Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8b51_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH1 GLU 9.A OE2 no hydrogen 3.278 N/A THR 2.A N GLU 5.A OE1 no hydrogen 3.107 N/A THR 2.A OG1 TYR 182.A O no hydrogen 2.718 N/A GLU 5.A N THR 2.A O no hydrogen 3.265 N/A GLN 6.A N THR 2.A O no hydrogen 3.065 N/A GLN 6.A N LEU 3.A O no hydrogen 3.286 N/A GLN 6.A NE2 ARG 1.A O no hydrogen 3.458 N/A GLN 6.A NE2 THR 2.A O no hydrogen 3.659 N/A TRP 7.A N LEU 3.A O no hydrogen 2.917 N/A TRP 7.A NE1 TYR 22.A OH no hydrogen 2.957 N/A LYS 8.A N GLY 4.A O no hydrogen 2.860 N/A LYS 8.A NZ SER 146.A O no hydrogen 2.959 N/A LYS 8.A NZ GLU 152.A OE1 no hydrogen 3.471 N/A LYS 8.A NZ GLU 152.A OE2 no hydrogen 3.420 N/A GLU 9.A N GLU 5.A O no hydrogen 3.407 N/A LYS 10.A N GLN 6.A O no hydrogen 2.972 N/A LEU 11.A N TRP 7.A O no hydrogen 2.788 N/A ASN 12.A N LYS 8.A O no hydrogen 2.860 N/A ASN 12.A ND2 LYS 8.A O no hydrogen 2.928 N/A ASN 12.A ND2 SER 147.A O no hydrogen 3.466 N/A GLY 13.A N GLU 9.A O no hydrogen 3.107 N/A GLY 13.A N LYS 10.A O no hydrogen 2.812 N/A LEU 14.A N LEU 11.A O no hydrogen 3.328 N/A ASP 18.A N SER 15.A OG no hydrogen 3.276 N/A PHE 19.A N SER 15.A O no hydrogen 2.801 N/A LEU 20.A N LYS 16.A O no hydrogen 3.219 N/A LYS 21.A N GLU 17.A O no hydrogen 3.367 N/A LYS 21.A NZ GLU 17.A OE2 no hydrogen 3.441 N/A LYS 21.A NZ ASP 18.A OD1 no hydrogen 3.547 N/A TYR 22.A N ASP 18.A O no hydrogen 2.907 N/A TYR 22.A N PHE 19.A O no hydrogen 2.964 N/A TYR 22.A OH LEU 235.A O no hydrogen 2.827 N/A ARG 23.A N PHE 19.A O no hydrogen 3.017 N/A LYS 24.A NZ GLU 29.A OE2 no hydrogen 3.419 N/A GLU 25.A N TYR 22.A O no hydrogen 3.012 N/A ALA 26.A N GLY 246.A O no hydrogen 3.060 N/A ILE 27.A N LYS 24.A O no hydrogen 3.475 N/A THR 28.A N PRO 205.A O no hydrogen 3.125 N/A GLU 29.A N LYS 248.A O no hydrogen 3.000 N/A ASP 31.A N GLU 250.A O.A no hydrogen 2.896 N/A ASP 31.A N GLU 250.A O.B no hydrogen 2.912 N/A ARG 32.A NH1 PRO 49.A O no hydrogen 2.845 N/A ARG 32.A NH1 ASP 252.A OD2 no hydrogen 2.953 N/A ARG 32.A NH2 PRO 49.A O no hydrogen 3.162 N/A SER 33.A N ASP 31.A OD1 no hydrogen 3.345 N/A SER 33.A OG ASP 31.A OD1 no hydrogen 3.070 N/A ALA 35.A N ARG 32.A O no hydrogen 2.884 N/A ARG 36.A N ARG 32.A O no hydrogen 3.318 N/A ARG 36.A N SER 33.A O no hydrogen 2.996 N/A LYS 37.A N SER 33.A O no hydrogen 3.433 N/A ALA 38.A N ALA 34.A O no hydrogen 3.271 N/A ARG 39.A N ALA 35.A O no hydrogen 3.025 N/A ARG 40.A N ARG 36.A O no hydrogen 2.950 N/A ASP 41.A N LYS 37.A O no hydrogen 2.628 N/A GLY 42.A N ARG 39.A O no hydrogen 3.418 N/A ASN 43.A N ALA 38.A O no hydrogen 2.848 N/A LYS 44.A NZ GLN 112.A OE1 no hydrogen 3.553 N/A THR 45.A N ASN 43.A OD1 no hydrogen 2.810 N/A THR 45.A OG1 ASN 43.A OD1 no hydrogen 2.900 N/A ARG 52.A NH1 LEU 206.A O no hydrogen 2.714 N/A ARG 52.A NH2 LEU 206.A O no hydrogen 2.740 N/A GLY 53.A N SER 51.A OG no hydrogen 3.123 N/A SER 54.A OG GLY 81.A O no hydrogen 2.723 N/A LYS 56.A N ARG 52.A O no hydrogen 3.426 N/A LYS 56.A NZ GLU 213.A OE2 no hydrogen 2.583 N/A LYS 56.A NZ TYR 215.A OH no hydrogen 3.007 N/A LEU 57.A N GLY 53.A O no hydrogen 2.983 N/A ARG 58.A N SER 54.A O no hydrogen 3.035 N/A ARG 58.A NH1 GLU 62.A OE2 no hydrogen 3.565 N/A TRP 59.A N ALA 55.A O no hydrogen 3.005 N/A MET 60.A N LEU 57.A O no hydrogen 2.902 N/A VAL 61.A N LEU 57.A O no hydrogen 2.889 N/A GLU 62.A N ARG 58.A O no hydrogen 2.908 N/A ARG 63.A NH1 TRP 59.A O no hydrogen 3.205 N/A GLN 64.A N VAL 61.A O no hydrogen 2.970 N/A PHE 65.A N MET 60.A O no hydrogen 2.903 N/A LYS 67.A N GLU 173.A OE1 no hydrogen 2.851 N/A LYS 67.A NZ GLN 64.A O no hydrogen 3.422 N/A ILE 69.A N THR 137.A OG1 no hydrogen 2.967 N/A GLY 70.A N GLY 91.A O no hydrogen 3.081 N/A LYS 71.A N ASP 136.A OD2 no hydrogen 2.830 N/A LYS 71.A NZ GLU 133.A OE2 no hydrogen 2.633 N/A LYS 71.A NZ PRO 134.A O no hydrogen 2.863 N/A VAL 72.A N GLU 94.A O no hydrogen 2.764 N/A VAL 73.A N THR 137.A O no hydrogen 2.997 N/A ASP 74.A N ARG 96.A O no hydrogen 2.844 N/A LEU 75.A N PHE 139.A O no hydrogen 2.963 N/A GLY 76.A N TYR 98.A O no hydrogen 2.731 N/A CYS 77.A N TYR 98.A O no hydrogen 2.899 N/A CYS 77.A SG GLY 78.A O no hydrogen 3.723 N/A GLY 78.A N THR 99.A OG1 no hydrogen 2.907 N/A ARG 79.A NH1 VAL 50.A O no hydrogen 2.893 N/A SER 83.A OG ASP 74.A OD2 no hydrogen 2.814 N/A TYR 84.A N GLY 80.A O no hydrogen 2.998 N/A TYR 84.A OH MET 109.A O no hydrogen 2.760 N/A TYR 85.A N GLY 81.A O no hydrogen 3.247 N/A ALA 86.A N TRP 82.A O no hydrogen 3.021 N/A ALA 87.A N SER 83.A O no hydrogen 3.020 N/A THR 88.A N TYR 85.A O no hydrogen 3.044 N/A THR 88.A OG1 TYR 85.A O no hydrogen 2.746 N/A LEU 89.A N ALA 86.A O no hydrogen 2.980 N/A LYS 90.A NZ TYR 114.A OH no hydrogen 3.240 N/A VAL 92.A N LEU 89.A O no hydrogen 3.108 N/A GLN 93.A N GLY 70.A O no hydrogen 2.790 N/A GLN 93.A NE2 LYS 90.A O no hydrogen 3.669 N/A GLN 93.A NE2 GLY 91.A O no hydrogen 3.525 N/A GLU 94.A N GLY 70.A O no hydrogen 3.350 N/A VAL 95.A N LEU 118.A O no hydrogen 3.026 N/A ARG 96.A N VAL 72.A O no hydrogen 2.762 N/A GLY 97.A N THR 120.A O no hydrogen 2.932 N/A TYR 98.A N ASP 74.A O no hydrogen 2.886 N/A TYR 98.A OH GLU 133.A OE1 no hydrogen 2.732 N/A THR 99.A N LYS 122.A O no hydrogen 3.164 N/A GLY 102.A N GLU 107.A OE2 no hydrogen 2.943 N/A HIS 105.A N GLY 102.A O no hydrogen 3.294 N/A GLU 106.A N GLU 106.A OE1 no hydrogen 2.689 N/A MET 109.A N ARG 79.A O no hydrogen 3.009 N/A MET 111.A N TYR 84.A OH no hydrogen 2.980 N/A GLN 112.A N LYS 44.A O no hydrogen 2.988 N/A TYR 114.A N LEU 255.A O no hydrogen 3.000 N/A GLY 115.A N GLY 258.A O no hydrogen 3.000 N/A TRP 116.A N SER 113.A O no hydrogen 2.917 N/A ASN 117.A ND2 ARG 260.A O no hydrogen 2.559 N/A LEU 118.A N GLY 115.A O no hydrogen 2.927 N/A VAL 119.A N TRP 116.A O no hydrogen 3.028 N/A THR 120.A N VAL 95.A O no hydrogen 2.982 N/A LYS 122.A N GLY 97.A O no hydrogen 2.948 N/A SER 123.A OG GLU 107.A OE1 no hydrogen 3.140 N/A VAL 125.A N THR 99.A O no hydrogen 2.942 N/A TYR 128.A N ASP 126.A OD1 no hydrogen 3.029 N/A TYR 129.A N ASP 126.A O no hydrogen 3.068 N/A LYS 130.A N VAL 127.A O no hydrogen 3.064 N/A LYS 130.A NZ PRO 131.A O no hydrogen 3.517 N/A LYS 130.A NZ GLU 133.A OE1 no hydrogen 3.354 N/A CYS 135.A SG THR 137.A O no hydrogen 4.002 N/A ASP 136.A N LYS 71.A O no hydrogen 2.983 N/A THR 137.A N LYS 71.A O no hydrogen 3.108 N/A THR 137.A OG1 ILE 69.A O no hydrogen 2.815 N/A LEU 138.A N GLU 173.A O no hydrogen 2.994 N/A PHE 139.A N VAL 73.A O no hydrogen 2.867 N/A CYS 140.A N CYS 175.A O no hydrogen 2.888 N/A CYS 140.A SG LEU 75.A O no hydrogen 3.877 N/A ASP 141.A N LEU 75.A O no hydrogen 3.307 N/A SER 146.A N GLU 152.A OE2 no hydrogen 2.952 N/A SER 148.A N SER 146.A OG no hydrogen 3.265 N/A VAL 151.A N SER 148.A OG no hydrogen 3.079 N/A GLU 152.A N SER 148.A O no hydrogen 3.111 N/A GLU 153.A N ALA 149.A O no hydrogen 2.835 N/A GLN 154.A N GLU 150.A O no hydrogen 3.016 N/A ARG 155.A N VAL 151.A O no hydrogen 2.952 N/A ARG 155.A NH1 GLU 144.A O no hydrogen 2.707 N/A THR 156.A N GLU 152.A O no hydrogen 2.941 N/A THR 156.A OG1 GLU 152.A O no hydrogen 2.639 N/A LEU 157.A N GLU 153.A O no hydrogen 2.918 N/A ARG 158.A N GLN 154.A O no hydrogen 3.039 N/A ILE 159.A N ARG 155.A O no hydrogen 3.181 N/A LEU 160.A N THR 156.A O no hydrogen 2.999 N/A GLU 161.A N LEU 157.A O no hydrogen 2.892 N/A MET 162.A N ARG 158.A O no hydrogen 3.075 N/A VAL 163.A N ILE 159.A O no hydrogen 2.858 N/A SER 164.A OG GLU 161.A O no hydrogen 2.976 N/A TRP 166.A N VAL 163.A O no hydrogen 2.866 N/A LEU 167.A N VAL 163.A O no hydrogen 2.949 N/A GLN 168.A N SER 164.A O no hydrogen 2.930 N/A ARG 169.A N TRP 166.A O no hydrogen 2.905 N/A GLY 170.A N LEU 167.A O no hydrogen 3.107 N/A PHE 174.A N SER 218.A OG no hydrogen 2.890 N/A CYS 175.A N LEU 138.A O no hydrogen 2.887 N/A ILE 176.A N TRP 216.A O no hydrogen 2.950 N/A LYS 177.A N CYS 140.A O no hydrogen 2.729 N/A LYS 177.A NZ GLY 143.A O no hydrogen 2.975 N/A VAL 178.A N MET 214.A O no hydrogen 2.690 N/A CYS 180.A N THR 156.A OG1 no hydrogen 3.221 N/A CYS 180.A SG ALA 149.A O no hydrogen 3.909 N/A CYS 180.A SG GLU 152.A OE1 no hydrogen 3.905 N/A TYR 182.A OH GLU 152.A OE1 no hydrogen 3.271 N/A ARG 185.A NH1 GLU 153.A OE2 no hydrogen 3.193 N/A VAL 186.A N MET 183.A O no hydrogen 3.007 N/A MET 187.A N MET 183.A O no hydrogen 2.916 N/A GLU 188.A N PRO 184.A O no hydrogen 2.886 N/A ARG 189.A N ARG 185.A O no hydrogen 3.085 N/A ARG 189.A NH2 LEU 160.A O no hydrogen 3.069 N/A LEU 190.A N VAL 186.A O no hydrogen 2.968 N/A GLU 191.A N MET 187.A O no hydrogen 3.064 N/A VAL 192.A N GLU 188.A O no hydrogen 3.172 N/A LEU 193.A N ARG 189.A O no hydrogen 2.828 N/A GLN 194.A N LEU 190.A O no hydrogen 2.525 N/A GLN 194.A NE2 GLY 199.A O no hydrogen 2.919 N/A GLN 194.A NE2 GLY 222.A O no hydrogen 2.945 N/A ARG 195.A N GLU 191.A O no hydrogen 2.804 N/A ARG 196.A N VAL 192.A O no hydrogen 3.148 N/A ARG 196.A N LEU 193.A O no hydrogen 3.068 N/A TYR 197.A N LEU 193.A O no hydrogen 2.790 N/A GLY 198.A N GLN 194.A O no hydrogen 2.833 N/A GLY 200.A N VAL 217.A O no hydrogen 3.039 N/A VAL 202.A N TYR 215.A O no hydrogen 3.027 N/A ARG 203.A NH1 ASN 211.A O no hydrogen 3.057 N/A ARG 203.A NH1 GLU 213.A O no hydrogen 2.839 N/A ARG 203.A NH2 ARG 208.A O no hydrogen 2.976 N/A ARG 203.A NH2 ASN 211.A O no hydrogen 3.134 N/A SER 207.A N VAL 204.A O no hydrogen 2.884 N/A SER 207.A OG VAL 204.A O no hydrogen 3.294 N/A SER 207.A OG GLU 213.A OE2 no hydrogen 2.703 N/A ARG 208.A NE GLU 29.A OE2 no hydrogen 3.041 N/A ARG 208.A NH2 GLU 29.A OE2 no hydrogen 3.001 N/A ASN 209.A N ARG 23.A O no hydrogen 2.837 N/A ASN 209.A ND2 TYR 22.A O no hydrogen 3.030 N/A ASN 209.A ND2 GLU 25.A O no hydrogen 2.766 N/A ASN 211.A N ARG 208.A O no hydrogen 3.265 N/A HIS 212.A ND1 HIS 212.A O no hydrogen 2.644 N/A HIS 212.A NE2 SER 232.A OG no hydrogen 2.704 N/A GLU 213.A N ASN 211.A OD1 no hydrogen 2.818 N/A MET 214.A N VAL 178.A O no hydrogen 3.012 N/A TYR 215.A N VAL 202.A O no hydrogen 2.961 N/A TYR 215.A OH ASP 141.A OD1 no hydrogen 2.699 N/A TRP 216.A N ILE 176.A O no hydrogen 2.817 N/A TRP 216.A NE1 GLY 198.A O no hydrogen 2.837 N/A VAL 217.A N GLY 200.A O no hydrogen 2.834 N/A SER 218.A N PHE 174.A O no hydrogen 3.181 N/A SER 218.A OG ARG 172.A O no hydrogen 3.398 N/A SER 218.A OG GLU 173.A OE1 no hydrogen 3.468 N/A SER 218.A OG PHE 174.A O no hydrogen 3.458 N/A GLY 219.A N PHE 65.A O no hydrogen 2.833 N/A ALA 220.A N VAL 217.A O no hydrogen 3.237 N/A HIS 226.A N ASN 223.A OD1 no hydrogen 3.136 N/A ALA 227.A N ASN 223.A O no hydrogen 3.189 N/A VAL 228.A N ILE 224.A O no hydrogen 3.117 N/A ASN 229.A N VAL 225.A O no hydrogen 3.063 N/A MET 230.A N HIS 226.A O no hydrogen 2.802 N/A THR 231.A N ALA 227.A O no hydrogen 3.431 N/A SER 232.A N VAL 228.A O no hydrogen 2.880 N/A SER 232.A OG HIS 212.A NE2 no hydrogen 2.704 N/A SER 232.A OG VAL 228.A O no hydrogen 3.152 N/A GLN 233.A N ASN 229.A O no hydrogen 2.803 N/A VAL 234.A N MET 230.A O no hydrogen 3.174 N/A LEU 235.A N THR 231.A O no hydrogen 2.946 N/A ILE 236.A N SER 232.A O no hydrogen 2.934 N/A GLY 237.A N GLN 233.A O no hydrogen 2.798 N/A ARG 238.A N VAL 234.A O no hydrogen 2.962 N/A ARG 238.A NH1 ASN 209.A OD1 no hydrogen 2.792 N/A MET 239.A N LEU 235.A O no hydrogen 3.295 N/A MET 239.A N ILE 236.A O no hydrogen 2.830 N/A LYS 241.A NZ GLU 25.A OE2 no hydrogen 2.943 N/A HIS 245.A N GLU 25.A OE1 no hydrogen 2.748 N/A GLY 246.A N GLU 25.A OE1 no hydrogen 2.653 N/A LYS 248.A N ILE 27.A O no hydrogen 2.702 N/A GLU 250.A N.A GLU 29.A O no hydrogen 2.728 N/A GLU 250.A N.B GLU 29.A O no hydrogen 2.736 N/A VAL 253.A N ASP 252.A OD1 no hydrogen 2.867 N/A LEU 255.A N GLY 47.A O no hydrogen 2.811 N/A GLY 256.A N ASN 254.A OD1 no hydrogen 3.227 N/A ARG 260.A N ASN 117.A OD1 no hydrogen 2.983 N/A ARG 260.A NH1 ALA 87.A O no hydrogen 2.363 N/A ARG 260.A NH1 LEU 89.A O no hydrogen 2.704 N/A ARG 260.A NH2 LEU 89.A O no hydrogen 3.092 N/A ARG 260.A NH2 LYS 90.A O no hydrogen 3.332 N/A