Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3k4y_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N ASP 173.A OD2 no hydrogen 2.915 N/A THR 3.A N LYS 48.A O no hydrogen 2.803 N/A ILE 4.A N LEU 174.A O no hydrogen 2.840 N/A LEU 5.A N ILE 50.A O no hydrogen 2.799 N/A LYS 6.A N LEU 176.A O no hydrogen 2.668 N/A LEU 7.A N VAL 52.A O no hydrogen 2.768 N/A GLY 8.A N ALA 178.A O no hydrogen 3.105 N/A SER 10.A N ASP 180.A OD1 no hydrogen 2.866 N/A SER 10.A N ASP 180.A OD2 no hydrogen 3.176 N/A SER 10.A OG ASP 180.A OD2 no hydrogen 3.408 N/A ILE 11.A N GLY 8.A O no hydrogen 3.164 N/A SER 13.A N SER 10.A O no hydrogen 3.230 N/A SER 13.A OG SER 20.A O no hydrogen 2.666 N/A ASP 14.A N SER 20.A OG no hydrogen 2.662 N/A ASN 16.A N ASP 14.A OD1 no hydrogen 3.425 N/A VAL 17.A N ASP 14.A O no hydrogen 2.834 N/A TYR 19.A N ALA 57.A O no hydrogen 3.046 N/A SER 20.A N VAL 17.A O no hydrogen 2.673 N/A LYS 22.A N LEU 12.A O no hydrogen 2.876 N/A LYS 22.A NZ SER 10.A O no hydrogen 2.476 N/A LEU 26.A N LYS 22.A O no hydrogen 2.909 N/A GLU 27.A N TRP 23.A O no hydrogen 2.809 N/A ARG 28.A N ASP 24.A O no hydrogen 2.981 N/A ARG 28.A NH1 GLU 32.A OE2 no hydrogen 3.153 N/A ARG 28.A NH2 GLY 237.A O no hydrogen 3.306 N/A ILE 29.A N ASN 25.A O no hydrogen 2.890 N/A ALA 30.A N LEU 26.A O no hydrogen 3.018 N/A MET 31.A N GLU 27.A O no hydrogen 3.047 N/A GLU 32.A N ARG 28.A O no hydrogen 2.975 N/A ILE 33.A N ILE 29.A O no hydrogen 2.946 N/A LYS 34.A N ALA 30.A O no hydrogen 2.856 N/A LYS 34.A NZ ASP 38.A OD1 no hydrogen 3.101 N/A ASN 35.A N MET 31.A O no hydrogen 2.623 N/A ALA 36.A N GLU 32.A O no hydrogen 2.863 N/A LEU 37.A N ILE 33.A O no hydrogen 3.005 N/A ASP 38.A N LYS 34.A O no hydrogen 2.885 N/A TYR 39.A N ASN 35.A O no hydrogen 2.926 N/A TYR 40.A N ALA 36.A O no hydrogen 2.898 N/A TYR 40.A OH LEU 247.A O no hydrogen 2.362 N/A LYS 41.A N LEU 37.A O no hydrogen 3.128 N/A ASN 42.A N ASP 38.A O no hydrogen 3.179 N/A GLN 43.A N TYR 39.A O no hydrogen 2.983 N/A ASN 44.A N LYS 41.A O no hydrogen 2.859 N/A LYS 45.A N TYR 40.A O no hydrogen 2.868 N/A LYS 48.A N MET 1.A O no hydrogen 3.071 N/A ILE 50.A N THR 3.A O no hydrogen 2.877 N/A LEU 51.A N PRO 140.A O no hydrogen 3.221 N/A VAL 52.A N LEU 5.A O no hydrogen 2.994 N/A HIS 53.A N ILE 142.A O no hydrogen 3.095 N/A HIS 53.A ND1 GLY 54.A O no hydrogen 3.059 N/A HIS 53.A NE2 ASN 94.A OD1 no hydrogen 3.155 N/A ALA 57.A N SER 13.A OG no hydrogen 2.884 N/A PHE 58.A N GLY 55.A O no hydrogen 2.744 N/A GLY 59.A N GLY 55.A O no hydrogen 2.997 N/A ALA 63.A N GLY 59.A O no hydrogen 2.877 N/A LYS 64.A N HIS 60.A O no hydrogen 2.700 N/A TYR 66.A N ALA 63.A O no hydrogen 2.735 N/A LEU 67.A N LYS 64.A O no hydrogen 2.951 N/A LYS 68.A N ILE 75.A O no hydrogen 3.058 N/A GLU 70.A N LYS 73.A O no hydrogen 2.937 N/A LYS 73.A N GLU 70.A O no hydrogen 3.101 N/A ILE 75.A N LYS 68.A O no hydrogen 2.986 N/A ILE 77.A N TYR 66.A O no hydrogen 2.942 N/A LYS 81.A N ASN 78.A O no hydrogen 3.078 N/A GLY 82.A N ASN 78.A O no hydrogen 2.885 N/A PHE 83.A N MET 79.A O no hydrogen 3.155 N/A GLU 85.A N LYS 81.A O no hydrogen 3.073 N/A ILE 86.A N GLY 82.A O no hydrogen 2.985 N/A GLN 87.A N PHE 83.A O no hydrogen 2.968 N/A GLN 87.A NE2 SER 114.A OG no hydrogen 2.499 N/A ARG 88.A N TRP 84.A O no hydrogen 2.568 N/A ALA 89.A N GLU 85.A O no hydrogen 3.151 N/A MET 90.A N ILE 86.A O no hydrogen 2.983 N/A ARG 91.A N GLN 87.A O no hydrogen 2.779 N/A ARG 91.A NH1 GLN 112.A OE1 no hydrogen 3.136 N/A ARG 92.A N ARG 88.A O no hydrogen 3.082 N/A PHE 93.A N ALA 89.A O no hydrogen 3.181 N/A ASN 94.A N MET 90.A O no hydrogen 2.901 N/A ASN 95.A N ARG 91.A O no hydrogen 2.853 N/A ASN 95.A ND2 ARG 91.A O no hydrogen 2.914 N/A ILE 96.A N ARG 92.A O no hydrogen 3.018 N/A ILE 97.A N PHE 93.A O no hydrogen 3.031 N/A ILE 98.A N ASN 94.A O no hydrogen 2.837 N/A ASP 99.A N ASN 95.A O no hydrogen 2.788 N/A THR 100.A N ILE 96.A O no hydrogen 3.148 N/A THR 100.A OG1 ILE 96.A O no hydrogen 2.777 N/A LEU 101.A N ILE 97.A O no hydrogen 2.926 N/A GLN 102.A N ILE 98.A O no hydrogen 2.761 N/A GLN 102.A NE2 ALA 108.A O no hydrogen 2.828 N/A SER 103.A N ASP 99.A O no hydrogen 2.845 N/A SER 103.A OG THR 100.A O no hydrogen 2.457 N/A TYR 104.A N LEU 101.A O no hydrogen 3.028 N/A ASP 105.A N GLN 102.A O no hydrogen 2.569 N/A ILE 106.A N LEU 101.A O no hydrogen 3.052 N/A ALA 108.A N ILE 106.A O no hydrogen 2.558 N/A VAL 109.A N VAL 139.A O no hydrogen 2.896 N/A ILE 111.A N VAL 141.A O no hydrogen 2.898 N/A SER 114.A N ASP 145.A OD2 no hydrogen 2.923 N/A SER 114.A OG ASP 145.A OD2 no hydrogen 2.843 N/A SER 115.A N GLN 112.A O no hydrogen 3.150 N/A SER 115.A OG GLN 112.A OE1 no hydrogen 3.024 N/A PHE 116.A N PRO 113.A O no hydrogen 2.860 N/A VAL 117.A N PRO 113.A O no hydrogen 2.811 N/A VAL 118.A N ILE 124.A O no hydrogen 2.974 N/A PHE 119.A N ILE 148.A O no hydrogen 2.854 N/A ILE 124.A N VAL 118.A O no hydrogen 2.932 N/A SER 128.A N ASP 126.A OD1 no hydrogen 2.707 N/A SER 128.A OG ASP 126.A OD1 no hydrogen 2.556 N/A SER 128.A OG ASP 126.A OD2 no hydrogen 3.408 N/A LYS 131.A N THR 127.A O no hydrogen 3.103 N/A GLU 132.A N SER 128.A O no hydrogen 3.197 N/A MET 133.A N ALA 129.A O no hydrogen 2.969 N/A LEU 134.A N ILE 130.A O no hydrogen 2.936 N/A LYS 135.A N LYS 131.A O no hydrogen 2.934 N/A ARG 136.A N GLU 132.A O no hydrogen 3.237 N/A ARG 136.A N MET 133.A O no hydrogen 3.128 N/A ARG 136.A NH1 GLU 132.A O no hydrogen 2.871 N/A ARG 136.A NH1 GLU 132.A OE1 no hydrogen 2.930 N/A ASN 137.A N LEU 134.A O no hydrogen 2.698 N/A LEU 138.A N MET 133.A O no hydrogen 2.862 N/A VAL 139.A N PRO 107.A O no hydrogen 2.699 N/A VAL 141.A N VAL 109.A O no hydrogen 2.648 N/A ILE 142.A N LEU 51.A O no hydrogen 3.009 N/A HIS 143.A ND1 GLY 144.A O no hydrogen 2.846 N/A GLY 144.A N HIS 53.A O no hydrogen 2.905 N/A ASP 145.A N ILE 157.A O no hydrogen 2.933 N/A ILE 146.A N ASP 145.A OD1 no hydrogen 2.811 N/A VAL 147.A N ARG 155.A O no hydrogen 2.960 N/A ASP 149.A N GLY 153.A O no hydrogen 3.123 N/A LYS 151.A N ASP 149.A OD1 no hydrogen 2.615 N/A GLY 153.A N ASP 149.A OD1 no hydrogen 2.703 N/A ARG 155.A N VAL 147.A O no hydrogen 2.890 N/A ILE 157.A N ASP 145.A O no hydrogen 2.877 N/A SER 158.A N ASP 161.A OD2 no hydrogen 2.876 N/A SER 158.A OG ASP 161.A OD2 no hydrogen 3.144 N/A ASP 161.A N SER 158.A O no hydrogen 3.105 N/A ASP 161.A N SER 158.A OG no hydrogen 3.235 N/A ILE 162.A N SER 158.A O no hydrogen 3.003 N/A VAL 163.A N GLY 159.A O no hydrogen 2.837 N/A TYR 165.A N ASP 161.A O no hydrogen 3.391 N/A TYR 165.A OH PHE 125.A O no hydrogen 2.678 N/A LEU 166.A N ILE 162.A O no hydrogen 2.922 N/A ALA 167.A N VAL 163.A O no hydrogen 2.822 N/A ASN 168.A N PRO 164.A O no hydrogen 3.083 N/A GLU 169.A N TYR 165.A O no hydrogen 2.975 N/A LEU 170.A N LEU 166.A O no hydrogen 2.683 N/A LYS 171.A N ASN 168.A O no hydrogen 3.182 N/A LYS 171.A NZ ASN 168.A O no hydrogen 3.117 N/A ALA 172.A N ALA 167.A O no hydrogen 3.067 N/A ASP 173.A N LEU 2.A O no hydrogen 2.942 N/A LEU 174.A N LEU 2.A O no hydrogen 3.275 N/A ILE 175.A N ARG 231.A O no hydrogen 2.946 N/A LEU 176.A N ILE 4.A O no hydrogen 2.692 N/A TYR 177.A N PHE 233.A O no hydrogen 2.760 N/A ALA 178.A N LYS 6.A O no hydrogen 3.047 N/A THR 179.A N PHE 235.A O no hydrogen 2.839 N/A THR 179.A OG1 VAL 181.A O no hydrogen 3.052 N/A THR 179.A OG1 PHE 235.A O no hydrogen 3.023 N/A VAL 181.A N THR 179.A OG1 no hydrogen 3.144 N/A VAL 184.A N THR 254.A OG1 no hydrogen 3.199 N/A ILE 186.A N LYS 189.A O no hydrogen 2.755 N/A ILE 191.A N VAL 184.A O no hydrogen 3.201 N/A ARG 193.A NE ASP 195.A OD2 no hydrogen 2.820 N/A ARG 193.A NH1 GLU 255.A OE1 no hydrogen 2.808 N/A ARG 193.A NH2 ASP 257.A OD2 no hydrogen 3.312 N/A ILE 194.A N GLU 255.A O no hydrogen 2.816 N/A ASP 195.A N ASN 198.A OD1 no hydrogen 2.817 N/A ASN 197.A N ASP 195.A OD1 no hydrogen 3.184 N/A ASN 198.A N ASP 195.A O no hydrogen 2.942 N/A ASN 198.A ND2 ARG 193.A O no hydrogen 3.275 N/A ILE 199.A N ASP 195.A O no hydrogen 3.086 N/A ILE 202.A N ASN 198.A O no hydrogen 2.849 N/A ILE 202.A N ILE 199.A O no hydrogen 2.574 N/A LEU 203.A N ILE 199.A O no hydrogen 2.706 N/A ASN 204.A N TYR 200.A O no hydrogen 2.841 N/A TYR 205.A N LYS 201.A O no hydrogen 3.411 N/A LEU 206.A N ILE 202.A O no hydrogen 2.818 N/A SER 207.A N LEU 203.A O no hydrogen 3.086 N/A SER 207.A OG LEU 203.A O no hydrogen 2.836 N/A GLY 208.A N TYR 205.A O no hydrogen 2.892 N/A SER 211.A OG ASP 213.A O no hydrogen 3.340 N/A ASP 213.A N SER 211.A OG no hydrogen 3.275 N/A THR 215.A N ASP 213.A OD1 no hydrogen 3.102 N/A THR 215.A OG1 ASP 213.A OD1 no hydrogen 2.320 N/A THR 215.A OG1 ASP 213.A OD2 no hydrogen 3.166 N/A GLY 217.A N THR 215.A OG1 no hydrogen 3.100 N/A MET 218.A N ASP 213.A OD2 no hydrogen 3.167 N/A LYS 219.A NZ SER 207.A OG no hydrogen 3.235 N/A TYR 220.A OH ASP 160.A O no hydrogen 3.232 N/A LYS 221.A N GLY 217.A O no hydrogen 3.312 N/A ILE 222.A N MET 218.A O no hydrogen 2.936 N/A GLU 223.A N LYS 219.A O no hydrogen 3.044 N/A MET 224.A N TYR 220.A O no hydrogen 3.140 N/A ILE 225.A N LYS 221.A O no hydrogen 3.155 N/A ARG 226.A N ILE 222.A O no hydrogen 3.249 N/A LYS 227.A N GLU 223.A O no hydrogen 2.816 N/A ASN 228.A N MET 224.A O no hydrogen 2.979 N/A ASN 228.A N ILE 225.A O no hydrogen 3.055 N/A LYS 229.A N ARG 226.A O no hydrogen 3.031 N/A CYS 230.A N ILE 225.A O no hydrogen 3.350 N/A CYS 230.A SG ARG 231.A O no hydrogen 3.705 N/A ARG 231.A N ASP 173.A O no hydrogen 3.414 N/A ARG 231.A NE GLU 255.A OE2 no hydrogen 2.450 N/A ARG 231.A NH2 GLU 255.A OE2 no hydrogen 2.927 N/A GLY 232.A N ILE 256.A O no hydrogen 2.956 N/A PHE 233.A N ILE 175.A O no hydrogen 2.932 N/A VAL 234.A N THR 254.A O no hydrogen 3.033 N/A PHE 235.A N TYR 177.A O no hydrogen 3.029 N/A ASN 236.A ND2 ASP 182.A OD1 no hydrogen 3.096 N/A GLY 237.A N THR 179.A O no hydrogen 2.938 N/A ASN 238.A N ASN 236.A OD1 no hydrogen 2.702 N/A ASN 238.A ND2 ASN 25.A OD1 no hydrogen 2.790 N/A LYS 239.A N ASN 236.A O no hydrogen 3.279 N/A ASN 241.A N GLU 32.A OE2 no hydrogen 2.538 N/A ASN 242.A N LYS 239.A O no hydrogen 3.125 N/A TYR 244.A N GLU 32.A OE1 no hydrogen 3.114 N/A LYS 245.A N ASN 241.A O no hydrogen 2.748 N/A ALA 246.A N ASN 242.A O no hydrogen 2.745 N/A LEU 247.A N ILE 243.A O no hydrogen 2.963 N/A LEU 248.A N TYR 244.A O no hydrogen 3.128 N/A LEU 248.A N LYS 245.A O no hydrogen 2.678 N/A GLY 249.A N LYS 245.A O no hydrogen 2.785 N/A GLY 249.A N ALA 246.A O no hydrogen 2.871 N/A GLU 250.A N LYS 245.A O no hydrogen 3.050 N/A THR 254.A N VAL 234.A O no hydrogen 3.066 N/A THR 254.A OG1 ILE 191.A O no hydrogen 2.784 N/A GLU 255.A N LYS 192.A O no hydrogen 2.771 N/A ILE 256.A N GLY 232.A O no hydrogen 2.860 N/A ASP 257.A N ILE 194.A O no hydrogen 3.061 N/A PHE 258.A N CYS 230.A O no hydrogen 2.762 N/A SER 259.A N ASP 257.A OD1 no hydrogen 2.801 N/A SER 259.A OG ASP 257.A OD1 no hydrogen 2.518 N/A SER 259.A OG ASP 257.A OD2 no hydrogen 3.552 N/A