Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5lu8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A ND1 GLY 259.A O no hydrogen 2.670 N/A TRP 5.A N HIS 115.A O no hydrogen 2.864 N/A TRP 5.A NE1 ASP 114.A OD1 no hydrogen 2.979 N/A VAL 6.A N GLN 40.A O no hydrogen 2.941 N/A VAL 7.A N PHE 117.A O no hydrogen 2.909 N/A ILE 8.A N VAL 42.A O no hydrogen 2.760 N/A VAL 9.A N TYR 119.A O no hydrogen 2.909 N/A ALA 10.A N MET 44.A O no hydrogen 2.922 N/A GLY 11.A N THR 121.A O no hydrogen 2.950 N/A SER 12.A OG HIS 20.A ND1 no hydrogen 2.662 N/A GLY 14.A N ASP 48.A OD2 no hydrogen 2.899 N/A TRP 15.A NE1 ARG 199.A O no hydrogen 2.900 N/A ASN 17.A N GLY 14.A O no hydrogen 2.886 N/A ASN 17.A ND2 ASN 13.A O no hydrogen 2.886 N/A TYR 18.A N TRP 15.A O no hydrogen 3.133 N/A ARG 19.A NE ASP 205.A OD2 no hydrogen 2.983 N/A HIS 20.A N ASN 17.A O no hydrogen 3.130 N/A HIS 20.A ND1 SER 12.A OG no hydrogen 2.662 N/A GLN 21.A NE2 SER 12.A O no hydrogen 3.685 N/A GLN 21.A NE2 ASP 48.A OD1 no hydrogen 2.730 N/A ALA 22.A N TYR 18.A O no hydrogen 2.994 N/A ASP 23.A N ARG 19.A O no hydrogen 2.755 N/A ALA 24.A N HIS 20.A O no hydrogen 3.064 N/A CYS 25.A N GLN 21.A O no hydrogen 2.925 N/A CYS 25.A SG GLN 21.A O no hydrogen 3.233 N/A HIS 26.A N ALA 22.A O no hydrogen 2.999 N/A HIS 26.A ND1 ASN 63.A OD1 no hydrogen 2.683 N/A HIS 26.A NE2 ASP 216.A OD2 no hydrogen 2.621 N/A ALA 27.A N ASP 23.A O no hydrogen 2.938 N/A TYR 28.A N ALA 24.A O no hydrogen 2.977 N/A TYR 28.A OH ASP 38.A OD1 no hydrogen 2.734 N/A GLN 29.A N CYS 25.A O no hydrogen 3.083 N/A GLN 29.A NE2 VAL 70.A O no hydrogen 2.804 N/A GLN 29.A NE2 GLN 72.A O no hydrogen 2.919 N/A ILE 30.A N HIS 26.A O no hydrogen 3.128 N/A ILE 31.A N ALA 27.A O no hydrogen 3.125 N/A HIS 32.A N TYR 28.A O no hydrogen 2.903 N/A ARG 33.A N GLN 29.A O no hydrogen 2.858 N/A ARG 33.A NH1 ARG 33.A O no hydrogen 3.127 N/A ASN 34.A N ILE 30.A O no hydrogen 3.035 N/A ASN 34.A N ILE 31.A O no hydrogen 3.300 N/A ASN 34.A ND2 ILE 30.A O no hydrogen 2.860 N/A GLY 35.A N HIS 32.A O no hydrogen 3.239 N/A ILE 36.A N ILE 31.A O no hydrogen 3.347 N/A GLN 40.A N PRO 37.A O no hydrogen 2.934 N/A ILE 41.A N ASP 38.A O no hydrogen 3.030 N/A VAL 42.A N VAL 6.A O no hydrogen 2.813 N/A VAL 43.A N ASP 77.A OD2 no hydrogen 3.041 N/A MET 44.A N ILE 8.A O no hydrogen 2.708 N/A MET 45.A N TYR 78.A O no hydrogen 3.097 N/A ASP 47.A N GLN 21.A OE1 no hydrogen 2.776 N/A SER 52.A N ILE 49.A O no hydrogen 3.104 N/A ASP 54.A N SER 52.A OG no hydrogen 2.847 N/A ASN 55.A N SER 52.A O no hydrogen 2.916 N/A ASN 55.A ND2 ILE 49.A O no hydrogen 3.577 N/A ASN 55.A ND2 ALA 50.A O no hydrogen 2.963 N/A ASN 55.A ND2 ILE 60.A O no hydrogen 3.069 N/A THR 57.A N ASN 55.A OD1 no hydrogen 3.060 N/A THR 57.A OG1 ASN 55.A OD1 no hydrogen 3.312 N/A GLY 59.A N ALA 50.A O no hydrogen 2.800 N/A ILE 60.A N THR 57.A O no hydrogen 3.018 N/A VAL 61.A N ASP 69.A OD1 no hydrogen 3.006 N/A ILE 62.A N TYR 18.A OH no hydrogen 2.959 N/A ASN 63.A ND2 ASP 23.A OD1 no hydrogen 3.016 N/A ASN 63.A ND2 LEU 203.A O no hydrogen 2.835 N/A GLY 67.A N ARG 64.A O no hydrogen 2.798 N/A VAL 70.A N VAL 61.A O no hydrogen 2.848 N/A TYR 71.A N ASP 69.A OD1 no hydrogen 3.173 N/A TYR 71.A OH ASP 47.A OD1 no hydrogen 2.698 N/A GLN 72.A N ASP 69.A OD2 no hydrogen 3.032 N/A VAL 74.A N TYR 71.A O no hydrogen 3.115 N/A LYS 76.A NZ TYR 71.A OH no hydrogen 3.416 N/A TYR 78.A N VAL 43.A O no hydrogen 3.305 N/A TYR 78.A OH LYS 106.A O no hydrogen 2.598 N/A GLY 80.A N TYR 46.A O no hydrogen 2.869 N/A ASP 82.A N THR 79.A O no hydrogen 2.972 N/A VAL 83.A N GLY 80.A O no hydrogen 3.266 N/A GLN 86.A NE2 GLU 133.A OE2 no hydrogen 3.077 N/A ASN 87.A N THR 84.A OG1 no hydrogen 3.018 N/A ASN 87.A ND2 ASP 82.A O no hydrogen 2.914 N/A PHE 88.A N THR 84.A O no hydrogen 2.950 N/A LEU 89.A N PRO 85.A O no hydrogen 2.864 N/A ALA 90.A N GLN 86.A O no hydrogen 2.986 N/A VAL 91.A N ASN 87.A O no hydrogen 2.994 N/A LEU 92.A N PHE 88.A O no hydrogen 3.069 N/A ARG 93.A N LEU 89.A O no hydrogen 2.955 N/A ARG 93.A NH2 ASP 95.A OD2 no hydrogen 3.095 N/A GLY 94.A N VAL 91.A O no hydrogen 3.202 N/A ASP 95.A N ALA 90.A O no hydrogen 2.831 N/A ALA 96.A N GLY 94.A O no hydrogen 3.069 N/A ALA 98.A N ASP 95.A O no hydrogen 2.997 N/A ALA 98.A N ASP 95.A OD1 no hydrogen 3.274 N/A VAL 99.A N ALA 96.A O no hydrogen 3.018 N/A LYS 100.A N GLU 97.A O no hydrogen 3.437 N/A ILE 102.A N VAL 99.A O no hydrogen 3.043 N/A SER 104.A N ASP 77.A O no hydrogen 2.852 N/A SER 104.A OG ASP 77.A OD1 no hydrogen 2.854 N/A LYS 106.A N SER 104.A OG no hydrogen 3.221 N/A LYS 106.A NZ GLU 39.A O no hydrogen 2.761 N/A LEU 108.A N VAL 91.A O no hydrogen 3.049 N/A SER 110.A OG MET 152.A O no hydrogen 2.664 N/A GLY 111.A N ASP 114.A OD1 no hydrogen 2.798 N/A ASP 114.A N GLY 111.A O no hydrogen 3.240 N/A HIS 115.A N LYS 3.A O no hydrogen 2.854 N/A VAL 116.A N LYS 155.A O no hydrogen 2.994 N/A PHE 117.A N TRP 5.A O no hydrogen 2.902 N/A ILE 118.A N VAL 157.A O no hydrogen 2.806 N/A TYR 119.A N VAL 7.A O no hydrogen 2.925 N/A TYR 119.A OH SER 208.A OG no hydrogen 2.721 N/A PHE 120.A N TYR 159.A O no hydrogen 3.035 N/A THR 121.A N VAL 9.A O no hydrogen 2.893 N/A THR 121.A OG1 ASP 23.A OD2 no hydrogen 3.085 N/A HIS 122.A NE2 ASN 17.A OD1 no hydrogen 2.787 N/A SER 124.A N ILE 127.A O no hydrogen 2.973 N/A GLY 126.A N SER 167.A OG no hydrogen 2.733 N/A ILE 127.A N SER 124.A O no hydrogen 2.969 N/A LEU 128.A N LEU 135.A O no hydrogen 2.936 N/A VAL 129.A N HIS 122.A O no hydrogen 2.990 N/A PHE 130.A N ASP 134.A OD1 no hydrogen 3.218 N/A LEU 135.A N LEU 128.A O no hydrogen 2.839 N/A VAL 137.A N GLY 126.A O no hydrogen 2.879 N/A LEU 140.A N HIS 136.A O no hydrogen 3.191 N/A ASN 141.A N VAL 137.A O no hydrogen 2.833 N/A GLU 142.A N LYS 138.A O no hydrogen 2.935 N/A THR 143.A N ASP 139.A O no hydrogen 3.029 N/A THR 143.A OG1 ASP 139.A O no hydrogen 3.283 N/A ILE 144.A N LEU 140.A O no hydrogen 2.813 N/A HIS 145.A N ASN 141.A O no hydrogen 3.088 N/A TYR 146.A N GLU 142.A O no hydrogen 3.017 N/A MET 147.A N THR 143.A O no hydrogen 2.966 N/A TYR 148.A N ILE 144.A O no hydrogen 3.070 N/A LYS 149.A N HIS 145.A O no hydrogen 2.866 N/A HIS 150.A N TYR 146.A O no hydrogen 2.842 N/A HIS 150.A ND1 TYR 146.A O no hydrogen 3.111 N/A LYS 151.A N TYR 148.A O no hydrogen 3.070 N/A MET 152.A N MET 147.A O no hydrogen 2.892 N/A TYR 153.A OH ILE 176.A O no hydrogen 2.700 N/A ARG 154.A N ASP 114.A O no hydrogen 2.756 N/A ARG 154.A NH1 GLN 113.A OE1 no hydrogen 3.369 N/A LYS 155.A N ASP 114.A O no hydrogen 3.343 N/A MET 156.A N ASN 177.A O no hydrogen 3.078 N/A VAL 157.A N VAL 116.A O no hydrogen 2.777 N/A PHE 158.A N TYR 179.A O no hydrogen 2.993 N/A TYR 159.A N ILE 118.A O no hydrogen 2.828 N/A TYR 159.A OH GLN 228.A OE1 no hydrogen 2.821 N/A ILE 160.A N THR 181.A O no hydrogen 3.067 N/A GLU 161.A N PHE 120.A O no hydrogen 2.841 N/A CYS 163.A SG SER 190.A O no hydrogen 3.771 N/A GLU 164.A N GLU 188.A O no hydrogen 2.682 N/A SER 165.A N ALA 162.A O no hydrogen 3.175 N/A SER 165.A OG ALA 162.A O no hydrogen 2.734 N/A GLY 166.A N ALA 184.A O no hydrogen 2.929 N/A SER 167.A N GLU 164.A O no hydrogen 2.842 N/A SER 167.A OG GLU 164.A O no hydrogen 2.746 N/A MET 168.A N SER 165.A O no hydrogen 2.909 N/A MET 169.A N GLY 166.A O no hydrogen 3.204 N/A LEU 172.A N MET 169.A O no hydrogen 3.172 N/A TYR 179.A N MET 156.A O no hydrogen 2.932 N/A TYR 179.A OH GLN 243.A OE1 no hydrogen 2.678 N/A ALA 180.A N TYR 244.A O no hydrogen 3.015 N/A THR 181.A N PHE 158.A O no hydrogen 2.912 N/A THR 182.A N MET 242.A O no hydrogen 2.909 N/A THR 182.A OG1 ALA 184.A O no hydrogen 2.934 N/A ALA 183.A N ILE 160.A O no hydrogen 2.960 N/A ALA 184.A N SER 165.A OG no hydrogen 3.139 N/A ASN 185.A N GLU 188.A OE2 no hydrogen 2.995 N/A ARG 187.A N ASN 185.A OD1 no hydrogen 2.917 N/A GLU 188.A N ASN 185.A O no hydrogen 3.392 N/A SER 190.A OG GLU 161.A OE2 no hydrogen 2.951 N/A CYS 193.A N GLY 204.A O no hydrogen 2.919 N/A TYR 194.A OH GLU 213.A OE2 no hydrogen 2.640 N/A ASP 196.A N THR 201.A O no hydrogen 2.838 N/A ARG 199.A N ASP 196.A OD2 no hydrogen 2.976 N/A ARG 199.A NH1 ASP 196.A OD2 no hydrogen 3.017 N/A ARG 199.A NH2 THR 57.A OG1 no hydrogen 3.122 N/A SER 200.A N GLU 197.A O no hydrogen 3.285 N/A SER 200.A OG GLU 197.A O no hydrogen 3.558 N/A THR 201.A N ASP 196.A O no hydrogen 3.309 N/A THR 201.A OG1 TRP 15.A O no hydrogen 3.230 N/A LEU 203.A N TYR 194.A O no hydrogen 2.861 N/A GLY 204.A N CYS 193.A O no hydrogen 3.413 N/A TRP 206.A N TYR 191.A O no hydrogen 3.073 N/A SER 208.A N GLU 161.A OE1 no hydrogen 2.891 N/A SER 208.A OG TYR 119.A OH no hydrogen 2.721 N/A SER 208.A OG GLU 161.A OE1 no hydrogen 2.741 N/A VAL 209.A N ASP 205.A O no hydrogen 2.807 N/A ASN 210.A N TRP 206.A O no hydrogen 3.000 N/A ASN 210.A ND2 HIS 235.A O no hydrogen 3.064 N/A ASN 210.A ND2 THR 236.A OG1 no hydrogen 3.054 N/A TRP 211.A N TYR 207.A O no hydrogen 3.159 N/A MET 212.A N SER 208.A O no hydrogen 3.018 N/A GLU 213.A N VAL 209.A O no hydrogen 2.929 N/A ASP 214.A N ASN 210.A O no hydrogen 3.240 N/A SER 215.A N TRP 211.A O no hydrogen 2.921 N/A SER 215.A OG TRP 211.A O no hydrogen 3.391 N/A SER 215.A OG GLN 258.A OE1 no hydrogen 2.599 N/A ASP 216.A N MET 212.A O no hydrogen 2.891 N/A VAL 217.A N ASP 214.A O no hydrogen 3.059 N/A GLU 218.A N ASP 214.A O no hydrogen 2.992 N/A THR 221.A N ASP 219.A OD1 no hydrogen 3.166 N/A THR 221.A OG1 ASP 219.A OD1 no hydrogen 2.544 N/A LYS 222.A N ASP 219.A O no hydrogen 3.163 N/A GLU 223.A N ASP 219.A O no hydrogen 3.044 N/A LEU 225.A N MET 252.A O no hydrogen 2.870 N/A HIS 226.A N SER 250.A O no hydrogen 2.754 N/A LYS 227.A N THR 224.A OG1 no hydrogen 3.005 N/A LYS 227.A NZ GLU 218.A OE1 no hydrogen 3.316 N/A GLN 228.A N THR 224.A O no hydrogen 3.050 N/A GLN 228.A NE2 ASP 214.A OD2 no hydrogen 2.800 N/A GLN 228.A NE2 SER 215.A OG no hydrogen 3.081 N/A TYR 229.A N LEU 225.A O no hydrogen 2.777 N/A TYR 229.A OH VAL 241.A O no hydrogen 2.888 N/A HIS 230.A N HIS 226.A O no hydrogen 2.981 N/A LEU 231.A N LYS 227.A O no hydrogen 2.912 N/A VAL 232.A N GLN 228.A O no hydrogen 2.803 N/A LYS 233.A N TYR 229.A O no hydrogen 2.813 N/A SER 234.A N HIS 230.A O no hydrogen 2.887 N/A SER 234.A OG HIS 230.A O no hydrogen 2.264 N/A HIS 235.A N LEU 231.A O no hydrogen 3.176 N/A HIS 235.A N VAL 232.A O no hydrogen 3.189 N/A HIS 235.A ND1 LEU 231.A O no hydrogen 2.529 N/A THR 236.A N LYS 233.A O no hydrogen 3.327 N/A THR 236.A OG1 VAL 232.A O no hydrogen 2.843 N/A SER 239.A OG ALA 183.A O no hydrogen 2.464 N/A HIS 240.A N GLU 188.A OE2 no hydrogen 2.639 N/A HIS 240.A ND1 GLU 188.A OE1 no hydrogen 2.690 N/A HIS 240.A ND1 GLU 188.A OE2 no hydrogen 3.133 N/A MET 242.A N THR 182.A O no hydrogen 2.979 N/A TYR 244.A N ALA 180.A O no hydrogen 2.803 N/A ASN 246.A N VAL 178.A O no hydrogen 2.989 N/A THR 248.A N ASN 246.A OD1 no hydrogen 3.112 N/A THR 248.A OG1 ASN 246.A OD1 no hydrogen 2.738 N/A ILE 249.A N ASN 246.A O no hydrogen 3.197 N/A SER 250.A N LYS 247.A O no hydrogen 2.946 N/A SER 250.A OG LYS 247.A O no hydrogen 2.484 N/A THR 251.A N THR 248.A O no hydrogen 2.979 N/A THR 251.A OG1 THR 248.A O no hydrogen 2.598 N/A MET 252.A N ILE 249.A O no hydrogen 2.977 N/A VAL 254.A N GLU 223.A O no hydrogen 2.884 N/A MET 255.A N LEU 220.A O no hydrogen 3.141 N/A GLN 256.A N LYS 253.A O no hydrogen 2.988 N/A PHE 257.A N VAL 254.A O no hydrogen 3.018 N/A GLN 258.A N VAL 254.A O no hydrogen 2.924 N/A GLN 258.A NE2 GLN 228.A OE1 no hydrogen 3.175 N/A GLY 259.A N MET 255.A O no hydrogen 3.062 N/A MET 260.A N ASN 34.A O no hydrogen 2.987 N/A