Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2cl2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N ILE 219.A O no hydrogen 2.961 N/A TYR 3.A OH GLU 190.A OE2 no hydrogen 2.544 N/A HIS 4.A N GLN 298.A O.B no hydrogen 3.254 N/A HIS 4.A N GLN 298.A OXT.A no hydrogen 2.918 N/A HIS 4.A N GLN 298.A OXT.B no hydrogen 3.372 N/A LEU 5.A N ALA 217.A O no hydrogen 2.748 N/A GLU 6.A N VAL 296.A O no hydrogen 2.755 N/A ASP 7.A N VAL 296.A O no hydrogen 3.085 N/A TRP 9.A N VAL 294.A O no hydrogen 2.937 N/A ALA 13.A N VAL 10.A O no hydrogen 3.102 N/A PHE 14.A N GLY 11.A O no hydrogen 3.229 N/A LEU 15.A N SER 12.A O no hydrogen 3.023 N/A SER 16.A N ALA 13.A O no hydrogen 3.160 N/A SER 16.A OG ALA 13.A O no hydrogen 3.242 N/A THR 17.A N ALA 13.A O no hydrogen 3.181 N/A THR 17.A OG1 ALA 13.A O no hydrogen 2.960 N/A PHE 18.A N PHE 14.A O no hydrogen 3.020 N/A THR 19.A N ARG 75.A O no hydrogen 2.878 N/A HIS 20.A ND1 GLN 36.A OE1 no hydrogen 3.005 N/A HIS 20.A NE2 THR 45.A OG1 no hydrogen 2.796 N/A GLU 21.A N ARG 73.A O no hydrogen 2.778 N/A THR 27.A N ASP 25.A OD1 no hydrogen 3.204 N/A THR 27.A OG1 ASP 25.A OD1 no hydrogen 3.006 N/A THR 27.A OG1 ASP 25.A OD2 no hydrogen 2.853 N/A HIS 28.A N ASP 25.A O no hydrogen 2.931 N/A HIS 28.A ND1 ASP 256.A OD2 no hydrogen 2.589 N/A GLY 29.A N ASP 25.A OD2 no hydrogen 2.858 N/A ARG 30.A N PHE 253.A O no hydrogen 2.800 N/A ARG 30.A NE ASN 278.A OD1 no hydrogen 2.841 N/A ARG 30.A NH1 GLY 66.A O no hydrogen 2.904 N/A ARG 30.A NH2 SER 63.A O no hydrogen 3.094 N/A ARG 30.A NH2 GLY 66.A O no hydrogen 3.283 N/A ARG 30.A NH2 ASN 278.A OD1 no hydrogen 3.049 N/A ASN 32.A N ARG 69.A O no hydrogen 2.874 N/A ASN 32.A ND2 ASN 70.A OD1 no hydrogen 2.951 N/A VAL 34.A N SER 71.A O no hydrogen 3.146 N/A GLN 36.A NE2 LEU 15.A O no hydrogen 2.893 N/A THR 38.A N ASP 35.A OD1.A no hydrogen 2.922 N/A THR 38.A N ASP 35.A OD2.B no hydrogen 2.873 N/A THR 38.A OG1 ASP 35.A OD1.A no hydrogen 3.000 N/A THR 38.A OG1 ASP 35.A OD2.A no hydrogen 2.636 N/A THR 38.A OG1 ASP 35.A OD2.B no hydrogen 2.695 N/A ALA 39.A N ASP 35.A O.A no hydrogen 2.888 N/A ALA 39.A N ASP 35.A O.B no hydrogen 2.882 N/A LEU 40.A N GLN 36.A O no hydrogen 2.969 N/A ALA 41.A N ALA 37.A O no hydrogen 2.965 N/A LYS 42.A N THR 38.A O no hydrogen 2.924 N/A ASN 43.A N LEU 40.A O no hydrogen 3.259 N/A LEU 44.A N ALA 39.A O no hydrogen 2.814 N/A THR 45.A N ALA 39.A O no hydrogen 3.268 N/A THR 45.A OG1 HIS 20.A NE2 no hydrogen 2.796 N/A TYR 46.A N ILE 53.A O no hydrogen 2.933 N/A SER 48.A N THR 51.A O no hydrogen 3.113 N/A THR 51.A N SER 48.A O no hydrogen 3.094 N/A THR 51.A OG1 ASP 50.A OD1 no hydrogen 3.296 N/A LEU 52.A N ILE 291.A O no hydrogen 2.950 N/A ILE 53.A N TYR 46.A O no hydrogen 2.758 N/A LEU 54.A N TRP 289.A O no hydrogen 3.110 N/A ARG 55.A N.A LEU 44.A O no hydrogen 2.800 N/A ARG 55.A N.B LEU 44.A O no hydrogen 2.799 N/A ARG 55.A NH1.A ALA 285.A O no hydrogen 3.286 N/A ARG 55.A NH1.B ASN 43.A O no hydrogen 3.255 N/A ALA 56.A N ALA 287.A O no hydrogen 3.126 N/A ASP 57.A N ASN 70.A O no hydrogen 2.950 N/A THR 59.A N ASP 57.A OD1 no hydrogen 2.868 N/A THR 60.A N ASP 57.A OD1 no hydrogen 2.812 N/A THR 60.A OG1 ASP 57.A OD1 no hydrogen 3.385 N/A THR 60.A OG1 ASP 57.A OD2 no hydrogen 2.594 N/A LEU 62.A N ASN 278.A O no hydrogen 2.938 N/A GLY 66.A N SER 63.A O no hydrogen 2.853 N/A ARG 69.A N ARG 30.A O no hydrogen 3.090 N/A ARG 69.A NE VAL 277.A O no hydrogen 2.970 N/A ARG 69.A NH1 ASP 57.A O no hydrogen 2.904 N/A ARG 69.A NH1 THR 60.A O no hydrogen 3.008 N/A ARG 69.A NH2 THR 60.A O no hydrogen 2.765 N/A ARG 69.A NH2 VAL 277.A O no hydrogen 2.768 N/A SER 71.A N ASN 32.A O no hydrogen 3.030 N/A SER 71.A OG LEU 251.A O no hydrogen 2.740 N/A VAL 72.A N SER 71.A OG no hydrogen 2.832 N/A ARG 73.A NE GLU 21.A OE1 no hydrogen 2.863 N/A ARG 73.A NH2 GLU 107.A OE2 no hydrogen 2.948 N/A ILE 74.A N ILE 249.A O no hydrogen 2.892 N/A ARG 75.A N THR 19.A O no hydrogen 2.866 N/A ARG 75.A NH1 GLU 107.A OE1 no hydrogen 2.862 N/A SER 76.A N ILE 247.A O no hydrogen 2.805 N/A SER 76.A OG LYS 78.A O no hydrogen 2.759 N/A ILE 77.A N THR 17.A O no hydrogen 2.927 N/A LYS 78.A NZ GLU 6.A OE2 no hydrogen 2.757 N/A LYS 78.A NZ ASP 7.A OD1 no hydrogen 2.934 N/A LYS 78.A NZ ASP 7.A OD2 no hydrogen 2.881 N/A TYR 80.A N ASN 245.A O no hydrogen 2.862 N/A TYR 80.A OH ASP 7.A OD2 no hydrogen 2.602 N/A HIS 83.A N ARG 191.A O no hydrogen 3.034 N/A HIS 83.A ND1 THR 81.A O no hydrogen 2.737 N/A HIS 83.A NE2 GLU 104.A OE2 no hydrogen 2.612 N/A VAL 84.A N TYR 297.A O no hydrogen 2.890 N/A ALA 85.A N MET 189.A O no hydrogen 2.917 N/A VAL 86.A N ARG 295.A O no hydrogen 2.793 N/A PHE 87.A N TYR 187.A O no hydrogen 2.736 N/A ASP 88.A N SER 293.A O no hydrogen 2.959 N/A VAL 89.A N GLY 185.A O no hydrogen 2.933 N/A ARG 90.A N ASP 290.A O no hydrogen 2.765 N/A ARG 90.A NH1 ASP 50.A O no hydrogen 3.333 N/A ARG 90.A NH1 ASP 290.A OD1 no hydrogen 2.867 N/A ARG 90.A NH2 ASP 50.A O no hydrogen 3.006 N/A HIS 91.A N ASP 290.A O no hydrogen 3.221 N/A HIS 91.A ND1 TYR 288.A O no hydrogen 2.825 N/A MET 92.A N ASN 180.A OD1 no hydrogen 2.830 N/A GLN 94.A N ASN 286.A O no hydrogen 3.122 N/A GLY 95.A N ASP 124.A OD1 no hydrogen 2.779 N/A GLY 95.A N ASP 124.A OD2 no hydrogen 3.107 N/A GLY 97.A N ASN 123.A OD1 no hydrogen 2.734 N/A THR 98.A N GLY 95.A O no hydrogen 3.102 N/A THR 98.A OG1 GLY 95.A O no hydrogen 2.708 N/A TRP 99.A N THR 252.A O no hydrogen 2.915 N/A TRP 99.A NE1 GLU 120.A OE2 no hydrogen 2.993 N/A ALA 101.A N ASN 250.A O no hydrogen 3.076 N/A ALA 102.A N ILE 119.A O no hydrogen 2.884 N/A TRP 103.A N ILE 248.A O no hydrogen 2.905 N/A TRP 103.A NE1 ASN 250.A OD1 no hydrogen 2.801 N/A GLU 104.A N VAL 116.A O no hydrogen 2.860 N/A THR 105.A N ASN 246.A O no hydrogen 3.128 N/A THR 105.A OG1 GLY 114.A O no hydrogen 2.766 N/A ASP 109.A N ASP 106.A O no hydrogen 3.469 N/A TRP 110.A N GLU 107.A O no hydrogen 3.492 N/A TRP 110.A NE1 GLU 115.A OE1 no hydrogen 2.840 N/A ASN 112.A N ASP 109.A O no hydrogen 2.810 N/A GLY 114.A N PRO 111.A O no hydrogen 2.968 N/A VAL 116.A N GLU 104.A O no hydrogen 2.916 N/A ASP 117.A N THR 131.A O no hydrogen 2.796 N/A ILE 118.A N ALA 102.A O no hydrogen 2.895 N/A ILE 119.A N ALA 102.A O no hydrogen 3.028 N/A GLU 120.A N ASN 128.A OD1 no hydrogen 2.840 N/A ASN 123.A N THR 98.A O no hydrogen 2.918 N/A ASN 123.A ND2 ALA 258.A O no hydrogen 3.050 N/A GLN 125.A N VAL 122.A O no hydrogen 2.912 N/A GLN 125.A NE2 ASN 123.A O no hydrogen 3.075 N/A SER 126.A OG ALA 172.A O no hydrogen 2.966 N/A SER 126.A OG TYR 175.A O no hydrogen 2.770 N/A ASN 128.A N SER 174.A OG no hydrogen 2.933 N/A ASN 128.A ND2 ILE 118.A O no hydrogen 2.930 N/A ALA 129.A N GLU 120.A O no hydrogen 3.204 N/A MET 130.A N VAL 167.A O no hydrogen 2.883 N/A THR 131.A N ASP 117.A O no hydrogen 3.096 N/A LEU 132.A N CYS 165.A O no hydrogen 2.963 N/A HIS 133.A N GLU 115.A O no hydrogen 2.963 N/A THR 134.A N CYS 155.A O no hydrogen 2.946 N/A THR 134.A OG1 GLY 135.A O no hydrogen 2.840 N/A ALA 139.A N ASN 235.A O no hydrogen 3.018 N/A MET 140.A N ASN 153.A O no hydrogen 2.764 N/A ARG 144.A NE PHE 230.A O no hydrogen 2.831 N/A ARG 144.A NH1 PRO 141.A O no hydrogen 2.917 N/A ARG 144.A NH1 ASN 153.A OD1 no hydrogen 2.943 N/A ARG 144.A NH2 PHE 230.A O no hydrogen 3.155 N/A THR 147.A N PRO 227.A O no hydrogen 2.893 N/A GLY 148.A N THR 228.A O no hydrogen 2.833 N/A HIS 149.A N GLN 168.A O no hydrogen 2.923 N/A THR 151.A N GLY 166.A O no hydrogen 2.984 N/A ASN 154.A ND2 THR 159.A OG1 no hydrogen 2.910 N/A CYS 155.A N CYS 138.A O no hydrogen 2.875 N/A ASP 156.A N ASN 154.A OD1 no hydrogen 3.108 N/A VAL 157.A N THR 134.A O no hydrogen 2.967 N/A ASN 158.A N ASP 156.A OD1 no hydrogen 2.961 N/A THR 159.A N ASP 156.A O no hydrogen 3.223 N/A THR 159.A OG1 ASP 156.A OD2 no hydrogen 2.860 N/A THR 163.A N ASP 160.A OD1 no hydrogen 3.022 N/A THR 163.A OG1 ASP 160.A O no hydrogen 2.999 N/A THR 163.A OG1 GLY 164.A O no hydrogen 2.928 N/A GLY 164.A N ASP 160.A OD1 no hydrogen 3.477 N/A CYS 165.A N LEU 132.A O no hydrogen 2.865 N/A CYS 165.A SG LEU 132.A O no hydrogen 3.695 N/A GLY 166.A N ASN 152.A O no hydrogen 2.940 N/A VAL 167.A N MET 130.A O no hydrogen 2.791 N/A GLN 168.A N HIS 149.A O no hydrogen 2.830 N/A ALA 169.A N ASN 128.A O no hydrogen 2.912 N/A THR 171.A OG1 ASN 173.A OD1 no hydrogen 2.715 N/A SER 174.A N THR 171.A O no hydrogen 3.252 N/A SER 174.A OG THR 171.A O no hydrogen 2.718 N/A TYR 175.A N ALA 172.A O no hydrogen 3.145 N/A PHE 179.A N TYR 175.A O no hydrogen 3.180 N/A ASN 180.A N GLY 176.A O no hydrogen 2.947 N/A ASN 180.A ND2 MET 92.A O no hydrogen 2.808 N/A ASN 180.A ND2 GLN 94.A OE1 no hydrogen 2.825 N/A ALA 181.A N PRO 177.A O no hydrogen 2.865 N/A ASN 182.A N SER 178.A O no hydrogen 3.215 N/A ASN 182.A N PHE 179.A O no hydrogen 3.134 N/A ASN 182.A ND2 ASN 204.A OD1 no hydrogen 2.961 N/A GLY 183.A N ASN 180.A O no hydrogen 3.067 N/A GLY 184.A N PHE 179.A O no hydrogen 2.850 N/A GLY 185.A N VAL 89.A O no hydrogen 2.894 N/A TRP 186.A N PHE 201.A O no hydrogen 2.841 N/A TYR 187.A N PHE 87.A O no hydrogen 2.949 N/A TYR 187.A OH SER 174.A O no hydrogen 2.672 N/A ALA 188.A N TRP 199.A O no hydrogen 2.932 N/A MET 189.A N ALA 85.A O no hydrogen 2.901 N/A GLU 190.A N LYS 197.A O no hydrogen 2.878 N/A ARG 191.A N HIS 83.A O no hydrogen 2.873 N/A ARG 191.A NH1 ASP 243.A O no hydrogen 2.913 N/A ARG 191.A NH2 ASP 243.A O no hydrogen 2.950 N/A THR 192.A N PHE 195.A O no hydrogen 2.918 N/A SER 194.A N THR 192.A OG1 no hydrogen 3.056 N/A PHE 195.A N THR 192.A OG1 no hydrogen 3.281 N/A ILE 196.A N PHE 231.A O no hydrogen 3.027 N/A LYS 197.A N GLU 190.A O no hydrogen 2.879 N/A VAL 198.A N ALA 229.A O no hydrogen 2.907 N/A TRP 199.A N ALA 188.A O no hydrogen 2.770 N/A TRP 199.A NE1 GLY 225.A O no hydrogen 3.009 N/A PHE 200.A N THR 228.A OG1 no hydrogen 3.018 N/A PHE 201.A N TRP 186.A O no hydrogen 2.877 N/A ARG 203.A N GLY 184.A O no hydrogen 2.943 N/A ARG 203.A NE GLY 183.A O no hydrogen 2.888 N/A ARG 203.A NH1 ASP 88.A OD1 no hydrogen 2.927 N/A ARG 203.A NH2 ASP 88.A OD1 no hydrogen 2.861 N/A ARG 203.A NH2 VAL 89.A O no hydrogen 2.970 N/A ARG 203.A NH2 GLY 183.A O no hydrogen 3.560 N/A ALA 205.A N PRO 202.A O no hydrogen 3.021 N/A ILE 212.A N PRO 209.A O no hydrogen 2.924 N/A ALA 213.A N PRO 209.A O no hydrogen 2.944 N/A SER 214.A N ASN 210.A O no hydrogen 2.886 N/A SER 214.A OG ASN 210.A OD1 no hydrogen 3.552 N/A ILE 219.A N TYR 3.A O no hydrogen 3.023 N/A ASN 220.A N ASP 211.A OD2 no hydrogen 2.820 N/A THR 221.A N ALA 1.A O no hydrogen 2.984 N/A THR 221.A OG1 GLU 190.A OE1 no hydrogen 2.895 N/A THR 221.A OG1 GLU 190.A OE2 no hydrogen 3.330 N/A ASP 222.A N ASN 220.A OD1 no hydrogen 3.030 N/A ASN 223.A N ASN 220.A O no hydrogen 3.221 N/A TRP 224.A N THR 221.A O no hydrogen 3.163 N/A TRP 224.A NE1 ASP 211.A OD2 no hydrogen 3.098 N/A ALA 229.A N VAL 198.A O no hydrogen 2.971 N/A PHE 231.A N ILE 196.A O no hydrogen 2.761 N/A CYS 236.A N ASN 233.A O no hydrogen 3.273 N/A GLY 239.A N ASN 193.A O no hydrogen 3.258 N/A SER 240.A N ASP 237.A O no hydrogen 3.121 N/A SER 240.A N ASP 237.A OD1 no hydrogen 3.146 N/A SER 240.A OG ASP 237.A O no hydrogen 3.062 N/A HIS 241.A N ILE 238.A O no hydrogen 3.029 N/A ASP 243.A N GLY 113.A O no hydrogen 3.052 N/A ASN 245.A N TYR 80.A O no hydrogen 2.857 N/A ASN 246.A N THR 105.A O no hydrogen 2.904 N/A ASN 246.A ND2 THR 105.A O no hydrogen 3.676 N/A ILE 247.A N SER 76.A OG no hydrogen 2.906 N/A ILE 248.A N TRP 103.A O no hydrogen 2.766 N/A ILE 249.A N ILE 74.A O no hydrogen 2.990 N/A ASN 250.A N ALA 101.A O no hydrogen 2.947 N/A ASN 250.A ND2 TYR 33.A OH no hydrogen 3.029 N/A LEU 251.A N VAL 72.A O no hydrogen 3.268 N/A THR 252.A N TRP 99.A O no hydrogen 3.051 N/A THR 252.A OG1 ASP 25.A OD2 no hydrogen 2.785 N/A PHE 253.A N THR 252.A OG1 no hydrogen 2.859 N/A CYS 254.A N GLY 97.A O no hydrogen 2.864 N/A ASP 256.A N THR 27.A O no hydrogen 2.952 N/A GLY 259.A N GLY 255.A O no hydrogen 2.927 N/A GLN 260.A N TRP 257.A O no hydrogen 3.342 N/A GLN 260.A NE2 ASP 256.A O no hydrogen 2.848 N/A PHE 264.A N GLN 260.A O no hydrogen 2.776 N/A ASN 265.A N ALA 261.A O no hydrogen 2.774 N/A GLY 266.A N SER 262.A O no hydrogen 2.919 N/A ALA 267.A N ILE 263.A O no hydrogen 3.103 N/A ALA 267.A N PHE 264.A O no hydrogen 3.206 N/A GLY 268.A N ASN 265.A O no hydrogen 2.958 N/A CYS 269.A N PHE 264.A O no hydrogen 3.253 N/A ASP 275.A N SER 272.A OG no hydrogen 3.043 N/A TYR 276.A N SER 272.A O no hydrogen 2.916 N/A VAL 277.A N CYS 273.A O no hydrogen 2.876 N/A ASN 278.A N VAL 274.A O no hydrogen 2.839 N/A ASN 279.A N ASP 275.A O no hydrogen 3.038 N/A ASN 279.A N TYR 276.A O no hydrogen 3.313 N/A ASN 280.A ND2 TYR 276.A O no hydrogen 2.923 N/A ALA 283.A N ASN 280.A O no hydrogen 2.921 N/A PHE 284.A N PRO 281.A O no hydrogen 2.955 N/A ALA 285.A N SER 282.A O.A no hydrogen 3.185 N/A ALA 285.A N SER 282.A O.B no hydrogen 3.390 N/A ALA 287.A N PHE 284.A O no hydrogen 3.016 N/A TRP 289.A N LEU 54.A O no hydrogen 2.782 N/A TRP 289.A NE1 ASN 250.A O no hydrogen 3.157 N/A ASP 290.A N HIS 91.A O no hydrogen 2.891 N/A ILE 291.A N LEU 52.A O no hydrogen 2.830 N/A ALA 292.A N ASP 88.A O no hydrogen 2.839 N/A VAL 294.A N TRP 9.A O no hydrogen 2.985 N/A ARG 295.A N VAL 86.A O no hydrogen 2.919 N/A VAL 296.A N ASP 7.A O no hydrogen 2.896 N/A TYR 297.A N VAL 84.A O no hydrogen 2.760 N/A TYR 297.A OH PRO 216.A O no hydrogen 2.784 N/A GLN 298.A N.A HIS 4.A O no hydrogen 2.889 N/A GLN 298.A N.B HIS 4.A O no hydrogen 2.877 N/A