Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k9d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N ASP 28.A O no hydrogen 2.744 N/A GLY 6.A N TYR 97.A O no hydrogen 2.750 N/A ILE 7.A N ALA 31.A O no hydrogen 2.817 N/A ASN 8.A N VAL 99.A O no hydrogen 2.757 N/A ASN 8.A ND2 GLU 100.A OE1 no hydrogen 2.759 N/A GLY 9.A N ASN 33.A O no hydrogen 2.842 N/A PHE 10.A N ASP 34.A OD2 no hydrogen 2.817 N/A ARG 12.A NE GLU 321.A OE2 no hydrogen 2.930 N/A ARG 12.A NH1 ASP 49.A OD2 no hydrogen 2.638 N/A ARG 12.A NH2 ASP 49.A OD1 no hydrogen 3.013 N/A ARG 12.A NH2 ASP 49.A OD2 no hydrogen 3.314 N/A ARG 12.A NH2 GLU 321.A OE1 no hydrogen 2.830 N/A ARG 12.A NH2 GLU 321.A OE2 no hydrogen 3.509 N/A ARG 15.A N GLY 11.A O no hydrogen 2.825 N/A ARG 15.A NH1 PHE 10.A O no hydrogen 2.814 N/A LEU 16.A N ARG 12.A O no hydrogen 3.244 N/A VAL 17.A N ILE 13.A O no hydrogen 2.777 N/A LEU 18.A N GLY 14.A O no hydrogen 3.313 N/A ARG 19.A N ARG 15.A O no hydrogen 2.987 N/A ARG 19.A NH1 HIS 52.A O no hydrogen 3.380 N/A ARG 19.A NH1 GLY 53.A O no hydrogen 2.989 N/A ARG 19.A NH2 PHE 46.A O no hydrogen 3.090 N/A ARG 19.A NH2 GLY 53.A O no hydrogen 2.882 N/A ALA 20.A N LEU 16.A O no hydrogen 2.787 N/A ALA 21.A N VAL 17.A O no hydrogen 2.801 N/A VAL 22.A N LEU 18.A O no hydrogen 2.974 N/A GLU 23.A N ARG 19.A O no hydrogen 3.102 N/A LYS 24.A N ALA 20.A O no hydrogen 2.866 N/A LYS 24.A NZ ASP 330.A OD1 no hydrogen 2.928 N/A ASP 25.A N ALA 21.A O no hydrogen 2.834 N/A ASP 28.A N PRO 3.A O no hydrogen 2.751 N/A VAL 30.A N VAL 5.A O no hydrogen 2.830 N/A ALA 31.A N VAL 5.A O no hydrogen 3.367 N/A VAL 32.A N SER 78.A O no hydrogen 2.866 N/A ASN 33.A N ILE 7.A O no hydrogen 2.808 N/A ASN 33.A ND2 ASN 8.A OD1 no hydrogen 2.798 N/A ASN 33.A ND2 SER 82.A O no hydrogen 2.813 N/A ASP 34.A N HIS 80.A O no hydrogen 3.037 N/A PHE 36.A N ASP 34.A OD1 no hydrogen 2.962 N/A ILE 37.A N ASP 34.A O no hydrogen 3.434 N/A TYR 41.A N ASN 38.A OD1 no hydrogen 2.974 N/A MET 42.A N ASN 38.A O no hydrogen 2.799 N/A VAL 43.A N ILE 39.A O no hydrogen 3.051 N/A TYR 44.A N ASP 40.A O no hydrogen 3.218 N/A MET 45.A N TYR 41.A O no hydrogen 2.887 N/A PHE 46.A N MET 42.A O no hydrogen 2.942 N/A LYS 47.A N VAL 43.A O no hydrogen 2.849 N/A TYR 48.A N TYR 44.A O no hydrogen 3.001 N/A THR 51.A N ASP 49.A OD1 no hydrogen 3.000 N/A HIS 52.A N ASP 49.A OD1 no hydrogen 2.795 N/A HIS 52.A NE2 GLU 321.A OE1 no hydrogen 2.822 N/A GLY 53.A N ASP 49.A O no hydrogen 2.992 N/A PHE 55.A N LYS 47.A O no hydrogen 2.838 N/A SER 58.A N THR 69.A O no hydrogen 2.827 N/A SER 60.A N ILE 67.A O no hydrogen 2.961 N/A GLU 62.A N LYS 65.A O no hydrogen 2.938 N/A LYS 65.A N GLU 62.A O no hydrogen 2.976 N/A LEU 66.A N ILE 77.A O no hydrogen 2.733 N/A ILE 67.A N SER 60.A O no hydrogen 2.745 N/A VAL 68.A N HIS 75.A O no hydrogen 2.974 N/A THR 69.A N SER 58.A O no hydrogen 2.961 N/A THR 69.A OG1 THR 73.A O no hydrogen 2.787 N/A THR 69.A OG1 THR 74.A OG1 no hydrogen 3.216 N/A ASN 70.A N THR 73.A O no hydrogen 3.315 N/A GLY 71.A N THR 69.A OG1 no hydrogen 3.072 N/A THR 73.A N ASN 70.A OD1 no hydrogen 2.950 N/A THR 73.A OG1 ASP 25.A OD1 no hydrogen 3.240 N/A THR 74.A OG1 THR 69.A OG1 no hydrogen 3.216 N/A HIS 75.A N VAL 68.A O no hydrogen 2.685 N/A ILE 77.A N LEU 66.A O no hydrogen 2.803 N/A SER 78.A N VAL 30.A O no hydrogen 2.745 N/A SER 78.A OG ASP 93.A OD1 no hydrogen 3.333 N/A HIS 80.A N VAL 32.A O no hydrogen 2.890 N/A HIS 80.A NE2 ASP 93.A OD2 no hydrogen 2.571 N/A ASN 81.A ND2.B ASP 34.A O no hydrogen 2.754 N/A SER 82.A N ASN 33.A OD1 no hydrogen 2.741 N/A ALA 86.A N ASP 84.A OD1 no hydrogen 3.155 N/A GLU 87.A N ASP 84.A O no hydrogen 2.826 N/A ILE 88.A N PRO 85.A O no hydrogen 3.298 N/A TRP 90.A N ILE 88.A O no hydrogen 2.984 N/A TRP 90.A NE1 HIS 114.A ND1 no hydrogen 2.930 N/A GLY 91.A N GLY 117.A O no hydrogen 2.928 N/A ASP 93.A N PRO 89.A O no hydrogen 3.224 N/A GLY 94.A N GLY 91.A O no hydrogen 3.024 N/A ALA 95.A N TRP 90.A O no hydrogen 2.860 N/A GLU 96.A N LYS 4.A O no hydrogen 2.940 N/A TYR 97.A N LYS 4.A O no hydrogen 3.175 N/A VAL 98.A N LYS 121.A O no hydrogen 2.846 N/A VAL 99.A N GLY 6.A O no hydrogen 2.741 N/A GLU 100.A N ILE 123.A O no hydrogen 2.862 N/A SER 101.A N ASN 8.A O no hydrogen 2.785 N/A SER 101.A OG ASN 8.A O no hydrogen 2.995 N/A SER 101.A OG GLY 9.A O no hydrogen 2.864 N/A THR 102.A N GLU 100.A OE2 no hydrogen 3.162 N/A THR 102.A OG1 GLU 100.A OE2 no hydrogen 2.680 N/A VAL 104.A N THR 102.A OG1 no hydrogen 3.140 N/A THR 108.A N ASP 130.A OD1 no hydrogen 3.011 N/A THR 108.A OG1 ASP 130.A OD1 no hydrogen 2.876 N/A LYS 110.A N THR 107.A OG1 no hydrogen 3.272 N/A ALA 111.A N THR 107.A O no hydrogen 2.887 N/A SER 112.A N THR 108.A O no hydrogen 2.881 N/A SER 112.A OG ASP 109.A O no hydrogen 2.685 N/A ALA 113.A N LYS 110.A O no hydrogen 3.218 N/A HIS 114.A N ALA 111.A O no hydrogen 3.245 N/A HIS 114.A NE2 GLU 100.A OE1 no hydrogen 2.763 N/A LEU 115.A N SER 112.A O no hydrogen 2.854 N/A LYS 116.A N ALA 113.A O no hydrogen 3.148 N/A GLY 117.A N HIS 114.A O no hydrogen 3.183 N/A GLY 118.A N LEU 115.A O no hydrogen 2.978 N/A ALA 119.A N HIS 114.A O no hydrogen 3.274 N/A LYS 120.A N GLU 96.A O no hydrogen 2.879 N/A LYS 121.A N GLU 96.A O no hydrogen 3.089 N/A LYS 121.A NZ TYR 143.A OH no hydrogen 3.105 N/A LYS 121.A NZ LYS 145.A O no hydrogen 2.872 N/A LYS 121.A NZ ASN 148.A O no hydrogen 3.028 N/A LYS 121.A NZ HIS 149.A ND1 no hydrogen 2.906 N/A VAL 122.A N HIS 149.A O no hydrogen 2.945 N/A ILE 123.A N VAL 98.A O no hydrogen 2.777 N/A ILE 124.A N ILE 151.A O no hydrogen 2.624 N/A SER 125.A N GLU 100.A O no hydrogen 3.052 N/A SER 125.A OG GLU 100.A O no hydrogen 3.346 N/A SER 128.A OG THR 106.A O no hydrogen 2.588 N/A SER 128.A OG ASP 130.A OD1 no hydrogen 3.323 N/A ASP 130.A N SER 128.A OG no hydrogen 3.422 N/A ALA 131.A N SER 128.A OG no hydrogen 3.040 N/A PHE 134.A N SER 152.A O no hydrogen 2.876 N/A VAL 135.A N ASN 139.A OD1 no hydrogen 2.889 N/A GLY 137.A N ASN 140.A OD1 no hydrogen 2.938 N/A VAL 138.A N VAL 135.A O no hydrogen 3.001 N/A ASN 139.A N VAL 135.A O no hydrogen 3.160 N/A ASN 139.A ND2 MET 133.A O no hydrogen 3.203 N/A THR 142.A N ASN 139.A O no hydrogen 3.018 N/A THR 142.A OG1 ASN 139.A O no hydrogen 2.573 N/A TYR 143.A N ASN 140.A O no hydrogen 3.085 N/A ASP 144.A N ASN 148.A OD1 no hydrogen 2.932 N/A LYS 145.A NZ ARG 338.A O no hydrogen 3.051 N/A LYS 145.A NZ ARG 338.A OXT no hydrogen 3.569 N/A ASN 147.A N ASP 144.A O no hydrogen 3.026 N/A ASN 147.A ND2 ASP 144.A OD2 no hydrogen 2.591 N/A ASN 148.A N ASP 144.A O no hydrogen 2.654 N/A ILE 151.A N VAL 122.A O no hydrogen 2.851 N/A SER 152.A N PRO 132.A O no hydrogen 2.999 N/A SER 152.A OG ALA 126.A O no hydrogen 2.388 N/A ASN 153.A N ILE 124.A O no hydrogen 2.970 N/A ALA 154.A N SER 152.A OG no hydrogen 2.998 N/A SER 155.A OG THR 158.A OG1 no hydrogen 3.027 N/A CYS 156.A SG HIS 183.A NE2 no hydrogen 3.457 N/A THR 157.A OG1 TYR 318.A OH no hydrogen 2.707 N/A THR 158.A N SER 155.A OG no hydrogen 3.123 N/A THR 158.A OG1 SER 155.A OG no hydrogen 3.027 N/A THR 158.A OG1 ALA 217.A O no hydrogen 3.020 N/A ASN 159.A N SER 155.A O no hydrogen 3.016 N/A ASN 159.A ND2 ASN 153.A O no hydrogen 2.836 N/A ASN 159.A ND2 SER 155.A O no hydrogen 2.930 N/A CYS 160.A N CYS 156.A O no hydrogen 3.116 N/A CYS 160.A N THR 157.A O no hydrogen 2.968 N/A CYS 160.A SG SER 297.A OG no hydrogen 3.533 N/A CYS 160.A SG ALA 316.A O no hydrogen 3.574 N/A CYS 160.A SG TRP 317.A O no hydrogen 3.914 N/A LEU 161.A N THR 157.A O no hydrogen 2.862 N/A ALA 162.A N THR 158.A O no hydrogen 2.900 N/A ALA 165.A N LEU 161.A O no hydrogen 2.738 N/A LYS 166.A N ALA 162.A O no hydrogen 2.823 N/A LYS 166.A NZ ASP 170.A OD2 no hydrogen 3.040 N/A VAL 167.A N PRO 163.A O no hydrogen 3.172 N/A ILE 168.A N LEU 164.A O no hydrogen 3.011 N/A HIS 169.A N ALA 165.A O no hydrogen 2.763 N/A ASP 170.A N LYS 166.A O no hydrogen 2.892 N/A LYS 171.A N VAL 167.A O no hydrogen 3.116 N/A PHE 172.A N ILE 168.A O no hydrogen 2.749 N/A GLY 173.A N ILE 168.A O no hydrogen 3.347 N/A GLY 173.A N HIS 169.A O no hydrogen 2.854 N/A ILE 174.A N HIS 169.A ND1 no hydrogen 2.911 N/A ILE 175.A N ARG 252.A O no hydrogen 3.116 N/A GLY 177.A N LYS 231.A O no hydrogen 2.922 N/A LEU 178.A N THR 250.A O no hydrogen 2.550 N/A MET 179.A N THR 233.A O no hydrogen 3.130 N/A THR 180.A N ASP 248.A O no hydrogen 2.652 N/A THR 181.A N MET 235.A O no hydrogen 3.108 N/A THR 181.A OG1 VAL 246.A O no hydrogen 3.128 N/A THR 181.A OG1 TYR 318.A OH no hydrogen 2.631 N/A VAL 182.A N VAL 246.A O no hydrogen 2.819 N/A HIS 183.A N PHE 237.A O no hydrogen 2.843 N/A HIS 183.A ND1 ALA 184.A O no hydrogen 2.614 N/A ALA 184.A N SER 245.A OG no hydrogen 3.038 N/A THR 185.A N THR 241.A O no hydrogen 2.893 N/A THR 185.A OG1 VAL 239.A O no hydrogen 3.207 N/A THR 185.A OG1 THR 241.A O no hydrogen 3.300 N/A THR 186.A N GLN 189.A OE1 no hydrogen 3.084 N/A THR 186.A OG1 THR 188.A OG1 no hydrogen 3.233 N/A THR 188.A OG1 THR 186.A OG1 no hydrogen 3.233 N/A GLN 189.A N THR 186.A O no hydrogen 3.123 N/A GLY 194.A N GLY 203.A O no hydrogen 2.850 N/A SER 196.A OG LEU 199.A O no hydrogen 2.581 N/A LEU 199.A N SER 196.A O no hydrogen 2.836 N/A ASP 202.A N LEU 199.A O no hydrogen 3.051 N/A GLY 203.A N TRP 200.A O no hydrogen 3.164 N/A ARG 204.A N ARG 201.A O no hydrogen 3.239 N/A ARG 204.A NE ASP 193.A OD2 no hydrogen 3.054 N/A GLY 205.A N ASP 193.A OD1 no hydrogen 2.880 N/A ALA 206.A N LYS 190.A O no hydrogen 2.763 N/A GLN 208.A N GLY 205.A O no hydrogen 3.335 N/A ASN 209.A N ALA 206.A O no hydrogen 3.493 N/A ASN 209.A ND2 GLY 205.A O no hydrogen 2.904 N/A ILE 211.A N ARG 238.A O no hydrogen 2.794 N/A ALA 213.A N ALA 236.A O no hydrogen 2.799 N/A ALA 217.A N THR 215.A OG1 no hydrogen 3.134 N/A ALA 220.A N GLY 216.A O no hydrogen 2.726 N/A VAL 221.A N ALA 218.A O no hydrogen 3.092 N/A GLY 222.A N LYS 219.A O no hydrogen 2.907 N/A LYS 223.A N ALA 220.A O no hydrogen 2.861 N/A VAL 224.A N ALA 220.A O no hydrogen 3.257 N/A ILE 225.A N VAL 221.A O no hydrogen 2.598 N/A LEU 228.A N ILE 225.A O no hydrogen 2.906 N/A ASN 229.A N PRO 226.A O no hydrogen 3.032 N/A LYS 231.A N LEU 228.A O no hydrogen 2.935 N/A LYS 231.A NZ ASP 227.A O no hydrogen 3.210 N/A MET 235.A N MET 179.A O no hydrogen 3.161 N/A ALA 236.A N ALA 213.A O no hydrogen 2.713 N/A PHE 237.A N THR 181.A O no hydrogen 2.946 N/A ARG 238.A N ILE 211.A O no hydrogen 2.688 N/A VAL 239.A N HIS 183.A O no hydrogen 2.926 N/A THR 241.A N VAL 239.A O no hydrogen 2.846 N/A SER 245.A N TYR 318.A O no hydrogen 2.755 N/A SER 245.A OG ASN 320.A OD1 no hydrogen 2.703 N/A VAL 246.A N VAL 182.A O no hydrogen 2.938 N/A VAL 247.A N ALA 316.A O no hydrogen 2.677 N/A ASP 248.A N THR 180.A O no hydrogen 2.541 N/A LEU 249.A N LEU 314.A O no hydrogen 2.867 N/A THR 250.A N LEU 178.A O no hydrogen 2.544 N/A CYS 251.A N VAL 312.A O no hydrogen 2.927 N/A ARG 252.A N GLU 176.A O no hydrogen 2.903 N/A ARG 252.A NH1 GLU 176.A OE2 no hydrogen 2.567 N/A LEU 253.A N ASN 310.A O no hydrogen 2.759 N/A GLN 254.A N GLY 173.A O no hydrogen 2.728 N/A LYS 255.A N PHE 172.A O no hydrogen 2.904 N/A ALA 257.A N PRO 309.A O no hydrogen 2.997 N/A THR 258.A N GLU 261.A OE1 no hydrogen 3.156 N/A GLU 261.A N THR 258.A OG1 no hydrogen 3.029 N/A ILE 262.A N THR 258.A O no hydrogen 3.061 N/A LYS 263.A N MET 259.A O no hydrogen 2.866 N/A ALA 264.A N ASP 260.A O no hydrogen 3.063 N/A ALA 265.A N GLU 261.A O no hydrogen 3.045 N/A VAL 266.A N ILE 262.A O no hydrogen 3.068 N/A LYS 267.A N LYS 263.A O no hydrogen 2.872 N/A GLU 268.A N ALA 264.A O no hydrogen 3.044 N/A ALA 269.A N ALA 265.A O no hydrogen 3.244 N/A ALA 270.A N VAL 266.A O no hydrogen 2.776 N/A ASN 271.A N LYS 267.A O no hydrogen 2.783 N/A GLY 272.A N ALA 269.A O no hydrogen 3.224 N/A MET 274.A N ALA 269.A O no hydrogen 2.933 N/A LYS 275.A N GLY 272.A O no hydrogen 3.241 N/A ILE 277.A N MET 274.A O no hydrogen 2.885 N/A LEU 278.A N MET 274.A O no hydrogen 2.821 N/A GLU 279.A N SER 297.A O no hydrogen 2.849 N/A TYR 280.A N GLU 279.A OE1 no hydrogen 2.859 N/A TYR 280.A OH GLU 282.A OE2 no hydrogen 2.523 N/A THR 281.A N PHE 299.A O no hydrogen 3.074 N/A ASP 283.A N THR 281.A OG1 no hydrogen 3.017 N/A VAL 286.A N ASP 289.A OD2 no hydrogen 3.072 N/A ASP 289.A N VAL 286.A O no hydrogen 3.066 N/A PHE 290.A N SER 287.A O no hydrogen 2.863 N/A THR 291.A N THR 288.A O no hydrogen 3.228 N/A THR 291.A OG1 THR 288.A O no hydrogen 3.145 N/A GLY 292.A N ASP 319.A OD2 no hydrogen 2.626 N/A ASP 293.A N PHE 290.A O no hydrogen 3.012 N/A HIS 295.A N ASP 293.A OD1 no hydrogen 2.908 N/A HIS 295.A ND1 ASP 293.A OD1 no hydrogen 2.791 N/A SER 296.A N ILE 277.A O no hydrogen 2.849 N/A SER 297.A N ILE 277.A O no hydrogen 3.153 N/A SER 297.A OG CYS 160.A O no hydrogen 2.939 N/A ILE 298.A N TRP 317.A O no hydrogen 2.778 N/A PHE 299.A N GLU 279.A O no hydrogen 2.836 N/A ASP 300.A N ILE 315.A O no hydrogen 2.834 N/A ALA 301.A N THR 281.A O no hydrogen 3.113 N/A ALA 303.A N ASP 300.A O no hydrogen 3.202 N/A ALA 303.A N ASP 300.A OD1 no hydrogen 3.024 N/A CYS 304.A N ALA 301.A O no hydrogen 3.356 N/A CYS 304.A SG ASP 300.A O no hydrogen 3.274 N/A ILE 305.A N LYS 313.A O no hydrogen 3.226 N/A LEU 307.A N PHE 311.A O no hydrogen 3.075 N/A ASN 308.A N PHE 311.A O no hydrogen 3.531 N/A ASN 310.A N ASN 308.A OD1 no hydrogen 3.018 N/A ASN 310.A ND2 LEU 253.A O no hydrogen 2.953 N/A PHE 311.A N ASN 308.A O no hydrogen 3.094 N/A VAL 312.A N CYS 251.A O no hydrogen 3.027 N/A LYS 313.A N ILE 305.A O no hydrogen 2.898 N/A LYS 313.A NZ ASP 248.A OD1 no hydrogen 2.905 N/A LYS 313.A NZ ASP 248.A OD2 no hydrogen 3.345 N/A LYS 313.A NZ THR 250.A OG1 no hydrogen 3.046 N/A LEU 314.A N LEU 249.A O no hydrogen 2.766 N/A ALA 316.A N VAL 247.A O no hydrogen 2.988 N/A TRP 317.A N ILE 298.A O no hydrogen 2.753 N/A TRP 317.A NE1 ASP 300.A OD2 no hydrogen 2.912 N/A TYR 318.A N SER 245.A O no hydrogen 2.890 N/A TYR 318.A OH THR 157.A OG1 no hydrogen 2.707 N/A TYR 318.A OH THR 181.A OG1 no hydrogen 2.631 N/A GLU 321.A N ASP 243.A OD1 no hydrogen 3.397 N/A TYR 322.A N ASP 319.A OD1 no hydrogen 2.800 N/A GLY 323.A N ASP 319.A O no hydrogen 2.854 N/A TYR 324.A OH ALA 154.A O no hydrogen 2.541 N/A SER 325.A N GLU 321.A O no hydrogen 3.208 N/A SER 325.A OG GLU 321.A O no hydrogen 2.867 N/A ASN 326.A N TYR 322.A O no hydrogen 3.032 N/A ASN 326.A ND2 TYR 322.A O no hydrogen 2.452 N/A ARG 327.A N GLY 323.A O no hydrogen 3.140 N/A ARG 327.A NE ASP 330.A OD2 no hydrogen 2.940 N/A ARG 327.A NH1 THR 294.A O no hydrogen 3.128 N/A ARG 327.A NH1 ASP 330.A OD2 no hydrogen 2.917 N/A ARG 327.A NH2 THR 294.A O no hydrogen 2.864 N/A ARG 327.A NH2 SER 296.A OG no hydrogen 3.058 N/A VAL 328.A N TYR 324.A O no hydrogen 3.017 N/A VAL 329.A N SER 325.A O no hydrogen 3.318 N/A ASP 330.A N ASN 326.A O no hydrogen 3.005 N/A LEU 331.A N ARG 327.A O no hydrogen 2.752 N/A ILE 332.A N VAL 328.A O no hydrogen 3.072 N/A SER 333.A N VAL 329.A O no hydrogen 2.995 N/A SER 333.A OG THR 26.A O no hydrogen 3.537 N/A TYR 334.A N ASP 330.A O no hydrogen 2.867 N/A ILE 335.A N LEU 331.A O no hydrogen 3.039 N/A ALA 336.A N ILE 332.A O no hydrogen 2.964 N/A SER 337.A N SER 333.A O no hydrogen 3.242 N/A SER 337.A N TYR 334.A O no hydrogen 3.058 N/A SER 337.A OG TYR 334.A O no hydrogen 2.468 N/A ARG 338.A N ILE 335.A O no hydrogen 3.067 N/A