Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1a3l_L.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N SER 26.A OG no hydrogen 3.184 N/A THR 5.A N ARG 24.A O no hydrogen 2.843 N/A SER 10.A OG LYS 108.A O no hydrogen 2.740 N/A VAL 13.A N GLU 110.A O no hydrogen 2.799 N/A GLY 16.A N VAL 83.A O no hydrogen 2.850 N/A ALA 17.A N THR 14.A O no hydrogen 3.026 N/A SER 18.A OG SER 81.A O no hydrogen 2.761 N/A ALA 19.A N ILE 80.A O no hydrogen 2.913 N/A ILE 21.A N LEU 78.A O no hydrogen 2.813 N/A CYS 23.A N PHE 76.A O no hydrogen 2.842 N/A ARG 24.A N THR 5.A O no hydrogen 2.801 N/A SER 25.A N THR 74.A O no hydrogen 2.807 N/A SER 25.A OG LYS 27.A O no hydrogen 2.810 N/A SER 26.A N VAL 3.A O no hydrogen 3.104 N/A LYS 27.A NZ GLU 98.A OE2 no hydrogen 2.495 N/A ASN 33.A N ASN 31D.A OD1 no hydrogen 3.038 N/A GLY 34.A N ASN 31D.A O no hydrogen 3.030 N/A ILE 35.A N ASN 33.A OD1 no hydrogen 2.961 N/A HIS 37.A N LEU 29B.A O no hydrogen 2.848 N/A HIS 37.A ND1 ASN 96.A OD1 no hydrogen 2.928 N/A MET 38.A N ILE 36.A O no hydrogen 2.952 N/A TYR 39.A N ALA 94.A O no hydrogen 3.174 N/A TYR 39.A OH ASN 96.A OD1 no hydrogen 3.401 N/A TRP 40.A N ILE 53.A O no hydrogen 2.890 N/A TYR 41.A N TYR 92.A O no hydrogen 2.757 N/A LEU 42.A N GLN 50.A O no hydrogen 2.866 N/A GLN 43.A N VAL 90.A O no hydrogen 2.736 N/A GLN 43.A NE2 GLN 47.A O no hydrogen 2.656 N/A LYS 44.A NZ GLU 86.A O no hydrogen 3.441 N/A LYS 44.A NZ GLU 86.A OE2 no hydrogen 2.976 N/A GLN 47.A N LYS 44.A O no hydrogen 2.845 N/A GLN 50.A N LEU 42.A O no hydrogen 2.830 N/A LEU 52.A N TRP 40.A O no hydrogen 2.912 N/A ILE 53.A N TRP 40.A O no hydrogen 3.364 N/A TYR 54.A N LYS 58.A O no hydrogen 2.737 N/A MET 56.A N MET 38.A O no hydrogen 2.807 N/A LYS 58.A N TYR 54.A O no hydrogen 2.866 N/A LYS 58.A NZ GLN 55.A OE1 no hydrogen 2.747 N/A ALA 60.A N LEU 52.A O no hydrogen 2.812 N/A ALA 63.A N ALA 60.A O no hydrogen 2.907 N/A ARG 66.A NH1 ARG 82.A O no hydrogen 3.257 N/A ARG 66.A NH1 ASP 87.A OD1 no hydrogen 3.528 N/A ARG 66.A NH1 ASP 87.A OD2 no hydrogen 2.532 N/A ARG 66.A NH2 ASP 87.A OD1 no hydrogen 3.241 N/A PHE 67.A N PRO 64.A O no hydrogen 2.876 N/A SER 68.A N ARG 79.A O no hydrogen 2.999 N/A SER 70.A N THR 77.A O no hydrogen 3.017 N/A SER 72.A N ASP 75.A O no hydrogen 2.862 N/A PHE 76.A N CYS 23.A O no hydrogen 2.852 N/A THR 77.A N SER 70.A O no hydrogen 2.818 N/A LEU 78.A N ILE 21.A O no hydrogen 2.768 N/A ARG 79.A N SER 68.A O no hydrogen 2.853 N/A ILE 80.A N ALA 19.A O no hydrogen 2.790 N/A SER 81.A N ARG 66.A O no hydrogen 2.974 N/A VAL 83.A N ALA 17.A O no hydrogen 2.870 N/A GLU 84.A N ASP 87.A OD2 no hydrogen 3.135 N/A ASP 87.A N GLU 84.A O no hydrogen 3.095 N/A VAL 88.A N ALA 85.A O no hydrogen 3.358 N/A VAL 90.A N GLN 43.A O no hydrogen 2.940 N/A TYR 91.A N THR 107.A O no hydrogen 2.804 N/A TYR 91.A OH ASP 87.A O no hydrogen 2.708 N/A TYR 92.A N TYR 41.A O no hydrogen 2.643 N/A GLN 95.A N THR 102.A O no hydrogen 2.813 N/A GLN 95.A NE2 GLU 98.A O no hydrogen 3.164 N/A GLN 95.A NE2 THR 102.A OG1 no hydrogen 3.299 N/A ASN 96.A ND2 TYR 39.A OH no hydrogen 3.303 N/A LEU 97.A N GLN 95.A OE1 no hydrogen 2.649 N/A GLU 98.A N GLN 95.A OE1 no hydrogen 3.245 N/A THR 102.A N GLN 95.A O no hydrogen 3.237 N/A THR 102.A OG1 ILE 2.A O no hydrogen 2.648 N/A GLY 104.A N CYS 93.A O no hydrogen 2.789 N/A THR 107.A N TYR 91.A O no hydrogen 2.912 N/A THR 107.A OG1 GLN 6.A OE1 no hydrogen 3.206 N/A THR 107.A OG1 ALA 7.A O no hydrogen 2.653 N/A LYS 108.A N ALA 8.A O no hydrogen 2.878 N/A LEU 109.A N GLY 89.A O no hydrogen 2.839 N/A ILE 111.A N GLN 171.A OE1 no hydrogen 3.104 N/A LYS 112.A N VAL 13.A O no hydrogen 2.821 N/A ARG 113.A NE ALA 114.A O no hydrogen 2.715 N/A ARG 113.A NH1 ASP 175.A O no hydrogen 2.970 N/A ARG 113.A NH2 ALA 114.A O no hydrogen 3.169 N/A ALA 116.A N TYR 145.A O no hydrogen 2.775 N/A THR 119.A N ASN 142.A O no hydrogen 2.984 N/A SER 121.A N PHE 140.A O no hydrogen 2.972 N/A PHE 123.A N VAL 138.A O no hydrogen 2.719 N/A GLN 129.A N SER 126.A OG no hydrogen 3.016 N/A LEU 130.A N SER 126.A O no hydrogen 3.200 N/A THR 131.A N SER 127.A O no hydrogen 3.106 N/A THR 131.A OG1 SER 127.A O no hydrogen 3.271 N/A SER 132.A N GLN 129.A O no hydrogen 2.944 N/A SER 132.A OG GLN 129.A O no hydrogen 2.449 N/A GLY 133.A N LEU 130.A O no hydrogen 2.788 N/A GLY 134.A N GLN 129.A O no hydrogen 3.196 N/A ALA 135.A N LEU 186.A O no hydrogen 2.891 N/A SER 136.A N GLN 129.A OE1 no hydrogen 2.951 N/A SER 136.A OG THR 185.A OG1 no hydrogen 2.667 N/A VAL 137.A N LEU 184.A O no hydrogen 2.804 N/A VAL 138.A N PHE 123.A O no hydrogen 3.000 N/A CYS 139.A N SER 182.A O no hydrogen 2.994 N/A CYS 139.A SG SER 121.A O no hydrogen 3.699 N/A PHE 140.A N SER 121.A O no hydrogen 2.824 N/A LEU 141.A N MET 180.A O no hydrogen 2.844 N/A ASN 142.A N THR 119.A O no hydrogen 2.981 N/A ASN 143.A N SER 179.A OG no hydrogen 2.867 N/A ASN 143.A ND2 ASP 175.A OD2 no hydrogen 2.813 N/A PHE 144.A N TYR 178.A O no hydrogen 2.833 N/A TYR 145.A N ALA 116.A O no hydrogen 2.949 N/A TYR 145.A OH ILE 111.A O no hydrogen 3.284 N/A ASN 150.A N THR 202.A O no hydrogen 3.034 N/A LYS 152.A N GLU 200.A O no hydrogen 3.038 N/A TRP 153.A NE1 SER 182.A OG no hydrogen 2.764 N/A LYS 154.A N THR 198.A O no hydrogen 2.869 N/A LYS 154.A NZ GLU 200.A OE2 no hydrogen 2.991 N/A ILE 155.A N SER 158.A O no hydrogen 2.782 N/A ASP 156.A N SER 196.A O no hydrogen 2.851 N/A SER 158.A N ILE 155.A O no hydrogen 2.810 N/A ARG 160.A N TRP 153.A O no hydrogen 2.685 N/A ARG 160.A NE ASN 162.A O no hydrogen 2.762 N/A ARG 160.A NH1 GLU 190.A OE2 no hydrogen 2.724 N/A ARG 160.A NH2 ASN 162.A O no hydrogen 3.405 N/A ARG 160.A NH2 GLU 190.A OE1 no hydrogen 3.407 N/A GLN 161.A NE2 GLU 159.A OE2 no hydrogen 2.528 N/A LEU 165.A N THR 183.A O no hydrogen 2.950 N/A SER 167.A N SER 181.A O no hydrogen 3.031 N/A THR 169.A N SER 179.A O no hydrogen 3.082 N/A THR 169.A OG1 SER 179.A O no hydrogen 3.162 N/A GLN 171.A NE2 ILE 111.A O no hydrogen 2.887 N/A GLN 171.A NE2 SER 176.A O no hydrogen 3.066 N/A ASP 172.A N THR 177.A O no hydrogen 2.952 N/A THR 173.A OG1 GLU 86.A OE1 no hydrogen 3.349 N/A LYS 174.A N ASP 172.A OD2 no hydrogen 2.802 N/A ASP 175.A N ASP 172.A OD2 no hydrogen 2.760 N/A SER 176.A N ASP 172.A O no hydrogen 3.101 N/A THR 177.A N ASP 175.A OD1 no hydrogen 2.965 N/A THR 177.A OG1 ASP 175.A OD1 no hydrogen 2.639 N/A THR 177.A OG1 ASP 175.A OD2 no hydrogen 3.265 N/A TYR 178.A N PHE 144.A O no hydrogen 2.855 N/A SER 179.A N THR 169.A OG1 no hydrogen 2.989 N/A MET 180.A N LEU 141.A O no hydrogen 2.735 N/A SER 181.A N SER 167.A O no hydrogen 2.931 N/A SER 182.A N CYS 139.A O no hydrogen 2.857 N/A SER 182.A OG ASN 166.A OD1 no hydrogen 2.823 N/A THR 183.A N LEU 165.A O no hydrogen 2.769 N/A LEU 184.A N VAL 137.A O no hydrogen 3.029 N/A THR 185.A N GLY 163.A O no hydrogen 2.759 N/A THR 185.A OG1 SER 136.A OG no hydrogen 2.667 N/A LEU 186.A N ALA 135.A O no hydrogen 2.747 N/A LYS 188.A N GLY 133.A O no hydrogen 3.076 N/A GLU 190.A N THR 187.A OG1 no hydrogen 3.297 N/A TYR 191.A N THR 187.A O no hydrogen 2.860 N/A GLU 192.A N LYS 188.A O no hydrogen 2.993 N/A ARG 193.A N GLU 190.A O no hydrogen 3.174 N/A ARG 193.A NE ASP 189.A OD1 no hydrogen 2.849 N/A ARG 193.A NE ASP 189.A OD2 no hydrogen 3.500 N/A ARG 193.A NH2 ASP 189.A OD2 no hydrogen 2.921 N/A HIS 194.A N TYR 191.A O no hydrogen 3.402 N/A HIS 194.A ND1 ASP 156.A OD2 no hydrogen 2.614 N/A ASN 195.A N ASP 156.A OD1 no hydrogen 3.075 N/A SER 196.A N ASP 156.A OD1 no hydrogen 2.928 N/A SER 196.A OG ASP 156.A OD1 no hydrogen 3.409 N/A TYR 197.A N PHE 214.A O no hydrogen 2.895 N/A TYR 197.A OH TYR 191.A O no hydrogen 2.461 N/A THR 198.A N LYS 154.A O no hydrogen 3.003 N/A CYS 199.A N LYS 212.A O no hydrogen 3.007 N/A GLU 200.A N LYS 152.A O no hydrogen 2.890 N/A ALA 201.A N ILE 210.A O no hydrogen 2.784 N/A THR 202.A N ASN 150.A O no hydrogen 3.036 N/A HIS 203.A ND1 THR 205.A OG1 no hydrogen 2.788 N/A HIS 203.A NE2 PRO 146.A O no hydrogen 2.914 N/A LYS 204.A NZ ASP 115.A OD2 no hydrogen 2.586 N/A THR 205.A OG1 HIS 203.A ND1 no hydrogen 2.788 N/A SER 206.A N HIS 203.A O no hydrogen 3.149 N/A ILE 210.A N ALA 201.A O no hydrogen 2.743 N/A LYS 212.A N CYS 199.A O no hydrogen 3.093 N/A PHE 214.A N TYR 197.A O no hydrogen 2.912 N/A ARG 216.A N ASN 195.A O no hydrogen 2.722 N/A ARG 216.A NE HIS 194.A O no hydrogen 3.097 N/A ARG 216.A NH2 HIS 194.A O no hydrogen 3.556 N/A LEU 29B.A N GLY 73.A O no hydrogen 2.995 N/A LEU 30C.A N SER 28A.A OG no hydrogen 3.140 N/A ASN 31D.A N ILE 35.A O no hydrogen 2.892 N/A ASN 31D.A ND2 HIS 37.A NE2 no hydrogen 3.287 N/A SER 32E.A OG ASN 31D.A OD1 no hydrogen 2.886 N/A