Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4lye_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 3.A OE1 no hydrogen 3.279 N/A MET 1.A N GLU 3.A OE2 no hydrogen 2.705 N/A GLU 3.A N GLU 3.A OE1 no hydrogen 2.781 N/A GLN 4.A N GLN 4.A OE1 no hydrogen 3.036 N/A PHE 5.A N PHE 2.A O no hydrogen 3.232 N/A SER 7.A OG HIS 18.A NE2 no hydrogen 2.752 N/A LYS 8.A N TYR 19.A O no hydrogen 2.985 N/A LYS 8.A NZ GLU 21.A OE2 no hydrogen 2.856 N/A ILE 10.A N THR 17.A O no hydrogen 2.941 N/A CYS 12.A N ILE 15.A O no hydrogen 2.688 N/A CYS 12.A SG ILE 10.A O no hydrogen 3.876 N/A CYS 12.A SG THR 17.A OG1 no hydrogen 3.106 N/A GLY 14.A N ASP 11.A OD2 no hydrogen 3.026 N/A ILE 15.A N CYS 12.A O no hydrogen 2.729 N/A ARG 16.A N ASP 69.A OD2 no hydrogen 2.806 N/A THR 17.A N ILE 10.A O no hydrogen 2.878 N/A THR 17.A OG1 ILE 15.A O no hydrogen 3.147 N/A THR 17.A OG1 HIS 86.A NE2 no hydrogen 2.985 N/A HIS 18.A N THR 68.A OG1 no hydrogen 2.950 N/A HIS 18.A ND1 ASP 61.A OD2 no hydrogen 3.092 N/A HIS 18.A NE2 SER 7.A OG no hydrogen 2.752 N/A TYR 19.A N LYS 8.A O no hydrogen 3.028 N/A ILE 20.A N ALA 59.A O no hydrogen 2.992 N/A MET 22.A N VAL 57.A O no hydrogen 3.086 N/A LEU 28.A N ARG 56.A O no hydrogen 2.871 N/A VAL 29.A N CYS 100.A O no hydrogen 2.885 N/A LEU 30.A N ILE 58.A O no hydrogen 2.686 N/A VAL 31.A N ILE 102.A O no hydrogen 2.711 N/A HIS 32.A ND1 GLY 33.A O no hydrogen 2.561 N/A GLY 33.A N ASN 43.A OD1 no hydrogen 2.802 N/A ALA 38.A N GLY 35.A O no hydrogen 3.216 N/A GLY 40.A N ASP 61.A OD1 no hydrogen 2.848 N/A ARG 41.A NE TYR 179.A OH no hydrogen 3.187 N/A ARG 41.A NH2 TYR 179.A OH no hydrogen 2.795 N/A SER 42.A N ASP 39.A OD1 no hydrogen 2.929 N/A SER 42.A OG ASP 39.A O no hydrogen 3.497 N/A SER 42.A OG ASP 39.A OD1 no hydrogen 2.621 N/A ASN 43.A N ASP 39.A O no hydrogen 3.232 N/A PHE 44.A N GLY 40.A O no hydrogen 3.069 N/A ASN 47.A N PHE 44.A O no hydrogen 3.087 N/A ASN 47.A ND2 MET 258.A O no hydrogen 2.755 N/A PHE 48.A N PHE 44.A O no hydrogen 2.936 N/A PHE 51.A N ASN 47.A O no hydrogen 2.996 N/A ALA 52.A N PHE 48.A O no hydrogen 2.785 N/A ARG 53.A N PRO 49.A O no hydrogen 3.352 N/A HIS 54.A N PHE 51.A O no hydrogen 3.072 N/A MET 55.A N PHE 51.A O no hydrogen 2.872 N/A ARG 56.A N ASP 26.A O no hydrogen 2.880 N/A ARG 56.A NE GLU 21.A OE1 no hydrogen 2.872 N/A ARG 56.A NH1 GLU 21.A OE1 no hydrogen 3.522 N/A ARG 56.A NH1 GLU 21.A OE2 no hydrogen 3.182 N/A VAL 57.A N MET 22.A O no hydrogen 2.889 N/A ILE 58.A N LEU 28.A O no hydrogen 2.794 N/A ALA 59.A N ILE 20.A O no hydrogen 3.150 N/A ASP 61.A N HIS 18.A O no hydrogen 2.945 N/A MET 62.A N HIS 32.A NE2 no hydrogen 3.069 N/A VAL 63.A N HIS 86.A ND1 no hydrogen 3.063 N/A GLY 64.A N ASP 69.A O no hydrogen 3.194 N/A PHE 65.A N MET 62.A O no hydrogen 2.783 N/A GLN 67.A N ASP 61.A OD2 no hydrogen 2.958 N/A THR 68.A N PHE 65.A O no hydrogen 3.113 N/A THR 68.A OG1 ASP 61.A O no hydrogen 2.702 N/A ASP 69.A N ARG 16.A O no hydrogen 2.803 N/A ALA 74.A N ASP 72.A OD1 no hydrogen 2.991 N/A GLY 75.A N ASP 72.A O no hydrogen 3.067 N/A TYR 78.A OH PRO 71.A O no hydrogen 2.618 N/A GLN 80.A NE2 THR 84.A OG1 no hydrogen 3.008 N/A GLN 80.A NE2 THR 110.A OG1 no hydrogen 3.098 N/A ALA 82.A N THR 79.A O no hydrogen 2.973 N/A ALA 82.A N THR 79.A OG1 no hydrogen 3.152 N/A ARG 83.A N THR 79.A O no hydrogen 3.195 N/A ARG 83.A NE GLN 80.A OE1 no hydrogen 2.956 N/A ARG 83.A NH2 GLN 80.A OE1 no hydrogen 3.131 N/A THR 84.A N GLN 80.A O no hydrogen 2.759 N/A THR 84.A OG1 GLN 80.A O no hydrogen 3.194 N/A ASP 85.A N ALA 81.A O no hydrogen 2.780 N/A HIS 86.A N ALA 82.A O no hydrogen 2.850 N/A HIS 86.A NE2 THR 17.A OG1 no hydrogen 2.985 N/A LEU 87.A N ARG 83.A O no hydrogen 2.866 N/A ILE 88.A N THR 84.A O no hydrogen 3.069 N/A SER 89.A N ASP 85.A O no hydrogen 2.903 N/A SER 89.A OG ASP 13.A OD1 no hydrogen 2.922 N/A PHE 90.A N HIS 86.A O no hydrogen 2.834 N/A ILE 91.A N LEU 87.A O no hydrogen 3.068 N/A LYS 92.A N ILE 88.A O no hydrogen 3.238 N/A ALA 93.A N SER 89.A O no hydrogen 2.711 N/A LEU 94.A N PHE 90.A O no hydrogen 3.180 N/A GLY 95.A N LYS 92.A O no hydrogen 2.833 N/A LEU 96.A N ILE 91.A O no hydrogen 3.199 N/A ILE 99.A N LEU 121.A O no hydrogen 2.791 N/A CYS 100.A N PRO 27.A O no hydrogen 3.132 N/A LEU 101.A N ARG 124.A O no hydrogen 3.022 N/A ILE 102.A N VAL 29.A O no hydrogen 2.951 N/A GLY 103.A N VAL 126.A O no hydrogen 3.055 N/A ASN 104.A N VAL 31.A O no hydrogen 2.960 N/A ASN 104.A ND2 ASN 43.A OD1 no hydrogen 3.031 N/A ALA 105.A N MET 128.A O no hydrogen 3.360 N/A GLY 107.A N ASN 104.A O no hydrogen 2.623 N/A THR 109.A N ALA 105.A O no hydrogen 2.830 N/A THR 109.A OG1 ALA 105.A O no hydrogen 3.516 N/A THR 109.A OG1 MET 106.A O no hydrogen 3.525 N/A THR 109.A OG1 ALA 131.A O no hydrogen 2.624 N/A THR 110.A N MET 106.A O no hydrogen 2.997 N/A THR 110.A OG1 MET 106.A O no hydrogen 2.810 N/A ALA 111.A N GLY 107.A O no hydrogen 2.841 N/A CYS 112.A N GLY 108.A O no hydrogen 2.840 N/A GLY 113.A N THR 109.A O no hydrogen 2.850 N/A ALA 114.A N THR 110.A O no hydrogen 2.942 N/A ALA 115.A N ALA 111.A O no hydrogen 2.967 N/A LEU 116.A N CYS 112.A O no hydrogen 2.778 N/A LYS 117.A N GLY 113.A O no hydrogen 2.902 N/A LYS 117.A NZ ASP 85.A OD1 no hydrogen 2.864 N/A ALA 118.A N ALA 114.A O no hydrogen 2.757 N/A GLU 120.A N GLU 120.A OE2 no hydrogen 2.744 N/A LEU 121.A N ALA 118.A O no hydrogen 3.139 N/A ILE 122.A N PRO 119.A O no hydrogen 3.065 N/A ASP 123.A N ILE 99.A O no hydrogen 2.816 N/A ARG 124.A N ILE 99.A O no hydrogen 3.363 N/A LEU 125.A N PRO 218.A O no hydrogen 3.066 N/A VAL 126.A N LEU 101.A O no hydrogen 2.787 N/A LEU 127.A N LEU 220.A O no hydrogen 2.928 N/A MET 128.A N GLY 103.A O no hydrogen 2.991 N/A GLY 129.A N LEU 222.A O no hydrogen 2.982 N/A ALA 131.A N ALA 105.A O no hydrogen 3.252 N/A ASN 133.A ND2 LYS 234.A O no hydrogen 3.055 N/A ILE 134.A N LEU 205.A O no hydrogen 2.907 N/A SER 135.A N ASP 138.A OD2 no hydrogen 2.819 N/A SER 135.A OG ASP 138.A OD2 no hydrogen 2.807 N/A ASP 138.A N SER 135.A OG no hydrogen 3.026 N/A MET 139.A N SER 135.A O no hydrogen 2.947 N/A VAL 140.A N PRO 136.A O no hydrogen 3.097 N/A ALA 141.A N ASP 137.A O no hydrogen 2.659 N/A ASN 142.A N ASP 138.A O no hydrogen 2.765 N/A ASN 142.A ND2 VAL 228.A O no hydrogen 2.931 N/A ARG 143.A N VAL 140.A O no hydrogen 3.094 N/A LEU 146.A N ASN 142.A O no hydrogen 3.093 N/A ALA 147.A N ASP 144.A O no hydrogen 3.456 N/A MET 150.A N LEU 146.A O no hydrogen 2.840 N/A SER 151.A N ALA 147.A O no hydrogen 2.803 N/A SER 151.A OG ALA 147.A O no hydrogen 3.121 N/A TYR 152.A OH SER 184.A OG no hydrogen 2.814 N/A SER 155.A N ASP 153.A OD1 no hydrogen 2.574 N/A SER 155.A OG ASP 153.A OD1 no hydrogen 2.594 N/A SER 155.A OG ASP 153.A OD2 no hydrogen 3.145 N/A GLY 158.A N SER 155.A OG no hydrogen 3.010 N/A MET 159.A N SER 155.A O no hydrogen 3.135 N/A MET 159.A N GLU 156.A O no hydrogen 2.998 N/A ARG 160.A N GLU 156.A O no hydrogen 3.033 N/A ARG 160.A NE GLU 156.A OE2 no hydrogen 3.241 N/A ARG 160.A NH2 GLU 156.A OE2 no hydrogen 3.512 N/A ARG 160.A NH2 ASP 174.A OD1 no hydrogen 2.972 N/A LYS 161.A N GLU 157.A O no hydrogen 2.846 N/A ILE 162.A N GLY 158.A O no hydrogen 3.034 N/A ILE 163.A N MET 159.A O no hydrogen 3.038 N/A ALA 164.A N ARG 160.A O no hydrogen 2.933 N/A ALA 165.A N LYS 161.A O no hydrogen 3.149 N/A LEU 166.A N ILE 162.A O no hydrogen 3.094 N/A LEU 166.A N ILE 163.A O no hydrogen 3.056 N/A THR 167.A N ALA 164.A O no hydrogen 3.479 N/A THR 167.A OG1 ILE 163.A O no hydrogen 2.838 N/A HIS 168.A N GLU 260.A OE1 no hydrogen 3.318 N/A HIS 168.A N GLU 260.A OE2 no hydrogen 3.415 N/A SER 169.A N GLU 260.A OE1 no hydrogen 3.179 N/A ILE 176.A N THR 173.A OG1 no hydrogen 3.201 N/A VAL 177.A N THR 173.A O no hydrogen 3.248 N/A HIS 178.A N ASP 174.A O no hydrogen 2.888 N/A TYR 179.A N ASP 175.A O no hydrogen 2.915 N/A TYR 179.A OH ASP 39.A OD2 no hydrogen 2.430 N/A ARG 180.A N ILE 176.A O no hydrogen 3.174 N/A ARG 180.A NE ALA 36.A O no hydrogen 3.196 N/A ARG 180.A NH2 ALA 36.A O no hydrogen 3.059 N/A HIS 181.A N VAL 177.A O no hydrogen 2.843 N/A HIS 181.A NE2 GLY 154.A O no hydrogen 2.886 N/A GLU 182.A N HIS 178.A O no hydrogen 2.854 N/A ALA 183.A N TYR 179.A O no hydrogen 2.967 N/A SER 184.A N ARG 180.A O no hydrogen 2.830 N/A SER 184.A OG TYR 152.A OH no hydrogen 2.814 N/A SER 184.A OG ARG 180.A O no hydrogen 3.388 N/A SER 184.A OG HIS 181.A O no hydrogen 2.526 N/A LEU 185.A N GLU 182.A O no hydrogen 3.134 N/A ARG 186.A N ALA 183.A O no hydrogen 3.407 N/A ARG 186.A NE ALA 183.A O no hydrogen 2.702 N/A THR 189.A N ARG 186.A O no hydrogen 3.167 N/A THR 189.A OG1 ALA 183.A O no hydrogen 3.230 N/A THR 189.A OG1 ARG 186.A O no hydrogen 3.554 N/A THR 190.A N ARG 186.A O no hydrogen 2.925 N/A THR 190.A OG1 SER 184.A O no hydrogen 2.932 N/A THR 190.A OG1 ARG 186.A O no hydrogen 2.763 N/A ALA 191.A N PRO 187.A O no hydrogen 3.159 N/A ALA 192.A N THR 188.A O no hydrogen 3.151 N/A TYR 193.A N THR 189.A O no hydrogen 2.882 N/A TYR 193.A N THR 190.A O no hydrogen 3.192 N/A TYR 193.A OH VAL 149.A O no hydrogen 2.547 N/A LYS 194.A N THR 190.A O no hydrogen 3.000 N/A ALA 195.A N ALA 191.A O no hydrogen 3.160 N/A THR 196.A N ALA 192.A O no hydrogen 2.887 N/A THR 196.A OG1 ALA 192.A O no hydrogen 2.799 N/A MET 197.A N TYR 193.A O no hydrogen 2.948 N/A GLY 198.A N LYS 194.A O no hydrogen 2.867 N/A TRP 199.A N ALA 195.A O no hydrogen 2.973 N/A ALA 200.A N THR 196.A O no hydrogen 3.047 N/A LYS 201.A N MET 197.A O no hydrogen 2.780 N/A GLN 202.A N GLY 198.A O no hydrogen 3.179 N/A ASN 203.A N TRP 199.A O no hydrogen 2.939 N/A ASN 203.A ND2 TRP 199.A O no hydrogen 3.036 N/A GLY 204.A N ALA 200.A O no hydrogen 2.685 N/A LEU 205.A N ILE 134.A O no hydrogen 2.892 N/A TYR 207.A N VAL 132.A O no hydrogen 2.756 N/A TYR 207.A OH THR 109.A O no hydrogen 2.975 N/A SER 208.A N GLN 211.A OE1 no hydrogen 2.701 N/A SER 208.A OG GLN 211.A OE1 no hydrogen 3.152 N/A GLN 211.A N SER 208.A OG no hydrogen 2.991 N/A LEU 212.A N SER 208.A O no hydrogen 2.951 N/A ALA 213.A N PRO 209.A O no hydrogen 2.929 N/A SER 214.A N GLN 211.A O no hydrogen 2.974 N/A SER 214.A OG GLN 211.A O no hydrogen 2.512 N/A LEU 215.A N LEU 212.A O no hydrogen 3.183 N/A LEU 220.A N LEU 125.A O no hydrogen 2.900 N/A VAL 221.A N ILE 246.A O no hydrogen 2.943 N/A LEU 222.A N LEU 127.A O no hydrogen 2.838 N/A GLY 223.A N HIS 248.A O no hydrogen 3.287 N/A LYS 225.A N PHE 250.A O no hydrogen 2.831 N/A ASN 226.A N CYS 253.A O no hydrogen 2.900 N/A ASP 227.A N GLY 224.A O no hydrogen 3.138 N/A MET 229.A N ASP 227.A OD1 no hydrogen 2.811 N/A VAL 230.A N ASP 227.A OD1 no hydrogen 2.971 N/A LYS 234.A N PRO 231.A O no hydrogen 2.816 N/A LYS 234.A NZ ASN 133.A O no hydrogen 2.987 N/A LYS 234.A NZ ASP 138.A OD2 no hydrogen 3.013 N/A VAL 235.A N PRO 231.A O no hydrogen 3.282 N/A ILE 236.A N VAL 232.A O no hydrogen 2.704 N/A ASP 237.A N ARG 233.A O no hydrogen 2.870 N/A GLN 238.A N LYS 234.A O no hydrogen 3.060 N/A GLN 238.A NE2 ALA 130.A O no hydrogen 2.994 N/A GLN 238.A NE2 ASN 133.A OD1 no hydrogen 3.320 N/A ILE 239.A N VAL 235.A O no hydrogen 3.050 N/A LEU 240.A N ILE 236.A O no hydrogen 2.989 N/A ALA 241.A N ASP 237.A O no hydrogen 2.766 N/A ILE 242.A N GLN 238.A O no hydrogen 3.083 N/A GLN 244.A N GLN 244.A OE1 no hydrogen 2.612 N/A GLN 244.A NE2 LEU 215.A O no hydrogen 2.894 N/A GLN 244.A NE2 MET 217.A O no hydrogen 2.873 N/A ALA 245.A N ILE 242.A O no hydrogen 2.940 N/A ILE 246.A N VAL 219.A O no hydrogen 2.899 N/A HIS 248.A N VAL 221.A O no hydrogen 3.069 N/A PHE 250.A N GLY 223.A O no hydrogen 3.003 N/A CYS 253.A N ASN 226.A OD1 no hydrogen 2.800 N/A CYS 253.A SG GLY 254.A O no hydrogen 3.349 N/A GLY 254.A N GLU 260.A OE2 no hydrogen 2.980 N/A HIS 255.A ND1 ASP 227.A OD2 no hydrogen 2.800 N/A HIS 255.A NE2 ASN 104.A OD1 no hydrogen 2.596 N/A TRP 256.A N LEU 166.A O no hydrogen 2.900 N/A VAL 257.A N HIS 255.A O no hydrogen 2.867 N/A ILE 259.A N TRP 256.A O no hydrogen 3.244 N/A GLU 260.A N TRP 256.A O no hydrogen 2.859 N/A TYR 261.A N VAL 257.A O no hydrogen 2.919 N/A TYR 261.A OH ASN 252.A O no hydrogen 2.687 N/A GLU 263.A N GLU 263.A OE1 no hydrogen 3.062 N/A PHE 265.A N TYR 261.A O no hydrogen 2.951 N/A CYS 266.A N PRO 262.A O no hydrogen 2.935 N/A CYS 266.A SG ASN 47.A O no hydrogen 3.833 N/A CYS 266.A SG PRO 262.A O no hydrogen 3.316 N/A THR 267.A N GLU 263.A O no hydrogen 2.663 N/A THR 267.A OG1 GLU 263.A O no hydrogen 2.970 N/A GLN 268.A N GLU 264.A O no hydrogen 2.822 N/A GLN 268.A NE2 GLU 264.A OE2 no hydrogen 2.743 N/A THR 269.A N PHE 265.A O no hydrogen 3.054 N/A THR 269.A OG1 PHE 265.A O no hydrogen 2.561 N/A THR 269.A OG1 CYS 266.A O no hydrogen 3.171 N/A LEU 270.A N CYS 266.A O no hydrogen 2.828 N/A HIS 271.A N THR 267.A O no hydrogen 2.876 N/A PHE 272.A N GLN 268.A O no hydrogen 3.050 N/A PHE 273.A N THR 269.A O no hydrogen 2.819 N/A GLY 274.A N HIS 271.A O no hydrogen 2.975 N/A LYS 275.A N LEU 270.A O no hydrogen 2.823 N/A LYS 275.A NZ ASP 26.A OD2 no hydrogen 2.814 N/A