Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xrf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A N ASP 113.A OD1 no hydrogen 3.119 N/A ARG 1.A NE GLY 242.A O no hydrogen 2.936 N/A ARG 1.A NH2 VAL 114.A O no hydrogen 3.028 N/A VAL 3.A N CYS 111.A O no hydrogen 3.068 N/A HIS 4.A N CYS 241.A O no hydrogen 3.011 N/A TYR 9.A N ASN 7.A OD1 no hydrogen 3.013 N/A LEU 10.A N ASN 7.A O no hydrogen 3.449 N/A LEU 12.A N TYR 9.A O no hydrogen 3.146 N/A MET 13.A N LEU 10.A O no hydrogen 3.140 N/A ASP 16.A N THR 25.A OG1 no hydrogen 2.845 N/A LEU 18.A N LEU 23.A O no hydrogen 2.809 N/A HIS 20.A N GLU 101.A OE2 no hydrogen 3.202 N/A HIS 20.A ND1 GLU 101.A OE2 no hydrogen 2.860 N/A LEU 21.A N LEU 18.A O no hydrogen 3.135 N/A LEU 21.A N GLU 101.A OE1 no hydrogen 2.910 N/A ASP 22.A N TYR 19.A O no hydrogen 3.426 N/A LEU 23.A N LEU 18.A O no hydrogen 3.241 N/A THR 25.A N ASP 16.A O no hydrogen 3.159 N/A THR 27.A OG1 HIS 28.A ND1 no hydrogen 2.816 N/A HIS 28.A N GLY 24.A O no hydrogen 3.031 N/A HIS 28.A ND1 THR 27.A OG1 no hydrogen 2.816 N/A ALA 32.A N ASN 29.A OD1 no hydrogen 3.422 N/A MET 33.A N ASN 29.A O no hydrogen 2.974 N/A PHE 34.A N LEU 30.A O no hydrogen 2.876 N/A GLY 35.A N PRO 31.A O no hydrogen 3.022 N/A VAL 37.A N PHE 34.A O no hydrogen 2.987 N/A LYS 38.A N PRO 82.A O no hydrogen 2.929 N/A LYS 38.A NZ CYS 112.A O no hydrogen 2.912 N/A PHE 39.A N PRO 82.A O no hydrogen 3.059 N/A VAL 40.A N THR 115.A O no hydrogen 2.856 N/A CYS 41.A N LEU 84.A O no hydrogen 2.761 N/A CYS 41.A SG.B ILE 117.A O no hydrogen 3.731 N/A VAL 42.A N ILE 117.A O no hydrogen 2.971 N/A GLY 43.A N ILE 86.A O no hydrogen 3.195 N/A ARG 48.A N SER 45.A OG no hydrogen 3.357 N/A ARG 48.A NH1 GLN 276.A OE1 no hydrogen 2.897 N/A ARG 48.A NH2 GLN 276.A OE1 no hydrogen 2.714 N/A MET 49.A N SER 45.A O no hydrogen 2.990 N/A LYS 50.A N PRO 46.A O no hydrogen 2.948 N/A LYS 50.A NZ ASP 64.A OD2 no hydrogen 3.409 N/A ALA 51.A N ASN 47.A O no hydrogen 3.028 N/A PHE 52.A N ARG 48.A O no hydrogen 2.944 N/A ALA 53.A N MET 49.A O no hydrogen 2.942 N/A LEU 54.A N LYS 50.A O no hydrogen 3.036 N/A PHE 55.A N ALA 51.A O no hydrogen 2.948 N/A MET 56.A N PHE 52.A O no hydrogen 2.807 N/A HIS 57.A N ALA 53.A O no hydrogen 2.929 N/A LYS 58.A N LEU 54.A O no hydrogen 3.482 N/A GLU 59.A N PHE 55.A O no hydrogen 3.053 N/A LEU 60.A N MET 56.A O no hydrogen 2.819 N/A GLY 61.A N LYS 58.A O no hydrogen 3.140 N/A PHE 62.A N HIS 57.A O no hydrogen 3.197 N/A ILE 68.A N MET 77.A O no hydrogen 2.770 N/A CYS 69.A N ASP 67.A OD1 no hydrogen 2.745 N/A CYS 69.A SG LEU 21.A O no hydrogen 3.265 N/A ALA 70.A N ASP 67.A O no hydrogen 3.121 N/A THR 72.A N CYS 69.A O no hydrogen 3.032 N/A ARG 74.A N THR 72.A OG1 no hydrogen 3.159 N/A TYR 75.A OH SER 94.A O no hydrogen 2.591 N/A CYS 76.A N.A SER 87.A OG no hydrogen 3.080 N/A CYS 76.A N.B SER 87.A OG no hydrogen 3.069 N/A CYS 76.A SG.A PRO 46.A O no hydrogen 3.725 N/A CYS 76.A SG.B ASP 67.A OD2 no hydrogen 3.407 N/A MET 77.A N ASP 67.A OD1 no hydrogen 2.847 N/A TYR 78.A N ALA 85.A O no hydrogen 2.860 N/A LYS 79.A NZ ASP 36.A OD1 no hydrogen 3.160 N/A LYS 79.A NZ ASP 36.A OD2 no hydrogen 3.215 N/A LYS 79.A NZ GLY 81.A O no hydrogen 2.682 N/A THR 80.A N VAL 83.A O no hydrogen 2.912 N/A VAL 83.A N THR 80.A O no hydrogen 2.990 N/A LEU 84.A N PHE 39.A O no hydrogen 2.763 N/A ALA 85.A N TYR 78.A O no hydrogen 2.749 N/A ILE 86.A N CYS 41.A O no hydrogen 2.845 N/A SER 87.A N CYS 76.A O.A no hydrogen 3.136 N/A SER 87.A N CYS 76.A O.B no hydrogen 3.061 N/A HIS 88.A N GLY 43.A O no hydrogen 2.790 N/A HIS 88.A ND1 GLY 89.A O no hydrogen 2.796 N/A GLY 89.A N GLY 44.A O no hydrogen 3.203 N/A GLY 91.A N GLU 230.A OE2 no hydrogen 2.720 N/A SER 94.A OG HIS 88.A O no hydrogen 2.513 N/A ILE 95.A N GLY 91.A O no hydrogen 3.209 N/A SER 96.A N ILE 92.A O no hydrogen 2.899 N/A SER 96.A OG ILE 92.A O no hydrogen 3.425 N/A SER 96.A OG PRO 93.A O no hydrogen 2.798 N/A ILE 97.A N PRO 93.A O no hydrogen 3.199 N/A MET 98.A N SER 94.A O no hydrogen 3.446 N/A LEU 99.A N ILE 95.A O no hydrogen 2.789 N/A HIS 100.A N SER 96.A O no hydrogen 2.928 N/A GLU 101.A N ILE 97.A O no hydrogen 3.255 N/A LEU 102.A N MET 98.A O no hydrogen 2.746 N/A ILE 103.A N LEU 99.A O no hydrogen 2.804 N/A LYS 104.A N HIS 100.A O no hydrogen 3.163 N/A LYS 104.A NZ ASP 16.A OD1 no hydrogen 2.900 N/A LYS 104.A NZ ASP 16.A OD2 no hydrogen 3.403 N/A LEU 105.A N GLU 101.A O no hydrogen 2.852 N/A LEU 106.A N LEU 102.A O no hydrogen 2.888 N/A HIS 107.A N ILE 103.A O no hydrogen 2.979 N/A HIS 107.A ND1 VAL 3.A O no hydrogen 3.279 N/A HIS 108.A N LYS 104.A O no hydrogen 2.822 N/A HIS 108.A NE2 ASP 16.A OD2 no hydrogen 2.683 N/A ALA 109.A N LEU 105.A O no hydrogen 3.027 N/A ARG 110.A N HIS 107.A O no hydrogen 3.038 N/A CYS 111.A N LEU 106.A O no hydrogen 2.852 N/A CYS 111.A SG PHE 34.A O no hydrogen 2.957 N/A ASP 113.A N ARG 1.A O no hydrogen 2.781 N/A THR 115.A N LYS 38.A O no hydrogen 2.889 N/A ILE 116.A N LYS 244.A O no hydrogen 2.858 N/A ILE 117.A N VAL 40.A O no hydrogen 2.783 N/A ARG 118.A N ALA 246.A O no hydrogen 2.935 N/A ARG 118.A NE GLU 228.A OE1 no hydrogen 2.881 N/A ARG 118.A NH1 HIS 88.A NE2 no hydrogen 3.322 N/A ILE 119.A N VAL 42.A O no hydrogen 2.779 N/A GLY 120.A N VAL 248.A O no hydrogen 3.266 N/A SER 122.A OG VAL 250.A O no hydrogen 3.079 N/A GLY 123.A N ILE 227.A O no hydrogen 2.948 N/A GLY 124.A N LEU 253.A O no hydrogen 2.771 N/A ILE 125.A N ARG 225.A O no hydrogen 2.957 N/A GLY 126.A N ASP 254.A OD1 no hydrogen 2.881 N/A GLY 130.A N THR 251.A O no hydrogen 2.665 N/A THR 131.A N ALA 128.A O no hydrogen 3.213 N/A THR 131.A OG1 ALA 128.A O no hydrogen 2.629 N/A VAL 132.A N PRO 181.A O no hydrogen 2.797 N/A VAL 133.A N CYS 249.A O no hydrogen 2.731 N/A ILE 134.A N LEU 183.A O no hydrogen 2.843 N/A THR 135.A N VAL 247.A O no hydrogen 2.884 N/A THR 135.A OG1 THR 187.A OG1 no hydrogen 2.629 N/A THR 135.A OG1 VAL 247.A O no hydrogen 3.445 N/A ASP 136.A N GLY 185.A O no hydrogen 3.139 N/A ILE 137.A N ASP 136.A OD1 no hydrogen 2.809 N/A VAL 139.A N THR 187.A O no hydrogen 2.765 N/A ASP 140.A N LYS 144.A O no hydrogen 2.917 N/A PHE 142.A N ASP 140.A OD1 no hydrogen 2.933 N/A PHE 143.A N ASP 140.A O no hydrogen 2.948 N/A LYS 144.A N ASP 140.A OD1 no hydrogen 2.996 N/A ARG 146.A N LYS 144.A O no hydrogen 2.870 N/A ARG 146.A NE ASP 140.A OD2 no hydrogen 2.890 N/A ARG 146.A NH2 ASP 140.A OD2 no hydrogen 3.114 N/A PHE 147.A N ARG 158.A O no hydrogen 2.668 N/A GLN 149.A N VAL 156.A O no hydrogen 3.022 N/A ILE 151.A N ASN 154.A O no hydrogen 2.708 N/A ASN 154.A N ILE 151.A O no hydrogen 2.920 N/A VAL 156.A N GLN 149.A O no hydrogen 2.842 N/A ARG 158.A N PHE 147.A O no hydrogen 2.771 N/A THR 160.A OG1 ALA 138.A O no hydrogen 2.673 N/A LEU 166.A N ASP 163.A OD2 no hydrogen 3.201 N/A SER 167.A N ASP 163.A O no hydrogen 3.135 N/A SER 167.A OG LYS 164.A O no hydrogen 2.691 N/A GLU 168.A N LYS 164.A O no hydrogen 3.029 N/A GLU 169.A N GLU 165.A O no hydrogen 2.927 N/A LEU 170.A N LEU 166.A O no hydrogen 2.935 N/A PHE 171.A N SER 167.A O no hydrogen 3.048 N/A ASN 172.A N GLU 168.A O no hydrogen 2.951 N/A CYS 173.A N GLU 169.A O no hydrogen 2.952 N/A CYS 173.A SG GLU 169.A O no hydrogen 3.243 N/A SER 174.A N LEU 170.A O no hydrogen 3.008 N/A SER 174.A OG PHE 171.A O no hydrogen 2.647 N/A GLU 176.A N CYS 173.A O no hydrogen 3.418 N/A ILE 177.A N SER 174.A O no hydrogen 3.210 N/A THR 182.A OG1 PHE 180.A O no hydrogen 2.931 N/A LEU 183.A N VAL 132.A O no hydrogen 2.930 N/A GLY 185.A N ILE 134.A O no hydrogen 3.198 N/A HIS 186.A N GLY 223.A O no hydrogen 3.103 N/A HIS 186.A ND1 ASP 136.A OD1 no hydrogen 2.726 N/A THR 187.A N ILE 137.A O no hydrogen 3.082 N/A THR 187.A OG1 THR 135.A OG1 no hydrogen 2.629 N/A THR 187.A OG1 ASN 226.A OD1 no hydrogen 2.569 N/A MET 188.A N ASN 226.A O no hydrogen 2.875 N/A CYS 189.A N VAL 139.A O no hydrogen 2.818 N/A CYS 189.A SG THR 232.A OG1 no hydrogen 3.349 N/A THR 190.A N GLU 228.A O no hydrogen 3.143 N/A THR 190.A OG1 ASP 192.A O no hydrogen 2.855 N/A GLY 196.A N ASP 192.A OD2 no hydrogen 2.831 N/A GLN 197.A N TYR 194.A O no hydrogen 3.256 N/A GLN 197.A NE2 THR 190.A OG1 no hydrogen 3.075 N/A GLY 198.A N GLU 195.A O no hydrogen 3.295 N/A ARG 199.A N TYR 194.A O no hydrogen 2.832 N/A ARG 199.A NE ASP 259.A O no hydrogen 2.656 N/A ARG 199.A NH1 PHE 193.A O no hydrogen 3.247 N/A ARG 199.A NH1 GLN 197.A OE1 no hydrogen 2.859 N/A ARG 199.A NH2 ASP 259.A O no hydrogen 3.075 N/A LEU 200.A N ASP 259.A OD2 no hydrogen 2.946 N/A CYS 205.A SG ARG 199.A O no hydrogen 3.968 N/A CYS 205.A SG PHE 207.A O no hydrogen 3.434 N/A LYS 211.A N SER 208.A OG no hydrogen 3.242 N/A LYS 212.A N SER 208.A O no hydrogen 3.066 N/A LYS 212.A NZ ARG 255.A O no hydrogen 3.128 N/A LYS 212.A NZ ASP 259.A OD1 no hydrogen 2.734 N/A LEU 213.A N ARG 209.A O no hydrogen 2.897 N/A ASP 214.A N GLU 210.A O no hydrogen 2.955 N/A TYR 215.A N LYS 211.A O no hydrogen 3.043 N/A TYR 215.A OH SER 141.A O no hydrogen 2.646 N/A LEU 216.A N LYS 212.A O no hydrogen 2.920 N/A LYS 217.A N LEU 213.A O no hydrogen 2.999 N/A ARG 218.A N ASP 214.A O no hydrogen 3.055 N/A ARG 218.A NE ASP 214.A OD2 no hydrogen 2.824 N/A ARG 218.A NH2 ASP 214.A OD2 no hydrogen 3.104 N/A ALA 219.A N TYR 215.A O no hydrogen 2.951 N/A PHE 220.A N LEU 216.A O no hydrogen 2.869 N/A LYS 221.A N LYS 217.A O no hydrogen 2.999 N/A ALA 222.A N ARG 218.A O no hydrogen 2.907 N/A GLY 223.A N PHE 220.A O no hydrogen 2.905 N/A VAL 224.A N ALA 219.A O no hydrogen 2.883 N/A ARG 225.A N HIS 186.A O no hydrogen 2.929 N/A ARG 225.A NH1 PHE 220.A O no hydrogen 2.794 N/A ARG 225.A NH1 VAL 224.A O no hydrogen 2.911 N/A ASN 226.A ND2 SER 122.A OG no hydrogen 3.030 N/A ILE 227.A N GLY 123.A O no hydrogen 2.794 N/A GLU 228.A N MET 188.A O no hydrogen 2.897 N/A GLU 230.A N GLU 228.A OE1 no hydrogen 2.949 N/A GLU 230.A N GLU 228.A OE2 no hydrogen 3.316 N/A SER 231.A N GLU 228.A OE2 no hydrogen 2.963 N/A SER 231.A OG GLU 228.A OE2 no hydrogen 2.600 N/A PHE 234.A N GLU 230.A O no hydrogen 3.225 N/A ALA 235.A N SER 231.A O no hydrogen 2.936 N/A ALA 236.A N THR 232.A O no hydrogen 2.940 N/A MET 237.A N VAL 233.A O no hydrogen 3.002 N/A CYS 238.A N PHE 234.A O no hydrogen 3.141 N/A CYS 238.A SG PHE 234.A O no hydrogen 3.263 N/A GLY 239.A N ALA 235.A O no hydrogen 3.272 N/A CYS 241.A N CYS 238.A O no hydrogen 3.104 N/A CYS 241.A SG MET 237.A O no hydrogen 3.453 N/A LEU 243.A N CYS 238.A O no hydrogen 3.045 N/A LYS 244.A N VAL 114.A O no hydrogen 3.132 N/A ALA 246.A N ILE 116.A O no hydrogen 3.022 N/A VAL 248.A N ARG 118.A O no hydrogen 2.829 N/A CYS 249.A N VAL 133.A O no hydrogen 2.994 N/A CYS 249.A SG THR 121.A O no hydrogen 4.016 N/A VAL 250.A N GLY 120.A O no hydrogen 2.860 N/A THR 251.A N THR 131.A O no hydrogen 2.901 N/A LEU 252.A N SER 122.A O no hydrogen 3.010 N/A ARG 255.A N GLY 124.A O no hydrogen 2.672 N/A ARG 255.A NE CYS 258.A O no hydrogen 3.261 N/A ARG 255.A NE ASP 259.A OD1 no hydrogen 3.160 N/A ARG 255.A NH1 GLN 197.A O no hydrogen 2.711 N/A ARG 255.A NH2 GLN 197.A O no hydrogen 2.926 N/A ARG 255.A NH2 ASP 259.A OD1 no hydrogen 2.788 N/A LEU 256.A N ASP 254.A OD1 no hydrogen 3.014 N/A ASP 257.A N ASP 254.A O no hydrogen 3.096 N/A CYS 258.A N ASP 254.A O no hydrogen 3.210 N/A CYS 258.A SG GLN 260.A O no hydrogen 3.861 N/A GLN 260.A NE2 ASP 201.A OD2 no hydrogen 2.587 N/A VAL 267.A N PRO 264.A O no hydrogen 2.854 N/A LEU 268.A N PRO 264.A O no hydrogen 2.990 N/A VAL 269.A N HIS 265.A O no hydrogen 3.079 N/A GLU 270.A N ASP 266.A O no hydrogen 3.125 N/A TYR 271.A N VAL 267.A O no hydrogen 2.998 N/A GLN 272.A N LEU 268.A O no hydrogen 2.909 N/A GLN 273.A N VAL 269.A O no hydrogen 3.070 N/A GLN 273.A N GLU 270.A O no hydrogen 3.273 N/A ARG 274.A N TYR 271.A O no hydrogen 2.954 N/A ARG 274.A NH1 GLY 130.A O no hydrogen 2.737 N/A ARG 274.A NH2 GLU 270.A OE2 no hydrogen 3.192 N/A LEU 277.A N ARG 274.A O no hydrogen 3.148 N/A LEU 278.A N ARG 274.A O no hydrogen 3.477 N/A ILE 279.A N PRO 275.A O no hydrogen 3.096 N/A SER 280.A N GLN 276.A O no hydrogen 2.945 N/A SER 280.A OG GLU 59.A OE1 no hydrogen 2.594 N/A ASN 281.A N LEU 277.A O no hydrogen 3.166 N/A PHE 282.A N LEU 278.A O no hydrogen 2.867 N/A ILE 283.A N ILE 279.A O no hydrogen 2.765 N/A ARG 284.A N SER 280.A O no hydrogen 2.891 N/A ARG 284.A NE GLU 59.A OE1 no hydrogen 3.453 N/A ARG 284.A NE SER 280.A OG no hydrogen 3.129 N/A ARG 285.A N ASN 281.A O no hydrogen 2.961 N/A ARG 285.A NH2 GLU 176.A OE2 no hydrogen 2.938 N/A ARG 286.A N PHE 282.A O no hydrogen 2.941 N/A ARG 286.A NE GLU 169.A OE1 no hydrogen 3.110 N/A ARG 286.A NE GLU 169.A OE2 no hydrogen 3.254 N/A ARG 286.A NH2 GLU 169.A OE2 no hydrogen 2.762 N/A LEU 287.A N ILE 283.A O no hydrogen 2.850 N/A GLY 288.A N ARG 285.A O no hydrogen 3.179 N/A LEU 289.A N ARG 284.A O no hydrogen 2.773 N/A