Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xkf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 67.A OD2 no hydrogen 3.410 N/A ARG 2.A N ASP 5.A OD2 no hydrogen 3.055 N/A ASP 5.A N ARG 2.A O no hydrogen 2.801 N/A TYR 6.A N ALA 3.A O no hydrogen 3.073 N/A GLU 7.A N ARG 21.A O no hydrogen 3.017 N/A LEU 9.A N LYS 19.A O no hydrogen 2.857 N/A ILE 12.A N CYS 17.A O no hydrogen 2.712 N/A ARG 16.A NE GLU 33.A OE1 no hydrogen 3.115 N/A ARG 16.A NH2 GLU 33.A OE1 no hydrogen 3.188 N/A ARG 16.A NH2 GLU 33.A OE2 no hydrogen 3.183 N/A CYS 17.A N GLY 13.A O no hydrogen 2.721 N/A GLN 18.A N TRP 31.A O no hydrogen 2.960 N/A GLN 18.A NE2 THR 11.A OG1 no hydrogen 3.022 N/A LYS 19.A N TYR 10.A O no hydrogen 3.028 N/A LYS 19.A NZ TYR 10.A OH no hydrogen 3.312 N/A LYS 19.A NZ TYR 83.A OH no hydrogen 3.515 N/A ILE 20.A N LEU 29.A O no hydrogen 2.794 N/A ARG 21.A N GLU 7.A O no hydrogen 3.058 N/A ARG 22.A N LYS 27.A O no hydrogen 2.797 N/A ARG 22.A NH1 ASP 25.A OD1 no hydrogen 3.370 N/A ARG 22.A NH1 ASP 25.A OD2 no hydrogen 2.643 N/A LYS 23.A N ASP 5.A O no hydrogen 2.798 N/A LYS 23.A NZ GLU 4.A O no hydrogen 2.827 N/A GLY 26.A N ARG 22.A O no hydrogen 2.709 N/A LYS 27.A N ASP 25.A OD1 no hydrogen 2.923 N/A LEU 29.A N ILE 20.A O no hydrogen 2.848 N/A VAL 30.A N MET 81.A O no hydrogen 3.079 N/A TRP 31.A N GLN 18.A O no hydrogen 2.908 N/A TRP 31.A NE1 GLN 18.A OE1 no hydrogen 3.003 N/A LYS 32.A N ILE 79.A O no hydrogen 2.911 N/A GLU 33.A N ARG 16.A O no hydrogen 2.758 N/A LEU 34.A N LEU 77.A O no hydrogen 2.676 N/A TYR 36.A N THR 75.A O no hydrogen 2.984 N/A GLY 37.A N ASP 35.A OD1 no hydrogen 2.880 N/A MET 39.A N TYR 36.A O no hydrogen 3.162 N/A THR 40.A N GLU 43.A OE1 no hydrogen 3.424 N/A GLU 43.A N THR 40.A OG1 no hydrogen 3.110 N/A LYS 44.A N THR 40.A O no hydrogen 2.965 N/A GLN 45.A N GLU 41.A O no hydrogen 2.891 N/A MET 46.A N ALA 42.A O no hydrogen 3.159 N/A LEU 47.A N GLU 43.A O no hydrogen 2.914 N/A VAL 48.A N LYS 44.A O no hydrogen 2.843 N/A SER 49.A N GLN 45.A O no hydrogen 3.112 N/A GLU 50.A N MET 46.A O no hydrogen 3.061 N/A VAL 51.A N LEU 47.A O no hydrogen 3.051 N/A ASN 52.A N VAL 48.A O no hydrogen 3.063 N/A LEU 53.A N SER 49.A O no hydrogen 3.229 N/A LEU 54.A N GLU 50.A O no hydrogen 3.115 N/A ARG 55.A N VAL 51.A O no hydrogen 3.238 N/A LEU 57.A N LEU 54.A O no hydrogen 3.153 N/A ASN 61.A N HIS 59.A ND1 no hydrogen 2.933 N/A ASN 61.A ND2 VAL 142.A O no hydrogen 3.019 N/A ILE 62.A N HIS 59.A O no hydrogen 2.985 N/A VAL 63.A N LEU 144.A O no hydrogen 2.957 N/A ARG 64.A N GLU 82.A OE2 no hydrogen 2.581 N/A ARG 64.A NH1 ARG 55.A O no hydrogen 3.377 N/A ASP 67.A N VAL 80.A O no hydrogen 3.138 N/A ARG 68.A N ASP 67.A OD1 no hydrogen 2.836 N/A ILE 69.A N TYR 78.A O no hydrogen 2.754 N/A ASP 71.A N THR 76.A O no hydrogen 2.952 N/A THR 73.A OG1 ASP 71.A OD1 no hydrogen 3.121 N/A ASN 74.A N ASP 71.A O no hydrogen 3.076 N/A THR 75.A N ARG 72.A O no hydrogen 3.401 N/A THR 75.A OG1 ASP 35.A OD1 no hydrogen 3.521 N/A THR 75.A OG1 ASN 74.A O no hydrogen 2.790 N/A THR 76.A N ASP 71.A O no hydrogen 3.177 N/A THR 76.A OG1 ASN 74.A O no hydrogen 2.713 N/A LEU 77.A N LEU 34.A O no hydrogen 2.614 N/A TYR 78.A N ILE 69.A O no hydrogen 2.719 N/A TYR 78.A OH GLU 33.A OE2 no hydrogen 3.385 N/A ILE 79.A N LYS 32.A O no hydrogen 3.054 N/A VAL 80.A N ASP 67.A O no hydrogen 2.987 N/A MET 81.A N VAL 30.A O no hydrogen 2.937 N/A GLU 82.A N ARG 64.A O no hydrogen 2.947 N/A GLY 86.A N LEU 136.A O no hydrogen 2.753 N/A GLY 87.A N CYS 84.A O no hydrogen 3.182 N/A LEU 89.A N PRO 131.A O no hydrogen 3.119 N/A LEU 89.A N VAL 134.A O no hydrogen 2.954 N/A ALA 90.A N PRO 131.A O no hydrogen 3.326 N/A SER 91.A N ASP 88.A OD1 no hydrogen 3.267 N/A SER 91.A OG ASP 88.A OD1 no hydrogen 2.668 N/A VAL 92.A N ASP 88.A O no hydrogen 3.482 N/A ILE 93.A N LEU 89.A O no hydrogen 2.895 N/A THR 94.A N ALA 90.A O no hydrogen 2.887 N/A THR 94.A OG1 ALA 90.A O no hydrogen 3.221 N/A THR 94.A OG1 SER 91.A O no hydrogen 2.890 N/A LYS 95.A N SER 91.A O no hydrogen 2.870 N/A GLY 96.A N VAL 92.A O no hydrogen 2.949 N/A THR 97.A N ILE 93.A O no hydrogen 3.064 N/A THR 97.A OG1 ILE 93.A O no hydrogen 3.327 N/A LYS 98.A N THR 94.A O no hydrogen 3.187 N/A GLU 99.A N LYS 95.A O no hydrogen 2.960 N/A ARG 100.A N THR 97.A O no hydrogen 3.159 N/A GLN 101.A N GLY 96.A O no hydrogen 2.995 N/A GLN 101.A NE2 TYR 102.A O no hydrogen 3.346 N/A VAL 108.A N ASP 104.A O no hydrogen 3.174 N/A LEU 109.A N GLU 105.A O no hydrogen 2.802 N/A ARG 110.A N GLU 106.A O no hydrogen 3.029 N/A VAL 111.A N PHE 107.A O no hydrogen 3.023 N/A MET 112.A N VAL 108.A O no hydrogen 2.897 N/A THR 113.A N LEU 109.A O no hydrogen 2.938 N/A THR 113.A OG1 LEU 109.A O no hydrogen 2.686 N/A GLN 114.A N ARG 110.A O no hydrogen 2.930 N/A GLN 114.A NE2 VAL 142.A O no hydrogen 3.474 N/A LEU 115.A N VAL 111.A O no hydrogen 2.857 N/A THR 116.A N MET 112.A O no hydrogen 3.101 N/A THR 116.A OG1 MET 112.A O no hydrogen 2.514 N/A LEU 117.A N THR 113.A O no hydrogen 3.176 N/A ALA 118.A N GLN 114.A O no hydrogen 3.031 N/A LEU 119.A N LEU 115.A O no hydrogen 2.883 N/A LYS 120.A N THR 116.A O no hydrogen 2.784 N/A GLU 121.A N LEU 117.A O no hydrogen 3.066 N/A CYS 122.A N ALA 118.A O no hydrogen 3.004 N/A CYS 122.A SG ALA 118.A O no hydrogen 3.387 N/A HIS 123.A N LEU 119.A O no hydrogen 2.879 N/A HIS 123.A NE2 ASP 169.A OD2 no hydrogen 2.707 N/A ARG 124.A N LYS 120.A O no hydrogen 3.142 N/A ARG 124.A NE GLU 121.A OE1 no hydrogen 3.029 N/A ARG 124.A NH2 GLU 121.A OE1 no hydrogen 3.452 N/A ARG 124.A NH2 GLU 121.A OE2 no hydrogen 2.790 N/A ARG 125.A N GLU 121.A O no hydrogen 3.063 N/A SER 126.A N CYS 122.A O no hydrogen 3.302 N/A SER 126.A N HIS 123.A O no hydrogen 3.129 N/A SER 126.A OG HIS 123.A O no hydrogen 2.531 N/A ASN 133.A N LYS 130.A O no hydrogen 2.943 N/A ASN 133.A ND2 ASP 128.A O no hydrogen 2.913 N/A VAL 134.A N PRO 131.A O no hydrogen 3.197 N/A PHE 135.A N LYS 143.A O no hydrogen 2.779 N/A LEU 136.A N GLY 87.A O no hydrogen 2.996 N/A ASP 137.A N ASN 141.A O no hydrogen 3.174 N/A LYS 139.A N ASP 137.A OD1 no hydrogen 2.894 N/A ASN 141.A N ASP 137.A OD1 no hydrogen 2.907 N/A ASN 141.A ND2 ASP 137.A OD2 no hydrogen 2.963 N/A ASN 141.A ND2 HIS 249.A O no hydrogen 2.766 N/A LYS 143.A N PHE 135.A O no hydrogen 2.711 N/A LYS 143.A NZ PRO 60.A O no hydrogen 3.013 N/A LYS 143.A NZ GLU 82.A OE1 no hydrogen 3.004 N/A LYS 143.A NZ GLU 82.A OE2 no hydrogen 3.306 N/A LEU 144.A N ASN 61.A O no hydrogen 2.892 N/A GLY 145.A N ASN 133.A O no hydrogen 2.911 N/A ASP 146.A N TYR 65.A OH no hydrogen 3.156 N/A TYR 153.A N THR 151.A O no hydrogen 3.051 N/A TYR 154.A OH GLU 179.A OE1 no hydrogen 2.685 N/A MET 155.A N PRO 152.A O no hydrogen 2.958 N/A SER 156.A OG GLU 158.A OE1 no hydrogen 3.116 N/A GLN 159.A N SER 156.A OG no hydrogen 3.325 N/A MET 160.A N SER 156.A O no hydrogen 2.852 N/A ASN 161.A N PRO 157.A O no hydrogen 3.353 N/A SER 163.A OG SER 168.A OG no hydrogen 3.208 N/A ASN 165.A ND2 ASP 227.A OD2 no hydrogen 2.835 N/A LYS 167.A N ASN 165.A OD1 no hydrogen 2.779 N/A LYS 167.A NZ ASP 227.A O no hydrogen 3.331 N/A LYS 167.A NZ ARG 230.A O no hydrogen 2.827 N/A SER 168.A N ASN 165.A O no hydrogen 2.964 N/A SER 168.A OG GLU 158.A OE1 no hydrogen 2.915 N/A SER 168.A OG SER 163.A OG no hydrogen 3.208 N/A ASP 169.A N GLU 166.A O no hydrogen 3.181 N/A TRP 171.A N LYS 167.A O no hydrogen 3.256 N/A SER 172.A N SER 168.A O no hydrogen 3.232 N/A SER 172.A OG SER 168.A O no hydrogen 3.306 N/A LEU 173.A N ASP 169.A O no hydrogen 2.895 N/A GLY 174.A N ILE 170.A O no hydrogen 2.889 N/A CYS 175.A N TRP 171.A O no hydrogen 2.891 N/A CYS 175.A SG TRP 171.A O no hydrogen 3.355 N/A LEU 176.A N SER 172.A O no hydrogen 2.976 N/A LEU 177.A N LEU 173.A O no hydrogen 2.827 N/A TYR 178.A N GLY 174.A O no hydrogen 2.848 N/A TYR 178.A OH ARG 205.A O no hydrogen 2.621 N/A GLU 179.A N CYS 175.A O no hydrogen 2.935 N/A LEU 180.A N LEU 176.A O no hydrogen 2.936 N/A CYS 181.A N LEU 177.A O no hydrogen 3.123 N/A CYS 181.A SG LEU 177.A O no hydrogen 3.395 N/A ALA 182.A N TYR 178.A O no hydrogen 2.888 N/A PHE 190.A N GLU 194.A OE1 no hydrogen 2.693 N/A GLU 194.A N SER 191.A OG no hydrogen 3.224 N/A LEU 195.A N SER 191.A O no hydrogen 2.827 N/A ALA 196.A N GLN 192.A O no hydrogen 2.951 N/A GLY 197.A N LYS 193.A O no hydrogen 3.176 N/A LYS 198.A N GLU 194.A O no hydrogen 3.072 N/A LYS 198.A NZ THR 188.A O no hydrogen 2.874 N/A ILE 199.A N LEU 195.A O no hydrogen 2.859 N/A ARG 200.A N ALA 196.A O no hydrogen 3.055 N/A GLU 201.A N GLY 197.A O no hydrogen 3.356 N/A GLY 202.A N LYS 198.A O no hydrogen 3.286 N/A GLY 202.A N ILE 199.A O no hydrogen 3.176 N/A ARG 206.A NH1 ILE 207.A O no hydrogen 2.829 N/A ARG 206.A NH1 TYR 211.A O no hydrogen 3.249 N/A ARG 206.A NH2 TYR 211.A O no hydrogen 2.829 N/A ARG 206.A NH2 ASP 213.A OD1 no hydrogen 2.956 N/A TYR 211.A N PRO 208.A O no hydrogen 3.078 N/A TYR 211.A OH LEU 103.A O no hydrogen 2.660 N/A TYR 211.A OH CYS 181.A O no hydrogen 3.400 N/A SER 212.A N GLU 105.A OE1 no hydrogen 2.923 N/A SER 212.A OG GLU 105.A OE2 no hydrogen 2.644 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.674 N/A LEU 215.A N SER 212.A OG no hydrogen 2.966 N/A ASN 216.A N SER 212.A O no hydrogen 2.956 N/A GLU 217.A N ASP 213.A O no hydrogen 2.835 N/A ILE 218.A N GLU 214.A O no hydrogen 3.288 N/A ILE 219.A N LEU 215.A O no hydrogen 3.219 N/A THR 220.A N ASN 216.A O no hydrogen 2.982 N/A THR 220.A OG1 ASN 216.A O no hydrogen 2.671 N/A ARG 221.A N GLU 217.A O no hydrogen 2.917 N/A MET 222.A N ILE 218.A O no hydrogen 3.048 N/A LEU 223.A N ILE 219.A O no hydrogen 3.176 N/A LEU 223.A N THR 220.A O no hydrogen 2.996 N/A ASN 224.A N ARG 221.A O no hydrogen 3.019 N/A LYS 226.A N ASN 224.A OD1 no hydrogen 3.027 N/A HIS 229.A N LYS 226.A O no hydrogen 2.954 N/A ARG 230.A N ASP 227.A O no hydrogen 3.304 N/A ARG 230.A NE ASN 224.A O no hydrogen 2.818 N/A ARG 230.A NH1 GLU 158.A OE1 no hydrogen 2.739 N/A ARG 230.A NH1 LYS 167.A O no hydrogen 2.890 N/A ARG 230.A NH2 GLU 158.A OE2 no hydrogen 2.380 N/A ARG 230.A NH2 ASN 224.A O no hydrogen 3.098 N/A SER 232.A N GLU 235.A OE1 no hydrogen 2.916 N/A SER 232.A OG GLU 234.A OE1 no hydrogen 3.546 N/A SER 232.A OG GLU 235.A OE1 no hydrogen 3.349 N/A GLU 234.A N GLU 234.A OE1 no hydrogen 2.796 N/A GLU 235.A N SER 232.A OG no hydrogen 3.143 N/A ILE 236.A N SER 232.A O no hydrogen 2.899 N/A LEU 237.A N VAL 233.A O no hydrogen 3.035 N/A GLU 238.A N GLU 234.A O no hydrogen 3.065 N/A ASN 239.A N ILE 236.A O no hydrogen 3.009 N/A LEU 241.A N ASN 239.A OD1 no hydrogen 2.893 N/A ILE 242.A N ASN 239.A O no hydrogen 2.939 N/A LEU 243.A N HIS 246.A ND1 no hydrogen 2.914 N/A HIS 245.A NE2 GLU 106.A OE2 no hydrogen 2.792 N/A HIS 246.A N LEU 243.A O no hydrogen 2.977 N/A HIS 246.A NE2 GLU 106.A OE1 no hydrogen 2.921 N/A HIS 247.A N GLU 244.A O no hydrogen 2.904 N/A HIS 247.A ND1 LEU 243.A O no hydrogen 3.000 N/A HIS 249.A N ASN 141.A OD1 no hydrogen 2.866 N/A HIS 249.A NE2 GLU 244.A OE1 no hydrogen 3.010 N/A