Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dki_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N SER 4.A OG no hydrogen 3.086 N/A GLN 7.A N SER 4.A O no hydrogen 2.943 N/A ALA 8.A N LEU 5.A O no hydrogen 2.905 N/A GLY 10.A N ASN 43.A OD1 no hydrogen 2.792 N/A ASN 11.A N GLU 165.A OE2 no hydrogen 2.802 N/A THR 12.A N GLU 165.A OE1 no hydrogen 3.300 N/A THR 12.A OG1 GLU 40.A OE2 no hydrogen 2.580 N/A VAL 15.A N ALA 37.A O no hydrogen 2.875 N/A LEU 17.A N LEU 35.A O no hydrogen 2.833 N/A ARG 19.A N GLU 255.A OE2 no hydrogen 2.823 N/A LEU 20.A N GLU 255.A OE2 no hydrogen 2.916 N/A SER 21.A N LEU 17.A O no hydrogen 2.861 N/A SER 21.A OG LEU 17.A O no hydrogen 2.620 N/A ARG 23.A N VAL 33.A O no hydrogen 3.060 N/A ARG 23.A NH1 ASP 29.A OD1 no hydrogen 3.342 N/A ARG 23.A NH2 ASP 29.A OD2 no hydrogen 2.646 N/A GLY 27.A N GLY 30.A O no hydrogen 2.905 N/A HIS 32.A N ASP 26.A OD1 no hydrogen 2.899 N/A VAL 33.A N ARG 23.A O no hydrogen 2.759 N/A ARG 34.A N ALA 284.A O no hydrogen 2.890 N/A ARG 34.A NE TRP 24.A O no hydrogen 2.773 N/A ARG 34.A NH2 TRP 24.A O no hydrogen 3.153 N/A LEU 35.A N SER 21.A OG no hydrogen 2.800 N/A TRP 36.A N ILE 286.A O no hydrogen 2.783 N/A TRP 36.A NE1 ASP 285.A OD1 no hydrogen 2.893 N/A ALA 37.A N VAL 15.A O no hydrogen 2.729 N/A LYS 38.A N LEU 288.A O no hydrogen 2.882 N/A LYS 38.A NZ THR 12.A O no hydrogen 3.005 N/A LYS 38.A NZ THR 12.A OG1 no hydrogen 2.841 N/A LYS 38.A NZ GLU 165.A OE1 no hydrogen 2.648 N/A LEU 39.A N PRO 13.A O no hydrogen 2.969 N/A GLU 40.A N VAL 290.A O no hydrogen 2.918 N/A ARG 42.A N LEU 39.A O no hydrogen 3.246 N/A ASN 43.A ND2 GLU 40.A O no hydrogen 2.865 N/A ASN 43.A ND2 GLU 40.A OE1 no hydrogen 3.080 N/A ASN 43.A ND2 SER 47.A O no hydrogen 3.402 N/A THR 45.A N ASP 49.A OD2 no hydrogen 2.741 N/A THR 45.A OG1 ASP 49.A OD1 no hydrogen 2.502 N/A THR 45.A OG1 ASP 49.A OD2 no hydrogen 3.266 N/A THR 45.A OG1 SER 82.A OG no hydrogen 3.204 N/A GLY 46.A N ASN 43.A O no hydrogen 3.062 N/A ILE 48.A N ALA 291.A O no hydrogen 2.899 N/A ASP 49.A N SER 82.A OG no hydrogen 3.201 N/A ARG 50.A N ILE 48.A O no hydrogen 3.134 N/A ARG 50.A NE GLU 40.A OE1 no hydrogen 2.804 N/A ARG 50.A NH1 GLU 165.A OE2 no hydrogen 3.015 N/A ARG 50.A NH2 THR 12.A OG1 no hydrogen 3.422 N/A ARG 50.A NH2 GLU 40.A OE1 no hydrogen 3.371 N/A ARG 50.A NH2 GLU 40.A OE2 no hydrogen 3.021 N/A ARG 50.A NH2 GLU 165.A OE1 no hydrogen 2.912 N/A ARG 50.A NH2 GLU 165.A OE2 no hydrogen 3.437 N/A VAL 53.A N ASP 49.A O no hydrogen 3.155 N/A ARG 54.A N ARG 50.A O no hydrogen 3.089 N/A MET 55.A N PRO 51.A O no hydrogen 2.772 N/A ILE 56.A N ALA 52.A O no hydrogen 3.320 N/A GLU 57.A N VAL 53.A O no hydrogen 3.060 N/A GLN 58.A N ARG 54.A O no hydrogen 2.796 N/A ALA 59.A N MET 55.A O no hydrogen 3.019 N/A GLU 60.A N ILE 56.A O no hydrogen 2.928 N/A ALA 61.A N GLU 57.A O no hydrogen 2.805 N/A ASP 62.A N GLN 58.A O no hydrogen 2.894 N/A GLY 63.A N GLU 60.A O no hydrogen 2.912 N/A LEU 64.A N ALA 59.A O no hydrogen 2.825 N/A LEU 65.A N ALA 59.A O no hydrogen 3.350 N/A ALA 69.A N ARG 66.A O no hydrogen 2.925 N/A THR 70.A N SER 142.A O no hydrogen 3.092 N/A ILE 71.A N ARG 93.A O no hydrogen 2.774 N/A LEU 72.A N VAL 144.A O no hydrogen 2.744 N/A GLU 73.A N ILE 95.A O no hydrogen 3.018 N/A GLY 77.A N THR 75.A OG1 no hydrogen 3.327 N/A ASN 78.A ND2 ASP 292.A OD2 no hydrogen 3.064 N/A THR 79.A OG1 GLN 148.A OE1 no hydrogen 2.478 N/A ILE 81.A N GLY 77.A O no hydrogen 3.233 N/A SER 82.A N ASN 78.A O no hydrogen 2.842 N/A SER 82.A OG THR 45.A OG1 no hydrogen 3.204 N/A SER 82.A OG ASP 49.A OD1 no hydrogen 2.675 N/A SER 82.A OG ASN 78.A O no hydrogen 3.031 N/A LEU 83.A N THR 79.A O no hydrogen 2.696 N/A ALA 84.A N GLY 80.A O no hydrogen 2.900 N/A MET 85.A N ILE 81.A O no hydrogen 3.129 N/A ALA 86.A N SER 82.A O no hydrogen 3.014 N/A ALA 87.A N LEU 83.A O no hydrogen 2.840 N/A ARG 88.A N ALA 84.A O no hydrogen 3.204 N/A LEU 89.A N MET 85.A O no hydrogen 3.057 N/A LYS 90.A N ALA 86.A O no hydrogen 2.841 N/A LYS 90.A NZ GLU 60.A OE1 no hydrogen 2.811 N/A LYS 90.A NZ GLU 60.A OE2 no hydrogen 3.271 N/A GLY 91.A N ARG 88.A O no hydrogen 3.170 N/A TYR 92.A N ALA 87.A O no hydrogen 2.668 N/A TYR 92.A OH GLU 60.A OE2 no hydrogen 2.484 N/A ARG 93.A N ALA 69.A O no hydrogen 3.145 N/A ILE 95.A N ILE 71.A O no hydrogen 2.852 N/A CYS 96.A N GLN 116.A O no hydrogen 2.852 N/A VAL 97.A N GLU 73.A O no hydrogen 2.906 N/A MET 98.A N ILE 118.A O no hydrogen 2.871 N/A GLU 100.A N SER 120.A O no hydrogen 2.796 N/A THR 102.A N PRO 99.A O no hydrogen 2.868 N/A THR 102.A OG1 PRO 99.A O no hydrogen 2.511 N/A GLU 105.A N GLU 105.A OE1 no hydrogen 2.875 N/A ARG 107.A N SER 103.A O no hydrogen 2.982 N/A ARG 107.A NH2 GLU 111.A OE2 no hydrogen 2.809 N/A GLN 108.A N VAL 104.A O no hydrogen 2.823 N/A GLU 111.A N ARG 107.A O no hydrogen 2.977 N/A LEU 112.A N GLN 108.A O no hydrogen 3.161 N/A TYR 113.A N LEU 109.A O no hydrogen 3.452 N/A GLY 114.A N GLU 111.A O no hydrogen 2.856 N/A ALA 115.A N LEU 110.A O no hydrogen 3.014 N/A GLN 116.A N LEU 94.A O no hydrogen 3.001 N/A ILE 118.A N CYS 96.A O no hydrogen 2.848 N/A SER 120.A N MET 98.A O no hydrogen 2.807 N/A SER 120.A OG MET 98.A O no hydrogen 3.424 N/A GLY 125.A N ALA 122.A O no hydrogen 3.190 N/A THR 128.A N GLY 124.A O no hydrogen 3.105 N/A ALA 129.A N GLY 125.A O no hydrogen 3.199 N/A VAL 130.A N SER 126.A O no hydrogen 2.748 N/A ALA 131.A N ASN 127.A O no hydrogen 3.108 N/A THR 132.A N THR 128.A O no hydrogen 2.782 N/A THR 132.A OG1 THR 128.A O no hydrogen 2.699 N/A ALA 133.A N ALA 129.A O no hydrogen 2.951 N/A LYS 134.A N VAL 130.A O no hydrogen 2.989 N/A GLU 135.A N ALA 131.A O no hydrogen 2.875 N/A LEU 136.A N THR 132.A O no hydrogen 2.920 N/A ALA 137.A N ALA 133.A O no hydrogen 2.886 N/A ALA 138.A N LYS 134.A O no hydrogen 3.077 N/A THR 139.A N LEU 136.A O no hydrogen 2.976 N/A THR 139.A OG1 LEU 136.A O no hydrogen 2.668 N/A ASN 140.A N ALA 137.A O no hydrogen 3.374 N/A TRP 143.A N ASN 140.A O no hydrogen 2.890 N/A VAL 144.A N THR 70.A O no hydrogen 2.814 N/A TYR 147.A N GLU 73.A OE1 no hydrogen 3.065 N/A TYR 147.A OH GLU 226.A OE1 no hydrogen 2.821 N/A TYR 147.A OH GLU 226.A OE2 no hydrogen 3.318 N/A GLN 148.A N GLU 73.A OE2 no hydrogen 2.886 N/A GLY 150.A N TYR 147.A O no hydrogen 3.077 N/A ASN 151.A ND2 LEU 146.A O no hydrogen 2.919 N/A ALA 153.A N ASN 151.A OD1 no hydrogen 2.962 N/A ASN 154.A N ASN 151.A O no hydrogen 2.828 N/A ASN 154.A ND2 GLN 148.A O no hydrogen 2.936 N/A ASN 154.A ND2 THR 182.A OG1 no hydrogen 3.033 N/A ASP 156.A N PRO 152.A O no hydrogen 2.820 N/A SER 157.A N ALA 153.A O no hydrogen 3.032 N/A SER 157.A N ASN 154.A O no hydrogen 3.189 N/A SER 157.A OG ASN 154.A O no hydrogen 2.839 N/A HIS 158.A N THR 155.A O no hydrogen 2.925 N/A HIS 158.A ND1 THR 162.A OG1 no hydrogen 2.759 N/A TYR 159.A N THR 155.A O no hydrogen 3.111 N/A TYR 159.A OH GLU 195.A OE1 no hydrogen 2.628 N/A CYS 160.A N ASP 156.A O no hydrogen 2.932 N/A CYS 160.A SG ASP 156.A O no hydrogen 3.530 N/A CYS 160.A SG ASP 156.A OD1 no hydrogen 3.784 N/A THR 162.A OG1 HIS 158.A ND1 no hydrogen 2.759 N/A GLY 163.A N HIS 158.A O no hydrogen 2.826 N/A GLU 165.A N GLY 161.A O no hydrogen 3.050 N/A LEU 166.A N THR 162.A O no hydrogen 3.041 N/A LEU 167.A N GLY 163.A O no hydrogen 3.017 N/A ALA 168.A N PRO 164.A O no hydrogen 3.045 N/A ASP 169.A N GLU 165.A O no hydrogen 2.954 N/A LEU 170.A N LEU 166.A O no hydrogen 2.730 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.953 N/A ILE 173.A N LEU 170.A O no hydrogen 3.022 N/A THR 174.A N ASP 285.A O no hydrogen 3.054 N/A THR 174.A OG1 HIS 175.A ND1 no hydrogen 2.873 N/A THR 174.A OG1 ASP 285.A O no hydrogen 3.183 N/A HIS 175.A N ASP 285.A O no hydrogen 3.368 N/A HIS 175.A ND1 THR 174.A OG1 no hydrogen 2.873 N/A PHE 176.A N LYS 201.A O no hydrogen 2.779 N/A VAL 177.A N ALA 287.A O no hydrogen 2.893 N/A ALA 178.A N VAL 203.A O no hydrogen 3.250 N/A LEU 180.A N ALA 205.A O no hydrogen 3.079 N/A THR 183.A OG1 THR 182.A O no hydrogen 2.505 N/A GLY 184.A N THR 182.A OG1 no hydrogen 3.213 N/A MET 187.A N THR 183.A O no hydrogen 2.787 N/A GLY 188.A N GLY 184.A O no hydrogen 2.826 N/A THR 189.A N THR 185.A O no hydrogen 2.959 N/A THR 189.A OG1 THR 185.A O no hydrogen 2.738 N/A GLY 190.A N LEU 186.A O no hydrogen 2.826 N/A ARG 191.A N MET 187.A O no hydrogen 3.112 N/A ARG 191.A NH1 GLU 195.A OE2 no hydrogen 3.177 N/A PHE 192.A N GLY 188.A O no hydrogen 3.111 N/A LEU 193.A N THR 189.A O no hydrogen 2.900 N/A ARG 194.A N GLY 190.A O no hydrogen 2.914 N/A ARG 194.A NE ILE 232.A O no hydrogen 2.828 N/A ARG 194.A NH2 ILE 232.A O no hydrogen 3.166 N/A GLU 195.A N ARG 191.A O no hydrogen 3.129 N/A GLU 195.A N PHE 192.A O no hydrogen 3.081 N/A HIS 196.A N LEU 193.A O no hydrogen 3.188 N/A HIS 196.A ND1 PHE 192.A O no hydrogen 2.898 N/A VAL 197.A N LEU 193.A O no hydrogen 2.783 N/A VAL 200.A N VAL 197.A O no hydrogen 3.440 N/A LYS 201.A N THR 174.A O no hydrogen 2.815 N/A LYS 201.A NZ ASN 199.A O no hydrogen 3.071 N/A LYS 201.A NZ ASN 199.A OD1 no hydrogen 2.915 N/A ILE 202.A N THR 234.A OG1 no hydrogen 2.835 N/A VAL 203.A N PHE 176.A O no hydrogen 2.726 N/A ALA 204.A N ALA 235.A O no hydrogen 2.810 N/A ALA 205.A N ALA 178.A O no hydrogen 3.036 N/A GLU 206.A N TYR 237.A O no hydrogen 2.907 N/A ARG 208.A N VAL 239.A O no hydrogen 3.391 N/A GLY 210.A N GLU 221.A OE1 no hydrogen 3.102 N/A GLU 211.A N ARG 208.A O no hydrogen 3.050 N/A TYR 214.A OH THR 300.A OG1 no hydrogen 3.222 N/A LEU 216.A N VAL 213.A O no hydrogen 2.931 N/A ARG 217.A N LEU 180.A O no hydrogen 2.927 N/A ARG 217.A NE GLY 181.A O no hydrogen 3.111 N/A ARG 217.A NH1 PHE 223.A O no hydrogen 2.769 N/A ASN 218.A ND2 PRO 207.A O no hydrogen 2.907 N/A GLU 221.A N ASN 218.A OD1 no hydrogen 2.804 N/A GLY 222.A N ASN 218.A O no hydrogen 2.848 N/A GLU 226.A N GLU 226.A OE1 no hydrogen 2.815 N/A LEU 227.A N TYR 149.A O no hydrogen 3.143 N/A TYR 228.A N PRO 225.A O no hydrogen 2.882 N/A GLU 231.A N ASP 229.A OD1 no hydrogen 3.170 N/A ILE 232.A N ASP 229.A O no hydrogen 3.243 N/A LEU 233.A N PRO 230.A O no hydrogen 3.330 N/A THR 234.A N ILE 202.A O no hydrogen 2.811 N/A THR 234.A OG1 ILE 202.A O no hydrogen 3.031 N/A ALA 235.A N ILE 202.A O no hydrogen 3.347 N/A TYR 237.A N ALA 204.A O no hydrogen 2.878 N/A SER 238.A OG GLU 206.A OE2 no hydrogen 2.658 N/A VAL 239.A N GLU 206.A O no hydrogen 2.915 N/A ALA 241.A N GLU 211.A OE1 no hydrogen 2.853 N/A ALA 244.A N GLY 240.A O no hydrogen 2.952 N/A VAL 245.A N ALA 241.A O no hydrogen 2.930 N/A ARG 246.A N VAL 242.A O no hydrogen 2.863 N/A ARG 246.A NE ASP 243.A OD1 no hydrogen 3.013 N/A ARG 246.A NH2 ASP 243.A OD1 no hydrogen 3.463 N/A ARG 247.A N ASP 243.A O no hydrogen 3.074 N/A ARG 247.A NE HIS 268.A ND1 no hydrogen 2.983 N/A ARG 247.A NH1 HIS 268.A ND1 no hydrogen 3.547 N/A ARG 247.A NH2 GLU 250.A OE1 no hydrogen 2.895 N/A THR 248.A N ALA 244.A O no hydrogen 3.143 N/A THR 248.A OG1 ALA 244.A O no hydrogen 2.850 N/A ARG 249.A N VAL 245.A O no hydrogen 3.163 N/A ARG 249.A NE ALA 302.A O no hydrogen 3.192 N/A ARG 249.A NH1 GLY 305.A O no hydrogen 2.874 N/A ARG 249.A NH2 GLY 305.A O no hydrogen 3.130 N/A GLU 250.A N ARG 246.A O no hydrogen 3.030 N/A LEU 251.A N ARG 247.A O no hydrogen 2.940 N/A VAL 252.A N THR 248.A O no hydrogen 3.466 N/A HIS 253.A N ARG 249.A O no hydrogen 3.007 N/A THR 254.A N GLU 250.A O no hydrogen 2.930 N/A THR 254.A OG1 GLU 250.A O no hydrogen 2.801 N/A GLU 255.A N LEU 251.A O no hydrogen 2.874 N/A GLY 256.A N VAL 252.A O no hydrogen 3.049 N/A GLY 260.A N ASP 292.A O no hydrogen 2.960 N/A THR 263.A N GLY 260.A O no hydrogen 3.214 N/A ALA 265.A N ILE 261.A O no hydrogen 3.412 N/A VAL 266.A N SER 262.A O no hydrogen 3.020 N/A LEU 267.A N THR 263.A O no hydrogen 2.689 N/A HIS 268.A N GLY 264.A O no hydrogen 2.901 N/A ALA 269.A N ALA 265.A O no hydrogen 3.118 N/A ALA 270.A N VAL 266.A O no hydrogen 2.875 N/A LEU 271.A N LEU 267.A O no hydrogen 2.860 N/A GLY 272.A N HIS 268.A O no hydrogen 3.057 N/A VAL 273.A N ALA 269.A O no hydrogen 2.863 N/A GLY 274.A N ALA 270.A O no hydrogen 2.742 N/A ALA 275.A N LEU 271.A O no hydrogen 2.757 N/A GLY 276.A N GLY 272.A O no hydrogen 3.282 N/A ALA 277.A N VAL 273.A O no hydrogen 3.065 N/A LEU 278.A N GLY 274.A O no hydrogen 2.940 N/A ALA 279.A N ALA 275.A O no hydrogen 2.937 N/A ALA 280.A N GLY 276.A O no hydrogen 2.956 N/A GLY 281.A N LEU 278.A O no hydrogen 3.083 N/A GLU 282.A N ALA 277.A O no hydrogen 2.789 N/A ARG 283.A NH1 GLU 172.A O no hydrogen 2.878 N/A ARG 283.A NH1 ASP 285.A OD2 no hydrogen 2.794 N/A ALA 284.A N HIS 32.A O no hydrogen 3.116 N/A ASP 285.A N THR 174.A OG1 no hydrogen 2.895 N/A ILE 286.A N ARG 34.A O no hydrogen 2.765 N/A ALA 287.A N HIS 175.A O no hydrogen 3.020 N/A LEU 288.A N TRP 36.A O no hydrogen 2.881 N/A VAL 289.A N VAL 177.A O no hydrogen 3.104 N/A VAL 290.A N LYS 38.A O no hydrogen 2.990 N/A ALA 291.A N THR 263.A OG1 no hydrogen 3.371 N/A GLY 294.A N PHE 258.A O no hydrogen 3.017 N/A LYS 296.A NZ ASN 78.A OD1 no hydrogen 3.275 N/A LYS 296.A NZ ASP 292.A OD2 no hydrogen 2.846 N/A TYR 297.A N GLY 294.A O no hydrogen 2.870 N/A TYR 297.A OH ASP 292.A OD1 no hydrogen 3.318 N/A TYR 297.A OH ASP 292.A OD2 no hydrogen 2.388 N/A LEU 298.A N TRP 295.A O no hydrogen 3.348 N/A THR 300.A N TYR 297.A O no hydrogen 3.153 N/A THR 300.A OG1 TYR 214.A OH no hydrogen 3.222 N/A TYR 303.A OH ALA 259.A O no hydrogen 2.670 N/A ASP 309.A N SER 306.A OG no hydrogen 3.224 N/A ALA 310.A N SER 306.A O no hydrogen 3.104 N/A