Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4i97_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 2.A N VAL 56.A O no hydrogen 2.810 N/A LEU 3.A N ASN 27.A O no hydrogen 3.004 N/A TYR 4.A N THR 54.A O no hydrogen 2.951 N/A TYR 5.A N LYS 29.A O no hydrogen 3.209 N/A SER 9.A N LEU 6.A O no hydrogen 3.162 N/A SER 10.A OG SER 165.A OG no hydrogen 3.112 N/A CYS 12.A SG SER 9.A OG no hydrogen 3.263 N/A ARG 13.A N SER 9.A O no hydrogen 2.957 N/A ARG 13.A NE GLY 8.A O no hydrogen 3.134 N/A ARG 13.A NH1 GLY 8.A O no hydrogen 2.877 N/A ARG 13.A NH1 SER 165.A OG no hydrogen 2.892 N/A ARG 13.A NH2 ALA 161.A O no hydrogen 3.316 N/A ARG 13.A NH2 ASN 196.A OD1 no hydrogen 3.112 N/A SER 14.A N SER 10.A O no hydrogen 2.978 N/A ILE 16.A N CYS 12.A O no hydrogen 3.058 N/A MET 17.A N ARG 13.A O no hydrogen 3.016 N/A VAL 18.A N SER 14.A O no hydrogen 3.250 N/A ALA 19.A N VAL 15.A O no hydrogen 2.905 N/A LYS 20.A N ILE 16.A O no hydrogen 3.061 N/A ALA 21.A N MET 17.A O no hydrogen 2.758 N/A ILE 22.A N VAL 18.A O no hydrogen 3.061 N/A ILE 22.A N ALA 19.A O no hydrogen 3.081 N/A GLY 23.A N LYS 20.A O no hydrogen 3.050 N/A LEU 24.A N ALA 19.A O no hydrogen 2.983 N/A ASN 27.A N ALA 1.A O no hydrogen 2.868 N/A ASN 27.A ND2 ASP 2.A OD1 no hydrogen 3.118 N/A LYS 29.A N LEU 3.A O no hydrogen 2.837 N/A LYS 29.A NZ TYR 4.A OH no hydrogen 2.963 N/A LEU 31.A N TYR 5.A O no hydrogen 3.155 N/A ASP 32.A N GLU 37.A OE2 no hydrogen 3.234 N/A SER 34.A OG ASP 32.A OD1 no hydrogen 2.718 N/A THR 35.A N ASP 32.A O no hydrogen 3.158 N/A THR 35.A OG1 ASP 32.A O no hydrogen 3.349 N/A GLY 36.A N LEU 33.A O no hydrogen 2.980 N/A LEU 39.A N GLY 36.A O no hydrogen 3.003 N/A LYS 40.A N GLU 37.A O no hydrogen 3.179 N/A VAL 44.A N LYS 40.A O no hydrogen 2.929 N/A LYS 45.A N PRO 41.A O no hydrogen 2.910 N/A ILE 46.A N PHE 43.A O no hydrogen 2.901 N/A ASN 47.A N PHE 43.A O no hydrogen 2.903 N/A ASN 47.A ND2 THR 51.A O no hydrogen 3.105 N/A ASN 47.A ND2 THR 51.A OG1 no hydrogen 2.956 N/A ASN 47.A ND2 THR 54.A OG1 no hydrogen 3.095 N/A GLN 49.A N ASN 47.A OD1 no hydrogen 2.806 N/A HIS 50.A N ASN 47.A O no hydrogen 2.872 N/A HIS 50.A ND1 HIS 50.A O no hydrogen 2.826 N/A THR 54.A N TYR 4.A O no hydrogen 3.164 N/A THR 54.A OG1 THR 51.A O no hydrogen 2.657 N/A LEU 55.A N LEU 62.A O no hydrogen 2.734 N/A VAL 56.A N ASP 2.A O no hydrogen 2.816 N/A ASP 57.A N PHE 60.A O no hydrogen 2.852 N/A PHE 60.A N ASP 57.A O no hydrogen 3.118 N/A LEU 62.A N LEU 55.A O no hydrogen 2.885 N/A TRP 63.A NE1 GLN 49.A OE1 no hydrogen 3.028 N/A ARG 66.A NE ASP 100.A OD2 no hydrogen 2.912 N/A ARG 66.A NH2 ASP 100.A OD2 no hydrogen 2.854 N/A ILE 68.A N GLU 64.A O no hydrogen 2.987 N/A LEU 69.A N SER 65.A O no hydrogen 2.929 N/A TYR 71.A N ALA 67.A O no hydrogen 3.075 N/A TYR 71.A OH ASP 57.A OD1 no hydrogen 2.594 N/A LEU 72.A N ILE 68.A O no hydrogen 2.880 N/A VAL 73.A N LEU 69.A O no hydrogen 3.020 N/A GLU 74.A N VAL 70.A O no hydrogen 2.788 N/A LYS 75.A N TYR 71.A O no hydrogen 3.032 N/A LYS 75.A NZ ASP 57.A OD1 no hydrogen 2.642 N/A LYS 75.A NZ ASP 57.A OD2 no hydrogen 3.504 N/A TYR 76.A N LEU 72.A O no hydrogen 2.815 N/A TYR 76.A OH ASP 57.A OD2 no hydrogen 2.689 N/A GLY 77.A N VAL 73.A O no hydrogen 3.025 N/A SER 81.A N THR 79.A OG1 no hydrogen 3.139 N/A SER 81.A OG THR 79.A OG1 no hydrogen 2.793 N/A TYR 83.A N ASP 80.A O no hydrogen 2.833 N/A TYR 83.A OH ASN 94.A OD1 no hydrogen 2.942 N/A LYS 85.A N ASP 80.A OD2 no hydrogen 3.151 N/A ARG 90.A N CYS 86.A O no hydrogen 3.028 N/A ARG 90.A NE PRO 84.A O no hydrogen 2.851 N/A ALA 91.A N PRO 87.A O no hydrogen 2.820 N/A VAL 92.A N LYS 88.A O no hydrogen 3.251 N/A ILE 93.A N LYS 89.A O no hydrogen 3.251 N/A ASN 94.A N ARG 90.A O no hydrogen 2.862 N/A GLN 95.A N ALA 91.A O no hydrogen 2.982 N/A ARG 96.A N VAL 92.A O no hydrogen 3.114 N/A ARG 96.A NE ALA 147.A O no hydrogen 2.807 N/A ARG 96.A NH1 GLN 95.A OE1 no hydrogen 2.670 N/A ARG 96.A NH2 ALA 147.A O no hydrogen 3.192 N/A LEU 97.A N ILE 93.A O no hydrogen 3.067 N/A TYR 98.A N ASN 94.A O no hydrogen 2.962 N/A PHE 99.A N GLN 95.A O no hydrogen 2.828 N/A ASP 100.A N ARG 96.A O no hydrogen 2.748 N/A MET 101.A N LEU 97.A O no hydrogen 2.966 N/A GLY 102.A N TYR 98.A O no hydrogen 2.737 N/A THR 103.A N PHE 99.A O no hydrogen 2.797 N/A LEU 104.A N PHE 99.A O no hydrogen 3.013 N/A TYR 105.A N ASP 100.A O no hydrogen 2.869 N/A TYR 105.A OH TYR 113.A OH no hydrogen 2.727 N/A GLN 106.A N MET 101.A O no hydrogen 3.198 N/A GLN 106.A NE2 GLN 106.A O no hydrogen 3.409 N/A GLN 106.A NE2 ASN 110.A OD1 no hydrogen 2.813 N/A SER 107.A N THR 103.A O no hydrogen 3.224 N/A SER 107.A OG THR 103.A O no hydrogen 3.308 N/A SER 107.A OG LEU 104.A O no hydrogen 2.743 N/A PHE 108.A N LEU 104.A O no hydrogen 3.126 N/A ALA 109.A N TYR 105.A O no hydrogen 2.815 N/A ASN 110.A N GLN 106.A O no hydrogen 2.936 N/A TYR 111.A N SER 107.A O no hydrogen 3.040 N/A TYR 112.A N PHE 108.A O no hydrogen 2.886 N/A TYR 113.A N ALA 109.A O no hydrogen 2.990 N/A TYR 113.A OH TYR 105.A OH no hydrogen 2.727 N/A GLN 115.A NE2 TYR 111.A O no hydrogen 2.851 N/A VAL 116.A N TYR 112.A O no hydrogen 3.019 N/A PHE 117.A N TYR 113.A O no hydrogen 2.948 N/A ALA 118.A N PRO 114.A O no hydrogen 3.130 N/A ALA 120.A N PRO 114.A O no hydrogen 3.016 N/A GLU 125.A N ASP 123.A OD1 no hydrogen 2.892 N/A TYR 127.A N ASP 123.A O no hydrogen 2.989 N/A TYR 127.A OH GLU 131.A OE2 no hydrogen 3.265 N/A LYS 128.A N PRO 124.A O no hydrogen 3.181 N/A LYS 128.A NZ GLU 125.A OE2 no hydrogen 3.504 N/A LYS 129.A N GLU 125.A O no hydrogen 3.347 N/A MET 130.A N LEU 126.A O no hydrogen 3.162 N/A GLU 131.A N TYR 127.A O no hydrogen 3.040 N/A ALA 132.A N LYS 128.A O no hydrogen 2.944 N/A ALA 133.A N LYS 129.A O no hydrogen 3.264 N/A VAL 134.A N MET 130.A O no hydrogen 3.285 N/A GLU 135.A N GLU 131.A O no hydrogen 3.058 N/A PHE 136.A N ALA 132.A O no hydrogen 3.034 N/A LEU 137.A N ALA 133.A O no hydrogen 3.088 N/A ASN 138.A N VAL 134.A O no hydrogen 2.930 N/A ASN 138.A ND2 GLU 177.A OE2.A no hydrogen 2.393 N/A THR 139.A N GLU 135.A O no hydrogen 3.034 N/A THR 139.A OG1 GLU 135.A O no hydrogen 3.321 N/A PHE 140.A N PHE 136.A O no hydrogen 2.899 N/A LEU 141.A N LEU 137.A O no hydrogen 3.181 N/A LEU 141.A N ASN 138.A O no hydrogen 3.030 N/A GLU 142.A N THR 139.A O no hydrogen 2.958 N/A GLN 144.A N LEU 141.A O no hydrogen 3.075 N/A ALA 147.A N ASP 156.A OD1 no hydrogen 2.793 N/A SER 151.A OG ASP 150.A OD1.A no hydrogen 3.065 N/A THR 153.A N ASP 156.A OD2 no hydrogen 2.960 N/A THR 153.A OG1 ASP 156.A OD2 no hydrogen 3.549 N/A ILE 154.A N LEU 82.A O no hydrogen 2.872 N/A ILE 157.A N THR 153.A O no hydrogen 3.276 N/A ALA 158.A N ILE 154.A O no hydrogen 2.932 N/A LEU 159.A N ALA 155.A O no hydrogen 3.113 N/A LEU 160.A N ASP 156.A O no hydrogen 2.824 N/A LEU 160.A N ILE 157.A O no hydrogen 3.116 N/A ALA 161.A N ILE 157.A O no hydrogen 3.076 N/A THR 162.A N ALA 158.A O no hydrogen 3.151 N/A THR 162.A OG1 ASP 100.A OD1 no hydrogen 2.426 N/A THR 162.A OG1 ALA 158.A O no hydrogen 3.552 N/A MET 163.A N LEU 159.A O no hydrogen 2.873 N/A SER 164.A N LEU 160.A O no hydrogen 3.057 N/A SER 164.A OG LEU 160.A O no hydrogen 2.956 N/A SER 164.A OG ALA 161.A O no hydrogen 3.219 N/A SER 165.A N ALA 161.A O no hydrogen 3.143 N/A SER 165.A OG SER 10.A OG no hydrogen 3.112 N/A SER 165.A OG ALA 161.A O no hydrogen 2.856 N/A PHE 166.A N THR 162.A O no hydrogen 3.023 N/A GLU 167.A N MET 163.A O no hydrogen 3.011 N/A VAL 168.A N SER 164.A O no hydrogen 3.126 N/A ALA 169.A N SER 165.A O no hydrogen 3.147 N/A GLY 170.A N GLU 167.A O no hydrogen 2.898 N/A TYR 171.A N PHE 166.A O no hydrogen 3.136 N/A TYR 171.A OH TYR 176.A OH no hydrogen 2.716 N/A SER 174.A N ASP 172.A OD1 no hydrogen 3.160 N/A SER 174.A OG ASP 172.A OD1 no hydrogen 2.852 N/A TYR 176.A N PHE 173.A O no hydrogen 3.384 N/A TYR 176.A OH TYR 171.A OH no hydrogen 2.716 N/A ASN 178.A N ASN 138.A OD1 no hydrogen 2.965 N/A ASN 178.A ND2 ASN 138.A O no hydrogen 3.162 N/A ASN 178.A ND2 GLU 142.A OE2 no hydrogen 2.663 N/A VAL 179.A N ASN 138.A OD1 no hydrogen 3.132 N/A ASN 180.A N TYR 176.A O no hydrogen 2.816 N/A ASN 180.A ND2 TYR 176.A O no hydrogen 3.221 N/A LYS 181.A N GLU 177.A O.A no hydrogen 3.137 N/A LYS 181.A N GLU 177.A O.B no hydrogen 2.965 N/A TRP 182.A N ASN 178.A O no hydrogen 2.833 N/A TRP 182.A NE1 ASP 156.A OD1 no hydrogen 2.856 N/A TYR 183.A N VAL 179.A O no hydrogen 2.836 N/A TYR 183.A OH GLU 167.A OE1 no hydrogen 2.543 N/A ALA 184.A N ASN 180.A O no hydrogen 3.036 N/A ASN 185.A N LYS 181.A O no hydrogen 2.974 N/A ASN 185.A ND2 TYR 146.A OH no hydrogen 3.174 N/A ALA 186.A N TRP 182.A O no hydrogen 2.833 N/A LYS 187.A N TYR 183.A O no hydrogen 2.925 N/A LYS 188.A N ASN 185.A O no hydrogen 2.924 N/A VAL 189.A N ASN 185.A O no hydrogen 3.069 N/A THR 190.A N ALA 186.A O no hydrogen 2.904 N/A THR 190.A OG1 ALA 186.A O no hydrogen 2.526 N/A TRP 193.A N THR 190.A O no hydrogen 3.285 N/A ASN 196.A N GLY 192.A O no hydrogen 2.986 N/A ASN 196.A ND2 SER 164.A OG no hydrogen 2.941 N/A TRP 197.A N TRP 193.A O no hydrogen 2.754 N/A ALA 198.A N ASP 194.A O no hydrogen 3.110 N/A GLY 199.A N GLU 195.A O no hydrogen 2.932 N/A CYS 200.A N ASN 196.A O no hydrogen 2.895 N/A CYS 200.A SG SER 164.A OG no hydrogen 3.277 N/A CYS 200.A SG ASN 196.A O no hydrogen 3.441 N/A GLN 201.A N ALA 198.A O no hydrogen 3.137 N/A GLN 201.A NE2 TRP 197.A O no hydrogen 2.838 N/A GLU 202.A N GLY 199.A O no hydrogen 2.998 N/A PHE 203.A N GLY 199.A O no hydrogen 3.288 N/A LYS 204.A N CYS 200.A O no hydrogen 2.873 N/A LYS 205.A N GLU 202.A O no hydrogen 3.263 N/A LYS 205.A NZ GLU 202.A OE1 no hydrogen 2.469 N/A LYS 205.A NZ GLU 202.A OE2 no hydrogen 2.757 N/A TYR 206.A N PHE 203.A O no hydrogen 3.112 N/A PHE 207.A N LYS 204.A O no hydrogen 2.953 N/A