Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lgp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N ASP 2.A OD1 no hydrogen 3.257 N/A LYS 5.A N ASP 2.A O no hydrogen 2.847 N/A ASN 6.A N GLN 248.A O no hydrogen 3.037 N/A THR 7.A N GLN 248.A O no hydrogen 2.819 N/A THR 7.A OG1 ASN 6.A OD1 no hydrogen 3.015 N/A THR 7.A OG1 GLN 248.A O no hydrogen 3.524 N/A CYS 8.A N GLY 59.A O no hydrogen 2.901 N/A CYS 8.A SG LYS 9.A O no hydrogen 4.043 N/A LYS 9.A NZ GLN 248.A OE1 no hydrogen 3.306 N/A LYS 9.A NZ GLU 249.A O no hydrogen 3.389 N/A LEU 10.A N GLN 61.A O no hydrogen 2.770 N/A LEU 11.A N LEU 117.A O no hydrogen 2.896 N/A VAL 12.A N GLN 64.A O no hydrogen 2.848 N/A VAL 13.A N HIS 119.A O no hydrogen 2.903 N/A ALA 14.A N ARG 66.A O no hydrogen 2.901 N/A ASP 15.A N PHE 121.A O no hydrogen 3.130 N/A HIS 16.A N ASN 82.A OD1 no hydrogen 2.964 N/A HIS 16.A ND1 ASN 82.A OD1 no hydrogen 2.876 N/A ARG 17.A NH1 ASP 93.A O no hydrogen 2.820 N/A PHE 18.A N ASP 15.A OD1 no hydrogen 2.871 N/A TYR 19.A N ASP 15.A O no hydrogen 2.947 N/A ARG 20.A N HIS 16.A O no hydrogen 2.983 N/A TYR 21.A N ARG 17.A O no hydrogen 2.942 N/A MET 22.A N PHE 18.A O no hydrogen 2.753 N/A GLY 23.A N PHE 18.A O no hydrogen 3.051 N/A GLY 25.A N TYR 19.A O no hydrogen 3.037 N/A GLU 26.A N GLY 23.A O no hydrogen 2.890 N/A THR 29.A OG1 GLU 26.A OE1 no hydrogen 2.832 N/A THR 30.A N GLU 26.A O no hydrogen 3.119 N/A THR 30.A OG1 GLU 26.A O no hydrogen 2.798 N/A THR 31.A N GLU 27.A O no hydrogen 2.976 N/A THR 31.A OG1 GLU 27.A O no hydrogen 3.008 N/A THR 31.A OG1 SER 28.A O no hydrogen 3.294 N/A ASN 32.A N SER 28.A O no hydrogen 2.914 N/A ASN 32.A ND2.B GLU 36.A OE2 no hydrogen 3.546 N/A TYR 33.A N THR 29.A O no hydrogen 3.200 N/A LEU 34.A N THR 30.A O no hydrogen 3.320 N/A ILE 35.A N THR 31.A O no hydrogen 2.780 N/A GLU 36.A N ASN 32.A O no hydrogen 3.032 N/A LEU 37.A N TYR 33.A O no hydrogen 3.025 N/A ILE 38.A N LEU 34.A O no hydrogen 2.961 N/A ASP 39.A N ILE 35.A O no hydrogen 3.081 N/A ARG 40.A N GLU 36.A O no hydrogen 2.955 N/A ARG 40.A NE ASP 177.A OD1 no hydrogen 3.363 N/A ARG 40.A NE ASP 177.A OD2 no hydrogen 2.733 N/A ARG 40.A NH2 ASP 177.A OD1 no hydrogen 2.861 N/A VAL 41.A N LEU 37.A O no hydrogen 2.912 N/A ASP 42.A N ILE 38.A O no hydrogen 2.716 N/A ASP 43.A N ASP 39.A O no hydrogen 3.051 N/A TYR 45.A N VAL 41.A O no hydrogen 3.150 N/A TYR 45.A OH THR 181.A O no hydrogen 2.842 N/A ARG 46.A N ASP 42.A O no hydrogen 2.776 N/A ARG 46.A NH1 ASP 42.A OD2 no hydrogen 3.024 N/A ARG 46.A NH1 ASP 43.A OD1 no hydrogen 2.904 N/A ARG 46.A NH2 ASP 43.A OD1 no hydrogen 3.025 N/A ASN 47.A N ASP 43.A O no hydrogen 3.247 N/A ASN 47.A ND2 ASP 43.A O no hydrogen 2.770 N/A THR 48.A N TYR 45.A O no hydrogen 3.055 N/A THR 48.A OG1 ILE 44.A O no hydrogen 2.574 N/A TRP 50.A N PHE 55.A O no hydrogen 2.949 N/A ASN 52.A N ALA 49.A O no hydrogen 3.023 N/A ASN 52.A ND2 GLN 229.A OE1 no hydrogen 2.781 N/A ALA 53.A N ASP 51.A OD1 no hydrogen 2.858 N/A PHE 55.A N ASP 51.A OD1 no hydrogen 3.078 N/A LYS 56.A N GLY 54.A O no hydrogen 2.988 N/A GLY 57.A N ARG 46.A O no hydrogen 2.918 N/A GLY 59.A N ASN 6.A O no hydrogen 3.086 N/A ILE 60.A N ASP 42.A OD1 no hydrogen 2.956 N/A GLN 61.A N CYS 8.A O no hydrogen 3.174 N/A GLN 61.A NE2 SER 251.A O no hydrogen 3.253 N/A GLU 63.A N LEU 10.A O no hydrogen 2.777 N/A GLN 64.A N LEU 10.A O no hydrogen 3.397 N/A ARG 66.A N VAL 12.A O no hydrogen 2.774 N/A ARG 66.A NH1 GLU 111.A OE1 no hydrogen 2.769 N/A ARG 66.A NH2 GLU 111.A OE1 no hydrogen 3.125 N/A LEU 68.A N ALA 14.A O no hydrogen 2.955 N/A GLN 72.A N ASN 82.A O no hydrogen 2.910 N/A GLN 72.A NE2 GLU 73.A O no hydrogen 2.907 N/A LYS 75.A N GLU 78.A OE1 no hydrogen 2.873 N/A GLU 78.A N LYS 75.A O no hydrogen 3.033 N/A TYR 81.A N ASP 107.A OD2 no hydrogen 3.060 N/A ASN 82.A N HIS 80.A ND1 no hydrogen 2.981 N/A ASN 82.A ND2 SER 70.A O no hydrogen 2.967 N/A MET 83.A N HIS 80.A O no hydrogen 3.137 N/A SER 86.A OG LYS 92.A O no hydrogen 2.810 N/A GLU 91.A N ASN 89.A OD1 no hydrogen 3.083 N/A LYS 92.A N ASN 89.A O no hydrogen 3.028 N/A TRP 95.A N GLN 124.A OE1 no hydrogen 2.789 N/A ASP 96.A N TYR 87.A O no hydrogen 3.013 N/A MET 99.A N ASP 96.A OD2 no hydrogen 3.021 N/A LEU 100.A N ASP 96.A O no hydrogen 2.976 N/A LEU 101.A N VAL 97.A O no hydrogen 3.040 N/A GLU 102.A N LYS 98.A O no hydrogen 3.139 N/A GLN 103.A N MET 99.A O no hydrogen 2.836 N/A GLN 103.A NE2 ASP 107.A OD1 no hydrogen 3.362 N/A GLN 103.A NE2 ASP 107.A OD2 no hydrogen 3.061 N/A PHE 104.A N LEU 100.A O no hydrogen 2.807 N/A SER 105.A N LEU 101.A O no hydrogen 3.024 N/A SER 105.A OG LEU 101.A O no hydrogen 2.792 N/A SER 105.A OG SER 159.A OG no hydrogen 2.699 N/A PHE 106.A N GLU 102.A O no hydrogen 2.997 N/A ASP 107.A N GLN 103.A O no hydrogen 2.932 N/A ILE 108.A N PHE 104.A O no hydrogen 2.926 N/A ALA 109.A N PHE 106.A O no hydrogen 3.509 N/A GLU 111.A N GLU 111.A OE2 no hydrogen 2.793 N/A ALA 112.A N ILE 108.A O no hydrogen 2.791 N/A SER 113.A N ALA 109.A O no hydrogen 3.051 N/A SER 113.A OG GLU 110.A O no hydrogen 2.696 N/A LYS 114.A N GLU 111.A O no hydrogen 3.098 N/A LYS 114.A NZ GLU 110.A O no hydrogen 3.548 N/A LYS 114.A NZ GLU 110.A OE1 no hydrogen 2.801 N/A VAL 115.A N ALA 112.A O no hydrogen 3.403 N/A LEU 117.A N LYS 9.A O no hydrogen 3.294 N/A ALA 118.A N ASN 158.A O no hydrogen 2.910 N/A HIS 119.A N LEU 11.A O no hydrogen 2.858 N/A HIS 119.A NE2 THR 162.A OG1 no hydrogen 2.767 N/A LEU 120.A N GLY 160.A O no hydrogen 2.919 N/A PHE 121.A N VAL 13.A O no hydrogen 2.717 N/A THR 122.A N THR 162.A O no hydrogen 2.913 N/A THR 122.A OG1 ASP 15.A OD1 no hydrogen 3.334 N/A THR 122.A OG1 ASP 15.A OD2 no hydrogen 2.568 N/A TYR 123.A OH THR 170.A OG1 no hydrogen 2.648 N/A GLN 124.A N SER 163.A OG no hydrogen 3.058 N/A GLN 124.A NE2 THR 122.A OG1 no hydrogen 2.904 N/A ASP 125.A N ASP 93.A OD2 no hydrogen 2.771 N/A THR 130.A N ASP 127.A O no hydrogen 3.429 N/A LEU 133.A N LEU 161.A O no hydrogen 3.220 N/A TYR 135.A N SER 159.A O no hydrogen 3.156 N/A GLY 140.A N LEU 157.A O no hydrogen 2.871 N/A VAL 141.A N ASN 187.A O no hydrogen 2.921 N/A CYS 142.A N CYS 116.A O no hydrogen 3.000 N/A CYS 142.A SG LYS 242.A O no hydrogen 3.488 N/A TYR 146.A N ILE 155.A O no hydrogen 2.859 N/A SER 148.A N LYS 153.A O no hydrogen 2.934 N/A GLY 151.A N SER 148.A OG no hydrogen 2.787 N/A LYS 152.A N SER 148.A O no hydrogen 2.655 N/A LYS 153.A NZ PHE 106.A O no hydrogen 2.822 N/A ILE 155.A N TYR 146.A O no hydrogen 2.930 N/A LEU 157.A N LYS 144.A O no hydrogen 3.235 N/A ASN 158.A ND2 ALA 112.A O no hydrogen 2.795 N/A ASN 158.A ND2 VAL 115.A O no hydrogen 3.039 N/A ASN 158.A ND2 CYS 116.A O no hydrogen 3.375 N/A SER 159.A OG SER 105.A OG no hydrogen 2.699 N/A GLY 160.A N ALA 118.A O no hydrogen 3.167 N/A LEU 161.A N LEU 133.A O no hydrogen 2.756 N/A THR 162.A N LEU 120.A O no hydrogen 2.895 N/A THR 162.A OG1 HIS 119.A NE2 no hydrogen 2.767 N/A THR 162.A OG1 THR 180.A OG1 no hydrogen 2.912 N/A SER 163.A N LEU 131.A O no hydrogen 2.811 N/A SER 163.A OG GLN 124.A O no hydrogen 2.640 N/A SER 163.A OG LYS 165.A O no hydrogen 3.441 N/A THR 164.A N THR 122.A O no hydrogen 3.208 N/A LYS 165.A N SER 163.A OG no hydrogen 3.329 N/A LYS 165.A NZ ASP 93.A OD1 no hydrogen 3.130 N/A LYS 165.A NZ ASP 93.A OD2 no hydrogen 3.229 N/A ASN 166.A N LYS 169.A O no hydrogen 2.942 N/A TYR 167.A N ASP 125.A OD1 no hydrogen 2.809 N/A GLY 168.A N ASP 125.A OD2 no hydrogen 2.624 N/A LYS 169.A N ASN 166.A O no hydrogen 3.308 N/A LYS 169.A NZ THR 170.A O no hydrogen 2.818 N/A THR 170.A OG1 TYR 123.A OH no hydrogen 2.648 N/A ILE 171.A N THR 164.A O no hydrogen 2.834 N/A LEU 172.A N GLU 175.A OE1 no hydrogen 2.913 N/A ALA 176.A N LEU 172.A O no hydrogen 2.967 N/A ASP 177.A N THR 173.A O no hydrogen 2.957 N/A VAL 179.A N GLU 175.A O no hydrogen 3.071 N/A THR 180.A N ALA 176.A O no hydrogen 3.083 N/A THR 180.A OG1 THR 162.A OG1 no hydrogen 2.912 N/A THR 180.A OG1 ALA 176.A O no hydrogen 3.510 N/A THR 181.A N ASP 177.A O no hydrogen 2.955 N/A THR 181.A OG1 ASP 177.A O no hydrogen 2.742 N/A HIS 182.A N LEU 178.A O no hydrogen 3.013 N/A HIS 182.A ND1 VAL 211.A O no hydrogen 2.762 N/A GLU 183.A N VAL 179.A O no hydrogen 2.921 N/A LEU 184.A N THR 180.A O no hydrogen 2.867 N/A GLY 185.A N THR 181.A O no hydrogen 2.834 N/A HIS 186.A N HIS 182.A O no hydrogen 3.102 N/A HIS 186.A ND1 ALA 190.A O no hydrogen 2.985 N/A HIS 186.A NE2 HIS 182.A NE2 no hydrogen 3.076 N/A HIS 186.A NE2 HIS 192.A NE2 no hydrogen 3.074 N/A ASN 187.A N GLU 183.A O no hydrogen 3.103 N/A ASN 187.A ND2 TYR 135.A O no hydrogen 2.911 N/A ASN 187.A ND2 SER 159.A O no hydrogen 3.044 N/A PHE 188.A N LEU 184.A O no hydrogen 2.808 N/A GLY 189.A N HIS 186.A O no hydrogen 2.919 N/A ALA 190.A N GLY 185.A O no hydrogen 2.947 N/A ASP 193.A N MET 212.A O no hydrogen 2.970 N/A LEU 197.A N PRO 194.A O no hydrogen 3.289 N/A CYS 200.A N LEU 197.A O no hydrogen 2.949 N/A ALA 201.A N LEU 197.A O no hydrogen 2.967 N/A ALA 201.A N ALA 198.A O no hydrogen 3.259 N/A GLN 206.A N ASN 203.A O no hydrogen 3.083 N/A GLY 207.A N GLU 204.A O no hydrogen 3.307 N/A GLY 208.A N ASN 203.A O no hydrogen 3.102 N/A LYS 209.A NZ PRO 202.A O no hydrogen 2.731 N/A VAL 211.A N MET 226.A O no hydrogen 2.912 N/A TYR 213.A N TYR 210.A O no hydrogen 3.118 N/A TYR 213.A OH ASP 195.A OD1 no hydrogen 2.642 N/A VAL 217.A N ILE 215.A O no hydrogen 2.685 N/A GLY 219.A N ASN 224.A OD1 no hydrogen 2.906 N/A HIS 221.A N ASN 224.A OD1 no hydrogen 2.908 N/A ASN 223.A N GLY 207.A O no hydrogen 3.043 N/A ASN 223.A ND2 GLN 206.A O no hydrogen 3.192 N/A ASN 223.A ND2 GLY 208.A O no hydrogen 2.961 N/A ASN 224.A N HIS 221.A O no hydrogen 3.217 N/A ASN 224.A ND2 LYS 209.A O no hydrogen 2.952 N/A MET 226.A N ASN 223.A O no hydrogen 2.811 N/A SER 228.A OG ASP 193.A OD1 no hydrogen 2.622 N/A SER 228.A OG SER 231.A OG no hydrogen 3.304 N/A GLN 229.A NE2 ASN 52.A OD1 no hydrogen 2.801 N/A SER 231.A N SER 228.A OG no hydrogen 3.040 N/A SER 231.A OG SER 228.A OG no hydrogen 3.304 N/A LYS 232.A N SER 228.A O no hydrogen 2.933 N/A LYS 232.A NZ ASN 52.A OD1 no hydrogen 3.266 N/A GLN 233.A N GLN 229.A O no hydrogen 3.010 N/A SER 234.A N CYS 230.A O no hydrogen 3.278 N/A SER 234.A OG CYS 230.A O no hydrogen 3.125 N/A ILE 235.A N SER 231.A O no hydrogen 2.824 N/A TYR 236.A N LYS 232.A O no hydrogen 2.709 N/A LYS 237.A N GLN 233.A O no hydrogen 3.417 N/A THR 238.A N SER 234.A O no hydrogen 3.359 N/A THR 238.A OG1 PHE 188.A O no hydrogen 3.187 N/A THR 238.A OG1 SER 234.A O no hydrogen 2.923 N/A ILE 239.A N ILE 235.A O no hydrogen 2.919 N/A GLU 240.A N TYR 236.A O no hydrogen 3.100 N/A SER 241.A N LYS 237.A O no hydrogen 3.052 N/A LYS 242.A N THR 238.A O no hydrogen 2.672 N/A LYS 242.A NZ GLU 245.A OE1 no hydrogen 3.143 N/A ALA 243.A N ILE 239.A O no hydrogen 2.906 N/A GLN 244.A NE2 ASP 2.A OD2 no hydrogen 3.117 N/A CYS 246.A N LYS 242.A O no hydrogen 3.214 N/A PHE 247.A N ALA 243.A O no hydrogen 2.910 N/A GLN 248.A N THR 7.A O no hydrogen 2.774 N/A ARG 250.A NH1 ASP 42.A OD1 no hydrogen 3.031 N/A SER 251.A N GLN 61.A OE1 no hydrogen 2.869 N/A