Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wi3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N ASP 3.A OD1 no hydrogen 3.393 N/A TYR 7.A N ASP 3.A O no hydrogen 2.969 N/A ILE 8.A N PRO 4.A O no hydrogen 3.029 N/A GLU 9.A N LYS 5.A O no hydrogen 3.131 N/A SER 10.A N GLU 6.A O no hydrogen 2.948 N/A LYS 11.A N TYR 7.A O no hydrogen 2.848 N/A LYS 11.A NZ TYR 25.A OH no hydrogen 3.280 N/A TYR 12.A N ILE 8.A O no hydrogen 2.744 N/A TYR 12.A OH GLU 117.A OE2 no hydrogen 2.513 N/A TYR 12.A OH GLN 121.A OE1 no hydrogen 3.253 N/A TYR 13.A N GLU 9.A O no hydrogen 3.077 N/A ASP 14.A N SER 10.A O no hydrogen 3.011 N/A ALA 15.A N LYS 11.A O no hydrogen 2.820 N/A LEU 16.A N TYR 12.A O no hydrogen 2.861 N/A PHE 17.A N TYR 13.A O no hydrogen 2.900 N/A SER 18.A N ASP 14.A O no hydrogen 2.899 N/A SER 18.A OG HIS 20.A NE2 no hydrogen 3.295 N/A SER 18.A OG THR 21.A OG1 no hydrogen 2.996 N/A THR 21.A N SER 18.A O no hydrogen 3.201 N/A THR 21.A OG1 SER 18.A O no hydrogen 3.264 N/A THR 21.A OG1 SER 18.A OG no hydrogen 2.996 N/A LEU 23.A N GLU 181.A OE1 no hydrogen 2.816 N/A ALA 24.A N GLU 181.A OE2 no hydrogen 3.208 N/A TYR 25.A N PRO 22.A O no hydrogen 3.112 N/A VAL 27.A N LEU 23.A O no hydrogen 3.032 N/A LYS 28.A N ALA 24.A O no hydrogen 2.884 N/A SER 29.A N TYR 25.A O no hydrogen 3.023 N/A ASN 30.A N TYR 25.A O no hydrogen 3.155 N/A LEU 31.A N PHE 26.A O no hydrogen 2.932 N/A ARG 33.A N SER 29.A O no hydrogen 3.065 N/A LEU 34.A N ASN 30.A O no hydrogen 3.074 N/A LYS 35.A N LEU 31.A O no hydrogen 2.956 N/A ASN 36.A N VAL 32.A O no hydrogen 2.917 N/A THR 37.A N ARG 33.A O no hydrogen 3.028 N/A THR 37.A OG1 ARG 33.A O no hydrogen 3.251 N/A CYS 38.A N LEU 34.A O no hydrogen 3.077 N/A CYS 38.A SG LEU 34.A O no hydrogen 3.335 N/A ARG 39.A N LYS 35.A O no hydrogen 2.772 N/A THR 40.A N ASN 36.A O no hydrogen 2.979 N/A THR 40.A OG1 ASN 36.A O no hydrogen 3.221 N/A LYS 41.A N THR 37.A O no hydrogen 2.934 N/A TYR 42.A N CYS 38.A O no hydrogen 2.821 N/A GLY 43.A N ARG 39.A O no hydrogen 2.815 N/A SER 46.A OG TYR 42.A O no hydrogen 3.518 N/A TYR 51.A N TYR 47.A O no hydrogen 2.788 N/A TYR 51.A OH GLU 127.A OE2 no hydrogen 2.745 N/A GLN 52.A N LYS 48.A O no hydrogen 2.970 N/A GLN 52.A NE2 TYR 143.A OH no hydrogen 3.432 N/A ALA 53.A N ILE 49.A O no hydrogen 2.970 N/A MET 54.A N ALA 50.A O no hydrogen 3.076 N/A LEU 55.A N TYR 51.A O no hydrogen 3.069 N/A GLN 56.A N GLN 52.A O no hydrogen 2.913 N/A PHE 58.A N LEU 55.A O no hydrogen 2.957 N/A LEU 59.A N GLN 56.A O no hydrogen 3.016 N/A SER 61.A N GLN 64.A OE1 no hydrogen 2.777 N/A GLN 64.A N SER 61.A OG no hydrogen 3.013 N/A PHE 65.A N SER 61.A O no hydrogen 2.845 N/A LYS 66.A N ILE 62.A O no hydrogen 3.165 N/A LYS 66.A NZ ASP 70.A OD2 no hydrogen 2.797 N/A ASP 67.A N VAL 63.A O no hydrogen 3.290 N/A ARG 68.A N GLN 64.A O no hydrogen 2.930 N/A ARG 68.A NH1 TYR 13.A OH no hydrogen 3.413 N/A ARG 68.A NH1 GLU 117.A OE1 no hydrogen 3.092 N/A ARG 68.A NH1 GLU 117.A OE2 no hydrogen 2.609 N/A ARG 68.A NH2 TYR 13.A OH no hydrogen 2.982 N/A HIS 69.A N PHE 65.A O no hydrogen 2.906 N/A HIS 69.A NE2 GLU 117.A OE1 no hydrogen 2.927 N/A ASP 70.A N LYS 66.A O no hydrogen 2.845 N/A ASN 71.A N ASP 67.A O no hydrogen 3.177 N/A ASN 71.A ND2 ASP 67.A O no hydrogen 3.315 N/A ASN 71.A ND2 ASP 67.A OD1 no hydrogen 2.633 N/A ARG 72.A N HIS 69.A O no hydrogen 3.234 N/A LEU 73.A N ARG 68.A O no hydrogen 2.789 N/A LEU 75.A N ARG 72.A O no hydrogen 3.197 N/A GLU 76.A N LEU 73.A O no hydrogen 2.982 N/A PHE 78.A N ASP 84.A OD1 no hydrogen 2.914 N/A SER 80.A OG GLU 9.A OE1 no hydrogen 3.386 N/A SER 80.A OG GLU 9.A OE2 no hydrogen 2.366 N/A ALA 83.A N GLU 9.A OE2 no hydrogen 3.305 N/A ASP 84.A N SER 80.A O no hydrogen 3.071 N/A GLU 85.A N PRO 81.A O no hydrogen 3.238 N/A LYS 86.A NZ ASP 14.A OD1 no hydrogen 3.164 N/A ARG 87.A N ALA 83.A O no hydrogen 3.032 N/A ARG 87.A NE ASP 84.A OD1 no hydrogen 2.990 N/A ARG 87.A NH1 LEU 75.A O no hydrogen 2.924 N/A ARG 87.A NH2 ASP 84.A OD1 no hydrogen 3.166 N/A LYS 88.A N ASP 84.A O no hydrogen 2.978 N/A ASN 89.A N GLU 85.A O no hydrogen 3.015 N/A CYS 90.A N LYS 86.A O no hydrogen 3.142 N/A CYS 90.A SG PHE 17.A O no hydrogen 3.643 N/A LEU 91.A N ARG 87.A O no hydrogen 3.030 N/A THR 92.A N LYS 88.A O no hydrogen 2.858 N/A THR 92.A OG1 LYS 88.A O no hydrogen 2.982 N/A LYS 93.A N ASN 89.A O no hydrogen 3.036 N/A PHE 94.A N CYS 90.A O no hydrogen 2.944 N/A VAL 95.A N LEU 91.A O no hydrogen 2.863 N/A ILE 96.A N LEU 91.A O no hydrogen 2.985 N/A GLN 97.A N THR 92.A O no hydrogen 2.831 N/A ASN 100.A N ASP 98.A OD1 no hydrogen 2.759 N/A LYS 101.A N ASP 98.A O no hydrogen 2.974 N/A LYS 101.A NZ ILE 96.A O no hydrogen 3.014 N/A ASN 102.A N THR 105.A OG1 no hydrogen 2.772 N/A ASN 102.A ND2 ASN 100.A O no hydrogen 3.061 N/A SER 104.A N ASN 102.A OD1 no hydrogen 2.575 N/A SER 104.A OG ASN 102.A OD1 no hydrogen 2.852 N/A THR 105.A N ASN 102.A O no hydrogen 3.331 N/A THR 105.A OG1 ASN 102.A O no hydrogen 3.298 N/A ASP 108.A N SER 104.A O no hydrogen 3.111 N/A LEU 109.A N THR 105.A O no hydrogen 2.909 N/A CYS 110.A N ILE 106.A O no hydrogen 2.776 N/A CYS 110.A SG ILE 106.A O no hydrogen 3.349 N/A VAL 111.A N ALA 107.A O no hydrogen 3.055 N/A VAL 112.A N ASP 108.A O no hydrogen 2.895 N/A LEU 113.A N LEU 109.A O no hydrogen 2.975 N/A LYS 114.A N CYS 110.A O no hydrogen 3.007 N/A SER 115.A N VAL 111.A O no hydrogen 2.884 N/A ARG 116.A N VAL 112.A O no hydrogen 2.905 N/A ARG 116.A NE ALA 15.A O no hydrogen 2.760 N/A ARG 116.A NE LEU 16.A O no hydrogen 3.436 N/A ARG 116.A NH1 THR 21.A O no hydrogen 3.202 N/A ARG 116.A NH2 ALA 15.A O no hydrogen 2.690 N/A ARG 116.A NH2 THR 21.A O no hydrogen 2.616 N/A GLU 117.A N LEU 113.A O no hydrogen 2.737 N/A ILE 118.A N LYS 114.A O no hydrogen 3.047 N/A LYS 119.A N SER 115.A O no hydrogen 3.426 N/A LYS 119.A NZ ALA 182.A O no hydrogen 3.112 N/A LEU 120.A N ARG 116.A O no hydrogen 3.073 N/A GLN 121.A N GLU 117.A O no hydrogen 2.912 N/A ILE 122.A N ILE 118.A O no hydrogen 3.063 N/A LEU 123.A N LYS 119.A O no hydrogen 2.963 N/A LEU 124.A N LEU 120.A O no hydrogen 2.920 N/A LEU 125.A N GLN 121.A O no hydrogen 2.959 N/A LEU 126.A N ILE 122.A O no hydrogen 2.874 N/A GLU 127.A N LEU 123.A O no hydrogen 3.014 N/A ILE 128.A N LEU 124.A O no hydrogen 2.986 N/A ILE 129.A N LEU 125.A O no hydrogen 2.814 N/A GLY 130.A N LEU 126.A O no hydrogen 2.906 N/A LEU 131.A N GLU 127.A O no hydrogen 3.082 N/A ASN 132.A N ILE 128.A O no hydrogen 3.021 N/A ASN 132.A ND2 GLN 52.A OE1 no hydrogen 3.108 N/A ASN 132.A ND2 ILE 128.A O no hydrogen 3.313 N/A ASP 133.A N GLY 130.A O no hydrogen 3.211 N/A LEU 134.A N ILE 129.A O no hydrogen 3.014 N/A ASN 137.A N LEU 134.A O no hydrogen 3.181 N/A PHE 138.A N ASP 135.A O no hydrogen 2.968 N/A ARG 139.A N TRP 136.A O no hydrogen 2.834 N/A CYS 144.A N ASP 142.A OD1 no hydrogen 3.337 N/A GLN 146.A N ASP 142.A O no hydrogen 2.997 N/A LEU 147.A N TYR 143.A O no hydrogen 2.971 N/A ASP 148.A N CYS 144.A O no hydrogen 3.176 N/A LEU 149.A N GLU 145.A O no hydrogen 3.040 N/A TYR 150.A N GLN 146.A O no hydrogen 3.049 N/A TYR 150.A OH LEU 60.A O no hydrogen 2.597 N/A LEU 151.A N LEU 147.A O no hydrogen 2.984 N/A ASP 152.A N ASP 148.A O no hydrogen 3.061 N/A ARG 153.A N LEU 149.A O no hydrogen 3.057 N/A ALA 154.A N TYR 150.A O no hydrogen 2.913 N/A CYS 155.A N LEU 151.A O no hydrogen 3.100 N/A CYS 155.A SG LEU 151.A O no hydrogen 3.323 N/A CYS 155.A SG ASP 152.A O no hydrogen 3.567 N/A ILE 156.A N ASP 152.A O no hydrogen 2.950 N/A LEU 157.A N ARG 153.A O no hydrogen 2.915 N/A ASP 158.A N ALA 154.A O no hydrogen 3.092 N/A ILE 159.A N CYS 155.A O no hydrogen 2.950 N/A LEU 160.A N ILE 156.A O no hydrogen 2.869 N/A LEU 161.A N LEU 157.A O no hydrogen 3.049 N/A SER 162.A N ASP 158.A O no hydrogen 2.999 N/A SER 163.A N ILE 159.A O no hydrogen 2.737 N/A SER 163.A N LEU 160.A O no hydrogen 3.267 N/A SER 163.A OG ILE 159.A O no hydrogen 3.419 N/A SER 163.A OG LEU 160.A O no hydrogen 2.874 N/A GLU 164.A N LEU 161.A O no hydrogen 3.084 N/A THR 165.A OG1 GLU 164.A O no hydrogen 2.640 N/A THR 167.A N ASP 98.A OD2 no hydrogen 3.394 N/A GLN 169.A N GLY 166.A O no hydrogen 3.290 N/A GLN 169.A NE2 ASP 108.A OD2 no hydrogen 2.608 N/A GLU 170.A N THR 167.A O no hydrogen 3.044 N/A HIS 171.A N THR 167.A O no hydrogen 3.392 N/A LYS 172.A N ILE 168.A O no hydrogen 2.999 N/A LYS 172.A NZ ASP 108.A OD1 no hydrogen 3.103 N/A LYS 173.A N GLN 169.A O no hydrogen 3.036 N/A LYS 173.A NZ LYS 173.A O no hydrogen 3.350 N/A ASN 174.A N GLU 170.A O no hydrogen 2.873 N/A ILE 175.A N LYS 172.A O no hydrogen 3.162 N/A LEU 176.A N LYS 173.A O no hydrogen 3.202 N/A ASP 177.A N ASN 174.A O no hydrogen 3.137 N/A SER 179.A N ASP 177.A OD1 no hydrogen 2.928 N/A SER 179.A OG ASP 177.A OD1 no hydrogen 2.669 N/A SER 179.A OG ASP 177.A OD2 no hydrogen 3.314 N/A LYS 180.A N ASP 177.A O no hydrogen 3.030 N/A SER 183.A N LYS 180.A O no hydrogen 3.092 N/A SER 183.A OG ASP 177.A O no hydrogen 2.934 N/A SER 183.A OG LYS 180.A O no hydrogen 2.746 N/A GLY 186.A N SER 183.A OG no hydrogen 2.962 N/A PHE 187.A N SER 183.A O no hydrogen 2.874 N/A ILE 188.A N LEU 184.A O no hydrogen 2.807 N/A ASN 189.A N VAL 185.A O no hydrogen 2.900 N/A TYR 190.A N GLY 186.A O no hydrogen 2.820 N/A VAL 191.A N PHE 187.A O no hydrogen 3.072 N/A LEU 192.A N PHE 187.A O no hydrogen 3.060 N/A ILE 193.A N ILE 188.A O no hydrogen 2.979 N/A TYR 195.A N VAL 191.A O no hydrogen 3.082 N/A PHE 196.A N LEU 192.A O no hydrogen 2.828 N/A ASN 197.A N ILE 193.A O no hydrogen 3.254 N/A HIS 202.A N ASP 135.A OD2 no hydrogen 2.868 N/A ALA 203.A N ASP 135.A OD1 no hydrogen 2.735 N/A VAL 204.A N VAL 200.A O no hydrogen 3.089 N/A GLU 205.A N PRO 201.A O no hydrogen 3.070 N/A PHE 206.A N HIS 202.A O no hydrogen 2.950 N/A ILE 207.A N ALA 203.A O no hydrogen 2.925 N/A ILE 208.A N VAL 204.A O no hydrogen 3.019 N/A GLN 209.A N GLU 205.A O no hydrogen 3.019 N/A LYS 210.A N PHE 206.A O no hydrogen 2.871 N/A LYS 210.A NZ ASP 148.A O no hydrogen 3.428 N/A LEU 211.A N ILE 207.A O no hydrogen 2.999 N/A LYS 212.A N ILE 208.A O no hydrogen 2.888 N/A