Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3twk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N GLY 180.A O no hydrogen 2.887 N/A VAL 6.A N GLU 2.A O no hydrogen 3.175 N/A GLU 7.A N LEU 3.A O no hydrogen 2.816 N/A ALA 8.A N PRO 4.A O no hydrogen 2.987 N/A ALA 9.A N GLU 5.A O no hydrogen 3.175 N/A ARG 10.A N VAL 6.A O no hydrogen 3.013 N/A ARG 10.A NE GLU 7.A OE1 no hydrogen 2.907 N/A ARG 10.A NE GLU 7.A OE2 no hydrogen 3.294 N/A ARG 10.A NH1 ALA 54.A O no hydrogen 3.206 N/A ARG 10.A NH2 GLU 7.A OE2 no hydrogen 2.946 N/A ARG 11.A N GLU 7.A O no hydrogen 3.028 N/A ARG 11.A NE GLU 7.A OE2 no hydrogen 2.851 N/A ALA 12.A N ALA 8.A O no hydrogen 2.968 N/A ILE 13.A N ALA 9.A O no hydrogen 3.124 N/A GLU 14.A N ARG 10.A O no hydrogen 3.284 N/A GLU 15.A N ARG 11.A O no hydrogen 3.043 N/A CYS 17.A N ILE 13.A O no hydrogen 2.923 N/A GLY 19.A N ILE 51.A O no hydrogen 2.756 N/A LYS 20.A NZ ASN 16.A O no hydrogen 2.856 N/A LYS 21.A N ASP 113.A OD2 no hydrogen 2.652 N/A ILE 22.A N LYS 49.A O no hydrogen 2.818 N/A LYS 23.A N GLU 111.A O no hydrogen 2.840 N/A ARG 24.A N GLU 111.A O no hydrogen 3.423 N/A ARG 24.A NE GLU 111.A OE1 no hydrogen 2.849 N/A ARG 24.A NH2 GLU 111.A OE1 no hydrogen 2.812 N/A ILE 26.A N PHE 109.A O no hydrogen 2.771 N/A ALA 28.A N LYS 107.A O no hydrogen 2.869 N/A LYS 32.A N ASP 30.A OD1 no hydrogen 2.971 N/A VAL 33.A N ASP 30.A OD1 no hydrogen 2.846 N/A ILE 34.A N ASP 30.A O no hydrogen 2.911 N/A HIS 35.A N VAL 129.A O no hydrogen 2.818 N/A ASP 41.A N SER 38.A OG no hydrogen 3.104 N/A PHE 42.A N SER 38.A O no hydrogen 3.043 N/A GLN 43.A N PRO 39.A O no hydrogen 2.848 N/A THR 44.A N SER 40.A O no hydrogen 2.987 N/A THR 44.A OG1 SER 40.A O no hydrogen 3.025 N/A SER 45.A N ASP 41.A O no hydrogen 2.936 N/A ILE 46.A N PHE 42.A O no hydrogen 3.342 N/A LEU 47.A N GLN 43.A O no hydrogen 3.164 N/A GLY 48.A N ILE 22.A O no hydrogen 2.838 N/A LYS 49.A N ILE 46.A O no hydrogen 3.162 N/A LYS 49.A NZ SER 67.A O no hydrogen 2.888 N/A LYS 49.A NZ SER 67.A OG no hydrogen 3.153 N/A LYS 49.A NZ PRO 68.A O no hydrogen 2.880 N/A THR 50.A N ASP 66.A OD2 no hydrogen 2.417 N/A ILE 51.A N LYS 20.A O no hydrogen 3.326 N/A ILE 52.A N GLU 64.A O no hydrogen 2.711 N/A SER 53.A N GLU 64.A O no hydrogen 3.339 N/A SER 53.A OG GLU 64.A OE1 no hydrogen 2.590 N/A ALA 54.A N GLU 14.A OE2 no hydrogen 3.201 N/A ARG 55.A N TRP 62.A O no hydrogen 2.803 N/A ARG 56.A NE GLU 7.A OE1 no hydrogen 2.814 N/A ARG 56.A NH1 GLY 58.A O no hydrogen 2.835 N/A ARG 56.A NH1 ASP 147.A OD1 no hydrogen 2.707 N/A ARG 56.A NH2 ASP 147.A OD1 no hydrogen 3.270 N/A ARG 56.A NH2 ASP 147.A OD2 no hydrogen 2.935 N/A LYS 57.A N ASN 60.A O no hydrogen 2.989 N/A LYS 57.A NZ GLU 151.A OE2 no hydrogen 3.551 N/A GLY 58.A N ASP 147.A OD1 no hydrogen 2.812 N/A LYS 59.A NZ GLN 175.A OE1 no hydrogen 3.348 N/A LYS 59.A NZ ILE 181.A O no hydrogen 2.962 N/A ASN 60.A N LYS 57.A O no hydrogen 2.952 N/A ASN 60.A ND2 LYS 57.A O no hydrogen 3.346 N/A LEU 61.A N PHE 73.A O no hydrogen 2.909 N/A TRP 62.A N ARG 55.A O no hydrogen 2.949 N/A LEU 63.A N PRO 71.A O no hydrogen 3.011 N/A GLU 64.A N SER 53.A O no hydrogen 2.860 N/A ASP 66.A N THR 50.A O no hydrogen 2.814 N/A SER 67.A OG ASP 66.A OD1 no hydrogen 3.492 N/A PHE 70.A N LEU 132.A O no hydrogen 2.769 N/A SER 72.A N ARG 130.A O no hydrogen 2.833 N/A PHE 73.A N LEU 61.A O no hydrogen 2.496 N/A GLN 74.A N LYS 128.A O no hydrogen 2.837 N/A GLY 78.A N PHE 75.A O no hydrogen 2.947 N/A ALA 79.A N THR 121.A O no hydrogen 2.799 N/A TYR 81.A N SER 119.A O no hydrogen 2.748 N/A ILE 82.A N SER 93.A O no hydrogen 2.944 N/A LYS 83.A N GLU 117.A O no hydrogen 2.932 N/A THR 88.A OG1 GLU 15.A OE1 no hydrogen 2.877 N/A LYS 89.A N GLU 15.A OE2 no hydrogen 3.241 N/A TYR 90.A N THR 88.A OG1 no hydrogen 3.107 N/A SER 93.A N TYR 90.A O no hydrogen 3.114 N/A SER 93.A OG ILE 80.A O no hydrogen 2.880 N/A ALA 94.A N LYS 91.A O no hydrogen 3.154 N/A LYS 96.A N GLU 99.A OE2 no hydrogen 2.588 N/A GLU 99.A N LYS 96.A O no hydrogen 2.879 N/A TRP 101.A NE1 GLU 117.A OE1 no hydrogen 2.791 N/A TYR 105.A N SER 103.A OG no hydrogen 2.938 N/A SER 106.A N SER 103.A O no hydrogen 3.116 N/A SER 106.A OG SER 119.A OG no hydrogen 2.868 N/A LYS 107.A N PHE 120.A O no hydrogen 2.820 N/A LYS 107.A NZ ASP 30.A OD2 no hydrogen 2.689 N/A PHE 108.A N PHE 120.A O no hydrogen 3.295 N/A PHE 109.A N ILE 26.A O no hydrogen 2.920 N/A VAL 110.A N LEU 118.A O no hydrogen 2.994 N/A GLU 111.A N ARG 24.A O no hydrogen 2.871 N/A LEU 112.A N LEU 116.A O no hydrogen 2.560 N/A ASP 113.A N LYS 21.A O no hydrogen 3.199 N/A LEU 116.A N ASP 113.A O no hydrogen 3.415 N/A GLU 117.A N LYS 83.A O no hydrogen 2.957 N/A LEU 118.A N VAL 110.A O no hydrogen 2.995 N/A SER 119.A N TYR 81.A O no hydrogen 2.783 N/A SER 119.A OG SER 106.A OG no hydrogen 2.868 N/A SER 119.A OG PHE 108.A O no hydrogen 3.442 N/A PHE 120.A N PHE 108.A O no hydrogen 2.779 N/A THR 121.A N ALA 79.A O no hydrogen 2.791 N/A ASP 122.A N TYR 105.A O no hydrogen 3.159 N/A ARG 125.A N ASP 122.A OD1 no hydrogen 3.053 N/A ARG 125.A NE ASP 30.A OD1 no hydrogen 3.433 N/A ARG 125.A NE ASP 30.A OD2 no hydrogen 2.715 N/A ARG 125.A NH2 ASP 30.A OD1 no hydrogen 2.748 N/A ALA 127.A N ASP 122.A OD2 no hydrogen 2.792 N/A LYS 128.A N GLN 74.A O no hydrogen 2.929 N/A LYS 128.A NZ LYS 32.A O no hydrogen 3.021 N/A VAL 129.A N VAL 33.A O no hydrogen 2.725 N/A ARG 130.A N SER 72.A O no hydrogen 3.099 N/A ARG 130.A NH1 GLN 74.A OE1 no hydrogen 3.072 N/A ARG 130.A NH2 GLN 74.A OE1 no hydrogen 3.278 N/A LEU 132.A N PHE 70.A O no hydrogen 2.906 N/A THR 136.A N ASN 134.A OD1 no hydrogen 2.937 N/A THR 136.A OG1 ASN 134.A OD1 no hydrogen 2.939 N/A SER 137.A N ASN 134.A O no hydrogen 3.105 N/A SER 142.A N VAL 138.A O no hydrogen 3.022 N/A GLU 143.A N PRO 140.A O no hydrogen 3.059 N/A LEU 144.A N ILE 141.A O no hydrogen 3.199 N/A GLY 145.A N GLN 175.A O no hydrogen 2.861 N/A ASP 147.A N GLU 151.A OE2 no hydrogen 3.043 N/A ALA 148.A N SER 179.A O no hydrogen 3.071 N/A LEU 149.A N ASP 147.A OD2 no hydrogen 2.958 N/A LEU 150.A N ASP 147.A OD2 no hydrogen 2.696 N/A GLU 151.A N ASP 147.A O no hydrogen 2.815 N/A GLU 156.A N THR 153.A OG1 no hydrogen 3.152 N/A PHE 157.A N THR 153.A O no hydrogen 2.843 N/A ALA 158.A N VAL 154.A O no hydrogen 3.047 N/A GLU 159.A N ASP 155.A O no hydrogen 3.083 N/A SER 160.A N GLU 156.A O no hydrogen 3.023 N/A SER 160.A OG PHE 157.A O no hydrogen 2.914 N/A SER 160.A OG TYR 177.A OH no hydrogen 2.444 N/A LEU 161.A N PHE 157.A O no hydrogen 3.067 N/A ALA 162.A N ALA 158.A O no hydrogen 3.144 N/A LYS 163.A N SER 160.A O no hydrogen 3.269 N/A LYS 164.A N LEU 161.A O no hydrogen 3.032 N/A THR 167.A N GLU 288.A OE1 no hydrogen 3.074 N/A THR 167.A N GLU 288.A OE2 no hydrogen 3.149 N/A THR 167.A OG1 GLU 288.A OE1 no hydrogen 2.720 N/A ILE 168.A N GLN 199.A O no hydrogen 2.839 N/A LYS 169.A N PRO 197.A O no hydrogen 3.373 N/A LYS 169.A NZ ASP 187.A OD1 no hydrogen 2.901 N/A LYS 169.A NZ THR 266.A OG1 no hydrogen 2.788 N/A LEU 171.A N THR 167.A O no hydrogen 3.416 N/A LEU 172.A N ILE 168.A O no hydrogen 2.930 N/A LEU 173.A N LYS 169.A O no hydrogen 3.265 N/A LEU 173.A N PRO 170.A O no hydrogen 3.216 N/A ASP 174.A N LEU 171.A O no hydrogen 3.061 N/A GLY 176.A N ASP 174.A OD1 no hydrogen 2.993 N/A TYR 177.A N ASP 174.A O no hydrogen 2.979 N/A TYR 177.A OH SER 160.A OG no hydrogen 2.444 N/A ILE 178.A N ASP 174.A O no hydrogen 3.464 N/A SER 179.A N PRO 146.A O no hydrogen 3.028 N/A SER 179.A OG GLY 145.A O no hydrogen 2.897 N/A GLY 182.A N GLU 2.A OE1 no hydrogen 2.995 N/A TRP 184.A N GLU 2.A OE2 no hydrogen 2.822 N/A ILE 185.A N GLU 2.A OE1 no hydrogen 3.044 N/A ALA 186.A N GLY 182.A O no hydrogen 2.933 N/A ASP 187.A N ASN 183.A O no hydrogen 3.148 N/A GLU 188.A N TRP 184.A O no hydrogen 2.946 N/A VAL 189.A N ILE 185.A O no hydrogen 2.862 N/A LEU 190.A N ALA 186.A O no hydrogen 3.052 N/A TYR 191.A N ASP 187.A O no hydrogen 2.882 N/A GLN 192.A N GLU 188.A O no hydrogen 2.906 N/A ALA 193.A N VAL 189.A O no hydrogen 2.910 N/A ARG 194.A N TYR 191.A O no hydrogen 3.072 N/A ARG 194.A NH1 TYR 191.A O no hydrogen 2.846 N/A ILE 195.A N LEU 190.A O no hydrogen 2.985 N/A GLN 199.A N HIS 196.A O no hydrogen 3.045 N/A GLN 199.A NE2 LYS 274.A O no hydrogen 3.680 N/A ALA 201.A N ILE 166.A O no hydrogen 2.930 N/A SER 202.A OG LYS 164.A O no hydrogen 3.279 N/A SER 203.A N THR 200.A O no hydrogen 3.010 N/A SER 203.A OG GLN 199.A OE1 no hydrogen 3.241 N/A SER 203.A OG THR 200.A O no hydrogen 2.648 N/A LEU 204.A N ALA 201.A O no hydrogen 3.168 N/A SER 205.A N GLN 208.A OE1 no hydrogen 3.014 N/A SER 205.A OG GLU 207.A OE1 no hydrogen 3.565 N/A SER 205.A OG GLN 208.A OE1 no hydrogen 3.441 N/A GLU 207.A N GLU 207.A OE1 no hydrogen 2.811 N/A GLN 208.A N SER 205.A OG no hydrogen 3.281 N/A CYS 209.A N SER 205.A O no hydrogen 2.986 N/A CYS 209.A SG LEU 204.A O no hydrogen 4.049 N/A CYS 209.A SG SER 205.A O no hydrogen 3.276 N/A GLU 210.A N LYS 206.A O no hydrogen 3.133 N/A ALA 211.A N GLU 207.A O no hydrogen 3.028 N/A LEU 212.A N GLN 208.A O no hydrogen 2.879 N/A HIS 213.A N CYS 209.A O no hydrogen 2.774 N/A THR 214.A N GLU 210.A O no hydrogen 2.808 N/A THR 214.A OG1 GLU 210.A O no hydrogen 2.923 N/A SER 215.A N ALA 211.A O no hydrogen 2.906 N/A SER 215.A OG VAL 189.A O no hydrogen 2.900 N/A SER 215.A OG LEU 212.A O no hydrogen 3.146 N/A ILE 216.A N LEU 212.A O no hydrogen 2.932 N/A LYS 217.A N HIS 213.A O no hydrogen 3.203 N/A LYS 217.A NZ GLU 221.A OE1 no hydrogen 3.555 N/A LYS 217.A NZ GLU 221.A OE2 no hydrogen 3.371 N/A GLU 218.A N THR 214.A O no hydrogen 3.012 N/A VAL 219.A N SER 215.A O no hydrogen 2.969 N/A ILE 220.A N ILE 216.A O no hydrogen 2.990 N/A GLU 221.A N LYS 217.A O no hydrogen 2.904 N/A LYS 222.A N GLU 218.A O no hydrogen 3.034 N/A ALA 223.A N VAL 219.A O no hydrogen 3.110 N/A VAL 224.A N ILE 220.A O no hydrogen 3.109 N/A GLU 225.A N GLU 221.A O no hydrogen 2.898 N/A VAL 226.A N LYS 222.A O no hydrogen 3.117 N/A ASP 227.A N VAL 224.A O no hydrogen 2.845 N/A ALA 228.A N ALA 223.A O no hydrogen 2.817 N/A ASP 229.A N VAL 226.A O no hydrogen 2.988 N/A SER 231.A N ASP 229.A OD1 no hydrogen 3.274 N/A SER 231.A OG ASP 229.A OD1 no hydrogen 2.711 N/A SER 231.A OG ASP 229.A OD2 no hydrogen 3.194 N/A GLN 232.A N ASP 229.A O no hydrogen 2.820 N/A PHE 233.A N SER 230.A O no hydrogen 2.771 N/A TRP 237.A N PRO 234.A O no hydrogen 3.196 N/A ILE 238.A N GLU 188.A OE2 no hydrogen 2.934 N/A PHE 239.A N GLU 188.A OE1 no hydrogen 2.741 N/A ASN 241.A N ILE 238.A O no hydrogen 3.301 N/A ARG 242.A N PHE 239.A O no hydrogen 3.369 N/A ARG 242.A NE ASP 187.A OD2 no hydrogen 3.114 N/A LYS 244.A N ASN 241.A O no hydrogen 3.395 N/A LYS 248.A N LYS 245.A O no hydrogen 3.055 N/A VAL 251.A N LYS 254.A O no hydrogen 2.910 N/A LYS 254.A N VAL 251.A O no hydrogen 2.823 N/A LYS 254.A NZ GLU 271.A OE2 no hydrogen 3.353 N/A LYS 255.A NZ ASP 257.A OD1 no hydrogen 2.830 N/A ILE 256.A N ALA 249.A O no hydrogen 2.962 N/A ASP 257.A N TYR 268.A O no hydrogen 2.848 N/A ILE 259.A N THR 266.A O no hydrogen 3.024 N/A THR 260.A OG1 THR 265.A OG1 no hydrogen 3.300 N/A ALA 261.A N ARG 264.A O no hydrogen 2.907 N/A ARG 264.A N ALA 261.A O no hydrogen 3.064 N/A THR 265.A OG1 THR 260.A OG1 no hydrogen 3.300 N/A THR 266.A N ILE 259.A O no hydrogen 2.770 N/A ALA 267.A N ASP 187.A OD2 no hydrogen 3.139 N/A TYR 268.A N ASP 257.A O no hydrogen 3.061 N/A VAL 269.A N GLN 273.A OE1 no hydrogen 2.854 N/A LEU 272.A N VAL 269.A O no hydrogen 2.717 N/A GLN 273.A N VAL 269.A O no hydrogen 2.771 N/A GLN 273.A NE2 ILE 195.A O no hydrogen 2.970 N/A LYS 274.A NZ PRO 270.A O no hydrogen 3.517 N/A ASP 281.A N LYS 278.A O no hydrogen 3.160 N/A LYS 282.A N LYS 278.A O no hydrogen 3.087 N/A LEU 283.A N CYS 279.A O no hydrogen 2.929 N/A ALA 284.A N VAL 280.A O no hydrogen 2.984 N/A ALA 285.A N ASP 281.A O no hydrogen 2.999 N/A ALA 286.A N LYS 282.A O no hydrogen 2.964 N/A LEU 287.A N LEU 283.A O no hydrogen 3.008 N/A GLU 288.A N ALA 285.A O no hydrogen 3.071 N/A HIS 290.A N LEU 287.A O no hydrogen 2.969 N/A HIS 291.A N GLU 288.A O no hydrogen 2.987 N/A