Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ei3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N LEU 166.A O no hydrogen 2.792 N/A ILE 4.A N ARG 67.A O no hydrogen 2.648 N/A GLY 7.A N GLY 65.A O no hydrogen 2.694 N/A TYR 8.A N GLY 65.A O no hydrogen 3.230 N/A TYR 8.A OH GLU 116.A OE1 no hydrogen 2.674 N/A MET 9.A N ARG 50.A O no hydrogen 2.901 N/A GLY 10.A N TYR 63.A O no hydrogen 2.723 N/A ILE 11.A N VAL 52.A O no hydrogen 2.884 N/A SER 12.A N ASP 60.A O no hydrogen 3.034 N/A SER 12.A OG GLU 62.A OE2 no hydrogen 2.699 N/A VAL 13.A N HIS 54.A O no hydrogen 2.886 N/A LYS 14.A N ASP 59.A OD1 no hydrogen 3.055 N/A ALA 18.A N ASP 15.A OD1 no hydrogen 3.075 N/A TRP 19.A N ASP 15.A O no hydrogen 3.073 N/A TRP 19.A NE1 SER 257.A OG no hydrogen 2.919 N/A LYS 20.A N PRO 16.A O no hydrogen 2.844 N/A LYS 20.A NZ ASP 33.A OD2 no hydrogen 3.473 N/A SER 21.A N ASP 17.A O no hydrogen 3.215 N/A SER 21.A OG ASP 17.A O no hydrogen 3.526 N/A PHE 22.A N ALA 18.A O no hydrogen 2.833 N/A ALA 23.A N TRP 19.A O no hydrogen 2.807 N/A THR 24.A N LYS 20.A O no hydrogen 3.087 N/A THR 24.A OG1 LYS 20.A O no hydrogen 2.916 N/A THR 24.A OG1 SER 21.A O no hydrogen 3.405 N/A THR 24.A OG1 ASP 25.A OD1 no hydrogen 3.251 N/A ASP 25.A N SER 21.A O no hydrogen 2.887 N/A MET 26.A N PHE 22.A O no hydrogen 2.958 N/A GLY 28.A N THR 24.A O no hydrogen 3.057 N/A LEU 29.A N ALA 23.A O no hydrogen 2.958 N/A GLN 30.A N ARG 43.A O no hydrogen 3.126 N/A LEU 32.A N TYR 41.A O no hydrogen 2.725 N/A GLY 35.A N ASP 33.A OD1 no hydrogen 2.836 N/A ARG 39.A NE ASP 38.A OD1 no hydrogen 2.879 N/A ARG 39.A NH1 GLU 98.A OE2 no hydrogen 2.814 N/A ARG 39.A NH2 ASP 38.A OD2 no hydrogen 2.897 N/A ARG 39.A NH2 GLU 98.A OE2 no hydrogen 3.316 N/A PHE 40.A N VAL 53.A O no hydrogen 2.953 N/A TYR 41.A N LEU 32.A O no hydrogen 2.796 N/A TYR 41.A OH GLU 36.A OE1 no hydrogen 2.689 N/A LEU 42.A N ILE 51.A O no hydrogen 2.843 N/A ARG 43.A N GLN 30.A O no hydrogen 2.772 N/A ARG 43.A NE TRP 47.A O no hydrogen 3.063 N/A ARG 43.A NE HIS 48.A O no hydrogen 3.161 N/A ARG 43.A NH1 GLN 30.A OE1 no hydrogen 3.191 N/A ARG 43.A NH1 ASN 127.A O no hydrogen 2.841 N/A ARG 43.A NH2 TYR 46.A O no hydrogen 3.133 N/A ARG 43.A NH2 TRP 47.A O no hydrogen 3.142 N/A ARG 43.A NH2 ASN 127.A O no hydrogen 2.913 N/A TRP 47.A N ASP 45.A OD1 no hydrogen 2.989 N/A HIS 48.A N ARG 122.A O no hydrogen 3.077 N/A HIS 48.A ND1 HIS 49.A ND1 no hydrogen 2.713 N/A HIS 48.A NE2 GLU 34.A OE2 no hydrogen 2.765 N/A HIS 49.A ND1 HIS 48.A ND1 no hydrogen 2.713 N/A ARG 50.A N LEU 42.A O no hydrogen 2.912 N/A ARG 50.A NE ASP 45.A OD1 no hydrogen 3.380 N/A ARG 50.A NE ASP 45.A OD2 no hydrogen 3.016 N/A ARG 50.A NH1 GLU 5.A OE1 no hydrogen 2.920 N/A ARG 50.A NH1 GLY 7.A O no hydrogen 3.003 N/A ARG 50.A NH2 ASP 45.A OD2 no hydrogen 2.879 N/A ILE 51.A N LEU 42.A O no hydrogen 3.192 N/A VAL 52.A N MET 9.A O no hydrogen 2.849 N/A VAL 53.A N PHE 40.A O no hydrogen 2.814 N/A HIS 54.A N ILE 11.A O no hydrogen 2.851 N/A HIS 54.A NE2 TYR 63.A OH no hydrogen 2.655 N/A HIS 55.A N ASP 38.A O no hydrogen 2.834 N/A GLY 57.A N VAL 13.A O no hydrogen 2.964 N/A GLN 58.A N SER 12.A OG no hydrogen 3.010 N/A ASP 60.A N SER 12.A O no hydrogen 3.280 N/A LEU 61.A N ASP 60.A OD1 no hydrogen 2.745 N/A GLU 62.A N GLY 10.A O no hydrogen 2.690 N/A TYR 63.A N GLY 10.A O no hydrogen 3.125 N/A TYR 63.A OH HIS 54.A NE2 no hydrogen 2.655 N/A LEU 64.A N PRO 114.A O no hydrogen 3.208 N/A GLY 65.A N TYR 8.A O no hydrogen 2.704 N/A TRP 66.A N GLU 116.A O no hydrogen 2.838 N/A ARG 67.A N GLU 5.A O no hydrogen 2.990 N/A ARG 67.A NH1 GLU 5.A OE2 no hydrogen 2.938 N/A VAL 68.A N PHE 118.A O no hydrogen 2.943 N/A PHE 74.A N GLY 70.A O no hydrogen 3.006 N/A GLU 75.A N LYS 71.A O no hydrogen 2.836 N/A ALA 76.A N PRO 72.A O no hydrogen 2.963 N/A LEU 77.A N GLU 73.A O no hydrogen 2.872 N/A GLY 78.A N PHE 74.A O no hydrogen 3.043 N/A GLN 79.A N GLU 75.A O no hydrogen 3.211 N/A GLN 79.A NE2 ASP 83.A OD1 no hydrogen 2.706 N/A LYS 80.A N ALA 76.A O no hydrogen 2.924 N/A LYS 80.A NZ LEU 165.A O no hydrogen 2.988 N/A LEU 81.A N LEU 77.A O no hydrogen 2.977 N/A ILE 82.A N GLY 78.A O no hydrogen 2.914 N/A ASP 83.A N GLN 79.A O no hydrogen 2.782 N/A ALA 84.A N LYS 80.A O no hydrogen 3.109 N/A GLY 85.A N ILE 82.A O no hydrogen 2.879 N/A TYR 86.A N LEU 81.A O no hydrogen 3.017 N/A LYS 87.A NZ GLY 85.A O no hydrogen 3.000 N/A ARG 89.A N LYS 106.A O no hydrogen 2.888 N/A ARG 89.A NH1 GLU 95.A OE1 no hydrogen 2.611 N/A ARG 89.A NH1 GLU 95.A OE2 no hydrogen 3.360 N/A ARG 89.A NH2 GLU 95.A OE1 no hydrogen 3.538 N/A ARG 89.A NH2 GLU 95.A OE2 no hydrogen 2.662 N/A CYS 91.A N LEU 104.A O no hydrogen 2.730 N/A CYS 91.A SG GLU 95.A OE2 no hydrogen 3.622 N/A GLU 95.A N ASP 92.A OD1 no hydrogen 2.784 N/A ALA 96.A N ASP 92.A O no hydrogen 2.939 N/A GLN 97.A N LYS 93.A O no hydrogen 2.751 N/A GLN 97.A NE2 LYS 93.A O no hydrogen 3.630 N/A GLU 98.A N VAL 94.A O no hydrogen 3.027 N/A ARG 99.A NE GLU 116.A OE1 no hydrogen 2.892 N/A ARG 99.A NE GLU 116.A OE2 no hydrogen 3.362 N/A ARG 99.A NH2 GLU 116.A OE2 no hydrogen 2.799 N/A MET 100.A N GLN 97.A O no hydrogen 3.049 N/A VAL 101.A N ALA 96.A O no hydrogen 3.141 N/A LEU 102.A N TRP 119.A O no hydrogen 3.080 N/A LEU 102.A N GLY 120.A O no hydrogen 3.095 N/A GLY 103.A N TRP 119.A O no hydrogen 3.129 N/A MET 105.A N ILE 117.A O no hydrogen 2.913 N/A LYS 106.A N ARG 89.A O no hydrogen 2.923 N/A LYS 106.A NZ GLU 95.A OE2 no hydrogen 2.707 N/A THR 107.A N THR 115.A O no hydrogen 2.856 N/A THR 107.A OG1 LYS 87.A O no hydrogen 2.655 N/A ASP 109.A N ASN 113.A O no hydrogen 2.889 N/A GLY 111.A N ASP 109.A OD1 no hydrogen 2.835 N/A GLY 112.A N ASP 109.A O no hydrogen 2.930 N/A ASN 113.A N ASP 109.A OD1 no hydrogen 2.993 N/A ASN 113.A ND2 ASP 109.A OD2 no hydrogen 3.035 N/A ASN 113.A ND2 ARG 152.A O no hydrogen 2.846 N/A THR 115.A N THR 107.A O no hydrogen 2.897 N/A THR 115.A OG1 ASN 113.A O no hydrogen 2.760 N/A GLU 116.A N LEU 64.A O no hydrogen 2.832 N/A ILE 117.A N MET 105.A O no hydrogen 2.921 N/A PHE 118.A N TRP 66.A O no hydrogen 2.984 N/A TRP 119.A N GLY 103.A O no hydrogen 3.112 N/A ARG 122.A N MET 100.A O no hydrogen 3.291 N/A ARG 122.A NE ASP 124.A OD1 no hydrogen 2.661 N/A ARG 122.A NE ASP 124.A OD2 no hydrogen 3.343 N/A ARG 122.A NH2 ASP 124.A OD1 no hydrogen 3.424 N/A ARG 122.A NH2 ASP 124.A OD2 no hydrogen 3.300 N/A ASP 124.A N TYR 46.A O no hydrogen 2.734 N/A ASN 127.A N ASP 124.A O no hydrogen 2.869 N/A HIS 130.A N GLN 30.A OE1 no hydrogen 3.100 N/A GLY 132.A N GLY 28.A O no hydrogen 3.242 N/A ARG 133.A NH1 ASP 25.A O no hydrogen 3.183 N/A ARG 133.A NH1 MET 26.A O no hydrogen 2.985 N/A ARG 133.A NH1 THR 225.A OG1 no hydrogen 3.035 N/A ARG 133.A NH2 THR 225.A OG1 no hydrogen 2.742 N/A HIS 136.A N ASP 221.A OD1 no hydrogen 2.754 N/A GLY 137.A N ASP 221.A OD2 no hydrogen 2.652 N/A LYS 138.A N THR 217.A OG1 no hydrogen 2.864 N/A VAL 140.A N GLU 215.A O no hydrogen 2.837 N/A THR 141.A OG1 ASP 45.A OD2 no hydrogen 2.557 N/A GLN 144.A N THR 141.A O no hydrogen 3.001 N/A GLY 145.A N GLY 142.A O no hydrogen 3.075 N/A LEU 146.A N LEU 6.A O no hydrogen 2.949 N/A HIS 148.A N MET 213.A O no hydrogen 3.288 N/A CYS 149.A N SER 197.A O no hydrogen 3.256 N/A ILE 150.A N HIS 211.A O no hydrogen 3.072 N/A VAL 151.A N ALA 199.A O no hydrogen 3.333 N/A ARG 152.A N ARG 208.A O no hydrogen 2.778 N/A ARG 152.A NH1 ALA 205.A O no hydrogen 3.015 N/A GLN 153.A NE2 ASP 109.A OD2 no hydrogen 2.795 N/A GLU 158.A N ASP 155.A OD1 no hydrogen 3.083 N/A ALA 159.A N ASP 155.A O no hydrogen 2.962 N/A HIS 160.A N VAL 156.A O no hydrogen 2.829 N/A HIS 160.A NE2 GLY 170.A O no hydrogen 2.631 N/A LYS 161.A N ALA 157.A O no hydrogen 2.977 N/A LYS 161.A NZ TYR 86.A OH no hydrogen 2.902 N/A PHE 162.A N GLU 158.A O no hydrogen 3.064 N/A TYR 163.A N ALA 159.A O no hydrogen 2.954 N/A TYR 163.A OH ASP 109.A OD2 no hydrogen 2.645 N/A SER 164.A N HIS 160.A O no hydrogen 2.815 N/A SER 164.A OG HIS 160.A O no hydrogen 2.581 N/A LEU 165.A N LYS 161.A O no hydrogen 2.999 N/A LEU 166.A N PHE 162.A O no hydrogen 3.190 N/A GLY 167.A N SER 164.A O no hydrogen 2.983 N/A PHE 168.A N TYR 163.A O no hydrogen 3.043 N/A ARG 169.A N HIS 190.A O no hydrogen 2.945 N/A ARG 169.A NE ASP 272.A O no hydrogen 3.325 N/A ARG 169.A NH2 ASP 272.A O no hydrogen 3.028 N/A VAL 172.A N ASP 171.A OD1 no hydrogen 2.701 N/A GLU 173.A N LEU 186.A O no hydrogen 2.926 N/A TYR 174.A N LEU 186.A O no hydrogen 3.372 N/A TYR 174.A OH.A ASP 280.A OD1.A no hydrogen 2.777 N/A TYR 174.A OH.A ASP 280.A OD1.B no hydrogen 1.626 N/A TYR 174.A OH.B ASN 245.A OD1 no hydrogen 3.138 N/A TYR 174.A OH.B ASP 280.A OD1.B no hydrogen 2.750 N/A ARG 175.A N TYR 277.A O no hydrogen 2.998 N/A ARG 175.A NE GLU 185.A OE2 no hydrogen 2.747 N/A ARG 175.A NH2 GLU 185.A OE2 no hydrogen 3.230 N/A ILE 176.A N ALA 184.A O no hydrogen 2.820 N/A LEU 178.A N MET 182.A O no hydrogen 2.864 N/A GLY 181.A N LEU 178.A O no hydrogen 2.877 N/A ALA 184.A N ILE 176.A O no hydrogen 2.829 N/A LEU 186.A N TYR 174.A O no hydrogen 3.074 N/A SER 187.A N PHE 200.A O no hydrogen 2.846 N/A PHE 188.A N ASP 171.A O no hydrogen 3.045 N/A MET 189.A N ILE 198.A O no hydrogen 2.882 N/A HIS 190.A N ARG 169.A O no hydrogen 2.816 N/A HIS 190.A NE2 ASP 272.A OD1 no hydrogen 2.859 N/A ASN 192.A ND2 ILE 4.A O no hydrogen 2.838 N/A ARG 194.A N ASN 192.A OD1 no hydrogen 2.928 N/A ARG 194.A NE GLN 144.A O no hydrogen 2.867 N/A ARG 194.A NH2 VAL 140.A O no hydrogen 2.908 N/A ARG 194.A NH2 GLY 145.A O no hydrogen 3.123 N/A HIS 196.A ND1 ASP 195.A OD2 no hydrogen 2.965 N/A SER 197.A N MET 189.A O no hydrogen 2.861 N/A ILE 198.A N MET 189.A O no hydrogen 3.313 N/A ALA 199.A N CYS 149.A O no hydrogen 3.149 N/A PHE 200.A N SER 187.A O no hydrogen 2.919 N/A LYS 207.A NZ ASP 59.A O no hydrogen 2.695 N/A LYS 207.A NZ SER 257.A O no hydrogen 3.214 N/A ARG 208.A N ASP 60.A OD2 no hydrogen 2.666 N/A ARG 208.A NH1 LEU 61.A O no hydrogen 3.018 N/A LEU 209.A N ASP 60.A OD1 no hydrogen 3.022 N/A ASN 210.A N ILE 150.A O no hydrogen 2.883 N/A HIS 211.A ND1 ASN 210.A OD1 no hydrogen 2.759 N/A LEU 212.A N LEU 260.A O no hydrogen 3.068 N/A MET 213.A N HIS 148.A O no hydrogen 2.768 N/A LEU 214.A N GLU 262.A O no hydrogen 3.183 N/A TYR 216.A N GLY 264.A O no hydrogen 2.861 N/A TYR 216.A OH LEU 27.A O no hydrogen 2.672 N/A THR 217.A N LYS 138.A O no hydrogen 2.884 N/A THR 217.A OG1 LYS 138.A O no hydrogen 3.309 N/A THR 217.A OG1 HIS 218.A ND1 no hydrogen 2.712 N/A HIS 218.A ND1 THR 217.A OG1 no hydrogen 2.712 N/A GLU 220.A N GLU 220.A OE1 no hydrogen 2.793 N/A ASP 221.A N HIS 218.A O no hydrogen 3.115 N/A LEU 222.A N HIS 218.A O no hydrogen 3.332 N/A GLY 223.A N MET 219.A O no hydrogen 2.922 N/A TYR 224.A N GLU 220.A O no hydrogen 3.120 N/A THR 225.A N ASP 221.A O no hydrogen 2.950 N/A THR 225.A OG1 MET 26.A O no hydrogen 3.241 N/A THR 225.A OG1 TYR 216.A OH no hydrogen 2.690 N/A THR 225.A OG1 ASP 221.A O no hydrogen 3.228 N/A HIS 226.A N LEU 222.A O no hydrogen 2.835 N/A GLN 227.A N GLY 223.A O no hydrogen 2.880 N/A GLN 228.A N TYR 224.A O no hydrogen 2.856 N/A GLN 228.A NE2 ASP 25.A O no hydrogen 3.136 N/A PHE 229.A N THR 225.A O no hydrogen 3.123 N/A VAL 230.A N HIS 226.A O no hydrogen 3.122 N/A LYS 231.A N GLN 227.A O no hydrogen 2.825 N/A ASN 232.A N GLN 228.A O no hydrogen 2.910 N/A ASN 232.A ND2 GLN 228.A O no hydrogen 2.716 N/A GLU 233.A N VAL 230.A O no hydrogen 3.005 N/A ILE 234.A N PHE 229.A O no hydrogen 2.810 N/A ALA 237.A N TYR 252.A O no hydrogen 2.839 N/A GLN 239.A N GLY 285.A O no hydrogen 2.763 N/A GLN 239.A NE2 GLU 287.A OE1 no hydrogen 3.090 N/A GLY 241.A N THR 250.A O no hydrogen 2.833 N/A ILE 242.A N PHE 282.A O no hydrogen 3.008 N/A HIS 243.A ND1.A ASP 280.A OD1.A no hydrogen 2.880 N/A HIS 243.A ND1.B ASP 280.A OD2.B no hydrogen 3.079 N/A HIS 243.A NE2.A TYR 252.A OH no hydrogen 2.791 N/A HIS 243.A NE2.B GLU 262.A OE2 no hydrogen 2.528 N/A ALA 244.A N TYR 174.A OH.A no hydrogen 3.055 N/A ALA 244.A N ASP 280.A OD1.B no hydrogen 2.973 N/A ASN 245.A N TYR 174.A OH.B no hydrogen 3.199 N/A ASN 245.A ND2 GLU 173.A OE1 no hydrogen 2.871 N/A ASP 246.A N ASN 245.A OD1 no hydrogen 2.802 N/A LYS 247.A N HIS 243.A O no hydrogen 2.944 N/A LYS 247.A NZ ALA 244.A O no hydrogen 2.880 N/A LYS 247.A NZ ASN 245.A O no hydrogen 2.786 N/A ALA 248.A N ASP 246.A OD1.A no hydrogen 2.682 N/A ALA 248.A N ASP 246.A OD1.B no hydrogen 2.987 N/A LEU 249.A N TRP 265.A O no hydrogen 2.924 N/A THR 250.A N GLY 241.A O no hydrogen 2.884 N/A THR 250.A OG1 GLU 262.A OE2 no hydrogen 2.664 N/A THR 250.A OG1 HIS 284.A NE2 no hydrogen 2.792 N/A PHE 251.A N PRO 263.A O no hydrogen 3.367 N/A TYR 252.A N LEU 238.A O no hydrogen 3.026 N/A TYR 252.A OH HIS 243.A NE2.A no hydrogen 2.791 N/A GLY 253.A N ILE 261.A O no hydrogen 2.845 N/A ALA 254.A N ASP 235.A O no hydrogen 2.815 N/A THR 255.A N TRP 259.A O no hydrogen 3.085 N/A THR 255.A OG1 TRP 259.A O no hydrogen 2.851 N/A SER 257.A N THR 255.A OG1 no hydrogen 3.102 N/A SER 257.A OG ASP 59.A OD1 no hydrogen 2.686 N/A GLY 258.A N THR 255.A O no hydrogen 3.085 N/A LEU 260.A N ASN 210.A O no hydrogen 3.113 N/A ILE 261.A N GLY 253.A O no hydrogen 2.801 N/A GLU 262.A N LEU 212.A O no hydrogen 2.734 N/A GLY 264.A N LEU 214.A O no hydrogen 2.929 N/A TRP 265.A N LEU 249.A O no hydrogen 2.924 N/A TRP 265.A NE1 THR 217.A O no hydrogen 3.022 N/A ARG 266.A NE LYS 247.A O no hydrogen 3.415 N/A ARG 266.A NE ARG 266.A O no hydrogen 3.352 N/A ARG 266.A NH2 LYS 247.A O no hydrogen 2.714 N/A GLY 267.A N GLU 215.A OE2 no hydrogen 3.060 N/A ALA 268.A N ASP 246.A O no hydrogen 2.705 N/A ALA 270.A N ALA 193.A O no hydrogen 2.822 N/A TYR 277.A N GLU 173.A O no hydrogen 2.763 N/A TYR 277.A OH GLU 275.A OE2 no hydrogen 2.493 N/A ASP 280.A N LEU 297.A O no hydrogen 2.666 N/A ILE 281.A N ILE 242.A O no hydrogen 2.991 N/A HIS 284.A N LEU 240.A O no hydrogen 2.934 N/A HIS 284.A ND1 ASP 280.A OD2.A no hydrogen 2.668 N/A HIS 284.A ND1 ASP 280.A OD2.B no hydrogen 2.742 N/A HIS 284.A NE2 THR 250.A OG1 no hydrogen 2.792 N/A GLU 287.A N ALA 237.A O no hydrogen 2.941 N/A ALA 288.A N ILE 236.A O no hydrogen 2.828 N/A TYR 291.A OH ASP 235.A OD2 no hydrogen 2.802 N/A LYS 296.A NZ SER 298.A OXT no hydrogen 3.411 N/A SER 298.A OG GLY 283.A O no hydrogen 2.667 N/A