Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ql6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLU 84.A O no hydrogen 2.497 N/A PHE 5.A N SER 1.A O no hydrogen 2.543 N/A TYR 6.A N THR 2.A O no hydrogen 2.701 N/A GLU 7.A N HIS 3.A O no hydrogen 2.370 N/A ASN 8.A N GLY 4.A O no hydrogen 2.895 N/A ASN 8.A N PHE 5.A O no hydrogen 3.023 N/A ASN 8.A ND2 TYR 83.A OH no hydrogen 3.398 N/A TYR 9.A N PHE 5.A O no hydrogen 2.791 N/A TYR 9.A OH ASP 81.A OD2 no hydrogen 3.106 N/A GLU 10.A N ILE 27.A O no hydrogen 2.888 N/A LYS 12.A N ARG 25.A O no hydrogen 2.589 N/A LYS 12.A NZ GLU 10.A OE2 no hydrogen 3.386 N/A GLU 13.A N GLU 13.A OE1 no hydrogen 2.924 N/A LEU 15.A N VAL 23.A O no hydrogen 2.932 N/A GLY 18.A N SER 21.A O no hydrogen 2.882 N/A SER 21.A N GLY 18.A O no hydrogen 3.441 N/A VAL 22.A N ILE 39.A O no hydrogen 3.219 N/A VAL 23.A N GLY 16.A O no hydrogen 2.797 N/A ARG 24.A N VAL 37.A O no hydrogen 2.853 N/A ARG 24.A NH1 LYS 12.A O no hydrogen 2.806 N/A ARG 25.A N GLU 13.A O no hydrogen 2.928 N/A ARG 25.A NE GLU 13.A OE1 no hydrogen 3.020 N/A ARG 25.A NE GLU 13.A OE2 no hydrogen 2.789 N/A ARG 25.A NH1 GLU 34.A OE1 no hydrogen 2.701 N/A ARG 25.A NH2 GLU 13.A OE1 no hydrogen 2.784 N/A CYS 26.A N TYR 35.A O no hydrogen 3.045 N/A ILE 27.A N GLU 10.A O no hydrogen 2.705 N/A HIS 28.A N LYS 33.A O no hydrogen 2.888 N/A HIS 28.A ND1 THR 31.A OG1 no hydrogen 2.871 N/A LYS 29.A N ASN 8.A O no hydrogen 2.849 N/A LYS 29.A NZ TYR 6.A O no hydrogen 2.997 N/A THR 31.A OG1 HIS 28.A ND1 no hydrogen 2.871 N/A CYS 32.A N HIS 28.A O no hydrogen 2.583 N/A LYS 33.A N THR 31.A OG1 no hydrogen 3.380 N/A TYR 35.A N CYS 26.A O no hydrogen 3.000 N/A ALA 36.A N PHE 93.A O no hydrogen 2.795 N/A VAL 37.A N ARG 24.A O no hydrogen 2.900 N/A LYS 38.A N LEU 91.A O no hydrogen 2.588 N/A LYS 38.A NZ GLU 63.A OE1 no hydrogen 3.554 N/A LYS 38.A NZ GLU 63.A OE2 no hydrogen 3.100 N/A ILE 39.A N VAL 22.A O no hydrogen 2.709 N/A ILE 40.A N PHE 89.A O no hydrogen 2.794 N/A ASP 41.A N SER 20.A O no hydrogen 3.057 N/A VAL 42.A N THR 87.A O no hydrogen 2.620 N/A GLY 45.A N ASP 41.A OD2 no hydrogen 2.426 N/A SER 47.A OG GLY 44.A O no hydrogen 2.565 N/A VAL 53.A N SER 49.A O no hydrogen 3.286 N/A GLN 54.A N ALA 50.A O no hydrogen 3.434 N/A GLN 54.A N GLU 51.A O no hydrogen 3.010 N/A GLU 55.A N GLU 51.A O no hydrogen 3.105 N/A GLU 55.A N GLU 52.A O no hydrogen 2.816 N/A LEU 56.A N GLU 52.A O no hydrogen 2.673 N/A ARG 57.A N VAL 53.A O no hydrogen 2.899 N/A ARG 57.A NE GLU 84.A OE2 no hydrogen 2.818 N/A ARG 57.A NH2 GLU 84.A OE1 no hydrogen 3.266 N/A ARG 57.A NH2 GLU 84.A OE2 no hydrogen 3.135 N/A GLU 58.A N GLN 54.A O no hydrogen 3.366 N/A ALA 59.A N LEU 56.A O no hydrogen 3.190 N/A THR 60.A N LEU 56.A O no hydrogen 3.194 N/A THR 60.A OG1 LEU 56.A O no hydrogen 3.166 N/A LEU 61.A N ARG 57.A O no hydrogen 3.114 N/A LYS 62.A N GLU 58.A O no hydrogen 3.171 N/A GLU 63.A N ALA 59.A O no hydrogen 2.907 N/A VAL 64.A N THR 60.A O no hydrogen 2.912 N/A ASP 65.A N LEU 61.A O no hydrogen 3.133 N/A ILE 66.A N LYS 62.A O no hydrogen 2.868 N/A LEU 67.A N GLU 63.A O no hydrogen 2.949 N/A ARG 68.A N VAL 64.A O no hydrogen 2.817 N/A LYS 69.A N ASP 65.A O no hydrogen 2.966 N/A LYS 69.A NZ GLN 163.A OE1 no hydrogen 2.517 N/A VAL 70.A N ILE 66.A O no hydrogen 3.046 N/A SER 71.A OG LEU 67.A O no hydrogen 2.916 N/A SER 71.A OG ARG 68.A O no hydrogen 3.519 N/A ASN 75.A N HIS 73.A ND1 no hydrogen 3.024 N/A ILE 76.A N HIS 73.A O no hydrogen 3.420 N/A ILE 77.A N LEU 155.A O no hydrogen 2.822 N/A LYS 80.A N VAL 92.A O no hydrogen 2.712 N/A ASP 81.A N VAL 92.A O no hydrogen 3.331 N/A TYR 83.A N PHE 90.A O no hydrogen 3.395 N/A TYR 83.A OH ASP 81.A OD2 no hydrogen 2.439 N/A THR 85.A N PHE 88.A O no hydrogen 2.926 N/A THR 85.A OG1 PHE 88.A O no hydrogen 3.535 N/A ASN 86.A ND2 ASN 86.A O no hydrogen 3.234 N/A THR 87.A N THR 85.A OG1 no hydrogen 3.343 N/A PHE 88.A N THR 85.A OG1 no hydrogen 3.235 N/A PHE 89.A N ILE 40.A O no hydrogen 2.814 N/A PHE 90.A N TYR 83.A O no hydrogen 2.976 N/A LEU 91.A N LYS 38.A O no hydrogen 2.748 N/A VAL 92.A N ASP 81.A O no hydrogen 2.793 N/A PHE 93.A N ALA 36.A O no hydrogen 2.532 N/A LYS 98.A N LEU 147.A O no hydrogen 3.134 N/A GLU 100.A N ASP 103.A OD2 no hydrogen 2.947 N/A LEU 101.A N ILE 145.A O no hydrogen 2.889 N/A PHE 102.A N PRO 142.A O no hydrogen 3.197 N/A TYR 104.A N GLU 100.A O no hydrogen 2.916 N/A TYR 104.A OH GLU 115.A OE1 no hydrogen 3.001 N/A TYR 104.A OH GLU 115.A OE2 no hydrogen 2.531 N/A LEU 105.A N LEU 101.A O no hydrogen 2.713 N/A THR 106.A N PHE 102.A O no hydrogen 2.989 N/A THR 106.A OG1 PHE 102.A O no hydrogen 3.249 N/A GLU 107.A N ASP 103.A O no hydrogen 3.398 N/A LYS 108.A N TYR 104.A O no hydrogen 3.292 N/A LYS 108.A N LEU 105.A O no hydrogen 3.245 N/A LYS 108.A NZ TYR 104.A OH no hydrogen 3.156 N/A LYS 108.A NZ GLU 115.A OE1 no hydrogen 3.193 N/A VAL 109.A N LEU 105.A O no hydrogen 2.870 N/A THR 110.A N LYS 108.A O no hydrogen 2.814 N/A LEU 111.A N LEU 212.A O no hydrogen 2.846 N/A GLU 115.A N SER 112.A OG no hydrogen 3.334 N/A THR 116.A N SER 112.A O no hydrogen 3.006 N/A THR 116.A OG1 SER 112.A O no hydrogen 2.967 N/A ARG 117.A N GLU 113.A O no hydrogen 2.895 N/A LYS 118.A N LYS 114.A O no hydrogen 3.179 N/A LYS 118.A NZ ASN 152.A OD1 no hydrogen 3.226 N/A ILE 119.A N GLU 115.A O no hydrogen 3.095 N/A MET 120.A N THR 116.A O no hydrogen 2.970 N/A ARG 121.A N ARG 117.A O no hydrogen 3.173 N/A ARG 121.A NH1 PHE 277.A O no hydrogen 3.548 N/A ALA 122.A N LYS 118.A O no hydrogen 3.287 N/A LEU 123.A N ILE 119.A O no hydrogen 2.999 N/A LEU 124.A N MET 120.A O no hydrogen 2.943 N/A GLU 125.A N ARG 121.A O no hydrogen 3.158 N/A VAL 126.A N ALA 122.A O no hydrogen 3.263 N/A ILE 127.A N LEU 123.A O no hydrogen 2.990 N/A CYS 128.A N LEU 124.A O no hydrogen 2.784 N/A CYS 128.A SG GLU 269.A OE2 no hydrogen 2.898 N/A ALA 129.A N GLU 125.A O no hydrogen 3.153 N/A LEU 130.A N VAL 126.A O no hydrogen 3.024 N/A LEU 130.A N ILE 127.A O no hydrogen 3.089 N/A HIS 131.A N ILE 127.A O no hydrogen 2.951 N/A HIS 131.A NE2 ASP 201.A OD2 no hydrogen 2.985 N/A LYS 132.A N CYS 128.A O no hydrogen 3.243 N/A ASN 134.A N HIS 131.A O no hydrogen 2.649 N/A ASN 134.A ND2 LEU 164.A O no hydrogen 2.566 N/A ILE 135.A N LEU 130.A O no hydrogen 2.765 N/A VAL 136.A N CYS 162.A O no hydrogen 2.896 N/A HIS 137.A N ASP 201.A OD2 no hydrogen 2.780 N/A HIS 137.A NE2 THR 156.A O no hydrogen 3.013 N/A ARG 138.A N ASP 201.A OD1 no hydrogen 2.900 N/A ARG 138.A NE PHE 160.A O no hydrogen 2.694 N/A ARG 138.A NH1 TYR 196.A OH no hydrogen 3.075 N/A ARG 138.A NH2 PHE 160.A O no hydrogen 2.952 N/A ASP 139.A N HIS 137.A ND1 no hydrogen 3.044 N/A LYS 141.A NZ ASP 139.A OD1 no hydrogen 3.083 N/A LYS 141.A NZ THR 176.A OG1 no hydrogen 2.780 N/A ASN 144.A N LYS 141.A O no hydrogen 3.096 N/A ASN 144.A ND2 ASP 139.A O no hydrogen 2.752 N/A LEU 146.A N LYS 154.A O no hydrogen 3.014 N/A LEU 147.A N GLY 99.A O no hydrogen 2.676 N/A ASP 148.A N ASN 152.A O no hydrogen 2.939 N/A ASP 150.A N ASP 148.A OD1 no hydrogen 2.731 N/A MET 151.A N ASP 148.A O no hydrogen 2.919 N/A ASN 152.A N ASP 148.A OD1 no hydrogen 3.352 N/A LYS 154.A N LEU 146.A O no hydrogen 2.837 N/A LYS 154.A NZ PRO 74.A O no hydrogen 2.888 N/A LEU 155.A N ASN 75.A O no hydrogen 2.811 N/A THR 156.A N ASN 144.A O no hydrogen 2.876 N/A SER 161.A N PHE 158.A O no hydrogen 3.099 N/A SER 161.A OG PHE 158.A O no hydrogen 3.020 N/A CYS 162.A N VAL 136.A O no hydrogen 3.345 N/A GLN 163.A NE2 LEU 133.A O no hydrogen 2.705 N/A LEU 164.A N ASN 134.A O no hydrogen 2.569 N/A ASP 165.A N GLU 168.A OE1 no hydrogen 2.946 N/A GLU 168.A N ASP 165.A O no hydrogen 3.078 N/A LEU 170.A N TYR 196.A O no hydrogen 2.855 N/A ARG 171.A NH2 ASN 190.A O no hydrogen 3.286 N/A ARG 171.A NH2 HIS 193.A O no hydrogen 2.391 N/A TYR 179.A N THR 176.A O no hydrogen 2.853 N/A LEU 180.A N PRO 177.A O no hydrogen 3.253 N/A GLU 183.A N GLU 183.A OE1 no hydrogen 2.915 N/A ILE 185.A N ALA 181.A O no hydrogen 3.412 N/A GLU 186.A N PRO 182.A O no hydrogen 2.904 N/A CYS 187.A N GLU 183.A O no hydrogen 2.842 N/A CYS 187.A SG ARG 171.A O no hydrogen 3.981 N/A SER 188.A N ILE 184.A O no hydrogen 3.028 N/A SER 188.A OG ILE 185.A O no hydrogen 2.471 N/A MET 189.A N GLU 186.A O no hydrogen 2.662 N/A ASN 190.A N CYS 187.A O no hydrogen 3.078 N/A ASN 192.A N ASN 190.A OD1 no hydrogen 2.988 N/A HIS 193.A N ASN 190.A O no hydrogen 3.158 N/A GLY 195.A N HIS 193.A ND1 no hydrogen 3.064 N/A TYR 196.A N LEU 170.A O no hydrogen 2.682 N/A TYR 196.A OH SER 172.A O no hydrogen 2.463 N/A LYS 198.A NZ HIS 131.A O no hydrogen 3.046 N/A LYS 198.A NZ ASN 134.A OD1 no hydrogen 3.088 N/A VAL 200.A N GLY 197.A O no hydrogen 3.107 N/A ASP 201.A N LYS 198.A O no hydrogen 3.071 N/A TRP 203.A N GLU 199.A O no hydrogen 3.299 N/A SER 204.A N VAL 200.A O no hydrogen 3.350 N/A SER 204.A OG TYR 179.A O no hydrogen 3.114 N/A THR 205.A N ASP 201.A O no hydrogen 2.886 N/A THR 205.A OG1 ASP 201.A O no hydrogen 2.918 N/A GLY 206.A N MET 202.A O no hydrogen 3.225 N/A VAL 207.A N TRP 203.A O no hydrogen 2.959 N/A ILE 208.A N SER 204.A O no hydrogen 2.975 N/A ILE 208.A N THR 205.A O no hydrogen 3.112 N/A MET 209.A N THR 205.A O no hydrogen 2.962 N/A TYR 210.A N GLY 206.A O no hydrogen 3.085 N/A TYR 210.A OH GLN 237.A O no hydrogen 2.916 N/A THR 211.A N VAL 207.A O no hydrogen 3.308 N/A THR 211.A OG1 VAL 207.A O no hydrogen 2.524 N/A LEU 212.A N ILE 208.A O no hydrogen 3.057 N/A LEU 213.A N MET 209.A O no hydrogen 3.313 N/A LEU 213.A N TYR 210.A O no hydrogen 3.082 N/A ALA 214.A N TYR 210.A O no hydrogen 2.876 N/A GLY 215.A N THR 211.A O no hydrogen 2.928 N/A LEU 226.A N LYS 223.A O no hydrogen 3.183 N/A MET 227.A N LYS 223.A O no hydrogen 3.253 N/A MET 227.A N GLN 224.A O no hydrogen 2.798 N/A LEU 228.A N GLN 224.A O no hydrogen 2.948 N/A ARG 229.A N MET 225.A O no hydrogen 3.295 N/A MET 230.A N LEU 226.A O no hydrogen 3.328 N/A ILE 231.A N MET 227.A O no hydrogen 3.009 N/A MET 232.A N LEU 228.A O no hydrogen 2.911 N/A SER 233.A N ARG 229.A O no hydrogen 2.902 N/A SER 233.A OG ARG 229.A O no hydrogen 3.484 N/A SER 233.A OG MET 230.A O no hydrogen 3.439 N/A GLY 234.A N ILE 231.A O no hydrogen 2.975 N/A ASN 235.A N MET 230.A O no hydrogen 3.134 N/A TRP 243.A N GLY 239.A O no hydrogen 3.191 N/A ASP 244.A N PRO 241.A O no hydrogen 3.145 N/A TYR 246.A N TRP 243.A O no hydrogen 3.272 N/A TYR 246.A OH LEU 213.A O no hydrogen 2.458 N/A SER 247.A N GLU 113.A OE1 no hydrogen 2.835 N/A SER 247.A OG GLU 113.A OE2 no hydrogen 2.575 N/A VAL 250.A N SER 247.A OG no hydrogen 3.080 N/A ASP 252.A N ASP 248.A O no hydrogen 2.887 N/A LEU 253.A N THR 249.A O no hydrogen 3.158 N/A VAL 254.A N VAL 250.A O no hydrogen 3.090 N/A SER 255.A N LYS 251.A O no hydrogen 3.012 N/A SER 255.A OG ASP 252.A O no hydrogen 2.851 N/A ARG 256.A N ASP 252.A O no hydrogen 3.222 N/A ARG 256.A N LEU 253.A O no hydrogen 2.913 N/A ARG 256.A NE ASP 252.A OD1 no hydrogen 3.247 N/A ARG 256.A NH2 ASP 252.A OD2 no hydrogen 2.700 N/A PHE 257.A N VAL 254.A O no hydrogen 2.817 N/A LEU 258.A N VAL 254.A O no hydrogen 3.117 N/A LYS 264.A N GLN 261.A O no hydrogen 3.046 N/A ARG 265.A N PRO 262.A O no hydrogen 3.168 N/A ARG 265.A NE VAL 259.A O no hydrogen 3.106 N/A ARG 265.A NH1 GLU 183.A OE1 no hydrogen 3.330 N/A ARG 265.A NH1 GLU 183.A OE2 no hydrogen 2.600 N/A ARG 265.A NH2 GLU 183.A OE1 no hydrogen 2.693 N/A ARG 265.A NH2 GLU 183.A OE2 no hydrogen 3.472 N/A ARG 265.A NH2 VAL 259.A O no hydrogen 3.031 N/A TYR 266.A N ARG 256.A O no hydrogen 2.921 N/A THR 267.A N GLU 270.A OE1 no hydrogen 3.177 N/A GLU 270.A N THR 267.A OG1 no hydrogen 2.999 N/A ALA 271.A N THR 267.A O no hydrogen 2.834 N/A LEU 272.A N ALA 268.A O no hydrogen 3.093 N/A ALA 273.A N GLU 269.A O no hydrogen 3.192 N/A ALA 273.A N GLU 270.A O no hydrogen 3.070 N/A HIS 274.A N ALA 271.A O no hydrogen 3.130 N/A HIS 274.A NE2 ASP 252.A OD1 no hydrogen 2.613 N/A PHE 276.A N HIS 274.A ND1 no hydrogen 3.265 N/A PHE 277.A N HIS 274.A O no hydrogen 3.124 N/A GLN 278.A N PRO 275.A O no hydrogen 2.703 N/A GLN 278.A NE2 LEU 272.A O no hydrogen 2.933 N/A GLN 278.A NE2 HIS 274.A O no hydrogen 2.880 N/A VAL 281.A N GLN 278.A O no hydrogen 3.444 N/A