Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lw1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N GLY 1.A O no hydrogen 2.978 N/A MET 6.A N MET 3.A O no hydrogen 3.048 N/A ARG 8.A NH1 GLU 44.A OE1 no hydrogen 3.507 N/A ARG 8.A NH1 GLU 44.A OE2 no hydrogen 2.953 N/A ARG 8.A NH2 GLU 44.A OE1 no hydrogen 2.814 N/A LEU 11.A N GLU 7.A O no hydrogen 2.954 N/A ILE 12.A N ARG 8.A O no hydrogen 3.078 N/A GLN 13.A N ALA 9.A O no hydrogen 2.942 N/A LYS 14.A N SER 10.A O no hydrogen 2.883 N/A ALA 15.A N LEU 11.A O no hydrogen 2.869 N/A LYS 16.A N ILE 12.A O no hydrogen 3.093 N/A LYS 16.A NZ GLU 43.A OE2.A no hydrogen 3.220 N/A LEU 17.A N GLN 13.A O no hydrogen 3.072 N/A ALA 18.A N LYS 14.A O no hydrogen 2.795 N/A GLU 19.A N ALA 15.A O no hydrogen 2.951 N/A GLN 20.A N LYS 16.A O no hydrogen 3.156 N/A GLN 20.A NE2.A LYS 16.A O no hydrogen 3.548 N/A ALA 21.A N LEU 17.A O no hydrogen 2.954 N/A GLU 22.A N GLU 19.A O no hydrogen 3.011 N/A ARG 23.A N ALA 18.A O no hydrogen 2.870 N/A ARG 23.A NE ASP 26.A OD2 no hydrogen 2.939 N/A ARG 23.A NH2 ASP 26.A OD2 no hydrogen 2.876 N/A MET 27.A N ARG 23.A O no hydrogen 2.926 N/A ALA 28.A N TYR 24.A O no hydrogen 2.886 N/A ALA 29.A N GLU 25.A O no hydrogen 3.008 N/A PHE 30.A N ASP 26.A O no hydrogen 2.889 N/A MET 31.A N MET 27.A O no hydrogen 2.961 N/A LYS 32.A N ALA 28.A O no hydrogen 2.847 N/A LYS 32.A NZ GLU 36.A OE2 no hydrogen 2.784 N/A GLY 33.A N ALA 29.A O no hydrogen 3.034 N/A ALA 34.A N PHE 30.A O no hydrogen 2.924 N/A VAL 35.A N MET 31.A O no hydrogen 2.872 N/A GLU 36.A N LYS 32.A O no hydrogen 2.947 N/A LYS 37.A N ALA 34.A O no hydrogen 3.126 N/A LYS 37.A NZ MET 3.A O no hydrogen 3.370 N/A LYS 37.A NZ MET 6.A O no hydrogen 2.731 N/A GLY 38.A N VAL 35.A O no hydrogen 3.008 N/A SER 42.A N GLU 44.A OE1 no hydrogen 2.863 N/A GLU 44.A N SER 42.A OG no hydrogen 3.152 N/A ARG 45.A N SER 42.A O no hydrogen 2.850 N/A ARG 45.A NH1 LEU 41.A O no hydrogen 2.928 N/A LEU 47.A N GLU 43.A O no hydrogen 3.005 N/A LEU 48.A N GLU 44.A O no hydrogen 2.977 N/A SER 49.A N ARG 45.A O no hydrogen 2.972 N/A VAL 50.A N ASN 46.A O no hydrogen 2.885 N/A ALA 51.A N LEU 47.A O no hydrogen 3.001 N/A TYR 52.A N LEU 48.A O no hydrogen 3.193 N/A LYS 53.A N SER 49.A O no hydrogen 2.878 N/A ASN 54.A N VAL 50.A O no hydrogen 3.082 N/A ASN 54.A ND2 VAL 50.A O no hydrogen 2.889 N/A VAL 55.A N ALA 51.A O no hydrogen 3.083 N/A VAL 56.A N TYR 52.A O no hydrogen 2.849 N/A GLY 57.A N LYS 53.A O no hydrogen 2.864 N/A GLY 58.A N ASN 54.A O no hydrogen 3.185 N/A GLN 59.A N VAL 55.A O no hydrogen 3.279 N/A GLN 59.A NE2.A GLU 95.A OE2.B no hydrogen 2.933 N/A ARG 60.A N VAL 56.A O no hydrogen 2.802 N/A ARG 60.A NE GLU 137.A OE1 no hydrogen 2.906 N/A ARG 60.A NH2 GLU 137.A OE1 no hydrogen 3.478 N/A ARG 60.A NH2 GLU 137.A OE2 no hydrogen 2.944 N/A ALA 61.A N GLY 57.A O no hydrogen 3.006 N/A ALA 62.A N GLY 58.A O no hydrogen 3.045 N/A TRP 63.A N GLN 59.A O no hydrogen 2.809 N/A TRP 63.A NE1 GLU 93.A OE1 no hydrogen 2.854 N/A ARG 64.A N ARG 60.A O no hydrogen 2.927 N/A VAL 65.A N ALA 61.A O no hydrogen 3.140 N/A LEU 66.A N ALA 62.A O no hydrogen 2.985 N/A SER 67.A N TRP 63.A O no hydrogen 2.786 N/A SER 67.A OG.B TRP 63.A O no hydrogen 3.094 N/A SER 68.A N ARG 64.A O no hydrogen 3.041 N/A ILE 69.A N VAL 65.A O no hydrogen 3.090 N/A GLU 70.A N LEU 66.A O no hydrogen 2.889 N/A GLN 71.A N SER 67.A O no hydrogen 2.865 N/A LYS 72.A N SER 68.A O no hydrogen 3.021 N/A SER 73.A N ILE 69.A O no hydrogen 2.981 N/A SER 73.A OG GLU 70.A O no hydrogen 2.479 N/A ASN 74.A N GLU 70.A O no hydrogen 3.217 N/A ASN 74.A N GLN 71.A O no hydrogen 3.057 N/A GLU 75.A N LYS 72.A O no hydrogen 3.061 N/A SER 78.A N GLU 75.A O no hydrogen 3.117 N/A SER 78.A OG SER 73.A O no hydrogen 3.131 N/A SER 78.A OG GLU 79.A O no hydrogen 3.315 N/A GLY 82.A N GLU 80.A OE2 no hydrogen 2.856 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.833 N/A ARG 86.A NH1 GLU 90.A OE1 no hydrogen 3.392 N/A ARG 86.A NH1 GLU 90.A OE2 no hydrogen 3.058 N/A GLU 87.A N PRO 83.A O no hydrogen 2.902 N/A TYR 88.A N GLU 84.A O no hydrogen 2.919 N/A ARG 89.A N VAL 85.A O no hydrogen 2.865 N/A ARG 89.A NE GLU 70.A OE1 no hydrogen 2.734 N/A ARG 89.A NH1 GLU 93.A OE1 no hydrogen 2.890 N/A ARG 89.A NH2 GLU 70.A OE1 no hydrogen 3.407 N/A ARG 89.A NH2 GLU 70.A OE2 no hydrogen 2.927 N/A GLU 90.A N ARG 86.A O no hydrogen 2.833 N/A LYS 91.A N GLU 87.A O no hydrogen 2.919 N/A VAL 92.A N TYR 88.A O no hydrogen 3.035 N/A GLU 93.A N ARG 89.A O no hydrogen 2.826 N/A THR 94.A N GLU 90.A O no hydrogen 2.868 N/A THR 94.A OG1.A GLU 90.A O no hydrogen 2.746 N/A THR 94.A OG1.B GLU 90.A O no hydrogen 3.326 N/A THR 94.A OG1.B LYS 91.A O no hydrogen 3.073 N/A GLU 95.A N LYS 91.A O no hydrogen 3.092 N/A LEU 96.A N VAL 92.A O no hydrogen 2.885 N/A GLN 97.A N GLU 93.A O no hydrogen 2.862 N/A GLY 98.A N THR 94.A O no hydrogen 2.935 N/A VAL 99.A N GLU 95.A O no hydrogen 3.050 N/A CYS 100.A N LEU 96.A O no hydrogen 2.990 N/A CYS 100.A SG LEU 96.A O no hydrogen 3.485 N/A CYS 100.A SG TYR 131.A O no hydrogen 3.818 N/A ASP 101.A N GLN 97.A O no hydrogen 2.844 N/A THR 102.A N GLY 98.A O no hydrogen 2.963 N/A THR 102.A OG1 GLY 98.A O no hydrogen 2.960 N/A VAL 103.A N VAL 99.A O no hydrogen 2.978 N/A LEU 104.A N CYS 100.A O no hydrogen 2.877 N/A GLY 105.A N ASP 101.A O no hydrogen 2.859 N/A LEU 106.A N THR 102.A O no hydrogen 3.038 N/A LEU 107.A N VAL 103.A O no hydrogen 2.990 N/A ASP 108.A N LEU 104.A O no hydrogen 2.958 N/A SER 109.A N GLY 105.A O no hydrogen 2.906 N/A LEU 111.A N LEU 106.A O no hydrogen 3.305 N/A ILE 112.A N LEU 107.A O no hydrogen 2.973 N/A GLU 114.A N HIS 110.A O no hydrogen 3.335 N/A ALA 115.A N ILE 112.A O no hydrogen 3.038 N/A SER 120.A OG ASP 117.A O no hydrogen 3.019 N/A ARG 121.A N ASP 117.A O no hydrogen 2.901 N/A ARG 121.A NE GLU 156.A OE2.A no hydrogen 3.466 N/A ARG 121.A NH1 ALA 115.A O no hydrogen 3.038 N/A ARG 121.A NH2 GLU 156.A OE2.A no hydrogen 3.280 N/A VAL 122.A N ALA 118.A O no hydrogen 2.840 N/A PHE 123.A N GLU 119.A O no hydrogen 3.234 N/A TYR 124.A N SER 120.A O no hydrogen 2.958 N/A LEU 125.A N ARG 121.A O no hydrogen 2.949 N/A LYS 126.A N VAL 122.A O no hydrogen 2.885 N/A LYS 126.A NZ ASP 130.A OD2 no hydrogen 2.881 N/A MET 127.A N PHE 123.A O no hydrogen 3.016 N/A LYS 128.A N TYR 124.A O no hydrogen 2.881 N/A GLY 129.A N LEU 125.A O no hydrogen 2.934 N/A ASP 130.A N LYS 126.A O no hydrogen 2.860 N/A TYR 131.A N MET 127.A O no hydrogen 2.953 N/A TYR 132.A N LYS 128.A O no hydrogen 3.036 N/A ARG 133.A N GLY 129.A O no hydrogen 2.837 N/A ARG 133.A NE TYR 154.A OH no hydrogen 2.904 N/A ARG 133.A NH2 ASP 130.A OD1 no hydrogen 3.149 N/A ARG 133.A NH2 TYR 154.A OH no hydrogen 3.511 N/A TYR 134.A N ASP 130.A O no hydrogen 2.900 N/A LEU 135.A N TYR 131.A O no hydrogen 3.062 N/A ALA 136.A N TYR 132.A O no hydrogen 2.818 N/A GLU 137.A N ARG 133.A O no hydrogen 2.981 N/A VAL 138.A N LEU 135.A O no hydrogen 3.252 N/A ALA 139.A N ALA 136.A O no hydrogen 3.266 N/A ARG 145.A NE ASP 142.A OD1 no hydrogen 3.234 N/A ARG 145.A NH2 ASP 142.A OD1 no hydrogen 3.263 N/A ILE 146.A N ASP 142.A O no hydrogen 2.908 N/A ILE 147.A N LYS 143.A O no hydrogen 2.931 N/A ASP 148.A N LYS 144.A O no hydrogen 2.932 N/A SER 149.A N ARG 145.A O no hydrogen 2.906 N/A SER 149.A OG ARG 145.A O no hydrogen 3.192 N/A ALA 150.A N ILE 146.A O no hydrogen 3.012 N/A ARG 151.A N ILE 147.A O no hydrogen 2.929 N/A ARG 151.A NE.B ASP 148.A OD1.A no hydrogen 2.801 N/A ARG 151.A NH2.B ASP 148.A OD1.A no hydrogen 3.320 N/A ARG 151.A NH2.B ASP 148.A OD2.A no hydrogen 3.276 N/A SER 152.A N ASP 148.A O no hydrogen 2.895 N/A SER 152.A OG.A GLU 156.A OE1.B no hydrogen 3.359 N/A SER 152.A OG.B ASP 148.A O no hydrogen 2.956 N/A ALA 153.A N SER 149.A O no hydrogen 3.138 N/A TYR 154.A N ALA 150.A O no hydrogen 2.971 N/A TYR 154.A OH ASP 130.A OD1 no hydrogen 2.585 N/A GLN 155.A N ARG 151.A O no hydrogen 2.818 N/A GLN 155.A NE2 GLN 155.A O no hydrogen 3.356 N/A GLN 155.A NE2 ASP 159.A OD1 no hydrogen 2.937 N/A GLU 156.A N SER 152.A O no hydrogen 3.013 N/A ALA 157.A N ALA 153.A O no hydrogen 3.032 N/A MET 158.A N TYR 154.A O no hydrogen 2.835 N/A ASP 159.A N GLN 155.A O no hydrogen 2.946 N/A ILE 160.A N GLU 156.A O no hydrogen 3.124 N/A SER 161.A N ALA 157.A O no hydrogen 2.918 N/A SER 161.A OG.A ALA 157.A O no hydrogen 3.354 N/A SER 161.A OG.A MET 158.A O no hydrogen 3.008 N/A LYS 162.A N MET 158.A O no hydrogen 2.922 N/A LYS 163.A N ASP 159.A O no hydrogen 3.348 N/A GLU 164.A N ILE 160.A O no hydrogen 2.863 N/A MET 165.A N SER 161.A O no hydrogen 2.984 N/A THR 168.A OG1 ASP 207.A OD2.B no hydrogen 2.665 N/A ASN 169.A N PRO 166.A O no hydrogen 3.017 N/A ASN 169.A ND2 GLU 119.A OE1.B no hydrogen 3.328 N/A ILE 171.A N ASN 169.A OD1 no hydrogen 2.853 N/A ARG 172.A N ASN 169.A OD1 no hydrogen 3.096 N/A ARG 172.A NH1 MET 165.A O no hydrogen 2.813 N/A LEU 173.A N ASN 169.A O no hydrogen 2.918 N/A GLY 174.A N PRO 170.A O no hydrogen 2.896 N/A LEU 175.A N ILE 171.A O no hydrogen 2.906 N/A ALA 176.A N ARG 172.A O no hydrogen 2.999 N/A LEU 177.A N LEU 173.A O no hydrogen 2.913 N/A ASN 178.A N GLY 174.A O no hydrogen 2.995 N/A ASN 178.A ND2 ASP 130.A OD1 no hydrogen 2.860 N/A ASN 178.A ND2 ASP 130.A OD2 no hydrogen 3.243 N/A PHE 179.A N LEU 175.A O no hydrogen 2.816 N/A SER 180.A N ALA 176.A O no hydrogen 2.861 N/A SER 180.A OG.A ALA 193.A O no hydrogen 2.887 N/A SER 180.A OG.B ALA 176.A O no hydrogen 3.435 N/A SER 180.A OG.B LEU 177.A O no hydrogen 2.664 N/A VAL 181.A N LEU 177.A O no hydrogen 3.065 N/A PHE 182.A N ASN 178.A O no hydrogen 2.891 N/A HIS 183.A N PHE 179.A O no hydrogen 2.957 N/A TYR 184.A N SER 180.A O no hydrogen 3.023 N/A GLU 185.A N VAL 181.A O no hydrogen 2.809 N/A ILE 186.A N PHE 182.A O no hydrogen 2.912 N/A ALA 187.A N PHE 182.A O no hydrogen 2.954 N/A SER 189.A N HIS 183.A O no hydrogen 2.776 N/A SER 189.A OG.A ALA 187.A O no hydrogen 3.149 N/A SER 189.A OG.B ALA 187.A O no hydrogen 3.029 N/A ALA 193.A N SER 189.A O no hydrogen 3.029 N/A ILE 194.A N PRO 190.A O no hydrogen 2.929 N/A SER 195.A N GLU 191.A O no hydrogen 2.933 N/A SER 195.A OG.B GLU 191.A O no hydrogen 3.047 N/A LEU 196.A N GLU 192.A O no hydrogen 2.913 N/A ALA 197.A N ALA 193.A O no hydrogen 3.004 N/A LYS 198.A N ILE 194.A O no hydrogen 2.923 N/A THR 199.A N SER 195.A O no hydrogen 2.916 N/A THR 199.A OG1.A SER 195.A O no hydrogen 3.422 N/A THR 199.A OG1.B SER 195.A O no hydrogen 3.017 N/A THR 199.A OG1.B LEU 196.A O no hydrogen 3.265 N/A THR 200.A N LEU 196.A O no hydrogen 2.928 N/A THR 200.A OG1 LEU 196.A O no hydrogen 2.679 N/A PHE 201.A N ALA 197.A O no hydrogen 2.952 N/A ASP 202.A N LYS 198.A O no hydrogen 2.934 N/A GLU 203.A N THR 199.A O no hydrogen 2.946 N/A ALA 204.A N THR 200.A O no hydrogen 3.040 N/A MET 205.A N PHE 201.A O no hydrogen 2.913 N/A ALA 206.A N ASP 202.A O no hydrogen 3.215 N/A ASP 207.A N ALA 204.A O no hydrogen 2.949 N/A LEU 208.A N MET 205.A O no hydrogen 3.285 N/A HIS 209.A ND1 ALA 206.A O no hydrogen 3.180 N/A THR 210.A N ASP 207.A O no hydrogen 3.147 N/A THR 210.A OG1 ASP 207.A O no hydrogen 2.771 N/A LEU 211.A N LEU 208.A O no hydrogen 3.058 N/A SER 212.A OG SER 215.A OG no hydrogen 3.296 N/A SER 215.A N SER 212.A OG no hydrogen 3.090 N/A SER 215.A OG SER 212.A OG no hydrogen 3.296 N/A TYR 216.A N SER 212.A O no hydrogen 2.844 N/A LYS 217.A N GLU 213.A O no hydrogen 3.052 N/A LYS 217.A NZ.B ASP 214.A OD1 no hydrogen 2.600 N/A ASP 218.A N ASP 214.A O no hydrogen 3.153 N/A SER 219.A N SER 215.A O no hydrogen 2.926 N/A SER 219.A OG THR 168.A O no hydrogen 2.677 N/A SER 219.A OG SER 215.A O no hydrogen 3.292 N/A THR 220.A N TYR 216.A O no hydrogen 2.928 N/A THR 220.A OG1 TYR 216.A O no hydrogen 2.850 N/A THR 220.A OG1 LYS 217.A O no hydrogen 3.346 N/A LEU 221.A N LYS 217.A O no hydrogen 3.111 N/A MET 223.A N SER 219.A O no hydrogen 2.990 N/A GLN 224.A N THR 220.A O no hydrogen 2.940 N/A GLN 224.A NE2 ASP 228.A OD1 no hydrogen 2.895 N/A LEU 226.A N ILE 222.A O no hydrogen 3.166 N/A ARG 227.A N MET 223.A O no hydrogen 2.958 N/A ASP 228.A N GLN 224.A O no hydrogen 2.803 N/A ASN 229.A N LEU 225.A O no hydrogen 3.030 N/A LEU 230.A N LEU 226.A O no hydrogen 2.920 N/A THR 231.A N ARG 227.A O no hydrogen 2.892 N/A THR 231.A OG1 ARG 227.A O no hydrogen 3.026 N/A LEU 232.A N ASP 228.A O no hydrogen 3.128 N/A TRP 233.A N ASN 229.A O no hydrogen 2.873 N/A TRP 233.A N LEU 230.A O no hydrogen 3.211 N/A THR 234.A N LEU 230.A O no hydrogen 2.930 N/A THR 234.A OG1 LEU 230.A O no hydrogen 2.654 N/A