Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8qle_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG GLU 5.A OE1 no hydrogen 2.691 N/A SER 3.A OG PHE 93.A O no hydrogen 2.883 N/A ILE 4.A N GLU 149.A OE2 no hydrogen 3.063 N/A GLU 5.A N GLU 5.A OE1 no hydrogen 2.870 N/A ASN 6.A N SER 3.A O no hydrogen 3.039 N/A ASN 6.A ND2 SER 3.A O no hydrogen 3.592 N/A ASN 6.A ND2 PHE 93.A O no hydrogen 2.345 N/A PHE 7.A N ILE 4.A O no hydrogen 3.261 N/A TYR 10.A N PHE 85.A O no hydrogen 2.881 N/A TYR 10.A OH GLU 5.A O no hydrogen 2.584 N/A ASP 11.A N GLN 14.A OE1 no hydrogen 3.074 N/A GLN 14.A N ASP 11.A OD2 no hydrogen 2.795 N/A GLN 14.A NE2 ASP 229.A OD1 no hydrogen 2.653 N/A TYR 15.A N ASP 11.A O no hydrogen 3.044 N/A TYR 15.A OH TRP 72.A O no hydrogen 2.657 N/A ASP 16.A N PHE 12.A O no hydrogen 2.748 N/A VAL 17.A N TRP 13.A O no hydrogen 2.886 N/A ILE 18.A N GLN 14.A O no hydrogen 3.268 N/A ARG 19.A N TYR 15.A O no hydrogen 3.000 N/A ARG 19.A NE ASP 16.A OD1 no hydrogen 3.380 N/A ARG 19.A NH1 ASP 16.A OD1 no hydrogen 2.768 N/A ARG 19.A NH2 ASN 73.A OD1 no hydrogen 3.313 N/A HIS 20.A N ASP 16.A O no hydrogen 2.919 N/A LEU 21.A N VAL 17.A O no hydrogen 2.884 N/A PHE 22.A N ILE 18.A O no hydrogen 3.229 N/A ALA 23.A N ARG 19.A O no hydrogen 3.107 N/A PHE 24.A N.A HIS 20.A O no hydrogen 2.810 N/A PHE 24.A N.B HIS 20.A O no hydrogen 2.829 N/A SER 25.A N LEU 21.A O no hydrogen 3.123 N/A SER 25.A OG LEU 21.A O no hydrogen 2.719 N/A THR 26.A N PHE 22.A O no hydrogen 3.051 N/A THR 26.A OG1 PHE 22.A O no hydrogen 2.829 N/A ALA 27.A N ALA 23.A O no hydrogen 3.055 N/A VAL 28.A N PHE 24.A O.A no hydrogen 2.896 N/A VAL 28.A N PHE 24.A O.B no hydrogen 2.946 N/A PHE 29.A N SER 25.A O no hydrogen 3.001 N/A LEU 30.A N THR 26.A O no hydrogen 3.110 N/A ALA 31.A N ALA 27.A O no hydrogen 2.936 N/A GLY 32.A N VAL 28.A O no hydrogen 2.917 N/A LEU 33.A N PHE 29.A O no hydrogen 3.156 N/A LEU 33.A N LEU 30.A O no hydrogen 3.070 N/A VAL 34.A N ALA 31.A O no hydrogen 3.004 N/A TYR 35.A OH SER 253.A OG no hydrogen 2.788 N/A TYR 35.A OH GLN 254.A OE1 no hydrogen 2.964 N/A PHE 36.A N GLY 32.A O no hydrogen 3.011 N/A ALA 37.A N LEU 33.A O no hydrogen 2.985 N/A MET 38.A N VAL 34.A O no hydrogen 3.050 N/A THR 39.A N TYR 35.A O no hydrogen 2.902 N/A THR 39.A OG1 TYR 35.A O no hydrogen 2.733 N/A ALA 40.A N PHE 36.A O no hydrogen 2.908 N/A THR 42.A N THR 39.A O no hydrogen 3.139 N/A THR 42.A OG1 THR 39.A O no hydrogen 2.849 N/A THR 43.A N ALA 40.A O no hydrogen 3.156 N/A THR 43.A OG1 THR 39.A O no hydrogen 2.766 N/A ALA 44.A N SER 260.A OG no hydrogen 2.994 N/A ASN 46.A ND2 GLU 263.A OE1 no hydrogen 3.099 N/A TYR 47.A N ALA 44.A O no hydrogen 3.003 N/A TYR 47.A OH GLU 263.A OE2 no hydrogen 2.446 N/A ARG 48.A N PRO 45.A O no hydrogen 3.394 N/A ARG 48.A NE ALA 40.A O no hydrogen 3.001 N/A ARG 48.A NE THR 43.A O no hydrogen 3.137 N/A ARG 48.A NH2 THR 43.A O no hydrogen 2.950 N/A SER 50.A N TYR 47.A O no hydrogen 3.169 N/A ASN 52.A N ARG 48.A O no hydrogen 3.137 N/A ILE 53.A N LEU 49.A O no hydrogen 2.786 N/A SER 54.A N SER 50.A O no hydrogen 2.972 N/A ALA 55.A N ALA 51.A O no hydrogen 3.132 N/A VAL 56.A N ASN 52.A O no hydrogen 3.131 N/A VAL 57.A N ILE 53.A O no hydrogen 2.910 N/A MET 58.A N SER 54.A O no hydrogen 2.869 N/A VAL 59.A N ALA 55.A O no hydrogen 3.166 N/A SER 60.A N VAL 56.A O no hydrogen 3.009 N/A SER 60.A OG ASN 101.A O no hydrogen 3.508 N/A SER 60.A OG ASP 105.A OD1 no hydrogen 2.648 N/A ALA 61.A N VAL 57.A O no hydrogen 2.810 N/A ALA 62.A N MET 58.A O no hydrogen 2.872 N/A LEU 63.A N VAL 59.A O no hydrogen 3.107 N/A GLU 64.A N SER 60.A O no hydrogen 2.918 N/A LEU 65.A N ALA 61.A O no hydrogen 2.916 N/A GLY 66.A N ALA 62.A O no hydrogen 2.841 N/A GLN 67.A N LEU 63.A O no hydrogen 2.947 N/A LEU 68.A N GLU 64.A O no hydrogen 3.156 N/A TRP 69.A N LEU 65.A O no hydrogen 2.867 N/A LEU 70.A N GLY 66.A O no hydrogen 3.112 N/A LEU 71.A N GLN 67.A O no hydrogen 2.862 N/A TRP 72.A N LEU 68.A O no hydrogen 2.840 N/A TRP 72.A NE1 TYR 15.A O no hydrogen 3.115 N/A ASN 73.A N TRP 69.A O no hydrogen 3.089 N/A ASN 73.A ND2 TRP 69.A O no hydrogen 2.876 N/A GLU 74.A N LEU 70.A O no hydrogen 2.973 N/A SER 75.A N LEU 71.A O no hydrogen 2.875 N/A SER 75.A OG LEU 71.A O no hydrogen 2.471 N/A GLN 77.A N VAL 86.A O no hydrogen 2.892 N/A ALA 79.A N SER 84.A O no hydrogen 2.932 N/A GLN 82.A N ALA 79.A O no hydrogen 3.092 N/A GLY 83.A N ALA 79.A O no hydrogen 2.885 N/A SER 84.A OG TYR 10.A O no hydrogen 3.538 N/A PHE 85.A N TYR 10.A O no hydrogen 2.633 N/A VAL 86.A N GLN 77.A O no hydrogen 2.857 N/A VAL 88.A N SER 75.A O no hydrogen 2.868 N/A GLU 91.A N VAL 88.A O no hydrogen 3.287 N/A PHE 93.A N ASN 6.A OD1 no hydrogen 2.836 N/A GLY 96.A N SER 94.A OG no hydrogen 2.965 N/A TYR 97.A N SER 94.A O no hydrogen 3.221 N/A ARG 98.A N.A ASN 95.A O.A no hydrogen 2.852 N/A ARG 98.A N.A ASN 95.A O.B no hydrogen 3.012 N/A ARG 98.A N.B ASN 95.A O.A no hydrogen 2.855 N/A ARG 98.A N.B ASN 95.A O.B no hydrogen 3.016 N/A ARG 98.A NE.B ASN 95.A OD1.A no hydrogen 2.670 N/A ARG 98.A NH1.A ASP 242.A OD2 no hydrogen 2.585 N/A ARG 98.A NH1.B ASP 242.A OD2 no hydrogen 2.908 N/A ARG 98.A NH2.A ASN 95.A OD1.A no hydrogen 2.601 N/A ARG 98.A NH2.A GLN 235.A OE1 no hydrogen 3.024 N/A ARG 98.A NH2.B ASN 95.A OD1.A no hydrogen 3.243 N/A ARG 98.A NH2.B GLN 235.A OE1 no hydrogen 2.722 N/A TYR 99.A N GLY 96.A O no hydrogen 3.159 N/A ASN 101.A N ARG 98.A O.B no hydrogen 3.157 N/A ASN 101.A ND2 SER 60.A O no hydrogen 2.733 N/A TRP 102.A N ARG 98.A O.A no hydrogen 3.324 N/A TRP 102.A N ARG 98.A O.B no hydrogen 3.322 N/A LEU 103.A N MET 100.A O no hydrogen 3.189 N/A ILE 104.A N ASN 101.A O no hydrogen 2.866 N/A ASP 105.A N ASN 101.A O no hydrogen 2.968 N/A VAL 106.A N TRP 102.A O no hydrogen 2.885 N/A MET 108.A N ILE 104.A O no hydrogen 3.233 N/A LEU 109.A N ASP 105.A O no hydrogen 2.820 N/A ALA 110.A N VAL 106.A O no hydrogen 3.122 N/A THR 111.A N PRO 107.A O no hydrogen 2.975 N/A THR 111.A OG1 PRO 107.A O no hydrogen 2.640 N/A GLN 112.A N MET 108.A O no hydrogen 2.880 N/A GLN 112.A NE2 SER 50.A OG no hydrogen 3.362 N/A GLN 112.A NE2 SER 54.A OG no hydrogen 2.978 N/A VAL 114.A N ALA 110.A O no hydrogen 3.350 N/A VAL 115.A N THR 111.A O no hydrogen 2.893 N/A VAL 116.A N GLN 112.A O no hydrogen 3.134 N/A CYS 117.A N LEU 113.A O no hydrogen 2.982 N/A CYS 117.A SG LEU 113.A O no hydrogen 3.455 N/A GLY 118.A N VAL 114.A O no hydrogen 3.240 N/A GLY 118.A N VAL 115.A O no hydrogen 2.885 N/A LEU 124.A N VAL 120.A O no hydrogen 3.212 N/A ARG 125.A N GLY 121.A O no hydrogen 2.988 N/A ASN 126.A N THR 122.A O no hydrogen 2.791 N/A ARG 127.A N GLU 123.A O no hydrogen 3.427 N/A ARG 127.A NH1 GLU 123.A O no hydrogen 2.905 N/A ARG 127.A NH1 GLU 123.A OE1 no hydrogen 2.879 N/A TRP 128.A N LEU 124.A O no hydrogen 2.889 N/A ALA 129.A N ARG 125.A O no hydrogen 2.903 N/A LYS 130.A N ASN 126.A O no hydrogen 3.100 N/A LEU 131.A N ARG 127.A O no hydrogen 2.833 N/A THR 132.A N TRP 128.A O no hydrogen 2.798 N/A THR 132.A OG1 TRP 128.A O no hydrogen 2.718 N/A ILE 133.A N ALA 129.A O no hydrogen 2.931 N/A ALA 134.A N LYS 130.A O no hydrogen 2.997 N/A GLY 135.A N LEU 131.A O no hydrogen 2.817 N/A VAL 136.A N THR 132.A O no hydrogen 2.828 N/A LEU 137.A N ILE 133.A O no hydrogen 3.070 N/A MET 138.A N ALA 134.A O no hydrogen 2.837 N/A ILE 139.A N GLY 135.A O no hydrogen 3.021 N/A LEU 140.A N VAL 136.A O no hydrogen 2.866 N/A THR 141.A N LEU 137.A O no hydrogen 3.015 N/A THR 141.A OG1 LEU 137.A O no hydrogen 2.679 N/A THR 141.A OG1 MET 138.A O no hydrogen 3.136 N/A GLY 142.A N MET 138.A O no hydrogen 2.969 N/A TYR 143.A N ILE 139.A O no hydrogen 2.803 N/A VAL 144.A N LEU 140.A O no hydrogen 3.138 N/A GLY 145.A N THR 141.A O no hydrogen 3.124 N/A GLN 146.A N GLY 142.A O no hydrogen 2.954 N/A TYR 147.A N TYR 143.A O no hydrogen 3.161 N/A TYR 147.A N VAL 144.A O no hydrogen 3.199 N/A PHE 148.A N GLY 145.A O no hydrogen 3.182 N/A GLU 149.A N GLN 146.A O no hydrogen 3.119 N/A VAL 152.A N PHE 148.A O no hydrogen 3.404 N/A ALA 153.A N GLU 149.A O no hydrogen 2.935 N/A GLY 154.A N ALA 151.A O no hydrogen 3.198 N/A VAL 155.A N PRO 150.A O no hydrogen 3.010 N/A GLU 162.A N GLU 162.A OE2 no hydrogen 2.907 N/A GLN 163.A N GLY 160.A O no hydrogen 2.885 N/A GLN 163.A NE2 GLU 162.A OE1 no hydrogen 3.408 N/A PHE 164.A N ALA 161.A O no hydrogen 3.147 N/A TRP 165.A N GLU 162.A O no hydrogen 3.140 N/A ILE 166.A N GLU 162.A O no hydrogen 2.933 N/A TRP 167.A N GLN 163.A O no hydrogen 2.953 N/A TRP 167.A NE1 GLN 163.A OE1 no hydrogen 2.799 N/A GLY 168.A N PHE 164.A O no hydrogen 3.123 N/A ILE 169.A N TRP 165.A O no hydrogen 2.918 N/A ILE 170.A N ILE 166.A O no hydrogen 3.084 N/A SER 171.A N TRP 167.A O no hydrogen 2.850 N/A SER 171.A OG MET 138.A O no hydrogen 2.665 N/A THR 172.A N GLY 168.A O no hydrogen 2.986 N/A THR 172.A OG1 GLY 168.A O no hydrogen 2.867 N/A ALA 173.A N ILE 169.A O no hydrogen 3.070 N/A PHE 174.A N ILE 170.A O no hydrogen 3.303 N/A PHE 175.A N SER 171.A O no hydrogen 2.989 N/A VAL 176.A N THR 172.A O no hydrogen 2.946 N/A TRP 177.A N ALA 173.A O no hydrogen 3.049 N/A MET 178.A N PHE 174.A O no hydrogen 3.035 N/A LEU 179.A N PHE 175.A O no hydrogen 2.932 N/A LEU 180.A N VAL 176.A O no hydrogen 2.899 N/A ILE 181.A N TRP 177.A O no hydrogen 3.003 N/A LEU 182.A N MET 178.A O no hydrogen 3.017 N/A ALA 183.A N LEU 179.A O no hydrogen 2.753 N/A ASN 184.A N LEU 180.A O no hydrogen 3.047 N/A ALA 185.A N ILE 181.A O no hydrogen 3.092 N/A VAL 186.A N LEU 182.A O no hydrogen 2.979 N/A ARG 187.A N ALA 183.A O no hydrogen 3.066 N/A ASN 188.A N ALA 185.A O no hydrogen 3.135 N/A ASN 188.A ND2 ASN 184.A O no hydrogen 2.813 N/A GLN 190.A N CYS 117.A O no hydrogen 2.808 N/A SER 194.A N GLU 262.A OE1 no hydrogen 3.112 N/A SER 194.A OG GLU 262.A OE2 no hydrogen 2.410 N/A VAL 197.A N SER 194.A OG no hydrogen 3.042 N/A ARG 198.A N SER 194.A O no hydrogen 3.047 N/A SER 199.A N ASP 195.A O no hydrogen 3.012 N/A ARG 200.A N GLU 196.A O no hydrogen 2.937 N/A LEU 201.A N VAL 197.A O no hydrogen 2.789 N/A LYS 202.A N ARG 198.A O no hydrogen 3.300 N/A PHE 203.A N SER 199.A O no hydrogen 2.984 N/A CYS 204.A N ARG 200.A O no hydrogen 2.978 N/A CYS 204.A SG ARG 200.A O no hydrogen 3.388 N/A PHE 205.A N LEU 201.A O no hydrogen 3.055 N/A TRP 206.A N LYS 202.A O no hydrogen 3.026 N/A PHE 207.A N PHE 203.A O no hydrogen 2.818 N/A LEU 208.A N CYS 204.A O no hydrogen 2.964 N/A LEU 209.A N PHE 205.A O no hydrogen 2.873 N/A ALA 210.A N TRP 206.A O no hydrogen 2.900 N/A THR 211.A N PHE 207.A O no hydrogen 2.941 N/A THR 211.A OG1 PHE 207.A O no hydrogen 2.908 N/A THR 211.A OG1 LEU 208.A O no hydrogen 3.253 N/A TRP 212.A N LEU 208.A O no hydrogen 2.856 N/A SER 213.A N LEU 209.A O no hydrogen 3.023 N/A SER 213.A OG LEU 209.A O no hydrogen 2.758 N/A ILE 214.A N THR 211.A O no hydrogen 3.281 N/A TYR 215.A N TRP 212.A O no hydrogen 2.999 N/A TYR 215.A OH ASP 242.A OD1 no hydrogen 2.580 N/A TYR 215.A OH SER 245.A OG no hydrogen 3.148 N/A ALA 218.A N ILE 214.A O no hydrogen 2.962 N/A TYR 219.A N TYR 215.A O no hydrogen 2.913 N/A TYR 219.A OH PHE 164.A O no hydrogen 2.681 N/A ALA 220.A N PRO 216.A O no hydrogen 3.073 N/A ALA 220.A N PHE 217.A O no hydrogen 3.094 N/A MET 221.A N ALA 218.A O no hydrogen 3.305 N/A LEU 223.A N ALA 220.A O no hydrogen 2.854 N/A PHE 224.A N MET 221.A O no hydrogen 2.868 N/A ALA 225.A N PRO 222.A O no hydrogen 3.012 N/A VAL 231.A N THR 227.A O no hydrogen 3.041 N/A VAL 232.A N ALA 228.A O no hydrogen 3.079 N/A VAL 233.A N ASP 229.A O no hydrogen 3.115 N/A ARG 234.A N GLY 230.A O no hydrogen 2.877 N/A ARG 234.A NE ALA 218.A O no hydrogen 2.862 N/A ARG 234.A NH1 GLU 149.A OE1 no hydrogen 2.907 N/A ARG 234.A NH1 ALA 218.A O no hydrogen 3.092 N/A ARG 234.A NH2 GLU 5.A OE2 no hydrogen 3.023 N/A ARG 234.A NH2 GLU 149.A OE2 no hydrogen 2.886 N/A GLN 235.A N VAL 231.A O no hydrogen 2.922 N/A GLN 235.A NE2 GLU 5.A OE2 no hydrogen 3.021 N/A GLN 235.A NE2 ASN 95.A OD1.A no hydrogen 2.922 N/A VAL 236.A N VAL 232.A O no hydrogen 2.934 N/A ILE 237.A N VAL 233.A O no hydrogen 2.915 N/A TYR 238.A N ARG 234.A O no hydrogen 3.019 N/A TYR 238.A OH ASN 95.A OD1.B no hydrogen 2.914 N/A THR 239.A N GLN 235.A O no hydrogen 2.982 N/A THR 239.A OG1 GLN 235.A O no hydrogen 2.777 N/A VAL 240.A N VAL 236.A O no hydrogen 2.936 N/A ALA 241.A N ILE 237.A O no hydrogen 2.952 N/A ASP 242.A N TYR 238.A O no hydrogen 2.740 N/A VAL 243.A N THR 239.A O no hydrogen 2.973 N/A SER 244.A N VAL 240.A O no hydrogen 2.912 N/A SER 244.A OG VAL 240.A O no hydrogen 2.642 N/A SER 244.A OG ALA 241.A O no hydrogen 3.044 N/A SER 245.A N ALA 241.A O no hydrogen 2.773 N/A SER 245.A OG TYR 215.A OH no hydrogen 3.148 N/A SER 245.A OG ALA 241.A O no hydrogen 2.782 N/A SER 245.A OG ASP 242.A O no hydrogen 3.497 N/A VAL 247.A N VAL 243.A O no hydrogen 2.968 N/A PHE 248.A N SER 244.A O no hydrogen 2.969 N/A VAL 250.A N LEU 246.A O no hydrogen 2.832 N/A ILE 251.A N VAL 247.A O no hydrogen 2.928 N/A LEU 252.A N PHE 248.A O no hydrogen 2.784 N/A SER 253.A N GLY 249.A O no hydrogen 2.884 N/A SER 253.A OG TYR 35.A OH no hydrogen 2.788 N/A SER 253.A OG VAL 250.A O no hydrogen 2.599 N/A GLN 254.A N VAL 250.A O no hydrogen 3.088 N/A GLN 254.A N ILE 251.A O no hydrogen 3.196 N/A VAL 255.A N ILE 251.A O no hydrogen 3.235 N/A ALA 256.A N LEU 252.A O no hydrogen 2.910 N/A LEU 257.A N SER 253.A O no hydrogen 2.964 N/A ARG 258.A N.A GLN 254.A O no hydrogen 3.050 N/A ARG 258.A N.B GLN 254.A O no hydrogen 3.052 N/A ARG 258.A NE.B GLU 262.A OE2 no hydrogen 2.892 N/A ARG 259.A N VAL 255.A O no hydrogen 2.863 N/A ARG 259.A NH1 VAL 116.A O no hydrogen 2.918 N/A ARG 259.A NH1 CYS 117.A O no hydrogen 2.989 N/A ARG 259.A NH1 GLN 190.A O no hydrogen 3.416 N/A ARG 259.A NH2 GLN 190.A O no hydrogen 2.732 N/A SER 260.A N ALA 256.A O no hydrogen 2.952 N/A SER 260.A OG ALA 256.A O no hydrogen 2.768 N/A ALA 261.A N LEU 257.A O no hydrogen 2.821 N/A GLU 262.A N ARG 258.A O.A no hydrogen 2.855 N/A GLU 262.A N ARG 258.A O.B no hydrogen 2.835 N/A GLU 263.A N ARG 259.A O no hydrogen 3.061 N/A GLU 263.A N SER 260.A O no hydrogen 3.239 N/A GLY 264.A N ALA 261.A O no hydrogen 2.891 N/A PHE 265.A N SER 260.A O no hydrogen 2.974 N/A ALA 268.A N PHE 265.A O no hydrogen 3.018 N/A ARG 269.A N PHE 265.A O no hydrogen 3.207 N/A ARG 269.A NE ALA 261.A O no hydrogen 3.007 N/A VAL 270.A N GLU 266.A O no hydrogen 2.894 N/A ALA 271.A N ALA 268.A O no hydrogen 3.264 N/A