Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ka1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N ASP 72.A OD2 no hydrogen 2.877 N/A LYS 3.A NZ GLU 69.A O no hydrogen 2.756 N/A VAL 4.A N GLU 30.A O no hydrogen 2.867 N/A ALA 5.A N VAL 73.A O no hydrogen 2.835 N/A VAL 6.A N SER 32.A O no hydrogen 2.838 N/A LEU 7.A N LEU 75.A O no hydrogen 2.833 N/A GLY 8.A N TYR 34.A O no hydrogen 2.795 N/A ALA 9.A N TYR 34.A O no hydrogen 3.046 N/A ALA 10.A N ASP 35.A OD2 no hydrogen 2.922 N/A GLN 15.A N GLY 11.A O no hydrogen 2.849 N/A GLN 15.A NE2 ALA 10.A O no hydrogen 3.060 N/A ALA 16.A N GLY 12.A O no hydrogen 3.157 N/A LEU 17.A N ILE 13.A O no hydrogen 2.873 N/A ALA 18.A N GLY 14.A O no hydrogen 2.797 N/A LEU 19.A N GLN 15.A O no hydrogen 2.925 N/A LEU 20.A N ALA 16.A O no hydrogen 3.034 N/A LEU 21.A N LEU 17.A O no hydrogen 2.881 N/A LYS 22.A N ALA 18.A O no hydrogen 2.834 N/A LYS 22.A NZ ILE 50.A O no hydrogen 3.171 N/A LYS 22.A NZ THR 52.A OG1 no hydrogen 2.889 N/A LYS 22.A NZ VAL 54.A O no hydrogen 2.777 N/A THR 23.A N LEU 19.A O no hydrogen 3.192 N/A THR 23.A OG1 LEU 19.A O no hydrogen 2.826 N/A THR 23.A OG1 LEU 20.A O no hydrogen 3.186 N/A GLN 24.A N LEU 21.A O no hydrogen 3.306 N/A LEU 25.A N LEU 21.A O no hydrogen 2.894 N/A GLY 28.A N ALA 53.A O no hydrogen 2.814 N/A SER 29.A N PRO 26.A O no hydrogen 3.094 N/A SER 29.A OG PRO 26.A O no hydrogen 2.747 N/A GLU 30.A N MET 2.A O no hydrogen 2.815 N/A LEU 31.A N LYS 55.A O no hydrogen 2.722 N/A SER 32.A N VAL 4.A O no hydrogen 2.856 N/A SER 32.A OG ALA 67.A O no hydrogen 2.657 N/A LEU 33.A N LYS 57.A O no hydrogen 2.899 N/A TYR 34.A N VAL 6.A O no hydrogen 2.914 N/A TYR 34.A OH GLY 61.A O no hydrogen 2.595 N/A ASP 35.A N PHE 59.A O no hydrogen 3.189 N/A ILE 36.A N ASP 35.A OD1 no hydrogen 3.105 N/A THR 40.A N ALA 37.A O no hydrogen 3.182 N/A THR 40.A OG1 ALA 37.A O no hydrogen 2.813 N/A VAL 43.A N VAL 39.A O no hydrogen 3.007 N/A ALA 44.A N THR 40.A O no hydrogen 3.208 N/A VAL 45.A N PRO 41.A O no hydrogen 3.018 N/A ASP 46.A N GLY 42.A O no hydrogen 2.861 N/A LEU 47.A N VAL 43.A O no hydrogen 3.057 N/A SER 48.A N ALA 44.A O no hydrogen 2.753 N/A SER 48.A OG VAL 45.A O no hydrogen 2.675 N/A HIS 49.A N ASP 46.A O no hydrogen 3.160 N/A ILE 50.A N LEU 47.A O no hydrogen 3.046 N/A THR 52.A N ILE 50.A O no hydrogen 2.820 N/A THR 52.A OG1 LYS 22.A O no hydrogen 2.762 N/A LYS 55.A N SER 29.A O no hydrogen 3.138 N/A LYS 57.A N LEU 31.A O no hydrogen 3.167 N/A PHE 59.A N LEU 33.A O no hydrogen 2.835 N/A GLY 61.A N ILE 36.A O no hydrogen 3.321 N/A ALA 64.A N GLN 100.A OE1 no hydrogen 2.778 N/A THR 65.A N ASP 63.A OD1 no hydrogen 3.064 N/A THR 65.A OG1 ASP 63.A OD1 no hydrogen 2.477 N/A THR 65.A OG1 ASP 63.A OD2 no hydrogen 3.469 N/A ALA 67.A N ALA 64.A O no hydrogen 2.972 N/A LEU 68.A N ALA 64.A O no hydrogen 3.240 N/A LEU 68.A N THR 65.A O no hydrogen 2.937 N/A GLU 69.A N THR 65.A O no hydrogen 3.137 N/A ALA 71.A N LEU 68.A O no hydrogen 2.954 N/A ASP 72.A N LYS 3.A O no hydrogen 2.808 N/A VAL 73.A N LYS 3.A O no hydrogen 3.172 N/A VAL 74.A N CYS 109.A O no hydrogen 2.796 N/A LEU 75.A N ALA 5.A O no hydrogen 2.803 N/A ILE 76.A N GLY 111.A O no hydrogen 2.884 N/A SER 77.A N LEU 7.A O no hydrogen 2.796 N/A SER 77.A OG GLY 8.A O no hydrogen 3.364 N/A VAL 80.A N ASN 90.A OD1 no hydrogen 2.837 N/A ARG 82.A NH1 HIS 173.A O no hydrogen 2.842 N/A VAL 89.A N LEU 86.A O no hydrogen 3.185 N/A ASN 90.A N LEU 86.A O no hydrogen 2.901 N/A ASN 90.A ND2 VAL 80.A O no hydrogen 3.029 N/A ASN 90.A ND2 ASN 115.A O no hydrogen 2.884 N/A ALA 91.A N PHE 87.A O no hydrogen 2.996 N/A VAL 94.A N ASN 90.A O no hydrogen 3.004 N/A LYS 95.A N ALA 91.A O no hydrogen 3.027 N/A ASN 96.A N GLY 92.A O no hydrogen 2.948 N/A LEU 97.A N ILE 93.A O no hydrogen 3.093 N/A VAL 98.A N VAL 94.A O no hydrogen 2.885 N/A GLN 99.A N LYS 95.A O no hydrogen 2.993 N/A GLN 100.A N ASN 96.A O no hydrogen 3.329 N/A GLN 100.A NE2 ASN 96.A O no hydrogen 3.588 N/A VAL 101.A N LEU 97.A O no hydrogen 3.018 N/A ALA 102.A N VAL 98.A O no hydrogen 2.869 N/A LYS 103.A N GLN 99.A O no hydrogen 3.221 N/A THR 104.A N GLN 100.A O no hydrogen 3.074 N/A THR 104.A N VAL 101.A O no hydrogen 3.264 N/A THR 104.A OG1 GLN 100.A O no hydrogen 3.187 N/A CYS 105.A N VAL 101.A O no hydrogen 2.940 N/A CYS 105.A SG LEU 68.A O no hydrogen 3.576 N/A ALA 108.A N CYS 105.A O no hydrogen 2.996 N/A CYS 109.A N ASP 72.A O no hydrogen 2.983 N/A ILE 110.A N LYS 138.A O no hydrogen 2.795 N/A GLY 111.A N VAL 74.A O no hydrogen 2.780 N/A ILE 112.A N PHE 140.A O no hydrogen 2.759 N/A ILE 113.A N ILE 76.A O no hydrogen 2.824 N/A THR 114.A N ILE 76.A O no hydrogen 3.077 N/A THR 114.A OG1 ILE 76.A O no hydrogen 3.225 N/A THR 114.A OG1 ALA 78.A O no hydrogen 2.704 N/A VAL 117.A N ASN 115.A OD1 no hydrogen 2.977 N/A ASN 118.A ND2 THR 177.A OG1 no hydrogen 3.222 N/A ASN 118.A ND2 ASP 298.A OD2 no hydrogen 3.024 N/A THR 119.A N PRO 116.A O no hydrogen 2.907 N/A THR 119.A OG1 ASP 298.A O no hydrogen 2.752 N/A THR 120.A N PRO 116.A O no hydrogen 2.840 N/A THR 120.A OG1 THR 114.A O no hydrogen 2.838 N/A THR 120.A OG1 PRO 116.A O no hydrogen 3.254 N/A VAL 121.A N VAL 117.A O no hydrogen 3.172 N/A ILE 123.A N THR 119.A O no hydrogen 3.073 N/A ALA 124.A N THR 120.A O no hydrogen 2.952 N/A ALA 125.A N VAL 121.A O no hydrogen 2.904 N/A GLU 126.A N ALA 122.A O no hydrogen 3.093 N/A VAL 127.A N ILE 123.A O no hydrogen 2.957 N/A LEU 128.A N ALA 124.A O no hydrogen 2.922 N/A LYS 129.A N ALA 125.A O no hydrogen 2.871 N/A LYS 129.A NZ GLU 126.A OE2 no hydrogen 3.511 N/A LYS 130.A N GLU 126.A O no hydrogen 2.950 N/A ALA 131.A N VAL 127.A O no hydrogen 3.065 N/A GLY 132.A N LYS 129.A O no hydrogen 2.942 N/A VAL 133.A N LEU 128.A O no hydrogen 3.010 N/A TYR 134.A OH GLU 251.A OE1 no hydrogen 2.656 N/A ASN 137.A N ASP 135.A OD1 no hydrogen 2.886 N/A LYS 138.A N ASP 135.A O no hydrogen 2.928 N/A LYS 138.A NZ LYS 107.A O no hydrogen 2.965 N/A PHE 140.A N ILE 110.A O no hydrogen 2.842 N/A GLY 141.A N TYR 249.A O no hydrogen 2.737 N/A VAL 142.A N ILE 112.A O no hydrogen 2.942 N/A ASP 146.A N THR 143.A O no hydrogen 2.885 N/A ILE 148.A N THR 144.A O no hydrogen 2.965 N/A ARG 149.A N LEU 145.A O no hydrogen 3.056 N/A SER 150.A N ASP 146.A O no hydrogen 3.047 N/A SER 150.A OG ASP 146.A O no hydrogen 2.842 N/A ASN 151.A N ILE 147.A O no hydrogen 2.901 N/A ASN 151.A ND2 GLU 166.A OE1 no hydrogen 2.968 N/A THR 152.A N ILE 148.A O no hydrogen 3.026 N/A THR 152.A OG1 ILE 148.A O no hydrogen 2.992 N/A PHE 153.A N ARG 149.A O no hydrogen 2.921 N/A VAL 154.A N SER 150.A O no hydrogen 2.892 N/A ALA 155.A N ASN 151.A O no hydrogen 2.991 N/A GLU 156.A N THR 152.A O no hydrogen 3.011 N/A LEU 157.A N PHE 153.A O no hydrogen 3.012 N/A LYS 158.A N VAL 154.A O no hydrogen 2.990 N/A LYS 158.A NZ SER 189.A O no hydrogen 2.690 N/A LYS 158.A NZ GLU 194.A OE2 no hydrogen 3.307 N/A LYS 160.A N ALA 155.A O no hydrogen 3.020 N/A GLU 164.A N GLN 161.A O no hydrogen 2.947 N/A VAL 165.A N PRO 162.A O no hydrogen 3.319 N/A VAL 167.A N ASN 151.A OD1 no hydrogen 2.834 N/A ILE 170.A N LEU 179.A O no hydrogen 2.938 N/A GLY 171.A N SER 261.A O no hydrogen 2.951 N/A GLY 172.A N THR 177.A O no hydrogen 2.708 N/A HIS 173.A N ASN 118.A OD1 no hydrogen 2.812 N/A HIS 173.A ND1 ASP 146.A OD2 no hydrogen 2.734 N/A SER 174.A N THR 177.A OG1 no hydrogen 3.138 N/A THR 177.A N SER 174.A O no hydrogen 3.011 N/A THR 177.A OG1 SER 174.A O no hydrogen 2.616 N/A ILE 178.A N GLY 175.A O no hydrogen 3.064 N/A LEU 179.A N ILE 170.A O no hydrogen 3.033 N/A LEU 181.A N PRO 168.A O no hydrogen 2.771 N/A SER 183.A N GLU 284.A OE2 no hydrogen 2.879 N/A SER 183.A OG GLU 284.A OE1 no hydrogen 2.731 N/A SER 183.A OG GLU 284.A OE2 no hydrogen 3.223 N/A GLN 184.A N LEU 181.A O no hydrogen 3.000 N/A GLN 184.A NE2 ILE 277.A O no hydrogen 2.821 N/A GLN 184.A NE2 THR 279.A O no hydrogen 2.980 N/A VAL 185.A N LEU 182.A O no hydrogen 3.315 N/A VAL 188.A N VAL 185.A O no hydrogen 3.396 N/A THR 191.A N GLU 194.A OE2 no hydrogen 3.009 N/A GLN 193.A NE2 ASP 197.A OD1 no hydrogen 2.891 N/A GLN 193.A NE2 ASP 197.A OD2 no hydrogen 3.278 N/A GLU 194.A N THR 191.A OG1 no hydrogen 3.027 N/A VAL 195.A N THR 191.A O no hydrogen 2.953 N/A ALA 196.A N GLU 192.A O no hydrogen 3.087 N/A ASP 197.A N GLN 193.A O no hydrogen 3.025 N/A LEU 198.A N GLU 194.A O no hydrogen 2.828 N/A THR 199.A N VAL 195.A O no hydrogen 2.860 N/A THR 199.A OG1 VAL 195.A O no hydrogen 2.759 N/A LYS 200.A N ALA 196.A O no hydrogen 3.084 N/A ARG 201.A N ASP 197.A O no hydrogen 2.943 N/A ARG 201.A NE GLU 208.A OE2 no hydrogen 2.705 N/A ARG 201.A NH1 GLU 156.A OE1 no hydrogen 3.249 N/A ARG 201.A NH2 GLU 208.A OE1 no hydrogen 3.197 N/A ILE 202.A N LEU 198.A O no hydrogen 2.905 N/A GLN 203.A N THR 199.A O no hydrogen 2.917 N/A GLN 203.A NE2 ILE 178.A O no hydrogen 2.890 N/A ASN 204.A N ARG 201.A O no hydrogen 3.193 N/A ASN 204.A ND2 LYS 200.A O no hydrogen 2.790 N/A ALA 205.A N ILE 202.A O no hydrogen 3.501 N/A THR 207.A N ASN 204.A O no hydrogen 2.932 N/A THR 207.A OG1 ASN 204.A O no hydrogen 3.226 N/A GLU 208.A N ALA 205.A O no hydrogen 3.066 N/A VAL 210.A N GLY 206.A O no hydrogen 3.054 N/A GLU 211.A N THR 207.A O no hydrogen 2.876 N/A ALA 212.A N GLU 208.A O no hydrogen 3.058 N/A LYS 213.A N VAL 209.A O no hydrogen 2.936 N/A LYS 213.A NZ SER 218.A O no hydrogen 2.763 N/A ALA 214.A N GLU 211.A O no hydrogen 2.950 N/A GLY 215.A N VAL 210.A O no hydrogen 2.923 N/A GLY 216.A N LYS 213.A O no hydrogen 2.908 N/A SER 218.A OG ARG 82.A O no hydrogen 3.195 N/A THR 220.A N SER 218.A O no hydrogen 3.013 N/A MET 223.A N ALA 219.A O no hydrogen 3.191 N/A GLY 224.A N THR 220.A O no hydrogen 2.912 N/A GLN 225.A N LEU 221.A O no hydrogen 2.966 N/A GLN 225.A NE2 GLN 225.A O no hydrogen 2.738 N/A ALA 226.A N SER 222.A O no hydrogen 2.866 N/A ALA 227.A N MET 223.A O no hydrogen 2.875 N/A ALA 228.A N GLY 224.A O no hydrogen 2.867 N/A ARG 229.A N GLN 225.A O no hydrogen 2.874 N/A ARG 229.A NE GLU 246.A OE1 no hydrogen 3.258 N/A ARG 229.A NE GLU 246.A OE2 no hydrogen 3.155 N/A ARG 229.A NH1 GLU 166.A OE1 no hydrogen 3.273 N/A ARG 229.A NH2 GLU 166.A OE1 no hydrogen 3.508 N/A ARG 229.A NH2 GLU 166.A OE2 no hydrogen 2.763 N/A ARG 229.A NH2 GLU 246.A OE1 no hydrogen 3.033 N/A PHE 230.A N ALA 226.A O no hydrogen 3.051 N/A GLY 231.A N ALA 227.A O no hydrogen 2.842 N/A LEU 232.A N ALA 228.A O no hydrogen 2.811 N/A SER 233.A N ARG 229.A O no hydrogen 3.010 N/A SER 233.A OG ARG 229.A O no hydrogen 3.111 N/A SER 233.A OG GLU 246.A OE2 no hydrogen 2.651 N/A LEU 234.A N PHE 230.A O no hydrogen 2.932 N/A VAL 235.A N GLY 231.A O no hydrogen 2.958 N/A ARG 236.A N LEU 232.A O no hydrogen 2.936 N/A ARG 236.A NE GLU 241.A OE2 no hydrogen 3.412 N/A ALA 237.A N SER 233.A O no hydrogen 2.998 N/A LEU 238.A N LEU 234.A O no hydrogen 2.857 N/A GLN 239.A N VAL 235.A O no hydrogen 2.983 N/A GLY 240.A N ALA 237.A O no hydrogen 2.999 N/A GLU 241.A N ARG 236.A O no hydrogen 2.945 N/A GLU 246.A N LEU 264.A O no hydrogen 2.972 N/A CYS 247.A SG VAL 169.A O no hydrogen 3.443 N/A ALA 248.A N GLN 262.A O no hydrogen 3.405 N/A TYR 249.A N GLY 141.A O no hydrogen 3.043 N/A TYR 249.A OH ASN 118.A O no hydrogen 2.842 N/A VAL 250.A N PHE 260.A O no hydrogen 3.235 N/A GLY 252.A N ARG 258.A O no hydrogen 3.313 N/A GLN 255.A N ASP 253.A OD1 no hydrogen 3.009 N/A ARG 258.A NE GLU 251.A OE2 no hydrogen 2.932 N/A ARG 258.A NH1 GLU 126.A OE2 no hydrogen 2.797 N/A ARG 258.A NH1 GLU 303.A OE2 no hydrogen 2.735 N/A ARG 258.A NH2 GLU 126.A OE2 no hydrogen 3.086 N/A ARG 258.A NH2 GLU 251.A OE1 no hydrogen 3.023 N/A PHE 260.A N VAL 250.A O no hydrogen 2.963 N/A SER 261.A N GLY 171.A O no hydrogen 2.722 N/A GLN 262.A N ALA 248.A O no hydrogen 3.390 N/A GLN 262.A NE2 LYS 275.A O no hydrogen 2.727 N/A LEU 264.A N GLU 246.A O no hydrogen 2.899 N/A LEU 265.A N GLU 273.A O no hydrogen 2.901 N/A LEU 266.A N VAL 244.A O no hydrogen 2.803 N/A GLY 267.A N GLY 270.A O no hydrogen 2.727 N/A LYS 268.A NZ LEU 238.A O no hydrogen 2.887 N/A GLY 270.A N GLY 267.A O no hydrogen 3.121 N/A VAL 271.A N ASN 137.A O no hydrogen 2.816 N/A GLU 272.A N LEU 265.A O no hydrogen 2.754 N/A GLU 273.A N LEU 265.A O no hydrogen 3.155 N/A ARG 274.A NE GLU 251.A O no hydrogen 2.919 N/A ARG 274.A NH1 ASN 137.A OD1 no hydrogen 2.843 N/A ARG 274.A NH2 ASN 137.A OD1 no hydrogen 3.246 N/A ARG 274.A NH2 GLU 251.A O no hydrogen 2.686 N/A LYS 275.A N PRO 263.A O no hydrogen 2.896 N/A GLY 278.A N SER 276.A OG no hydrogen 3.104 N/A SER 281.A N GLU 284.A OE1 no hydrogen 2.899 N/A GLU 284.A N SER 281.A OG no hydrogen 3.185 N/A GLN 285.A N SER 281.A O no hydrogen 2.843 N/A GLN 285.A NE2 LEU 280.A O no hydrogen 2.904 N/A ASN 286.A N ALA 282.A O no hydrogen 3.050 N/A ALA 287.A N PHE 283.A O no hydrogen 2.956 N/A LEU 288.A N GLU 284.A O no hydrogen 2.867 N/A GLU 289.A N GLN 285.A O no hydrogen 3.060 N/A GLY 290.A N ASN 286.A O no hydrogen 2.907 N/A MET 291.A N LEU 288.A O no hydrogen 3.327 N/A LEU 292.A N GLU 289.A O no hydrogen 3.399 N/A LEU 295.A N MET 291.A O no hydrogen 2.982 N/A LYS 296.A N LEU 292.A O no hydrogen 2.949 N/A LYS 297.A N ASP 293.A O no hydrogen 3.062 N/A ASP 298.A N THR 294.A O no hydrogen 2.955 N/A ILE 299.A N LEU 295.A O no hydrogen 3.017 N/A ALA 300.A N LYS 296.A O no hydrogen 2.964 N/A LEU 301.A N LYS 297.A O no hydrogen 3.025 N/A GLU 303.A N ILE 299.A O no hydrogen 3.007 N/A GLU 304.A N ALA 300.A O no hydrogen 2.876 N/A PHE 305.A N LEU 301.A O no hydrogen 3.277 N/A VAL 306.A N GLU 303.A O no hydrogen 3.255 N/A ASN 307.A N GLU 303.A O no hydrogen 2.983 N/A ASN 307.A ND2 GLU 126.A OE1 no hydrogen 2.867 N/A