogen 3.051 N/A LYS 293.A NZ ARG 292.A O no hydrogen 2.388 N/A GLU 296.A N LYS 293.A O no hydrogen 2.946 N/A TRP 297.A N VAL 308.A O no hydrogen 2.961 N/A ILE 298.A N VAL 290.A O no hydrogen 2.827 N/A LYS 299.A N SER 306.A O no hydrogen 2.830 N/A PHE 300.A N SER 288.A O no hydrogen 2.780 N/A ASP 301.A N LYS 304.A O no hydrogen 2.917 N/A LYS 304.A N ASP 301.A O no hydrogen 2.869 N/A SER 306.A N LYS 299.A O no hydrogen 2.952 N/A VAL 308.A N TRP 297.A O no hydrogen 2.865 N/A THR 309.A N ASP 312.A OD2 no hydrogen 2.904 N/A THR 309.A OG1 GLU 311.A OE1 no hydrogen 3.236 N/A THR 309.A OG1 ASP 312.A OD2 no hydrogen 3.067 N/A ASP 312.A N THR 309.A OG1 no hydrogen 3.419 N/A ILE 313.A N THR 309.A O no hydrogen 3.189 N/A LEU 314.A N PRO 310.A O no hydrogen 2.932 N/A ARG 315.A N GLU 311.A O no hydrogen 3.053 N/A LEU 316.A N ILE 313.A O no hydrogen 2.921 N/A SER 317.A OG ASP 219.A OD1 no hydrogen 2.467 N/A SER 317.A OG LEU 314.A O no hydrogen 3.364 N/A GLY 319.A N LEU 217.A O no hydrogen 2.639 N/A ILE 324.A N HIS 276.A O no hydrogen 2.939 N/A ALA 325.A N LEU 316.A O no hydrogen 2.799 N/A TYR 326.A N LEU 274.A O no hydrogen 2.851 N/A TYR 326.A OH ASP 98.A OD1 no hydrogen 2.636 N/A TYR 326.A OH ASP 98.A OD2 no hydrogen 3.370 N/A VAL 327.A N LEU 274.A O no hydrogen 2.989 N/A LEU 328.A N ILE 206.A O no hydrogen 2.881 N/A LEU 329.A N ALA 272.A O no hydrogen 2.828 N/A TYR 330.A N LEU 204.A O no hydrogen 2.949 N/A TYR 330.A OH PRO 223.A O no hydrogen 2.708 N/A GLY 331.A N ASP 269.A O no hydrogen 2.905 N/A ARG 334.A NH2 GLU 252.A O no hydrogen 2.629 N/A