Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tk1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N THR 1.A O no hydrogen 2.916 N/A ALA 6.A N VAL 2.A O no hydrogen 2.954 N/A ALA 7.A N LYS 3.A O no hydrogen 3.111 N/A ALA 8.A N ASP 4.A O no hydrogen 2.806 N/A ILE 9.A N LEU 5.A O no hydrogen 2.897 N/A ARG 10.A N ALA 6.A O no hydrogen 3.024 N/A ARG 10.A NE ASP 45.A OD2 no hydrogen 2.954 N/A ARG 10.A NH2 GLU 41.A O no hydrogen 3.275 N/A ARG 10.A NH2 ASP 45.A OD2 no hydrogen 3.008 N/A SER 11.A N ALA 7.A O no hydrogen 2.994 N/A SER 11.A OG ALA 7.A O no hydrogen 2.853 N/A SER 11.A OG ALA 8.A O no hydrogen 3.439 N/A GLY 12.A N ILE 9.A O no hydrogen 3.319 N/A ASP 13.A N ALA 8.A O no hydrogen 3.105 N/A ALA 16.A N ASP 13.A O no hydrogen 3.076 N/A ALA 20.A N ALA 16.A O no hydrogen 2.891 N/A ILE 21.A N LEU 17.A O no hydrogen 2.754 N/A THR 22.A N PRO 18.A O no hydrogen 2.914 N/A THR 22.A OG1 PRO 18.A O no hydrogen 3.290 N/A LEU 23.A N ARG 19.A O no hydrogen 2.820 N/A VAL 24.A N ALA 20.A O no hydrogen 3.092 N/A GLU 25.A N ILE 21.A O no hydrogen 2.916 N/A SER 26.A N LEU 23.A O no hydrogen 3.260 N/A SER 26.A OG HIS 31.A ND1 no hydrogen 2.919 N/A HIS 31.A ND1 SER 26.A OG no hydrogen 2.919 N/A ARG 32.A N ARG 28.A O no hydrogen 3.323 N/A GLU 33.A N ASP 30.A O no hydrogen 3.260 N/A ALA 35.A N HIS 31.A O no hydrogen 2.774 N/A GLN 36.A N ARG 32.A O no hydrogen 3.332 N/A GLN 36.A NE2 GLU 107.A OE2 no hydrogen 3.131 N/A GLU 37.A N GLU 33.A O no hydrogen 3.132 N/A LEU 38.A N ARG 34.A O no hydrogen 2.869 N/A LEU 39.A N ALA 35.A O no hydrogen 3.007 N/A LEU 40.A N GLN 36.A O no hydrogen 2.908 N/A GLU 41.A N GLU 37.A O no hydrogen 2.913 N/A LEU 42.A N LEU 38.A O no hydrogen 2.810 N/A MET 43.A N LEU 40.A O no hydrogen 3.262 N/A ASP 45.A N LEU 42.A O no hydrogen 2.857 N/A ALA 46.A N MET 43.A O no hydrogen 2.851 N/A GLY 47.A N GLU 113.A OE1 no hydrogen 2.901 N/A ARG 48.A N ASP 45.A O no hydrogen 3.073 N/A ALA 49.A N GLU 113.A OE2 no hydrogen 2.835 N/A MET 50.A N ASP 118.A O no hydrogen 2.845 N/A HIS 51.A N ASP 139.A OD2 no hydrogen 3.104 N/A HIS 51.A NE2 GLU 113.A OE2 no hydrogen 2.671 N/A VAL 52.A N VAL 120.A O no hydrogen 2.991 N/A GLY 53.A N THR 140.A O no hydrogen 2.760 N/A ILE 54.A N VAL 122.A O no hydrogen 2.737 N/A THR 55.A N VAL 142.A O no hydrogen 2.976 N/A THR 55.A OG1 THR 124.A OG1 no hydrogen 2.841 N/A VAL 60.A N VAL 57.A O no hydrogen 3.034 N/A LYS 62.A NZ GLU 123.A OE2 no hydrogen 2.472 N/A LYS 62.A NZ THR 124.A O no hydrogen 2.914 N/A SER 65.A N GLY 61.A O no hydrogen 2.896 N/A SER 65.A OG GLY 61.A O no hydrogen 2.681 N/A ILE 66.A N LYS 62.A O no hydrogen 2.949 N/A GLU 67.A N SER 63.A O no hydrogen 2.951 N/A ALA 68.A N THR 64.A O no hydrogen 2.989 N/A LEU 69.A N SER 65.A O no hydrogen 2.859 N/A GLY 70.A N ILE 66.A O no hydrogen 2.719 N/A MET 71.A N GLU 67.A O no hydrogen 2.879 N/A HIS 72.A N ALA 68.A O no hydrogen 3.005 N/A LEU 73.A N LEU 69.A O no hydrogen 2.913 N/A ILE 74.A N GLY 70.A O no hydrogen 3.037 N/A GLU 75.A N MET 71.A O no hydrogen 3.042 N/A GLY 77.A N ILE 74.A O no hydrogen 2.655 N/A HIS 78.A N LEU 73.A O no hydrogen 2.904 N/A HIS 78.A ND1 ASP 118.A OD1 no hydrogen 2.625 N/A ARG 79.A N ASP 118.A OD2 no hydrogen 2.934 N/A ALA 81.A N VAL 119.A O no hydrogen 3.079 N/A VAL 82.A N ALA 91.A O no hydrogen 2.811 N/A LEU 83.A N LEU 121.A O no hydrogen 2.743 N/A ALA 84.A N LEU 93.A O no hydrogen 2.933 N/A VAL 85.A N GLU 123.A O no hydrogen 3.000 N/A THR 88.A N ASP 86.A OD1 no hydrogen 3.200 N/A ARG 89.A N ASP 86.A O no hydrogen 2.968 N/A ALA 91.A N VAL 80.A O no hydrogen 2.889 N/A ARG 92.A NH2 GLU 123.A OE1 no hydrogen 3.223 N/A LEU 93.A N VAL 82.A O no hydrogen 2.931 N/A HIS 96.A N GLU 25.A OE2 no hydrogen 2.860 N/A ALA 102.A N LEU 98.A O no hydrogen 2.732 N/A LYS 103.A N GLY 99.A O no hydrogen 3.068 N/A LYS 103.A NZ GLU 107.A OE2 no hydrogen 2.979 N/A ALA 104.A N GLY 100.A O no hydrogen 3.181 N/A THR 105.A N VAL 101.A O no hydrogen 2.762 N/A THR 105.A OG1 VAL 101.A O no hydrogen 2.690 N/A ARG 106.A N ALA 102.A O no hydrogen 2.792 N/A ARG 106.A NH1 GLU 240.A OE1 no hydrogen 2.992 N/A ARG 106.A NH2 ASP 136.A O no hydrogen 3.205 N/A GLU 107.A N LYS 103.A O no hydrogen 3.092 N/A THR 108.A N ALA 104.A O no hydrogen 2.947 N/A THR 108.A OG1 ALA 104.A O no hydrogen 2.831 N/A ILE 109.A N THR 105.A O no hydrogen 2.989 N/A VAL 110.A N GLU 107.A O no hydrogen 2.948 N/A LEU 111.A N GLU 107.A O no hydrogen 3.267 N/A LEU 112.A N THR 108.A O no hydrogen 2.811 N/A GLU 113.A N ILE 109.A O no hydrogen 2.944 N/A ALA 114.A N VAL 110.A O no hydrogen 2.853 N/A ALA 115.A N LEU 111.A O no hydrogen 3.131 N/A GLY 116.A N GLU 113.A O no hydrogen 2.970 N/A PHE 117.A N LEU 112.A O no hydrogen 3.125 N/A ASP 118.A N ARG 79.A O no hydrogen 3.151 N/A VAL 119.A N ARG 79.A O no hydrogen 3.459 N/A VAL 120.A N MET 50.A O no hydrogen 2.876 N/A LEU 121.A N ALA 81.A O no hydrogen 2.906 N/A VAL 122.A N VAL 52.A O no hydrogen 2.820 N/A GLU 123.A N LEU 83.A O no hydrogen 2.883 N/A THR 124.A N ILE 54.A O no hydrogen 3.391 N/A THR 124.A OG1 THR 55.A OG1 no hydrogen 2.841 N/A VAL 125.A N VAL 85.A O no hydrogen 3.303 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.911 N/A VAL 134.A N SER 130.A O no hydrogen 3.027 N/A ALA 135.A N GLU 131.A O no hydrogen 2.900 N/A ASP 136.A N VAL 132.A O no hydrogen 2.930 N/A MET 137.A N VAL 134.A O no hydrogen 2.995 N/A VAL 138.A N ALA 135.A O no hydrogen 3.354 N/A ASP 139.A N HIS 51.A O no hydrogen 2.785 N/A THR 140.A OG1 HIS 222.A ND1 no hydrogen 2.747 N/A PHE 141.A N ASP 165.A OD2 no hydrogen 2.816 N/A VAL 142.A N GLY 53.A O no hydrogen 2.798 N/A PHE 143.A N ILE 166.A O no hydrogen 2.828 N/A LEU 144.A N THR 55.A O no hydrogen 2.865 N/A THR 145.A N VAL 168.A O no hydrogen 2.729 N/A THR 145.A OG1 VAL 168.A O no hydrogen 2.943 N/A THR 149.A N GLN 152.A O no hydrogen 3.241 N/A THR 149.A OG1 GLU 179.A OE1 no hydrogen 3.304 N/A GLN 152.A N THR 149.A O no hydrogen 3.324 N/A GLN 154.A N LEU 146.A O no hydrogen 2.816 N/A LYS 157.A NZ GLY 128.A O no hydrogen 2.530 N/A LYS 157.A NZ GLU 131.A OE1 no hydrogen 3.246 N/A LYS 157.A NZ GLU 131.A OE2 no hydrogen 2.364 N/A VAL 160.A N LYS 157.A O no hydrogen 3.232 N/A LEU 163.A N VAL 160.A O no hydrogen 2.871 N/A ALA 164.A N LEU 161.A O no hydrogen 3.046 N/A ASP 165.A N PHE 141.A O no hydrogen 2.875 N/A ILE 166.A N PHE 141.A O no hydrogen 3.293 N/A VAL 167.A N PRO 200.A O no hydrogen 3.217 N/A VAL 168.A N PHE 143.A O no hydrogen 2.737 N/A VAL 169.A N LEU 202.A O no hydrogen 2.839 N/A ASN 170.A N THR 145.A O no hydrogen 2.923 N/A ASN 170.A ND2 VAL 60.A O no hydrogen 3.251 N/A LYS 171.A NZ GLY 59.A O no hydrogen 2.944 N/A ALA 172.A N MET 204.A O no hydrogen 3.026 N/A ASP 173.A N LYS 171.A O no hydrogen 2.879 N/A HIS 176.A N ASP 173.A O no hydrogen 3.237 N/A HIS 176.A ND1 LYS 171.A O no hydrogen 3.164 N/A HIS 176.A NE2 ALA 147.A O no hydrogen 2.885 N/A ALA 177.A N GLY 174.A O no hydrogen 3.359 N/A ALA 180.A N HIS 176.A O no hydrogen 2.961 N/A ARG 181.A N ALA 177.A O no hydrogen 2.941 N/A LYS 182.A N VAL 178.A O no hydrogen 3.122 N/A ALA 183.A N GLU 179.A O no hydrogen 3.018 N/A ALA 184.A N ALA 180.A O no hydrogen 2.936 N/A ARG 185.A N ARG 181.A O no hydrogen 2.930 N/A GLU 186.A N LYS 182.A O no hydrogen 2.984 N/A LEU 187.A N ALA 183.A O no hydrogen 3.053 N/A ALA 188.A N ALA 184.A O no hydrogen 2.902 N/A GLY 189.A N ARG 185.A O no hydrogen 2.837 N/A ALA 190.A N GLU 186.A O no hydrogen 2.765 N/A MET 191.A N LEU 187.A O no hydrogen 2.979 N/A ARG 192.A N ALA 188.A O no hydrogen 3.006 N/A LEU 193.A N GLY 189.A O no hydrogen 2.797 N/A ILE 194.A N ALA 190.A O no hydrogen 3.078 N/A TRP 197.A NE1 ASP 165.A O no hydrogen 2.849 N/A LEU 202.A N VAL 167.A O no hydrogen 2.929 N/A MET 204.A N VAL 169.A O no hydrogen 3.073 N/A SER 205.A N THR 210.A O no hydrogen 2.887 N/A SER 205.A OG ASP 173.A OD2 no hydrogen 2.468 N/A ALA 206.A N ASN 170.A OD1 no hydrogen 2.968 N/A GLU 208.A N SER 205.A O no hydrogen 3.277 N/A GLU 208.A N SER 205.A OG no hydrogen 3.218 N/A GLY 209.A N SER 205.A O no hydrogen 2.837 N/A VAL 212.A N GLY 209.A O no hydrogen 3.426 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.669 N/A LEU 215.A N GLY 211.A O no hydrogen 2.964 N/A TRP 216.A N VAL 212.A O no hydrogen 3.334 N/A GLU 217.A N ALA 213.A O no hydrogen 2.993 N/A THR 218.A N GLU 214.A O no hydrogen 3.037 N/A THR 218.A OG1 GLU 214.A O no hydrogen 2.827 N/A VAL 219.A N LEU 215.A O no hydrogen 2.896 N/A LEU 220.A N TRP 216.A O no hydrogen 2.849 N/A LYS 221.A N GLU 217.A O no hydrogen 2.791 N/A HIS 222.A N THR 218.A O no hydrogen 2.932 N/A HIS 222.A ND1 THR 140.A OG1 no hydrogen 2.747 N/A ARG 223.A N VAL 219.A O no hydrogen 3.213 N/A GLN 224.A N LEU 220.A O no hydrogen 2.956 N/A VAL 225.A N LYS 221.A O no hydrogen 2.961 N/A LEU 226.A N HIS 222.A O no hydrogen 3.085 N/A ILE 227.A N ARG 223.A O no hydrogen 2.871 N/A ASP 228.A N GLN 224.A O no hydrogen 2.807 N/A ALA 229.A N VAL 225.A O no hydrogen 3.194 N/A GLY 230.A N ILE 227.A O no hydrogen 3.007 N/A GLU 231.A N LEU 226.A O no hydrogen 2.858 N/A ARG 235.A N GLU 231.A O no hydrogen 2.974 N/A ARG 235.A NE GLU 231.A OE1 no hydrogen 3.488 N/A ARG 236.A N PHE 232.A O no hydrogen 3.271 N/A ARG 236.A NE ASP 139.A OD1 no hydrogen 2.752 N/A ARG 236.A NH1 GLY 47.A O no hydrogen 2.741 N/A ARG 236.A NH2 ALA 49.A O no hydrogen 2.835 N/A ARG 236.A NH2 ASP 139.A OD1 no hydrogen 3.555 N/A ARG 236.A NH2 ASP 139.A OD2 no hydrogen 2.736 N/A ARG 237.A N GLU 233.A O no hydrogen 2.850 N/A ASP 238.A N LYS 234.A O no hydrogen 2.742 N/A GLN 239.A N ARG 235.A O no hydrogen 2.895 N/A GLN 239.A NE2 VAL 138.A O no hydrogen 3.076 N/A GLU 240.A N ARG 236.A O no hydrogen 3.118 N/A VAL 241.A N ARG 237.A O no hydrogen 3.262 N/A ASN 242.A N ASP 238.A O no hydrogen 2.858 N/A TRP 243.A N GLN 239.A O no hydrogen 2.767 N/A MET 244.A N GLU 240.A O no hydrogen 3.049 N/A TRP 245.A N VAL 241.A O no hydrogen 3.010 N/A THR 246.A N ASN 242.A O no hydrogen 2.843 N/A THR 246.A OG1 ASN 242.A O no hydrogen 3.070 N/A MET 247.A N TRP 243.A O no hydrogen 3.014 N/A VAL 248.A N MET 244.A O no hydrogen 3.063 N/A ARG 249.A N TRP 245.A O no hydrogen 2.698 N/A ASP 250.A N THR 246.A O no hydrogen 2.796 N/A ALA 251.A N MET 247.A O no hydrogen 2.957 N/A VAL 252.A N VAL 248.A O no hydrogen 3.171 N/A ILE 253.A N ARG 249.A O no hydrogen 2.988 N/A ASP 254.A N ASP 250.A O no hydrogen 2.824 N/A ARG 255.A N ALA 251.A O no hydrogen 2.947 N/A ARG 255.A NH1 ARG 255.A O no hydrogen 3.039 N/A ARG 255.A NH1 ALA 291.A O no hydrogen 3.111 N/A ARG 255.A NH2 ALA 291.A O no hydrogen 3.160 N/A ARG 255.A NH2 GLU 292.A O no hydrogen 3.032 N/A VAL 256.A N VAL 252.A O no hydrogen 3.201 N/A MET 257.A N ILE 253.A O no hydrogen 2.849 N/A THR 258.A N ASP 254.A O no hydrogen 2.884 N/A THR 258.A OG1 ASP 254.A O no hydrogen 2.926 N/A SER 259.A N VAL 256.A O no hydrogen 3.002 N/A SER 259.A OG VAL 256.A O no hydrogen 3.030 N/A VAL 262.A N SER 259.A OG no hydrogen 3.182 N/A ARG 263.A N SER 259.A O no hydrogen 2.865 N/A ARG 263.A NE THR 258.A O no hydrogen 3.285 N/A GLU 264.A N PRO 260.A O no hydrogen 2.859 N/A ILE 265.A N GLY 261.A O no hydrogen 3.181 N/A ILE 265.A N VAL 262.A O no hydrogen 3.176 N/A ARG 266.A N VAL 262.A O no hydrogen 2.808 N/A ARG 266.A NE GLU 270.A OE2 no hydrogen 3.478 N/A VAL 269.A N ILE 265.A O no hydrogen 2.940 N/A GLU 270.A N ARG 266.A O no hydrogen 2.962 N/A ARG 271.A N ALA 267.A O no hydrogen 3.067 N/A ARG 271.A NE.A GLU 268.A OE1 no hydrogen 3.017 N/A ARG 271.A NH1.A GLU 268.A OE1 no hydrogen 3.373 N/A ARG 271.A NH1.A GLU 268.A OE2 no hydrogen 2.681 N/A ARG 271.A NH2.A GLU 277.A OE2 no hydrogen 2.966 N/A GLN 272.A N GLU 268.A O no hydrogen 3.110 N/A VAL 273.A N VAL 269.A O no hydrogen 3.079 N/A ARG 274.A N GLU 270.A O no hydrogen 2.849 N/A GLU 275.A N ARG 271.A O no hydrogen 2.989 N/A GLY 276.A N VAL 273.A O no hydrogen 2.942 N/A GLU 277.A N GLN 272.A O no hydrogen 2.731 N/A LEU 278.A N GLN 272.A O no hydrogen 3.183 N/A LEU 282.A N THR 279.A OG1 no hydrogen 3.123 N/A ALA 283.A N THR 279.A O no hydrogen 3.082 N/A ALA 284.A N ALA 280.A O no hydrogen 2.923 N/A GLN 285.A N ALA 281.A O no hydrogen 3.064 N/A GLN 285.A NE2 ASP 289.A OD1 no hydrogen 3.091 N/A ARG 286.A N LEU 282.A O no hydrogen 2.797 N/A LEU 287.A N ALA 283.A O no hydrogen 2.944 N/A LEU 288.A N ALA 284.A O no hydrogen 2.943 N/A ASP 289.A N GLN 285.A O no hydrogen 2.872 N/A ALA 290.A N ARG 286.A O no hydrogen 2.947 N/A ALA 291.A N LEU 287.A O no hydrogen 3.170 N/A ALA 291.A N LEU 288.A O no hydrogen 3.144 N/A GLU 292.A N ASP 289.A O no hydrogen 3.067 N/A