Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p8u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 8.A N GLY 31.A O no hydrogen 3.225 N/A LYS 9.A N ASP 109.A O no hydrogen 2.578 N/A ILE 10.A N GLY 29.A O no hydrogen 2.734 N/A ASN 11.A N PHE 111.A O no hydrogen 2.745 N/A LEU 12.A N GLY 27.A O no hydrogen 3.028 N/A ARG 13.A N ASN 113.A O no hydrogen 3.094 N/A MET 14.A N ILE 25.A O no hydrogen 2.865 N/A GLU 15.A N VAL 115.A O no hydrogen 3.127 N/A GLY 16.A N PHE 23.A O no hydrogen 3.126 N/A ASN 17.A N PHE 117.A O no hydrogen 2.853 N/A VAL 18.A N HIS 21.A O no hydrogen 3.028 N/A ASN 19.A N GLY 119.A O no hydrogen 2.857 N/A ASN 19.A ND2 PHE 122.A O no hydrogen 2.797 N/A HIS 21.A N VAL 18.A O no hydrogen 2.723 N/A HIS 21.A NE2 GLY 47.A O no hydrogen 2.608 N/A PHE 23.A N GLY 16.A O no hydrogen 2.868 N/A VAL 24.A N GLU 46.A O no hydrogen 3.139 N/A ILE 25.A N MET 14.A O no hydrogen 2.904 N/A ASP 26.A N GLU 43.A O no hydrogen 2.934 N/A GLY 27.A N LEU 12.A O no hydrogen 2.867 N/A ASP 28.A N ASP 41.A O no hydrogen 3.268 N/A GLY 29.A N ILE 10.A O no hydrogen 2.941 N/A THR 30.A N SER 39.A O no hydrogen 3.005 N/A GLY 31.A N MET 8.A O no hydrogen 3.079 N/A LYS 32.A N LYS 37.A O no hydrogen 2.701 N/A LYS 32.A NZ ASP 7.A OD1 no hydrogen 2.647 N/A LYS 32.A NZ ASP 7.A OD2 no hydrogen 3.532 N/A GLU 35.A N LYS 32.A O no hydrogen 2.948 N/A GLY 36.A N LYS 32.A O no hydrogen 2.905 N/A GLY 36.A N PRO 33.A O no hydrogen 3.281 N/A LYS 37.A N LYS 32.A O no hydrogen 3.508 N/A GLN 38.A N GLU 209.A O no hydrogen 3.137 N/A SER 39.A N THR 30.A O no hydrogen 2.930 N/A SER 39.A OG.A LEU 207.A O no hydrogen 3.331 N/A MET 40.A N LEU 207.A O no hydrogen 2.902 N/A ASP 41.A N ASP 28.A O no hydrogen 3.064 N/A LEU 42.A N VAL 205.A O no hydrogen 2.679 N/A GLU 43.A N ASP 26.A O no hydrogen 2.875 N/A VAL 44.A N ASN 203.A O no hydrogen 2.923 N/A LYS 45.A N VAL 24.A O no hydrogen 2.964 N/A LYS 45.A NZ ASP 26.A OD2 no hydrogen 2.717 N/A ALA 53.A N VAL 128.A O no hydrogen 2.602 N/A ILE 56.A N ALA 53.A O no hydrogen 3.417 N/A LEU 57.A N PHE 54.A O no hydrogen 2.918 N/A THR 58.A N ASP 55.A O no hydrogen 3.263 N/A THR 58.A OG1 ASP 55.A O no hydrogen 2.991 N/A ALA 60.A N LEU 57.A O no hydrogen 2.840 N/A ARG 63.A N TYR 84.A OH no hydrogen 3.132 N/A ARG 63.A NE TYR 174.A OH no hydrogen 3.416 N/A ARG 63.A NH1 TYR 174.A OH no hydrogen 3.074 N/A VAL 64.A N ASN 62.A OD1 no hydrogen 3.072 N/A PHE 65.A N ASN 62.A O no hydrogen 3.096 N/A ALA 66.A N VAL 64.A O no hydrogen 2.876 N/A GLU 67.A N ALA 211.A O no hydrogen 3.024 N/A TYR 68.A OH HIS 187.A NE2 no hydrogen 2.826 N/A LYS 77.A N ASP 74.A OD1 no hydrogen 3.128 N/A LYS 77.A NZ PRO 33.A O no hydrogen 3.368 N/A LYS 77.A NZ VAL 64.A O no hydrogen 3.107 N/A LYS 77.A NZ ALA 66.A O no hydrogen 2.739 N/A LYS 77.A NZ ASP 74.A OD2 no hydrogen 3.011 N/A GLN 78.A N ASP 74.A O no hydrogen 3.026 N/A SER 79.A N PHE 76.A O no hydrogen 3.370 N/A SER 79.A OG.A TYR 75.A O no hydrogen 2.426 N/A SER 79.A OG.B TYR 75.A O no hydrogen 3.441 N/A SER 79.A OG.B PHE 76.A O no hydrogen 2.591 N/A LYS 82.A NZ GLU 178.A OE2 no hydrogen 2.660 N/A GLY 83.A N SER 79.A O no hydrogen 2.731 N/A TYR 84.A N ILE 104.A O no hydrogen 3.014 N/A TYR 84.A OH ASN 62.A OD1 no hydrogen 2.970 N/A SER 85.A N LYS 175.A O no hydrogen 3.079 N/A SER 85.A OG.A ASP 103.A OD1 no hydrogen 2.396 N/A TRP 86.A N ASN 102.A O no hydrogen 3.021 N/A GLU 87.A N THR 173.A O no hydrogen 3.001 N/A ARG 88.A N ALA 100.A O no hydrogen 2.824 N/A ARG 88.A NE THR 172.A OG1 no hydrogen 2.768 N/A ARG 88.A NH1 THR 59.A O no hydrogen 3.030 N/A SER 89.A N ARG 171.A O no hydrogen 2.903 N/A LEU 90.A N CYS 98.A O no hydrogen 2.760 N/A THR 91.A N ASP 169.A O no hydrogen 2.868 N/A PHE 92.A N GLY 96.A O no hydrogen 2.903 N/A GLU 93.A N ARG 167.A O no hydrogen 3.132 N/A GLY 95.A N PHE 92.A O no hydrogen 3.267 N/A GLY 96.A N ASP 94.A OD1 no hydrogen 3.289 N/A ILE 97.A N THR 120.A O no hydrogen 3.001 N/A CYS 98.A N LEU 90.A O no hydrogen 3.020 N/A ILE 99.A N HIS 118.A O no hydrogen 2.868 N/A ALA 100.A N ARG 88.A O no hydrogen 2.893 N/A ARG 101.A N ARG 116.A O no hydrogen 2.926 N/A ARG 101.A NE GLU 87.A OE2 no hydrogen 3.270 N/A ARG 101.A NH2 ASP 103.A OD1 no hydrogen 2.779 N/A ASN 102.A N TRP 86.A O no hydrogen 3.133 N/A ASN 102.A ND2 ASN 113.A OD1 no hydrogen 3.225 N/A ASP 103.A N LYS 114.A O no hydrogen 2.835 N/A ILE 104.A N TYR 84.A O no hydrogen 2.762 N/A THR 105.A N TYR 112.A O no hydrogen 2.957 N/A GLU 107.A N THR 110.A O no hydrogen 3.009 N/A THR 110.A N GLU 107.A O no hydrogen 3.323 N/A PHE 111.A N LYS 9.A O no hydrogen 3.002 N/A TYR 112.A N THR 105.A O no hydrogen 2.630 N/A ASN 113.A ND2 ASN 11.A O no hydrogen 2.737 N/A LYS 114.A N ASP 103.A O no hydrogen 2.980 N/A VAL 115.A N ARG 13.A O no hydrogen 2.982 N/A ARG 116.A N ARG 101.A O no hydrogen 2.821 N/A ARG 116.A NH2 VAL 115.A O no hydrogen 2.692 N/A PHE 117.A N GLU 15.A O no hydrogen 3.263 N/A HIS 118.A N ILE 99.A O no hydrogen 3.099 N/A GLY 119.A N ASN 17.A O no hydrogen 2.805 N/A THR 120.A N ILE 97.A O no hydrogen 2.960 N/A THR 120.A OG1 ASN 121.A OD1 no hydrogen 3.515 N/A ASN 121.A N THR 120.A OG1 no hydrogen 2.646 N/A PHE 122.A N ASN 19.A OD1 no hydrogen 3.246 N/A GLY 126.A N PRO 123.A O no hydrogen 3.088 N/A GLN 130.A N GLY 126.A O no hydrogen 2.967 N/A GLN 130.A NE2 ALA 124.A O no hydrogen 2.573 N/A LYS 131.A N VAL 128.A O no hydrogen 3.344 N/A LYS 131.A NZ LEU 50.A O no hydrogen 3.063 N/A LYS 132.A N PRO 127.A O no hydrogen 2.752 N/A LYS 132.A NZ GLU 161.A OE1 no hydrogen 2.983 N/A LYS 132.A NZ GLU 161.A OE2 no hydrogen 2.598 N/A THR 133.A OG1 ASP 55.A OD2 no hydrogen 2.631 N/A LEU 134.A N LEU 159.A O no hydrogen 2.728 N/A TRP 136.A NE1 ASP 55.A O no hydrogen 2.579 N/A GLU 137.A N ALA 157.A O no hydrogen 2.942 N/A SER 139.A N HIS 191.A O no hydrogen 2.947 N/A THR 140.A OG1 ASP 190.A OD1 no hydrogen 3.084 N/A GLU 141.A N VAL 189.A O no hydrogen 2.913 N/A LYS 142.A N ASP 153.A O no hydrogen 2.882 N/A MET 143.A N HIS 187.A O no hydrogen 2.808 N/A TYR 144.A N THR 151.A O no hydrogen 2.971 N/A TYR 144.A OH ASP 153.A OD2 no hydrogen 2.793 N/A ARG 146.A N VAL 149.A O no hydrogen 2.935 N/A THR 151.A N TYR 144.A O no hydrogen 2.887 N/A THR 151.A OG1 VAL 149.A O no hydrogen 3.396 N/A GLY 152.A N THR 172.A O no hydrogen 2.781 N/A ASP 153.A N LYS 142.A O no hydrogen 2.899 N/A ILE 154.A N PHE 170.A O no hydrogen 3.053 N/A HIS 155.A ND1 ASP 169.A OD1 no hydrogen 2.912 N/A MET 156.A N CYS 168.A O no hydrogen 2.624 N/A LEU 158.A N TYR 166.A O no hydrogen 2.872 N/A LEU 159.A N LYS 135.A O no hydrogen 2.785 N/A LEU 160.A N ALA 164.A O no hydrogen 2.784 N/A GLU 161.A N LYS 132.A O no hydrogen 3.258 N/A ASN 163.A N LEU 160.A O no hydrogen 2.922 N/A HIS 165.A NE2 GLU 137.A OE2 no hydrogen 2.848 N/A TYR 166.A N LEU 158.A O no hydrogen 2.906 N/A TYR 166.A OH ASP 94.A OD1 no hydrogen 2.624 N/A TYR 166.A OH ASP 94.A OD2 no hydrogen 3.116 N/A ARG 167.A N GLU 93.A OE2 no hydrogen 2.907 N/A ARG 167.A NH1 HIS 155.A ND1 no hydrogen 2.599 N/A ARG 167.A NH1 ASP 169.A OD1 no hydrogen 3.090 N/A ARG 167.A NH2 CYS 168.A O no hydrogen 3.306 N/A CYS 168.A N MET 156.A O no hydrogen 2.898 N/A ASP 169.A N THR 91.A O no hydrogen 2.940 N/A PHE 170.A N ILE 154.A O no hydrogen 2.880 N/A ARG 171.A N SER 89.A O no hydrogen 3.189 N/A ARG 171.A NE ASP 153.A OD1 no hydrogen 2.867 N/A ARG 171.A NH1 ASP 153.A OD2 no hydrogen 3.441 N/A THR 172.A N GLY 152.A O no hydrogen 2.785 N/A THR 173.A N GLU 87.A O no hydrogen 2.843 N/A TYR 174.A N LEU 150.A O no hydrogen 2.821 N/A TYR 174.A OH GLU 141.A OE1 no hydrogen 3.416 N/A TYR 174.A OH GLU 141.A OE2 no hydrogen 2.551 N/A LYS 175.A N SER 85.A O no hydrogen 2.859 N/A ALA 176.A N TYR 75.A OH no hydrogen 2.944 N/A LYS 177.A N GLY 83.A O no hydrogen 2.938 N/A HIS 187.A N MET 143.A O no hydrogen 3.060 N/A HIS 187.A ND1 GLY 185.A O no hydrogen 2.758 N/A HIS 187.A NE2 TYR 68.A OH no hydrogen 2.826 N/A PHE 188.A N HIS 214.A O no hydrogen 2.781 N/A VAL 189.A N GLU 141.A O no hydrogen 2.935 N/A ASP 190.A N VAL 212.A O no hydrogen 2.923 N/A HIS 191.A N SER 139.A O no hydrogen 3.006 N/A HIS 191.A ND1 GLU 209.A OE2 no hydrogen 2.880 N/A HIS 191.A NE2 GLU 141.A OE1 no hydrogen 3.059 N/A CYS 192.A N HIS 210.A O no hydrogen 3.010 N/A GLU 194.A N TYR 208.A O no hydrogen 2.941 N/A LEU 196.A N LYS 206.A O no hydrogen 2.702 N/A HIS 198.A ND1 ASP 199.A O no hydrogen 2.766 N/A ASP 199.A N LYS 204.A O no hydrogen 2.966 N/A TYR 202.A N ASP 199.A O no hydrogen 3.085 N/A ASN 203.A N ASP 199.A OD1 no hydrogen 3.062 N/A VAL 205.A N LEU 42.A O no hydrogen 3.004 N/A LYS 206.A N SER 197.A O no hydrogen 2.832 N/A LYS 206.A NZ ASP 41.A OD1 no hydrogen 3.293 N/A LEU 207.A N MET 40.A O no hydrogen 2.833 N/A TYR 208.A N GLU 194.A O no hydrogen 2.840 N/A GLU 209.A N GLN 38.A O no hydrogen 3.087 N/A HIS 210.A N CYS 192.A O no hydrogen 2.899 N/A ALA 211.A N GLY 36.A O no hydrogen 2.763 N/A VAL 212.A N ASP 190.A O no hydrogen 3.099 N/A ALA 213.A N GLU 67.A O no hydrogen 2.916 N/A HIS 214.A N PHE 188.A O no hydrogen 2.932 N/A HIS 214.A NE2 ASP 190.A OD1 no hydrogen 2.867 N/A GLY 216.A N HIS 214.A ND1 no hydrogen 3.175 N/A ASN 220.A N GLY 216.A O no hydrogen 3.100 N/A