Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pl6_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 10.A N ASN 9.A OD1 no hydrogen 2.653 N/A SER 20.A N ASP 39.A O no hydrogen 2.776 N/A GLN 21.A NE2 TYR 105.A O no hydrogen 2.823 N/A SER 24.A OG GLU 169.A OE2 no hydrogen 2.932 N/A SER 24.A OG TYR 228.A OH no hydrogen 2.978 N/A ASN 25.A ND2 SER 24.A OG no hydrogen 3.188 N/A LYS 26.A N ARG 123.A O no hydrogen 3.061 N/A THR 28.A N THR 125.A O no hydrogen 3.100 N/A LYS 30.A N LEU 127.A O no hydrogen 2.819 N/A GLY 31.A N THR 97.A O no hydrogen 2.767 N/A LYS 32.A N GLU 29.A O no hydrogen 3.297 N/A TYR 33.A OH GLU 35.A OE1 no hydrogen 2.365 N/A VAL 34.A N ILE 94.A O no hydrogen 3.034 N/A LEU 36.A N LEU 92.A O no hydrogen 2.994 N/A CYS 38.A N SER 90.A O no hydrogen 2.962 N/A CYS 38.A SG SER 20.A O no hydrogen 3.946 N/A ASP 39.A N SER 20.A O no hydrogen 2.982 N/A SER 42.A N GLY 16.A O no hydrogen 3.086 N/A HIS 44.A N ILE 41.A O no hydrogen 3.140 N/A HIS 44.A ND1 THR 109.A OG1 no hydrogen 2.666 N/A THR 45.A N ALA 111.A O no hydrogen 3.395 N/A THR 45.A OG1 ALA 111.A O no hydrogen 2.756 N/A ALA 46.A N SER 110.A O no hydrogen 3.117 N/A LEU 47.A N PHE 64.A O no hydrogen 3.044 N/A TYR 48.A N ALA 108.A O no hydrogen 2.622 N/A TYR 48.A OH GLY 113.A O no hydrogen 2.497 N/A TRP 49.A N ILE 62.A O no hydrogen 3.097 N/A TRP 49.A NE1 SER 90.A OG no hydrogen 2.865 N/A TYR 50.A N LEU 106.A O no hydrogen 2.760 N/A TYR 50.A OH GLN 116.A OE1 no hydrogen 2.567 N/A ARG 51.A N GLU 59.A O no hydrogen 2.893 N/A ARG 51.A NE TYR 105.A OH no hydrogen 3.173 N/A ARG 51.A NH2 TYR 105.A OH no hydrogen 2.846 N/A GLN 52.A N VAL 104.A O no hydrogen 2.811 N/A GLN 52.A NE2 GLN 56.A O no hydrogen 3.154 N/A GLN 56.A N SER 53.A O no hydrogen 3.082 N/A GLU 59.A N ARG 51.A O no hydrogen 2.850 N/A LEU 61.A N TRP 49.A O no hydrogen 3.147 N/A TYR 63.A N ASP 71.A O no hydrogen 2.674 N/A PHE 64.A N LEU 47.A O no hydrogen 2.790 N/A GLN 65.A N GLY 68.A O no hydrogen 2.876 N/A GLN 65.A NE2 TYR 63.A OH no hydrogen 2.690 N/A GLN 65.A NE2 LEU 112.A O no hydrogen 3.108 N/A GLY 66.A N THR 45.A O no hydrogen 2.870 N/A THR 67.A OG1 ARG 84.A O no hydrogen 3.487 N/A THR 67.A OG1 PRO 85.A O no hydrogen 3.449 N/A GLY 68.A N GLN 65.A O no hydrogen 3.217 N/A ALA 70.A N TYR 63.A O no hydrogen 2.620 N/A ASP 71.A N TYR 63.A O no hydrogen 3.282 N/A SER 73.A N ASP 71.A OD1 no hydrogen 3.144 N/A SER 73.A OG ASP 71.A OD1 no hydrogen 3.132 N/A LEU 75.A N ASP 72.A O no hydrogen 3.265 N/A ARG 79.A N ASN 77.A OD1 no hydrogen 2.569 N/A ARG 79.A NE GLN 95.A O no hydrogen 2.831 N/A ARG 79.A NE ARG 96.A O no hydrogen 3.155 N/A ARG 79.A NH2 GLN 95.A O no hydrogen 3.555 N/A ARG 79.A NH2 ARG 96.A O no hydrogen 3.433 N/A ARG 79.A NH2 ASP 101.A OD1 no hydrogen 3.457 N/A ARG 79.A NH2 ASP 101.A OD2 no hydrogen 2.400 N/A PHE 80.A N ASN 77.A O no hydrogen 3.167 N/A PHE 81.A N LYS 93.A O no hydrogen 3.159 N/A VAL 83.A N THR 91.A O no hydrogen 2.977 N/A ARG 84.A NE GLY 66.A O no hydrogen 3.053 N/A ARG 84.A NH1 SER 88.A O no hydrogen 3.384 N/A ARG 84.A NH2 THR 45.A O no hydrogen 2.455 N/A ARG 84.A NH2 GLY 66.A O no hydrogen 3.104 N/A GLY 87.A N ARG 84.A O no hydrogen 2.834 N/A SER 90.A N CYS 38.A O no hydrogen 3.056 N/A SER 90.A OG VAL 83.A O no hydrogen 3.104 N/A THR 91.A N VAL 83.A O no hydrogen 2.830 N/A LEU 92.A N LEU 36.A O no hydrogen 2.912 N/A LYS 93.A N PHE 81.A O no hydrogen 2.855 N/A ILE 94.A N VAL 34.A O no hydrogen 2.890 N/A GLN 95.A N ARG 79.A O no hydrogen 3.110 N/A THR 97.A N LYS 32.A O no hydrogen 3.015 N/A THR 97.A OG1 GLU 29.A O no hydrogen 3.114 N/A THR 97.A OG1 LYS 32.A O no hydrogen 3.341 N/A GLU 98.A N ASP 101.A OD2 no hydrogen 3.389 N/A ASP 101.A N GLU 98.A O no hydrogen 2.805 N/A SER 102.A N ARG 99.A O no hydrogen 3.201 N/A SER 102.A OG ARG 99.A O no hydrogen 3.391 N/A SER 102.A OG LEU 124.A O no hydrogen 3.471 N/A ALA 103.A N LEU 124.A O no hydrogen 3.158 N/A VAL 104.A N GLN 52.A O no hydrogen 2.763 N/A TYR 105.A N THR 122.A O no hydrogen 2.915 N/A TYR 105.A OH ASP 101.A O no hydrogen 2.812 N/A LEU 106.A N TYR 50.A O no hydrogen 2.774 N/A CYS 107.A N GLN 21.A OE1 no hydrogen 3.098 N/A CYS 107.A SG TYR 48.A O no hydrogen 3.586 N/A ALA 108.A N TYR 48.A O no hydrogen 3.022 N/A THR 109.A N TYR 117.A O no hydrogen 2.854 N/A THR 109.A OG1 HIS 44.A ND1 no hydrogen 2.666 N/A SER 110.A N ALA 46.A O no hydrogen 3.023 N/A SER 110.A OG THR 115.A O no hydrogen 2.691 N/A GLY 113.A N SER 110.A OG no hydrogen 2.811 N/A ASP 114.A N ASP 114.A OD1 no hydrogen 2.638 N/A THR 115.A OG1 ASP 114.A OD2 no hydrogen 3.451 N/A GLN 116.A NE2 GLY 113.A O no hydrogen 3.414 N/A GLN 116.A NE2 ASP 114.A O no hydrogen 3.419 N/A TYR 117.A N THR 109.A O no hydrogen 2.904 N/A GLY 119.A N CYS 107.A O no hydrogen 2.725 N/A THR 122.A N TYR 105.A O no hydrogen 3.168 N/A THR 122.A OG1 PRO 23.A O no hydrogen 2.771 N/A ARG 123.A N SER 24.A O no hydrogen 2.727 N/A ARG 123.A NH1 ASN 25.A OD1 no hydrogen 3.405 N/A LEU 124.A N ALA 103.A O no hydrogen 2.884 N/A THR 125.A N LYS 26.A O no hydrogen 3.075 N/A VAL 126.A N SER 102.A OG no hydrogen 2.715 N/A LEU 127.A N THR 28.A O no hydrogen 2.702 N/A LYS 131.A N ASP 129.A OD1 no hydrogen 2.880 N/A ASN 132.A ND2 ASP 198.A O no hydrogen 3.479 N/A VAL 133.A N LEU 130.A O no hydrogen 3.489 N/A PHE 134.A N TYR 164.A O no hydrogen 2.996 N/A GLU 137.A N THR 161.A O no hydrogen 2.762 N/A ALA 139.A N LEU 159.A O no hydrogen 2.996 N/A PHE 141.A N VAL 157.A O no hydrogen 2.741 N/A GLU 147.A N SER 144.A OG no hydrogen 2.995 N/A ILE 148.A N SER 144.A O no hydrogen 3.300 N/A SER 149.A N GLU 145.A O no hydrogen 3.156 N/A SER 149.A OG ALA 146.A O no hydrogen 3.201 N/A HIS 150.A N ALA 146.A O no hydrogen 3.004 N/A THR 151.A N GLU 147.A O no hydrogen 2.861 N/A THR 151.A OG1 GLU 147.A O no hydrogen 2.907 N/A GLN 152.A N ILE 148.A O no hydrogen 2.649 N/A GLN 152.A NE2 SER 149.A O no hydrogen 3.139 N/A LYS 153.A N THR 151.A OG1 no hydrogen 2.951 N/A ALA 154.A N VAL 209.A O no hydrogen 2.755 N/A THR 155.A N GLU 147.A OE2 no hydrogen 2.794 N/A THR 155.A OG1 GLU 147.A OE1 no hydrogen 2.464 N/A THR 155.A OG1 GLU 147.A OE2 no hydrogen 3.519 N/A LEU 156.A N LEU 207.A O no hydrogen 2.791 N/A VAL 157.A N PHE 141.A O no hydrogen 3.101 N/A CYS 158.A N SER 205.A O no hydrogen 2.897 N/A CYS 158.A SG ALA 139.A O no hydrogen 3.817 N/A LEU 159.A N ALA 139.A O no hydrogen 2.854 N/A ALA 160.A N LEU 203.A O no hydrogen 2.943 N/A THR 161.A N GLU 137.A O no hydrogen 2.865 N/A GLY 162.A N GLU 192.A OE2 no hydrogen 2.934 N/A PHE 163.A N TYR 201.A O no hydrogen 3.288 N/A TYR 164.A N PHE 134.A O no hydrogen 3.023 N/A HIS 167.A N PRO 165.A O no hydrogen 2.954 N/A GLU 169.A N GLN 226.A O no hydrogen 2.972 N/A SER 171.A N GLN 224.A O no hydrogen 2.729 N/A TRP 172.A NE1 SER 205.A OG no hydrogen 2.908 N/A TRP 173.A N ARG 222.A O no hydrogen 2.888 N/A TRP 173.A NE1 SER 171.A OG no hydrogen 2.954 N/A VAL 174.A N LYS 177.A O no hydrogen 3.209 N/A ASN 175.A N HIS 220.A O no hydrogen 2.985 N/A ASN 175.A ND2 ASN 219.A OD1 no hydrogen 3.041 N/A VAL 179.A N TRP 172.A O no hydrogen 2.843 N/A VAL 183.A N HIS 180.A O no hydrogen 3.386 N/A CYS 184.A N ARG 206.A O no hydrogen 2.829 N/A THR 185.A OG1 SER 205.A OG no hydrogen 2.860 N/A ASP 186.A N SER 204.A O no hydrogen 3.053 N/A LEU 190.A N SER 202.A O no hydrogen 3.070 N/A LYS 191.A NZ LEU 196.A O no hydrogen 3.324 N/A GLU 192.A N ARG 200.A O no hydrogen 2.900 N/A LEU 196.A N GLN 193.A O no hydrogen 3.256 N/A SER 199.A OG GLN 193.A O no hydrogen 3.395 N/A SER 199.A OG ARG 200.A O no hydrogen 2.869 N/A ARG 200.A NE GLY 162.A O no hydrogen 2.823 N/A TYR 201.A N PHE 163.A O no hydrogen 2.782 N/A SER 202.A N LEU 190.A O no hydrogen 3.130 N/A LEU 203.A N ALA 160.A O no hydrogen 2.761 N/A SER 204.A N ASP 186.A OD2 no hydrogen 2.834 N/A SER 204.A OG ASP 186.A OD1 no hydrogen 3.053 N/A SER 204.A OG ASP 186.A OD2 no hydrogen 2.422 N/A SER 205.A N CYS 158.A O no hydrogen 3.148 N/A SER 205.A OG CYS 184.A O no hydrogen 3.125 N/A SER 205.A OG THR 185.A OG1 no hydrogen 2.860 N/A ARG 206.A N CYS 184.A O no hydrogen 2.758 N/A LEU 207.A N LEU 156.A O no hydrogen 3.066 N/A ARG 208.A N GLY 182.A O no hydrogen 2.774 N/A ARG 208.A NE GLU 147.A OE1 no hydrogen 3.261 N/A ARG 208.A NH2 GLU 147.A OE1 no hydrogen 3.279 N/A VAL 209.A N ALA 154.A O no hydrogen 2.965 N/A ALA 211.A N GLN 152.A O no hydrogen 3.161 N/A PHE 213.A N SER 210.A O no hydrogen 3.075 N/A TRP 214.A N SER 210.A O no hydrogen 3.179 N/A GLN 215.A N ALA 211.A O no hydrogen 2.787 N/A ARG 218.A N ASN 216.A OD1 no hydrogen 3.084 N/A ASN 219.A N ASN 216.A O no hydrogen 2.922 N/A ASN 219.A ND2 PHE 213.A O no hydrogen 2.774 N/A HIS 220.A N ASN 175.A OD1 no hydrogen 2.824 N/A PHE 221.A N ALA 252.A O no hydrogen 2.875 N/A ARG 222.A N TRP 173.A O no hydrogen 2.810 N/A CYS 223.A N ALA 250.A O no hydrogen 2.909 N/A GLN 224.A N SER 171.A O no hydrogen 2.844 N/A VAL 225.A N VAL 248.A O no hydrogen 3.013 N/A GLN 226.A N GLU 169.A O no hydrogen 2.851 N/A PHE 227.A N GLN 246.A O no hydrogen 2.774 N/A TYR 228.A OH GLU 169.A OE1 no hydrogen 2.700 N/A GLY 229.A N THR 245.A OG1 no hydrogen 3.012 N/A LEU 230.A N PRO 243.A O no hydrogen 3.154 N/A SER 231.A N ASP 234.A OD1 no hydrogen 2.495 N/A SER 231.A OG ASN 233.A OD1 no hydrogen 2.461 N/A SER 231.A OG ASP 234.A OD1 no hydrogen 2.725 N/A ASP 234.A N SER 231.A O no hydrogen 3.412 N/A TRP 236.A NE1 ARG 240.A O no hydrogen 2.737 N/A GLN 238.A NE2 THR 237.A O no hydrogen 3.632 N/A ARG 240.A NH1 VAL 133.A O no hydrogen 2.983 N/A ARG 240.A NH2 LYS 131.A O no hydrogen 3.191 N/A ARG 240.A NH2 VAL 133.A O no hydrogen 2.820 N/A LYS 242.A NZ GLU 232.A O no hydrogen 2.787 N/A LYS 242.A NZ ASP 234.A O no hydrogen 2.754 N/A VAL 244.A N LYS 242.A O no hydrogen 2.759 N/A THR 245.A N LEU 230.A O no hydrogen 2.774 N/A THR 245.A OG1 GLY 229.A O no hydrogen 3.262 N/A GLN 246.A N PHE 227.A O no hydrogen 3.055 N/A GLN 246.A NE2 VAL 244.A O no hydrogen 2.849 N/A VAL 248.A N VAL 225.A O no hydrogen 3.024 N/A ALA 250.A N CYS 223.A O no hydrogen 3.039 N/A ALA 252.A N PHE 221.A O no hydrogen 3.127 N/A GLY 254.A N ASN 219.A O no hydrogen 2.931 N/A