Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1rke_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 5.A N ASP 260.A OD1 no hydrogen 3.332 N/A HIS 9.A NE2 ASP 131.A OD1 no hydrogen 2.522 N/A ARG 11.A N GLU 185.A O no hydrogen 2.806 N/A ARG 11.A NE GLN 184.A O no hydrogen 2.670 N/A ARG 11.A NH2 GLN 184.A O no hydrogen 3.422 N/A THR 12.A N GLU 185.A OE2 no hydrogen 2.926 N/A THR 12.A OG1 GLU 185.A OE2 no hydrogen 2.448 N/A ILE 13.A N THR 10.A OG1 no hydrogen 3.067 N/A GLU 14.A N THR 10.A O no hydrogen 3.285 N/A SER 15.A N ARG 11.A O no hydrogen 2.880 N/A SER 15.A OG ARG 11.A O no hydrogen 3.172 N/A SER 15.A OG THR 12.A O no hydrogen 3.212 N/A ILE 16.A N THR 12.A O no hydrogen 3.102 N/A LEU 17.A N ILE 13.A O no hydrogen 3.182 N/A GLU 18.A N GLU 14.A O no hydrogen 3.011 N/A ALA 21.A N LEU 17.A O no hydrogen 2.815 N/A GLN 22.A N GLU 18.A O no hydrogen 2.939 N/A GLN 23.A N PRO 19.A O no hydrogen 3.009 N/A ILE 24.A N VAL 20.A O no hydrogen 2.897 N/A SER 25.A N ALA 21.A O no hydrogen 2.861 N/A SER 25.A OG GLN 22.A O no hydrogen 2.801 N/A HIS 26.A N.A GLN 23.A O no hydrogen 3.188 N/A HIS 26.A N.B GLN 23.A O no hydrogen 3.190 N/A VAL 28.A N ILE 24.A O no hydrogen 2.946 N/A ILE 29.A N SER 25.A O no hydrogen 3.055 N/A MET 30.A N HIS 26.A O.A no hydrogen 3.075 N/A MET 30.A N HIS 26.A O.B no hydrogen 3.142 N/A HIS 31.A N LEU 27.A O no hydrogen 2.951 N/A GLU 32.A N VAL 28.A O no hydrogen 3.169 N/A GLU 33.A N ILE 29.A O no hydrogen 3.016 N/A GLY 34.A N MET 30.A O no hydrogen 2.975 N/A GLU 35.A N HIS 31.A O no hydrogen 3.071 N/A VAL 36.A N GLU 32.A O no hydrogen 2.782 N/A LYS 39.A N GLU 33.A O no hydrogen 3.111 N/A LYS 39.A NZ GLU 33.A OE1 no hydrogen 3.530 N/A ILE 41.A N PRO 103.A O no hydrogen 3.172 N/A THR 45.A N ASP 43.A OD2 no hydrogen 2.897 N/A THR 45.A OG1 ASP 43.A OD2 no hydrogen 2.875 N/A VAL 48.A N LEU 44.A O no hydrogen 2.926 N/A ALA 49.A N THR 45.A O no hydrogen 2.995 N/A ALA 50.A N ALA 46.A O no hydrogen 2.958 N/A VAL 51.A N PRO 47.A O no hydrogen 2.942 N/A GLN 52.A N VAL 48.A O no hydrogen 2.939 N/A ALA 53.A N ALA 49.A O no hydrogen 2.897 N/A ALA 54.A N ALA 50.A O no hydrogen 3.073 N/A ALA 54.A N VAL 51.A O no hydrogen 3.103 N/A VAL 55.A N GLN 52.A O no hydrogen 3.107 N/A SER 56.A N GLN 52.A O no hydrogen 2.860 N/A SER 56.A OG GLN 52.A O no hydrogen 3.437 N/A VAL 59.A N VAL 55.A O no hydrogen 2.791 N/A ARG 60.A N SER 56.A O no hydrogen 2.789 N/A ARG 60.A NH2 ASN 57.A OD1 no hydrogen 3.065 N/A VAL 61.A N ASN 57.A O no hydrogen 2.526 N/A GLY 62.A N VAL 59.A O no hydrogen 3.260 N/A LYS 63.A N VAL 59.A O no hydrogen 2.958 N/A LYS 63.A N ARG 60.A O no hydrogen 2.907 N/A LYS 63.A NZ GLU 86.A OE2 no hydrogen 3.083 N/A GLU 64.A N ARG 60.A O no hydrogen 3.185 N/A THR 68.A N THR 65.A O no hydrogen 3.035 N/A GLN 72.A NE2 GLU 70.A O no hydrogen 2.893 N/A LEU 74.A N ASP 71.A OD2 no hydrogen 2.766 N/A LYS 75.A N ASP 71.A O no hydrogen 3.069 N/A LYS 75.A NZ THR 69.A O no hydrogen 2.465 N/A ARG 76.A N GLN 72.A O no hydrogen 2.952 N/A ASP 77.A N ILE 73.A O no hydrogen 2.926 N/A MET 78.A N LEU 74.A O no hydrogen 2.760 N/A ALA 81.A N MET 78.A O no hydrogen 2.793 N/A PHE 82.A N MET 78.A O no hydrogen 3.197 N/A ILE 83.A N PRO 79.A O no hydrogen 3.089 N/A LYS 84.A N PRO 80.A O no hydrogen 3.301 N/A LYS 84.A NZ SER 121.A OG no hydrogen 2.488 N/A LYS 84.A NZ ASP 125.A OD2 no hydrogen 3.023 N/A VAL 85.A N ALA 81.A O no hydrogen 3.204 N/A GLU 86.A N PHE 82.A O no hydrogen 2.648 N/A ASN 87.A N ILE 83.A O no hydrogen 2.992 N/A ALA 88.A N LYS 84.A O no hydrogen 3.238 N/A ALA 88.A N VAL 85.A O no hydrogen 2.881 N/A CYS 89.A N VAL 85.A O no hydrogen 3.006 N/A THR 90.A N GLU 86.A O no hydrogen 3.023 N/A THR 90.A OG1 GLU 86.A O no hydrogen 3.273 N/A LYS 91.A N ASN 87.A O no hydrogen 3.095 N/A LYS 91.A NZ ASP 114.A OD2 no hydrogen 3.338 N/A LEU 92.A N ALA 88.A O no hydrogen 2.907 N/A VAL 93.A N CYS 89.A O no hydrogen 2.783 N/A GLN 94.A N THR 90.A O no hydrogen 3.017 N/A ALA 95.A N LYS 91.A O no hydrogen 3.052 N/A ALA 96.A N LEU 92.A O no hydrogen 3.095 N/A GLN 97.A N VAL 93.A O no hydrogen 2.993 N/A MET 98.A N GLN 94.A O no hydrogen 2.689 N/A LEU 99.A N ALA 95.A O no hydrogen 2.859 N/A GLN 100.A N GLN 97.A O no hydrogen 3.185 N/A GLN 100.A NE2 ASP 43.A OD1 no hydrogen 2.904 N/A SER 101.A N MET 98.A O no hydrogen 3.283 N/A ASP 102.A N MET 98.A O no hydrogen 3.084 N/A TYR 104.A N ASP 102.A OD1 no hydrogen 2.962 N/A SER 105.A N ASP 102.A O no hydrogen 2.984 N/A ALA 108.A N SER 105.A OG no hydrogen 3.334 N/A ARG 109.A NE GLU 35.A OE2 no hydrogen 3.231 N/A ARG 109.A NH2 TYR 104.A O no hydrogen 3.534 N/A ASP 110.A N VAL 106.A O no hydrogen 3.122 N/A TYR 111.A N PRO 107.A O no hydrogen 3.363 N/A LEU 112.A N ALA 108.A O no hydrogen 2.681 N/A ILE 113.A N ARG 109.A O no hydrogen 3.165 N/A ASP 114.A N ASP 110.A O no hydrogen 2.992 N/A GLY 115.A N TYR 111.A O no hydrogen 2.760 N/A SER 116.A N LEU 112.A O no hydrogen 3.073 N/A SER 116.A OG LEU 112.A O no hydrogen 2.857 N/A ARG 117.A N ILE 113.A O no hydrogen 2.901 N/A ARG 117.A NH1 ASP 114.A OD1 no hydrogen 3.122 N/A GLY 118.A N ASP 114.A O no hydrogen 2.942 N/A ILE 119.A N GLY 115.A O no hydrogen 2.835 N/A LEU 120.A N SER 116.A O no hydrogen 3.374 N/A SER 121.A N ARG 117.A O no hydrogen 2.967 N/A GLY 122.A N GLY 118.A O no hydrogen 2.710 N/A THR 123.A N ILE 119.A O no hydrogen 2.934 N/A THR 123.A OG1 ILE 119.A O no hydrogen 2.643 N/A SER 124.A N LEU 120.A O no hydrogen 3.019 N/A ASP 125.A N SER 121.A O no hydrogen 3.003 N/A LEU 126.A N GLY 122.A O no hydrogen 2.996 N/A LEU 127.A N THR 123.A O no hydrogen 2.990 N/A LEU 128.A N SER 124.A O no hydrogen 2.943 N/A THR 129.A N ASP 125.A O no hydrogen 3.024 N/A THR 129.A OG1 ASP 125.A O no hydrogen 2.632 N/A PHE 130.A N LEU 126.A O no hydrogen 2.979 N/A ASP 131.A N LEU 127.A O no hydrogen 2.985 N/A GLU 132.A N LEU 128.A O no hydrogen 2.940 N/A GLU 134.A N PHE 130.A O no hydrogen 3.033 N/A VAL 135.A N ASP 131.A O no hydrogen 3.001 N/A ARG 136.A N GLU 132.A O no hydrogen 3.018 N/A ARG 136.A NE ASP 71.A OD1 no hydrogen 2.811 N/A ARG 136.A NH2 ASP 71.A OD1 no hydrogen 3.221 N/A ARG 136.A NH2 ASP 71.A OD2 no hydrogen 2.922 N/A LYS 137.A N ALA 133.A O no hydrogen 2.997 N/A LYS 137.A NZ GLU 134.A OE2 no hydrogen 2.690 N/A ILE 138.A N GLU 134.A O no hydrogen 3.046 N/A ILE 139.A N VAL 135.A O no hydrogen 2.963 N/A ARG 140.A N ARG 136.A O no hydrogen 3.068 N/A VAL 141.A N ILE 138.A O no hydrogen 2.809 N/A CYS 142.A N ILE 138.A O no hydrogen 3.075 N/A CYS 142.A SG ILE 138.A O no hydrogen 3.426 N/A LYS 143.A N ILE 139.A O no hydrogen 2.866 N/A GLY 144.A N ARG 140.A O no hydrogen 3.072 N/A ILE 145.A N VAL 141.A O no hydrogen 3.276 N/A LEU 146.A N CYS 142.A O no hydrogen 2.968 N/A GLU 147.A N LYS 143.A O no hydrogen 3.053 N/A TYR 148.A N GLY 144.A O no hydrogen 3.185 N/A LEU 149.A N ILE 145.A O no hydrogen 2.920 N/A THR 150.A N LEU 146.A O no hydrogen 3.275 N/A VAL 151.A N TYR 148.A O no hydrogen 2.810 N/A ALA 152.A N LEU 149.A O no hydrogen 3.275 N/A VAL 154.A N VAL 151.A O no hydrogen 2.672 N/A VAL 155.A N ALA 152.A O no hydrogen 3.128 N/A LEU 161.A N THR 157.A O no hydrogen 2.843 N/A VAL 162.A N MET 158.A O no hydrogen 2.809 N/A THR 163.A N GLU 159.A O no hydrogen 3.203 N/A THR 163.A OG1 GLU 159.A O no hydrogen 2.810 N/A TYR 164.A N ASP 160.A O no hydrogen 2.600 N/A TYR 164.A OH TYR 148.A O no hydrogen 2.809 N/A THR 165.A N LEU 161.A O no hydrogen 2.855 N/A THR 165.A OG1 LEU 161.A O no hydrogen 3.160 N/A LYS 166.A N VAL 162.A O no hydrogen 3.350 N/A ASN 167.A N THR 163.A O no hydrogen 3.265 N/A ASN 167.A N TYR 164.A O no hydrogen 2.924 N/A ASN 167.A ND2 TYR 148.A OH no hydrogen 2.930 N/A LEU 168.A N TYR 164.A O no hydrogen 2.918 N/A GLY 169.A N THR 165.A O no hydrogen 3.131 N/A MET 172.A N LEU 168.A O no hydrogen 3.140 N/A THR 173.A N GLY 169.A O no hydrogen 3.184 N/A THR 173.A OG1 GLY 169.A O no hydrogen 2.821 N/A LYS 174.A N PRO 170.A O no hydrogen 2.860 N/A MET 175.A N GLY 171.A O no hydrogen 3.197 N/A ALA 176.A N MET 172.A O no hydrogen 3.023 N/A LYS 177.A N THR 173.A O no hydrogen 2.921 N/A LYS 177.A NZ GLU 181.A OE2 no hydrogen 2.426 N/A MET 178.A N LYS 174.A O no hydrogen 2.843 N/A ILE 179.A N MET 175.A O no hydrogen 2.857 N/A ASP 180.A N ALA 176.A O no hydrogen 2.994 N/A GLU 181.A N LYS 177.A O no hydrogen 2.991 N/A ARG 182.A N MET 178.A O no hydrogen 2.709 N/A ARG 182.A NH1 ASP 131.A OD2 no hydrogen 2.749 N/A ARG 182.A NH2 ASP 131.A OD1 no hydrogen 3.235 N/A GLN 183.A N ILE 179.A O no hydrogen 2.872 N/A GLN 183.A NE2 ASP 180.A O no hydrogen 3.359 N/A GLN 184.A N ASP 180.A O no hydrogen 3.082 N/A GLU 185.A N ARG 182.A O no hydrogen 2.779 N/A LEU 186.A N ARG 182.A O no hydrogen 3.357 N/A THR 187.A N HIS 9.A O no hydrogen 3.112 N/A THR 187.A OG1 PHE 8.A O no hydrogen 2.918 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 2.561 N/A HIS 191.A N HIS 188.A O no hydrogen 3.278 N/A ARG 192.A N HIS 188.A O no hydrogen 3.345 N/A VAL 193.A N GLN 189.A O no hydrogen 3.080 N/A MET 194.A N GLU 190.A O no hydrogen 3.195 N/A LEU 195.A N HIS 191.A O no hydrogen 2.896 N/A VAL 196.A N ARG 192.A O no hydrogen 3.075 N/A ASN 197.A N VAL 193.A O no hydrogen 2.926 N/A SER 198.A N MET 194.A O no hydrogen 3.109 N/A SER 198.A OG MET 194.A O no hydrogen 3.021 N/A SER 198.A OG GLU 244.A OE1 no hydrogen 2.843 N/A MET 199.A N LEU 195.A O no hydrogen 3.082 N/A ASN 200.A N VAL 196.A O no hydrogen 3.103 N/A THR 201.A N ASN 197.A O no hydrogen 3.038 N/A THR 201.A OG1 ASN 197.A O no hydrogen 2.973 N/A VAL 202.A N SER 198.A O no hydrogen 2.840 N/A LYS 203.A N MET 199.A O no hydrogen 2.904 N/A GLU 204.A N ASN 200.A O no hydrogen 3.087 N/A GLU 204.A N THR 201.A O no hydrogen 3.237 N/A LEU 205.A N THR 201.A O no hydrogen 3.147 N/A LEU 205.A N VAL 202.A O no hydrogen 3.309 N/A LEU 206.A N VAL 202.A O no hydrogen 3.345 N/A LEU 209.A N LEU 205.A O no hydrogen 2.891 N/A ILE 210.A N LEU 206.A O no hydrogen 3.123 N/A SER 211.A N PRO 207.A O no hydrogen 3.048 N/A ALA 212.A N VAL 208.A O no hydrogen 2.752 N/A MET 213.A N LEU 209.A O no hydrogen 2.898 N/A LYS 214.A N ILE 210.A O no hydrogen 2.811 N/A ILE 215.A N SER 211.A O no hydrogen 3.052 N/A PHE 216.A N ALA 212.A O no hydrogen 3.106 N/A VAL 217.A N MET 213.A O no hydrogen 3.071 N/A THR 218.A N LYS 214.A O no hydrogen 2.999 N/A THR 218.A OG1 LYS 214.A O no hydrogen 2.944 N/A THR 219.A N ILE 215.A O no hydrogen 2.882 N/A THR 219.A OG1 ILE 215.A O no hydrogen 2.672 N/A LYS 220.A N PHE 216.A O no hydrogen 2.762 N/A ASN 221.A N VAL 217.A O no hydrogen 2.914 N/A ASN 221.A N THR 218.A O no hydrogen 3.207 N/A SER 222.A N THR 219.A O no hydrogen 3.030 N/A LEU 231.A N ILE 227.A O no hydrogen 2.983 N/A LYS 232.A N GLU 228.A O no hydrogen 3.094 N/A LYS 232.A NZ LYS 232.A O no hydrogen 3.436 N/A ASN 233.A N GLU 229.A O no hydrogen 2.750 N/A ARG 234.A N ALA 230.A O no hydrogen 3.275 N/A ARG 234.A NE ASN 235.A OD1 no hydrogen 3.209 N/A ARG 234.A NH2 ASN 235.A OD1 no hydrogen 3.164 N/A ASN 235.A N LEU 231.A O no hydrogen 2.959 N/A PHE 236.A N LYS 232.A O no hydrogen 2.727 N/A THR 237.A N ASN 233.A O no hydrogen 3.369 N/A THR 237.A OG1 ASN 233.A O no hydrogen 3.090 N/A VAL 238.A N ARG 234.A O no hydrogen 2.991 N/A GLU 239.A N ASN 235.A O no hydrogen 2.985 N/A LYS 240.A N PHE 236.A O no hydrogen 3.061 N/A MET 241.A N THR 237.A O no hydrogen 2.950 N/A SER 242.A N VAL 238.A O no hydrogen 2.972 N/A SER 242.A OG VAL 238.A O no hydrogen 2.799 N/A ALA 243.A N GLU 239.A O no hydrogen 3.026 N/A GLU 244.A N LYS 240.A O no hydrogen 3.062 N/A ILE 245.A N MET 241.A O no hydrogen 2.937 N/A ASN 246.A N SER 242.A O no hydrogen 2.816 N/A ASN 246.A ND2 SER 242.A O no hydrogen 3.183 N/A GLU 247.A N ALA 243.A O no hydrogen 2.905 N/A ILE 248.A N GLU 244.A O no hydrogen 2.990 N/A ILE 249.A N ILE 245.A O no hydrogen 2.887 N/A ARG 250.A N ASN 246.A O no hydrogen 2.912 N/A ARG 250.A NE GLU 247.A OE1 no hydrogen 3.088 N/A ARG 250.A NE GLU 247.A OE2 no hydrogen 3.407 N/A ARG 250.A NH2 GLU 247.A OE2 no hydrogen 2.921 N/A VAL 251.A N GLU 247.A O no hydrogen 3.109 N/A LEU 252.A N ILE 248.A O no hydrogen 2.998 N/A GLN 253.A N ARG 250.A O no hydrogen 3.231 N/A LEU 254.A N VAL 251.A O no hydrogen 2.632 N/A THR 255.A N GLN 253.A O no hydrogen 2.976 N/A GLU 259.A N SER 256.A O no hydrogen 2.736 N/A ASP 260.A N TRP 257.A O no hydrogen 2.967 N/A