Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w06_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N GLU 4.A OE1.B no hydrogen 3.028 N/A GLU 5.A N GLY 1.A O no hydrogen 2.908 N/A ALA 6.A N VAL 2.A O no hydrogen 2.915 N/A HIS 7.A N VAL 3.A O.A no hydrogen 3.111 N/A HIS 7.A N VAL 3.A O.B no hydrogen 3.139 N/A HIS 7.A ND1 ASP 49.A O no hydrogen 2.904 N/A ASN 8.A N GLU 5.A O no hydrogen 3.101 N/A ASN 8.A ND2 ASP 49.A OD2 no hydrogen 2.888 N/A ASN 8.A ND2 THR 55.A O no hydrogen 3.005 N/A VAL 9.A N GLU 4.A O.A no hydrogen 2.904 N/A VAL 9.A N GLU 4.A O.B no hydrogen 2.906 N/A LYS 10.A N.A LEU 47.A O no hydrogen 2.933 N/A LYS 10.A N.B LEU 47.A O no hydrogen 2.880 N/A LYS 10.A NZ.A ASN 8.A O no hydrogen 3.225 N/A LYS 10.A NZ.B ASN 8.A O no hydrogen 3.049 N/A LYS 10.A NZ.B GLN 29.A OE1 no hydrogen 3.294 N/A ILE 12.A N VAL 45.A O no hydrogen 2.837 N/A THR 18.A OG1 GLY 15.A O no hydrogen 3.395 N/A THR 18.A OG1 GLU 16.A O no hydrogen 2.860 N/A ILE 19.A N.A ARG 44.A O.A no hydrogen 3.010 N/A ILE 19.A N.A ARG 44.A O.C no hydrogen 2.829 N/A ILE 19.A N.C ARG 44.A O.A no hydrogen 2.979 N/A ILE 19.A N.C ARG 44.A O.C no hydrogen 2.817 N/A VAL 20.A N ILE 89.A O no hydrogen 2.864 N/A LEU 21.A N.A VAL 46.A O no hydrogen 3.005 N/A LEU 21.A N.B VAL 46.A O no hydrogen 3.001 N/A GLY 22.A N VAL 91.A O no hydrogen 2.880 N/A HIS 23.A ND1 GLY 24.A O no hydrogen 2.788 N/A THR 27.A N GLY 24.A O no hydrogen 3.439 N/A THR 27.A OG1 ASP 28.A O no hydrogen 3.547 N/A ASP 28.A N THR 27.A OG1 no hydrogen 2.776 N/A GLN 29.A N ASP 49.A OD1 no hydrogen 2.890 N/A GLN 29.A NE2 ASN 8.A O no hydrogen 2.953 N/A GLN 29.A NE2 ASP 49.A OD1 no hydrogen 3.022 N/A SER 30.A N ASP 28.A OD1 no hydrogen 2.863 N/A SER 30.A OG ASP 28.A OD1 no hydrogen 2.658 N/A VAL 31.A N ASP 28.A O no hydrogen 2.955 N/A TRP 32.A N GLN 29.A O no hydrogen 3.127 N/A LYS 33.A N SER 30.A O no hydrogen 3.102 N/A LYS 33.A NZ GLU 172.A OE1 no hydrogen 3.088 N/A LYS 33.A NZ GLU 172.A OE2 no hydrogen 2.937 N/A LEU 35.A N TRP 32.A O no hydrogen 2.892 N/A VAL 36.A N TRP 32.A O no hydrogen 3.027 N/A HIS 38.A N LEU 35.A O no hydrogen 2.976 N/A LEU 39.A N VAL 36.A O no hydrogen 2.915 N/A VAL 40.A N VAL 36.A O no hydrogen 3.264 N/A ASP 42.A N LEU 39.A O no hydrogen 3.094 N/A TYR 43.A N LEU 39.A O no hydrogen 3.026 N/A ARG 44.A N.A ALA 17.A O no hydrogen 2.902 N/A ARG 44.A N.C ALA 17.A O no hydrogen 2.890 N/A ARG 44.A NE.A THR 18.A OG1 no hydrogen 2.924 N/A ARG 44.A NH1.C LEU 83.A O no hydrogen 3.417 N/A ARG 44.A NH2.A THR 18.A OG1 no hydrogen 2.895 N/A ARG 44.A NH2.C LEU 83.A O no hydrogen 3.499 N/A VAL 45.A N ILE 12.A O no hydrogen 2.860 N/A VAL 46.A N ILE 19.A O.A no hydrogen 2.864 N/A VAL 46.A N ILE 19.A O.C no hydrogen 2.823 N/A LEU 47.A N LYS 10.A O.A no hydrogen 2.875 N/A LEU 47.A N LYS 10.A O.B no hydrogen 2.934 N/A ASP 49.A N HIS 7.A O no hydrogen 2.792 N/A ASN 50.A N HIS 23.A NE2 no hydrogen 2.919 N/A ASN 50.A ND2 HIS 23.A O no hydrogen 3.019 N/A GLY 52.A N THR 56.A OG1 no hydrogen 3.046 N/A ALA 53.A N ASN 50.A O no hydrogen 3.046 N/A THR 55.A OG1 ASP 49.A OD2 no hydrogen 2.689 N/A THR 56.A N ALA 53.A O no hydrogen 2.906 N/A THR 56.A OG1 ALA 53.A O no hydrogen 2.702 N/A ASP 59.A N ASN 57.A OD1 no hydrogen 2.868 N/A TYR 60.A N ASN 57.A O no hydrogen 2.966 N/A PHE 61.A N PRO 58.A O no hydrogen 3.032 N/A ARG 65.A N ASP 62.A OD1 no hydrogen 3.065 N/A ARG 65.A NE TYR 66.A OH no hydrogen 3.339 N/A ARG 65.A NE ASP 75.A OD1 no hydrogen 3.125 N/A ARG 65.A NH2 ASP 75.A OD1 no hydrogen 2.736 N/A TYR 66.A N ASP 62.A O no hydrogen 3.059 N/A TYR 66.A OH ASP 75.A OD1 no hydrogen 3.293 N/A TYR 66.A OH ASP 75.A OD2 no hydrogen 2.564 N/A SER 67.A N ASP 64.A O no hydrogen 3.253 N/A SER 67.A OG ASP 64.A O no hydrogen 2.832 N/A GLU 70.A N ASN 68.A OD1.A no hydrogen 2.833 N/A GLY 71.A N ASN 68.A O.A no hydrogen 3.100 N/A GLY 71.A N ASN 68.A O.B no hydrogen 3.082 N/A SER 73.A N.A LEU 69.A O no hydrogen 3.102 N/A SER 73.A N.B LEU 69.A O no hydrogen 3.122 N/A SER 73.A OG.A GLU 70.A O no hydrogen 2.793 N/A SER 73.A OG.B LEU 69.A O no hydrogen 3.441 N/A SER 73.A OG.B ILE 99.A O no hydrogen 2.873 N/A PHE 74.A N GLU 70.A O no hydrogen 2.889 N/A ASP 75.A N GLY 71.A O no hydrogen 3.171 N/A LEU 76.A N TYR 72.A O no hydrogen 3.014 N/A ILE 77.A N.A SER 73.A O.A no hydrogen 3.076 N/A ILE 77.A N.A SER 73.A O.B no hydrogen 3.009 N/A ILE 77.A N.B SER 73.A O.A no hydrogen 3.035 N/A ILE 77.A N.B SER 73.A O.B no hydrogen 2.967 N/A ALA 78.A N PHE 74.A O no hydrogen 2.903 N/A ILE 79.A N ASP 75.A O no hydrogen 2.985 N/A LEU 80.A N LEU 76.A O no hydrogen 3.039 N/A GLU 81.A N.A ILE 77.A O.A no hydrogen 2.794 N/A GLU 81.A N.A ILE 77.A O.B no hydrogen 2.917 N/A GLU 81.A N.B ILE 77.A O.A no hydrogen 2.773 N/A GLU 81.A N.B ILE 77.A O.B no hydrogen 2.900 N/A ASP 82.A N ALA 78.A O no hydrogen 2.822 N/A LEU 83.A N ILE 79.A O no hydrogen 3.009 N/A LYS 84.A N GLU 81.A O.A no hydrogen 3.030 N/A LYS 84.A N GLU 81.A O.B no hydrogen 2.889 N/A ILE 85.A N LEU 80.A O no hydrogen 2.960 N/A CYS 88.A N LEU 110.A O no hydrogen 2.878 N/A CYS 88.A SG LEU 110.A O no hydrogen 3.663 N/A ILE 89.A N THR 18.A O no hydrogen 2.955 N/A PHE 90.A N LYS 113.A O no hydrogen 3.004 N/A VAL 91.A N VAL 20.A O no hydrogen 2.870 N/A GLY 92.A N VAL 115.A O no hydrogen 2.830 N/A HIS 93.A N GLY 22.A O no hydrogen 2.896 N/A HIS 93.A NE2 HIS 245.A O no hydrogen 2.846 N/A SER 94.A N ILE 117.A O.A no hydrogen 2.775 N/A SER 94.A N ILE 117.A O.B no hydrogen 2.745 N/A SER 94.A OG HIS 245.A NE2 no hydrogen 2.657 N/A SER 96.A N HIS 93.A O no hydrogen 2.940 N/A SER 96.A OG HIS 23.A O no hydrogen 2.740 N/A ALA 97.A N SER 94.A O no hydrogen 2.886 N/A ILE 99.A N VAL 95.A O no hydrogen 2.968 N/A GLY 100.A N SER 96.A O no hydrogen 2.876 N/A VAL 101.A N ALA 97.A O no hydrogen 3.019 N/A LEU 102.A N.A MET 98.A O no hydrogen 2.923 N/A LEU 102.A N.B MET 98.A O no hydrogen 2.881 N/A ALA 103.A N ILE 99.A O no hydrogen 2.961 N/A SER 104.A N GLY 100.A O no hydrogen 2.867 N/A SER 104.A OG VAL 101.A O no hydrogen 2.738 N/A LEU 105.A N VAL 101.A O no hydrogen 3.184 N/A LEU 105.A N LEU 102.A O.A no hydrogen 2.983 N/A LEU 105.A N LEU 102.A O.B no hydrogen 3.273 N/A ASN 106.A N LEU 102.A O.A no hydrogen 3.417 N/A ARG 107.A N ALA 103.A O no hydrogen 2.878 N/A ARG 107.A NE ASP 109.A OD1 no hydrogen 2.948 N/A ARG 107.A NH1 GLU 81.A OE1.B no hydrogen 2.764 N/A ARG 107.A NH2 ASP 109.A OD2 no hydrogen 2.847 N/A LEU 110.A N ARG 107.A O no hydrogen 3.068 N/A PHE 111.A N PRO 108.A O no hydrogen 3.112 N/A SER 112.A N CYS 88.A O no hydrogen 2.865 N/A SER 112.A OG CYS 88.A O no hydrogen 3.389 N/A LYS 113.A NZ HIS 262.A O no hydrogen 2.852 N/A LYS 113.A NZ ILE 263.A O no hydrogen 2.890 N/A LYS 113.A NZ ASN 265.A O no hydrogen 3.010 N/A LYS 113.A NZ ASP 266.A OD1 no hydrogen 2.724 N/A ILE 114.A N PRO 207.A O no hydrogen 2.943 N/A VAL 115.A N PHE 90.A O no hydrogen 2.804 N/A MET 116.A N HIS 209.A O no hydrogen 2.740 N/A ILE 117.A N.A GLY 92.A O no hydrogen 2.943 N/A ILE 117.A N.B GLY 92.A O no hydrogen 2.895 N/A SER 118.A N LEU 211.A O no hydrogen 2.925 N/A SER 118.A OG HIS 245.A O no hydrogen 2.893 N/A ARG 122.A N SER 120.A OG no hydrogen 3.110 N/A ARG 122.A NH1 SER 195.A O no hydrogen 3.152 N/A ASN 125.A N PHE 133.A O no hydrogen 2.823 N/A ASN 125.A ND2 GLU 134.A OE2 no hydrogen 2.876 N/A ASP 126.A N TYR 129.A O no hydrogen 2.908 N/A ASP 128.A N ASP 126.A OD1 no hydrogen 2.874 N/A TYR 129.A N ASP 126.A O no hydrogen 3.158 N/A TYR 129.A OH ARG 122.A O no hydrogen 2.775 N/A GLY 131.A N ASN 125.A OD1 no hydrogen 2.766 N/A GLY 132.A N ASN 125.A OD1 no hydrogen 2.887 N/A PHE 133.A N TYR 123.A O no hydrogen 3.051 N/A GLU 134.A N ASP 137.A OD1.B no hydrogen 2.833 N/A GLN 135.A NE2 GLN 194.A OE1 no hydrogen 2.957 N/A GLU 136.A N GLU 136.A OE1 no hydrogen 2.724 N/A ASP 137.A N.A GLU 134.A O no hydrogen 2.992 N/A LEU 138.A N GLU 134.A O no hydrogen 3.184 N/A ASN 139.A N GLN 135.A O no hydrogen 2.834 N/A GLN 140.A N GLU 136.A O no hydrogen 3.119 N/A GLN 140.A NE2 GLU 136.A O no hydrogen 3.333 N/A LEU 141.A N ASP 137.A O.A no hydrogen 2.954 N/A LEU 141.A N ASP 137.A O.B no hydrogen 3.183 N/A PHE 142.A N LEU 138.A O no hydrogen 2.936 N/A GLU 143.A N ASN 139.A O no hydrogen 3.035 N/A ALA 144.A N GLN 140.A O no hydrogen 2.947 N/A ILE 145.A N LEU 141.A O no hydrogen 3.048 N/A ARG 146.A N.A PHE 142.A O no hydrogen 2.946 N/A ARG 146.A N.B PHE 142.A O no hydrogen 2.991 N/A SER 147.A N GLU 143.A O no hydrogen 2.882 N/A SER 147.A OG.A GLU 143.A O no hydrogen 3.256 N/A SER 147.A OG.A ALA 144.A O no hydrogen 3.281 N/A ASN 148.A N ALA 144.A O no hydrogen 3.230 N/A TYR 149.A OH LEU 177.A O no hydrogen 2.750 N/A ALA 151.A N ASN 148.A OD1 no hydrogen 3.070 N/A TRP 152.A N ASN 148.A O no hydrogen 2.974 N/A CYS 153.A N TYR 149.A O no hydrogen 2.870 N/A CYS 153.A SG TYR 149.A O no hydrogen 3.381 N/A LEU 154.A N LYS 150.A O no hydrogen 2.962 N/A GLY 155.A N ALA 151.A O no hydrogen 3.097 N/A PHE 156.A N TRP 152.A O no hydrogen 2.801 N/A ALA 157.A N CYS 153.A O no hydrogen 3.009 N/A ALA 160.A N PHE 156.A O no hydrogen 2.906 N/A VAL 161.A N ALA 157.A O no hydrogen 2.961 N/A GLY 162.A N PRO 158.A O no hydrogen 2.935 N/A GLY 163.A N ASP 243.A OD2 no hydrogen 2.878 N/A ASP 166.A N ASP 164.A OD1 no hydrogen 2.845 N/A SER 167.A N ASP 164.A O no hydrogen 3.093 N/A SER 167.A OG ASP 164.A O no hydrogen 3.417 N/A VAL 170.A N SER 167.A OG no hydrogen 3.012 N/A GLN 171.A N SER 167.A O no hydrogen 3.043 N/A GLN 171.A NE2 ASP 166.A O no hydrogen 2.964 N/A GLU 172.A N ILE 168.A O no hydrogen 2.855 N/A PHE 173.A N ALA 169.A O no hydrogen 2.977 N/A SER 174.A N.A VAL 170.A O no hydrogen 2.856 N/A SER 174.A N.B VAL 170.A O no hydrogen 2.905 N/A SER 174.A OG.B VAL 170.A O no hydrogen 2.801 N/A ARG 175.A N GLN 171.A O no hydrogen 3.078 N/A THR 176.A N GLU 172.A O no hydrogen 2.977 N/A THR 176.A OG1 GLY 26.A O no hydrogen 2.686 N/A THR 176.A OG1 GLU 172.A O no hydrogen 3.454 N/A THR 176.A OG1 PHE 173.A O no hydrogen 3.273 N/A LEU 177.A N PHE 173.A O no hydrogen 2.809 N/A PHE 178.A N SER 174.A O.A no hydrogen 3.108 N/A PHE 178.A N SER 174.A O.B no hydrogen 2.940 N/A ASN 179.A N ARG 175.A O no hydrogen 3.034 N/A ASN 179.A N THR 176.A O no hydrogen 3.190 N/A MET 180.A N.A LEU 177.A O no hydrogen 3.189 N/A MET 180.A N.B LEU 177.A O no hydrogen 3.139 N/A ARG 181.A NE ASP 183.A OD1 no hydrogen 2.718 N/A ARG 181.A NH2 ASP 183.A OD1 no hydrogen 3.552 N/A ARG 181.A NH2 ASP 183.A OD2 no hydrogen 2.859 N/A ALA 185.A N ARG 181.A O no hydrogen 2.937 N/A LEU 186.A N PRO 182.A O no hydrogen 2.995 N/A SER 187.A N ASP 183.A O no hydrogen 3.070 N/A VAL 188.A N ILE 184.A O no hydrogen 2.824 N/A GLY 189.A N ALA 185.A O no hydrogen 2.849 N/A GLN 190.A N LEU 186.A O no hydrogen 3.019 N/A THR 191.A N SER 187.A O no hydrogen 2.950 N/A THR 191.A OG1 SER 187.A O no hydrogen 3.112 N/A ILE 192.A N VAL 188.A O no hydrogen 2.882 N/A PHE 193.A N GLY 189.A O no hydrogen 2.861 N/A GLN 194.A N GLN 190.A O no hydrogen 2.954 N/A GLN 194.A NE2 GLN 135.A OE1 no hydrogen 2.827 N/A SER 195.A N ILE 192.A O no hydrogen 3.064 N/A SER 195.A OG ILE 192.A O no hydrogen 2.712 N/A MET 197.A N.A PRO 121.A O no hydrogen 2.768 N/A MET 197.A N.B PRO 121.A O no hydrogen 2.764 N/A ARG 198.A N ASP 196.A OD1 no hydrogen 3.060 N/A ARG 198.A NE ASP 196.A OD1 no hydrogen 2.899 N/A ARG 198.A NH1 ASP 126.A OD2 no hydrogen 2.914 N/A ARG 198.A NH2 ASP 196.A OD2 no hydrogen 2.871 N/A GLN 199.A NE2 ASP 196.A O no hydrogen 3.600 N/A ILE 200.A N MET 197.A O.A no hydrogen 3.064 N/A LEU 201.A N ARG 198.A O no hydrogen 3.290 N/A PHE 203.A N ILE 200.A O no hydrogen 2.964 N/A VAL 204.A N LEU 201.A O no hydrogen 3.180 N/A CYS 208.A N GLU 234.A O no hydrogen 3.076 N/A CYS 208.A SG VAL 206.A O no hydrogen 3.479 N/A HIS 209.A N ILE 114.A O no hydrogen 2.856 N/A HIS 209.A ND1 HIS 262.A ND1 no hydrogen 2.870 N/A ILE 210.A N VAL 236.A O no hydrogen 2.776 N/A LEU 211.A N MET 116.A O no hydrogen 2.915 N/A GLN 212.A N GLU 238.A O no hydrogen 3.389 N/A GLN 212.A NE2 PRO 220.A O no hydrogen 3.642 N/A GLN 212.A NE2 SER 224.A OG.B no hydrogen 2.130 N/A SER 213.A OG SER 242.A OG no hydrogen 2.807 N/A SER 213.A OG GLY 244.A O no hydrogen 2.763 N/A VAL 214.A N ILE 240.A O no hydrogen 2.928 N/A LYS 215.A N SER 242.A O no hydrogen 3.393 N/A ALA 218.A N ASP 216.A OD1 no hydrogen 2.854 N/A VAL 219.A N ASP 216.A O no hydrogen 3.176 N/A VAL 223.A N PRO 220.A O no hydrogen 2.891 N/A SER 224.A N.A VAL 221.A O no hydrogen 2.980 N/A SER 224.A N.B VAL 221.A O no hydrogen 2.995 N/A SER 224.A OG.A VAL 221.A O no hydrogen 2.694 N/A TYR 226.A N VAL 222.A O no hydrogen 2.908 N/A LEU 227.A N VAL 223.A O no hydrogen 2.903 N/A HIS 228.A N SER 224.A O.A no hydrogen 3.020 N/A HIS 228.A N SER 224.A O.B no hydrogen 3.044 N/A HIS 228.A ND1 SER 235.A OG no hydrogen 2.730 N/A ALA 229.A N GLU 225.A O no hydrogen 2.830 N/A ASN 230.A N TYR 226.A O no hydrogen 2.988 N/A ASN 230.A N LEU 227.A O no hydrogen 3.289 N/A ASN 230.A ND2 TYR 226.A O no hydrogen 2.930 N/A LEU 231.A N LEU 227.A O no hydrogen 2.896 N/A GLY 232.A N LEU 201.A O no hydrogen 2.980 N/A CYS 233.A SG VAL 206.A O no hydrogen 3.301 N/A CYS 233.A SG GLU 234.A O no hydrogen 3.502 N/A SER 235.A OG HIS 228.A ND1 no hydrogen 2.730 N/A VAL 236.A N CYS 208.A O no hydrogen 3.107 N/A GLU 238.A N ILE 210.A O no hydrogen 2.903 N/A ILE 240.A N GLN 212.A O no hydrogen 2.782 N/A SER 242.A N ILE 240.A O no hydrogen 2.752 N/A SER 242.A OG SER 213.A OG no hydrogen 2.807 N/A GLY 244.A N LYS 215.A O no hydrogen 2.786 N/A HIS 245.A N ALA 160.A O no hydrogen 2.896 N/A HIS 245.A ND1 ASP 216.A OD1 no hydrogen 2.883 N/A HIS 245.A ND1 ASP 216.A OD2 no hydrogen 2.939 N/A HIS 245.A NE2 SER 94.A OG no hydrogen 2.657 N/A GLN 248.A N GLN 248.A OE1 no hydrogen 2.727 N/A LEU 249.A N LEU 246.A O no hydrogen 2.926 N/A SER 250.A N LEU 246.A O no hydrogen 3.111 N/A SER 250.A OG LEU 246.A O no hydrogen 3.264 N/A SER 251.A N PRO 247.A O no hydrogen 2.873 N/A SER 251.A OG.B SER 254.A OG no hydrogen 2.877 N/A SER 254.A N SER 251.A O no hydrogen 3.243 N/A SER 254.A OG SER 251.A O no hydrogen 3.309 N/A SER 254.A OG SER 251.A OG.B no hydrogen 2.877 N/A VAL 255.A N SER 251.A O no hydrogen 3.072 N/A VAL 255.A N PRO 252.A O no hydrogen 3.224 N/A ILE 256.A N PRO 252.A O no hydrogen 2.867 N/A ILE 259.A N VAL 255.A O no hydrogen 3.103 N/A LEU 260.A N ILE 256.A O no hydrogen 2.905 N/A ARG 261.A N.A PRO 257.A O no hydrogen 3.063 N/A ARG 261.A N.B PRO 257.A O no hydrogen 3.043 N/A ARG 261.A NH1.A GLU 238.A OE2 no hydrogen 2.853 N/A ARG 261.A NH2.A GLU 238.A OE1 no hydrogen 2.791 N/A ARG 261.A NH2.A GLU 238.A OE2 no hydrogen 3.503 N/A HIS 262.A N VAL 258.A O no hydrogen 3.187 N/A HIS 262.A ND1 HIS 209.A ND1 no hydrogen 2.870 N/A HIS 262.A NE2 GLU 238.A OE2 no hydrogen 2.788 N/A ILE 263.A N ILE 259.A O no hydrogen 2.923 N/A ARG 264.A N LEU 260.A O no hydrogen 2.872 N/A ARG 264.A NH1 HIS 38.A O no hydrogen 3.138 N/A ASN 265.A N ARG 261.A O.A no hydrogen 3.041 N/A ASN 265.A ND2 ARG 261.A O.A no hydrogen 2.931 N/A ASN 265.A ND2 ARG 261.A O.B no hydrogen 2.911 N/A