Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lia_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N LYS 1.A O no hydrogen 3.103 N/A LYS 6.A N LEU 2.A O no hydrogen 3.222 N/A SER 7.A N ALA 3.A O no hydrogen 3.215 N/A SER 7.A OG ALA 3.A O no hydrogen 3.190 N/A ILE 8.A N TYR 4.A O no hydrogen 2.722 N/A GLU 9.A N GLU 5.A O no hydrogen 3.075 N/A MET 10.A N LYS 6.A O no hydrogen 2.972 N/A ALA 11.A N SER 7.A O no hydrogen 2.940 N/A GLY 12.A N ILE 8.A O no hydrogen 2.996 N/A ASN 13.A N GLU 9.A O no hydrogen 2.710 N/A TYR 14.A N MET 10.A O no hydrogen 3.043 N/A ALA 15.A N ALA 11.A O no hydrogen 2.800 N/A ASN 16.A N GLY 12.A O no hydrogen 2.992 N/A GLN 17.A N ASN 13.A O no hydrogen 2.895 N/A GLN 17.A NE2 ASN 13.A OD1 no hydrogen 2.941 N/A PHE 18.A N TYR 14.A O no hydrogen 2.895 N/A ASP 19.A N ALA 15.A O no hydrogen 2.746 N/A ALA 20.A N ASN 16.A O no hydrogen 2.945 N/A MET 22.A N PHE 18.A O no hydrogen 3.473 N/A GLU 23.A N ASP 19.A O no hydrogen 2.905 N/A ALA 24.A N ALA 20.A O no hydrogen 3.159 N/A ASN 25.A N GLN 21.A O no hydrogen 2.956 N/A GLN 26.A N MET 22.A O no hydrogen 2.876 N/A ALA 27.A N GLU 23.A O no hydrogen 2.952 N/A ILE 28.A N ALA 24.A O no hydrogen 3.004 N/A ILE 28.A N ASN 25.A O no hydrogen 3.186 N/A ALA 29.A N ASN 25.A O no hydrogen 3.334 N/A ARG 30.A N GLN 26.A O no hydrogen 2.988 N/A THR 31.A N ALA 27.A O no hydrogen 2.906 N/A THR 31.A OG1 ALA 27.A O no hydrogen 2.683 N/A LEU 32.A N ILE 28.A O no hydrogen 2.992 N/A ALA 33.A N ALA 29.A O no hydrogen 2.895 N/A CYS 34.A N ARG 30.A O no hydrogen 2.911 N/A CYS 34.A SG ARG 30.A O no hydrogen 3.367 N/A THR 35.A N THR 31.A O no hydrogen 2.986 N/A THR 35.A OG1 THR 31.A O no hydrogen 2.630 N/A MET 36.A N LEU 32.A O no hydrogen 2.897 N/A ALA 37.A N ALA 33.A O no hydrogen 2.951 N/A GLU 38.A N THR 35.A O no hydrogen 2.919 N/A TYR 39.A N MET 36.A O no hydrogen 3.117 N/A TYR 39.A OH ASP 43.A O no hydrogen 3.322 N/A TYR 39.A OH GLU 46.A OE1 no hydrogen 2.352 N/A ASP 43.A N TYR 39.A OH no hydrogen 3.228 N/A ARG 44.A NE ASP 74.A OD2 no hydrogen 2.855 N/A ARG 44.A NH1 HIS 86.A NE2 no hydrogen 2.833 N/A ARG 44.A NH1 GLY 90.A O no hydrogen 2.910 N/A ARG 44.A NH2 ASP 74.A OD1 no hydrogen 2.900 N/A ARG 44.A NH2 ASP 74.A OD2 no hydrogen 3.400 N/A ARG 44.A NH2 ASP 77.A OD1 no hydrogen 2.935 N/A GLU 46.A N ASP 43.A OD1 no hydrogen 3.035 N/A ALA 47.A N ASP 43.A O no hydrogen 3.053 N/A MET 48.A N ARG 44.A O no hydrogen 2.903 N/A SER 49.A N GLU 45.A O no hydrogen 2.848 N/A SER 49.A OG GLU 45.A O no hydrogen 3.117 N/A ILE 50.A N GLU 46.A O no hydrogen 2.882 N/A ILE 51.A N ALA 47.A O no hydrogen 3.062 N/A LYS 52.A N MET 48.A O no hydrogen 3.095 N/A ARG 53.A N SER 49.A O no hydrogen 2.946 N/A ARG 53.A NE GLU 57.A OE2 no hydrogen 2.657 N/A ARG 53.A NH1 GLU 57.A OE2 no hydrogen 3.563 N/A ILE 54.A N ILE 50.A O no hydrogen 2.985 N/A LEU 55.A N ILE 51.A O no hydrogen 2.851 N/A ASN 56.A N LYS 52.A O no hydrogen 2.949 N/A GLU 57.A N ARG 53.A O no hydrogen 2.847 N/A ASN 58.A N LEU 55.A O no hydrogen 3.070 N/A ASN 58.A ND2 ILE 54.A O no hydrogen 2.834 N/A GLN 60.A N GLN 60.A OE1 no hydrogen 2.724 N/A GLN 60.A NE2 ASN 25.A OD1 no hydrogen 3.037 N/A GLN 60.A NE2 ASN 58.A OD1 no hydrogen 3.127 N/A LEU 61.A N ASN 58.A O no hydrogen 2.912 N/A ILE 62.A N ASP 159.A O no hydrogen 2.937 N/A VAL 64.A N CYS 96.A O no hydrogen 2.909 N/A TYR 65.A N GLY 157.A O no hydrogen 3.025 N/A TYR 65.A OH SER 141.A OG no hydrogen 2.431 N/A TYR 65.A OH ASP 143.A OD1 no hydrogen 2.242 N/A LEU 66.A N PRO 94.A O no hydrogen 3.198 N/A GLY 67.A N ILE 155.A O no hydrogen 3.037 N/A TYR 68.A N PHE 92.A O no hydrogen 2.958 N/A GLU 69.A N ALA 153.A O no hydrogen 2.820 N/A ASP 71.A N ASP 77.A OD2 no hydrogen 2.773 N/A ALA 72.A N GLU 69.A O no hydrogen 2.862 N/A GLY 75.A N ASP 71.A O no hydrogen 2.909 N/A ARG 76.A N ASP 74.A OD1 no hydrogen 2.754 N/A ASP 77.A N ASP 71.A OD1 no hydrogen 3.071 N/A ASN 79.A N ARG 76.A O no hydrogen 2.895 N/A TYR 80.A N ASP 77.A O no hydrogen 2.809 N/A ASN 82.A N ASP 87.A O no hydrogen 2.745 N/A ALA 83.A N TYR 80.A O no hydrogen 3.112 N/A HIS 86.A N ALA 83.A O no hydrogen 3.034 N/A HIS 86.A ND1 PRO 84.A O no hydrogen 2.822 N/A THR 89.A N ASP 87.A OD1 no hydrogen 2.805 N/A THR 89.A OG1 ASP 87.A OD1 no hydrogen 2.704 N/A GLY 90.A N ASP 87.A O no hydrogen 3.221 N/A ARG 91.A N THR 89.A OG1 no hydrogen 2.927 N/A ARG 91.A NH1 TYR 68.A O no hydrogen 3.016 N/A ARG 91.A NH2 ASP 112.A OD1 no hydrogen 2.739 N/A TYR 95.A N GLU 106.A O no hydrogen 2.749 N/A TYR 95.A OH ASP 159.A OD2 no hydrogen 2.561 N/A CYS 96.A N VAL 64.A O no hydrogen 2.945 N/A ASN 97.A N ILE 104.A O no hydrogen 2.828 N/A LYS 98.A N ILE 62.A O no hydrogen 2.910 N/A GLY 101.A N LYS 98.A O no hydrogen 3.088 N/A ILE 104.A N ASN 97.A O no hydrogen 2.809 N/A GLU 106.A N TYR 95.A O no hydrogen 3.201 N/A LEU 108.A N VAL 93.A O no hydrogen 2.821 N/A TYR 111.A OH ASP 87.A OD2 no hydrogen 2.594 N/A SER 113.A N HIS 110.A O no hydrogen 3.154 N/A SER 114.A N HIS 110.A O no hydrogen 2.743 N/A TYR 116.A OH VAL 109.A O no hydrogen 2.836 N/A TYR 117.A N SER 114.A O no hydrogen 3.120 N/A TYR 117.A OH GLU 69.A OE2 no hydrogen 2.524 N/A GLN 118.A N SER 114.A O no hydrogen 2.883 N/A LEU 119.A N ASP 115.A O no hydrogen 2.993 N/A LYS 121.A N TYR 117.A O no hydrogen 3.038 N/A LYS 121.A NZ GLU 69.A OE1 no hydrogen 2.913 N/A LYS 121.A NZ GLU 69.A OE2 no hydrogen 3.522 N/A THR 122.A N GLN 118.A O no hydrogen 2.927 N/A THR 122.A OG1 GLN 118.A O no hydrogen 2.954 N/A THR 123.A N LEU 119.A O no hydrogen 2.702 N/A THR 123.A OG1 LEU 119.A O no hydrogen 2.688 N/A GLY 124.A N PRO 120.A O no hydrogen 2.866 N/A LYS 125.A N THR 123.A OG1 no hydrogen 2.911 N/A THR 127.A N ASP 143.A O no hydrogen 2.735 N/A THR 129.A N SER 141.A O no hydrogen 2.918 N/A THR 129.A OG1 GLU 130.A O no hydrogen 2.885 N/A TYR 132.A N MET 139.A O no hydrogen 2.885 N/A TYR 134.A N ILE 137.A O no hydrogen 2.904 N/A ILE 137.A N TYR 134.A O no hydrogen 2.775 N/A MET 139.A N TYR 132.A O no hydrogen 2.799 N/A VAL 140.A N VAL 160.A O no hydrogen 3.155 N/A SER 141.A N THR 129.A OG1 no hydrogen 3.098 N/A SER 141.A OG ASP 143.A OD1 no hydrogen 3.475 N/A SER 141.A OG ASP 143.A OD2 no hydrogen 3.042 N/A SER 141.A OG ASP 159.A OD1 no hydrogen 3.338 N/A TYR 142.A N VAL 158.A O no hydrogen 2.846 N/A ASP 143.A N THR 127.A O no hydrogen 2.769 N/A SER 144.A N ALA 156.A O no hydrogen 2.808 N/A SER 144.A OG ASP 126.A OD1 no hydrogen 2.615 N/A ILE 146.A N GLY 154.A O no hydrogen 2.755 N/A LYS 148.A N GLU 151.A O no hydrogen 2.813 N/A LYS 148.A NZ ALA 72.A O no hydrogen 2.831 N/A GLU 151.A N LYS 148.A O no hydrogen 2.859 N/A ALA 153.A N ILE 146.A O no hydrogen 2.737 N/A ILE 155.A N GLY 67.A O no hydrogen 2.698 N/A ALA 156.A N SER 144.A O no hydrogen 2.974 N/A GLY 157.A N TYR 65.A O no hydrogen 3.010 N/A VAL 158.A N TYR 142.A O no hydrogen 2.980 N/A ASP 159.A N GLY 63.A O no hydrogen 2.759 N/A VAL 160.A N VAL 140.A O no hydrogen 2.682 N/A LEU 162.A N PHE 138.A O no hydrogen 2.855 N/A VAL 165.A N LEU 162.A O no hydrogen 2.848 N/A ASP 167.A N GLU 163.A O no hydrogen 3.247 N/A VAL 168.A N TYR 164.A O no hydrogen 2.844 N/A ALA 169.A N VAL 165.A O no hydrogen 2.610 N/A SER 170.A N ASP 166.A O no hydrogen 2.931 N/A SER 170.A OG ASP 166.A OD1 no hydrogen 2.571 N/A SER 171.A N VAL 168.A O no hydrogen 3.198 N/A SER 171.A OG VAL 168.A O no hydrogen 3.483 N/A ILE 172.A N ALA 169.A O no hydrogen 3.121 N/A THR 174.A N GLY 178.A O no hydrogen 3.082 N/A ASP 176.A N GLU 260.A OE1 no hydrogen 2.738 N/A THR 177.A N GLU 260.A OE1 no hydrogen 2.943 N/A THR 177.A OG1 GLU 260.A OE2 no hydrogen 2.484 N/A GLY 178.A N THR 174.A O no hydrogen 2.786 N/A TYR 179.A N VAL 255.A O no hydrogen 3.059 N/A PHE 181.A N VAL 253.A O no hydrogen 2.990 N/A MET 182.A N SER 191.A OG no hydrogen 3.026 N/A VAL 183.A N SER 251.A O no hydrogen 2.790 N/A SER 184.A N ILE 188.A O no hydrogen 2.930 N/A SER 184.A OG GLU 130.A OE1 no hydrogen 2.367 N/A ASN 185.A N GLU 130.A OE2 no hydrogen 3.197 N/A THR 186.A N GLU 130.A OE1 no hydrogen 2.957 N/A THR 186.A OG1 GLU 130.A OE1 no hydrogen 2.511 N/A GLY 187.A N SER 184.A O no hydrogen 2.834 N/A ILE 188.A N SER 184.A OG no hydrogen 3.178 N/A PHE 189.A N LYS 202.A O no hydrogen 2.973 N/A LEU 190.A N MET 182.A O no hydrogen 2.920 N/A HIS 192.A N ASP 166.A OD1 no hydrogen 3.067 N/A HIS 192.A NE2 THR 194.A OG1 no hydrogen 3.060 N/A THR 194.A OG1 HIS 192.A NE2 no hydrogen 3.060 N/A LYS 196.A NZ ASP 166.A OD1 no hydrogen 2.960 N/A LYS 196.A NZ ASP 166.A OD2 no hydrogen 2.789 N/A LYS 196.A NZ HIS 192.A O no hydrogen 2.609 N/A LYS 196.A NZ PRO 193.A O no hydrogen 3.522 N/A TRP 198.A N GLN 195.A O no hydrogen 2.853 N/A ILE 199.A N LYS 196.A O no hydrogen 3.243 N/A GLY 200.A N PHE 189.A O no hydrogen 2.712 N/A GLU 201.A N TRP 198.A O no hydrogen 2.924 N/A LYS 202.A N TRP 198.A O no hydrogen 2.846 N/A SER 203.A N ASP 206.A OD2 no hydrogen 2.756 N/A SER 203.A OG THR 186.A O no hydrogen 2.969 N/A LEU 204.A N GLY 187.A O no hydrogen 2.961 N/A SER 205.A N SER 203.A OG no hydrogen 3.192 N/A ASP 206.A N SER 203.A O no hydrogen 2.852 N/A PHE 207.A N LEU 204.A O no hydrogen 3.123 N/A VAL 209.A N PHE 207.A O no hydrogen 2.862 N/A GLU 211.A N GLU 211.A OE1 no hydrogen 2.764 N/A ILE 212.A N VAL 209.A O no hydrogen 2.985 N/A LYS 213.A N VAL 209.A O no hydrogen 3.098 N/A LYS 213.A NZ SER 205.A O no hydrogen 2.686 N/A ASN 214.A N GLU 210.A O no hydrogen 2.952 N/A ALA 215.A N GLU 211.A O no hydrogen 3.005 N/A ALA 216.A N ILE 212.A O no hydrogen 2.850 N/A SER 217.A N LYS 213.A O no hydrogen 3.076 N/A SER 217.A OG LYS 213.A O no hydrogen 3.252 N/A ASP 218.A N ASN 214.A O no hydrogen 3.181 N/A ILE 219.A N ALA 215.A O no hydrogen 2.886 N/A ARG 220.A N ALA 216.A O no hydrogen 2.880 N/A GLU 221.A N SER 217.A O no hydrogen 3.310 N/A GLY 222.A N ILE 219.A O no hydrogen 2.930 N/A ILE 223.A N ASP 218.A O no hydrogen 2.779 N/A GLY 225.A N TYR 242.A O no hydrogen 2.765 N/A VAL 227.A N MET 240.A O no hydrogen 2.942 N/A ILE 229.A N VAL 238.A O no hydrogen 2.970 N/A ASP 231.A N LYS 236.A O no hydrogen 2.717 N/A ILE 233.A N ASP 231.A OD1 no hydrogen 3.064 N/A THR 234.A OG1 ASP 231.A O no hydrogen 3.382 N/A GLY 235.A N ASP 231.A O no hydrogen 2.579 N/A LYS 236.A N THR 234.A OG1 no hydrogen 2.842 N/A VAL 238.A N ILE 229.A O no hydrogen 3.107 N/A ILE 239.A N VAL 256.A O no hydrogen 2.737 N/A MET 240.A N VAL 227.A O no hydrogen 2.877 N/A PHE 241.A N LEU 254.A O no hydrogen 2.798 N/A TYR 242.A N GLY 225.A O no hydrogen 2.923 N/A TYR 242.A OH ASP 218.A OD2 no hydrogen 2.603 N/A GLU 243.A N PHE 252.A O no hydrogen 2.957 N/A VAL 245.A N PHE 250.A O no hydrogen 2.850 N/A THR 247.A N ASP 19.A OD1 no hydrogen 2.977 N/A THR 247.A OG1 ASP 19.A OD1 no hydrogen 2.673 N/A ASP 249.A N LYS 246.A O no hydrogen 3.427 N/A SER 251.A N VAL 183.A O no hydrogen 2.841 N/A SER 251.A OG GLU 243.A O no hydrogen 3.293 N/A PHE 252.A N GLU 243.A O no hydrogen 3.099 N/A VAL 253.A N PHE 181.A O no hydrogen 2.770 N/A LEU 254.A N PHE 241.A O no hydrogen 2.629 N/A VAL 255.A N TYR 179.A O no hydrogen 2.784 N/A VAL 256.A N ILE 239.A O no hydrogen 2.778 N/A LYS 258.A N THR 237.A O no hydrogen 3.075 N/A LYS 258.A NZ GLU 228.A OE2 no hydrogen 2.587 N/A GLU 259.A N GLU 259.A OE1 no hydrogen 2.738 N/A GLU 260.A N PRO 257.A O no hydrogen 2.921 N/A MET 261.A N LYS 258.A O no hydrogen 3.258 N/A LEU 262.A N GLU 259.A O no hydrogen 3.131 N/A