Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8a0q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N VAL 55.A O no hydrogen 2.875 N/A LEU 4.A N GLU 28.A O no hydrogen 2.857 N/A HIS 5.A N VAL 53.A O no hydrogen 2.849 N/A HIS 5.A ND1 GLU 32.A OE2 no hydrogen 2.310 N/A GLY 6.A N ILE 30.A O no hydrogen 2.963 N/A VAL 9.A N SER 7.A OG no hydrogen 3.135 N/A SER 10.A N SER 7.A OG no hydrogen 2.957 N/A ASN 13.A N SER 10.A OG no hydrogen 3.186 N/A ASN 13.A ND2 SER 7.A O no hydrogen 3.028 N/A ASN 13.A ND2 HIS 29.A NE2 no hydrogen 3.014 N/A TYR 14.A N SER 10.A O no hydrogen 3.134 N/A ARG 15.A N PRO 11.A O no hydrogen 3.163 N/A ARG 15.A NH1 SER 64.A OG no hydrogen 2.950 N/A ARG 15.A NH2 SER 152.A O no hydrogen 2.974 N/A ILE 17.A N ASN 13.A O no hydrogen 3.145 N/A TRP 18.A N TYR 14.A O no hydrogen 2.941 N/A TRP 18.A NE1 ASN 196.A O no hydrogen 2.684 N/A ALA 19.A N ARG 15.A O no hydrogen 3.093 N/A LEU 20.A N VAL 16.A O no hydrogen 2.900 N/A LYS 21.A N ILE 17.A O no hydrogen 2.901 N/A LYS 21.A NZ ASN 196.A OD1 no hydrogen 2.980 N/A LEU 22.A N TRP 18.A O no hydrogen 2.896 N/A LYS 23.A N ALA 19.A O no hydrogen 3.077 N/A LYS 23.A NZ GLU 72.A OE1 no hydrogen 2.742 N/A LYS 23.A NZ TRP 75.A O no hydrogen 2.789 N/A LYS 23.A NZ GLU 77.A O no hydrogen 2.979 N/A LYS 23.A NZ ASN 78.A O no hydrogen 2.877 N/A GLY 24.A N LYS 21.A O no hydrogen 3.271 N/A VAL 25.A N LEU 20.A O no hydrogen 2.946 N/A GLU 28.A N VAL 2.A O no hydrogen 2.967 N/A ILE 30.A N LEU 4.A O no hydrogen 2.876 N/A GLU 32.A N GLY 6.A O no hydrogen 2.915 N/A THR 35.A N ASP 33.A OD1 no hydrogen 3.314 N/A THR 35.A OG1 ASP 33.A OD1 no hydrogen 3.039 N/A THR 35.A OG1 ASP 33.A OD2 no hydrogen 3.040 N/A LYS 37.A NZ LYS 49.A O no hydrogen 2.877 N/A SER 38.A OG GLU 32.A OE1 no hydrogen 2.754 N/A SER 38.A OG GLU 32.A OE2 no hydrogen 3.558 N/A LEU 42.A N SER 38.A O no hydrogen 3.381 N/A LYS 43.A N GLU 39.A O no hydrogen 3.085 N/A TYR 44.A N LEU 40.A O no hydrogen 2.881 N/A ASN 45.A N LEU 41.A O no hydrogen 3.012 N/A ASN 45.A ND2 LYS 50.A O no hydrogen 3.075 N/A TYR 48.A N ASN 45.A OD1 no hydrogen 3.402 N/A LYS 49.A N ASN 45.A O no hydrogen 2.998 N/A LYS 49.A NZ PRO 46.A O no hydrogen 2.836 N/A VAL 53.A N HIS 5.A O no hydrogen 3.103 N/A LEU 54.A N ILE 61.A O no hydrogen 2.879 N/A VAL 55.A N LYS 3.A O no hydrogen 2.809 N/A HIS 56.A N LYS 59.A O no hydrogen 2.943 N/A HIS 56.A ND1 TYR 70.A OH no hydrogen 2.654 N/A GLY 57.A N ASP 1.A O no hydrogen 2.876 N/A LYS 59.A N HIS 56.A O no hydrogen 3.170 N/A ILE 61.A N LEU 54.A O no hydrogen 2.760 N/A ILE 67.A N GLU 63.A O no hydrogen 2.907 N/A LEU 68.A N SER 64.A O no hydrogen 2.876 N/A GLU 69.A N LEU 65.A O no hydrogen 3.343 N/A TYR 70.A N VAL 66.A O no hydrogen 3.038 N/A TYR 70.A OH HIS 56.A ND1 no hydrogen 2.654 N/A ILE 71.A N ILE 67.A O no hydrogen 2.833 N/A GLU 72.A N LEU 68.A O no hydrogen 2.964 N/A GLU 73.A N GLU 69.A O no hydrogen 2.956 N/A THR 74.A N TYR 70.A O no hydrogen 2.843 N/A THR 74.A OG1 TYR 70.A O no hydrogen 2.790 N/A TRP 75.A N ILE 71.A O no hydrogen 2.887 N/A LEU 80.A N GLU 72.A OE1 no hydrogen 2.830 N/A LEU 80.A N GLU 72.A OE2 no hydrogen 3.299 N/A GLU 87.A N ASP 84.A OD2 no hydrogen 3.061 N/A ARG 88.A N ASP 84.A O no hydrogen 2.822 N/A ARG 88.A NH1 PRO 82.A O no hydrogen 2.819 N/A ALA 89.A N PRO 85.A O no hydrogen 2.905 N/A MET 90.A N TYR 86.A O no hydrogen 2.948 N/A ALA 91.A N GLU 87.A O no hydrogen 3.004 N/A ARG 92.A N ARG 88.A O no hydrogen 2.942 N/A ARG 92.A NE GLU 69.A OE1 no hydrogen 3.234 N/A ARG 92.A NH2 GLU 69.A OE1 no hydrogen 2.788 N/A PHE 93.A N ALA 89.A O no hydrogen 2.814 N/A TRP 94.A N MET 90.A O no hydrogen 3.068 N/A ILE 95.A N ALA 91.A O no hydrogen 2.971 N/A GLN 96.A N.A ARG 92.A O no hydrogen 2.919 N/A GLN 96.A N.B ARG 92.A O no hydrogen 2.924 N/A TYR 97.A N PHE 93.A O no hydrogen 2.890 N/A TYR 97.A OH VAL 126.A O no hydrogen 2.914 N/A GLY 98.A N TRP 94.A O no hydrogen 3.035 N/A ALA 99.A N ILE 95.A O no hydrogen 3.040 N/A THR 100.A N GLN 96.A O.A no hydrogen 2.968 N/A THR 100.A N GLN 96.A O.B no hydrogen 2.968 N/A THR 100.A OG1 GLN 96.A O.A no hydrogen 3.158 N/A THR 100.A OG1 GLN 96.A O.B no hydrogen 3.132 N/A LYS 101.A N TYR 97.A O no hydrogen 3.003 N/A THR 102.A N GLY 98.A O no hydrogen 2.831 N/A THR 102.A OG1 GLY 98.A O no hydrogen 2.743 N/A ALA 104.A N LYS 101.A O no hydrogen 2.907 N/A PHE 105.A N THR 102.A O no hydrogen 3.211 N/A GLY 106.A N ALA 103.A O no hydrogen 2.915 N/A LEU 108.A N PHE 105.A O no hydrogen 3.106 N/A PHE 109.A N GLY 106.A O no hydrogen 2.895 N/A ARG 110.A N ALA 107.A O no hydrogen 3.330 N/A ALA 111.A N ALA 107.A O no hydrogen 2.978 N/A LEU 116.A N GLY 113.A O no hydrogen 2.908 N/A GLU 117.A N GLY 113.A O no hydrogen 3.027 N/A ALA 119.A N GLU 115.A O no hydrogen 3.058 N/A ALA 120.A N LEU 116.A O no hydrogen 2.913 N/A LYS 121.A N GLU 117.A O no hydrogen 3.158 N/A GLU 122.A N LYS 118.A O no hydrogen 3.067 N/A VAL 123.A N ALA 119.A O no hydrogen 2.946 N/A VAL 124.A N ALA 120.A O no hydrogen 2.989 N/A GLU 125.A N LYS 121.A O no hydrogen 3.044 N/A VAL 126.A N GLU 122.A O no hydrogen 3.001 N/A LEU 127.A N VAL 123.A O no hydrogen 2.944 N/A ARG 128.A N VAL 124.A O no hydrogen 2.817 N/A ARG 128.A NH2 THR 176.A O no hydrogen 2.875 N/A VAL 129.A N GLU 125.A O no hydrogen 3.209 N/A LEU 130.A N VAL 126.A O no hydrogen 3.379 N/A GLU 131.A N LEU 127.A O no hydrogen 2.851 N/A GLU 132.A N.A ARG 128.A O no hydrogen 2.854 N/A GLU 132.A N.B ARG 128.A O no hydrogen 2.859 N/A GLN 133.A N VAL 129.A O no hydrogen 2.846 N/A GLY 134.A N LEU 130.A O no hydrogen 2.913 N/A LEU 135.A N LEU 130.A O no hydrogen 2.894 N/A GLY 136.A N GLU 131.A O no hydrogen 2.778 N/A LYS 138.A N LEU 135.A O no hydrogen 3.370 N/A LYS 138.A NZ GLY 134.A O no hydrogen 3.034 N/A LYS 138.A NZ LEU 135.A O no hydrogen 2.926 N/A PHE 140.A N GLY 143.A O no hydrogen 2.919 N/A PHE 141.A N ASP 150.A OD1 no hydrogen 2.875 N/A GLY 142.A N ASP 150.A OD2 no hydrogen 2.865 N/A GLY 143.A N PHE 140.A O no hydrogen 2.821 N/A ASN 147.A N ASP 150.A OD2 no hydrogen 3.013 N/A LEU 148.A N LEU 80.A O no hydrogen 2.908 N/A VAL 149.A N ASN 147.A OD1 no hydrogen 2.946 N/A ASP 150.A N ASN 147.A OD1 no hydrogen 3.371 N/A ILE 151.A N ASN 147.A O no hydrogen 3.116 N/A SER 152.A N LEU 148.A O no hydrogen 2.932 N/A SER 152.A OG LEU 148.A O no hydrogen 2.830 N/A PHE 153.A N VAL 149.A O no hydrogen 2.980 N/A PHE 153.A N ASP 150.A O no hydrogen 3.075 N/A GLY 154.A N ILE 151.A O no hydrogen 3.207 N/A PHE 156.A N PHE 153.A O no hydrogen 2.875 N/A THR 157.A N GLY 154.A O no hydrogen 3.069 N/A THR 157.A OG1 GLY 154.A O no hydrogen 2.637 N/A CYS 158.A N THR 157.A OG1 no hydrogen 2.892 N/A TRP 159.A NE1 VAL 9.A O no hydrogen 2.601 N/A LEU 160.A N LEU 155.A O no hydrogen 3.076 N/A GLU 161.A N THR 157.A O no hydrogen 2.979 N/A ALA 162.A N CYS 158.A O no hydrogen 2.992 N/A ILE 163.A N TRP 159.A O no hydrogen 3.031 N/A GLU 164.A N LEU 160.A O no hydrogen 2.888 N/A GLU 165.A N GLU 161.A O no hydrogen 3.114 N/A ALA 166.A N ALA 162.A O no hydrogen 3.010 N/A ALA 167.A N ILE 163.A O no hydrogen 2.884 N/A GLY 168.A N GLU 164.A O no hydrogen 2.874 N/A VAL 169.A N GLU 164.A O no hydrogen 3.169 N/A VAL 171.A N GLU 164.A OE2 no hydrogen 2.822 N/A LEU 172.A N GLU 164.A OE2 no hydrogen 2.880 N/A THR 176.A OG1 GLU 173.A O no hydrogen 3.490 N/A LEU 177.A N GLU 173.A O no hydrogen 2.907 N/A ARG 179.A NH1 ASP 137.A OD1 no hydrogen 3.041 N/A LEU 180.A N GLU 131.A OE2 no hydrogen 2.832 N/A HIS 181.A N LEU 177.A O no hydrogen 2.877 N/A ALA 182.A N PRO 178.A O no hydrogen 3.146 N/A TRP 183.A N ARG 179.A O no hydrogen 2.949 N/A TRP 183.A NE1 ASP 150.A OD1 no hydrogen 2.717 N/A ALA 184.A N LEU 180.A O no hydrogen 2.901 N/A GLN 185.A N HIS 181.A O no hydrogen 3.132 N/A ASN 186.A N ALA 182.A O no hydrogen 2.908 N/A PHE 187.A N TRP 183.A O no hydrogen 2.772 N/A ILE 188.A N ALA 184.A O no hydrogen 3.205 N/A GLU 189.A N GLN 185.A O no hydrogen 3.154 N/A GLU 189.A N ASN 186.A O no hydrogen 3.220 N/A VAL 190.A N PHE 187.A O no hydrogen 3.130 N/A LYS 194.A N VAL 190.A O no hydrogen 2.786 N/A GLU 195.A N PRO 191.A O no hydrogen 2.928 N/A ASN 196.A N ILE 193.A O no hydrogen 2.873 N/A ASN 196.A ND2 LEU 192.A O no hydrogen 2.806 N/A TYR 200.A OH GLU 161.A O no hydrogen 3.304 N/A TYR 200.A OH GLU 165.A OE1 no hydrogen 2.777 N/A LYS 202.A N ASP 199.A OD2 no hydrogen 3.014 N/A LEU 203.A N ASP 199.A O no hydrogen 3.010 N/A LEU 204.A N TYR 200.A O no hydrogen 2.787 N/A LEU 205.A N ASP 201.A O no hydrogen 3.123 N/A HIS 206.A N LYS 202.A O no hydrogen 3.046 N/A MET 207.A N LEU 203.A O no hydrogen 2.984 N/A LYS 208.A N LEU 204.A O no hydrogen 2.881 N/A GLY 209.A N LEU 205.A O no hydrogen 3.079 N/A VAL 210.A N HIS 206.A O no hydrogen 2.998 N/A ARG 211.A N MET 207.A O no hydrogen 2.881 N/A ARG 211.A NH1 ALA 111.A O no hydrogen 3.225 N/A ARG 211.A NH2 ALA 111.A O no hydrogen 3.406 N/A GLU 212.A N LYS 208.A O no hydrogen 2.949 N/A LYS 213.A N GLY 209.A O no hydrogen 3.111 N/A MET 214.A N VAL 210.A O no hydrogen 3.089 N/A MET 215.A N GLU 212.A O no hydrogen 3.301 N/A