Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dwf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 7.A N ARG 4.A O no hydrogen 2.802 N/A LEU 8.A N PRO 5.A O no hydrogen 3.240 N/A GLN 9.A N GLU 6.A O no hydrogen 3.224 N/A GLY 10.A N GLY 34.A O no hydrogen 2.914 N/A LYS 11.A N LEU 8.A O no hydrogen 3.128 N/A LYS 12.A N ASP 90.A OD2 no hydrogen 2.626 N/A LYS 12.A NZ MET 86.A O no hydrogen 3.176 N/A LYS 12.A NZ GLY 87.A O no hydrogen 2.961 N/A VAL 13.A N HIS 36.A O no hydrogen 2.923 N/A ILE 14.A N MET 91.A O no hydrogen 2.899 N/A VAL 15.A N VAL 38.A O no hydrogen 3.094 N/A THR 16.A N ILE 93.A O no hydrogen 3.172 N/A THR 16.A OG1 HIS 96.A ND1 no hydrogen 2.750 N/A ALA 18.A N THR 40.A O no hydrogen 3.057 N/A ARG 24.A N LYS 20.A O no hydrogen 3.198 N/A GLU 25.A N GLY 21.A O no hydrogen 3.315 N/A ILE 26.A N ILE 22.A O no hydrogen 2.854 N/A ALA 27.A N GLY 23.A O no hydrogen 3.013 N/A TYR 28.A N ARG 24.A O no hydrogen 2.999 N/A HIS 29.A N GLU 25.A O no hydrogen 3.034 N/A HIS 29.A NE2 GLU 215.A O no hydrogen 2.788 N/A LEU 30.A N ILE 26.A O no hydrogen 3.088 N/A ALA 31.A N ALA 27.A O no hydrogen 2.966 N/A LYS 32.A N TYR 28.A O no hydrogen 2.996 N/A MET 33.A N HIS 29.A O no hydrogen 3.089 N/A MET 33.A N LEU 30.A O no hydrogen 3.153 N/A GLY 34.A N ALA 31.A O no hydrogen 2.929 N/A ALA 35.A N LEU 30.A O no hydrogen 3.084 N/A HIS 36.A N LYS 11.A O no hydrogen 2.809 N/A HIS 36.A ND1 SER 61.A OG no hydrogen 2.734 N/A VAL 37.A N SER 61.A O no hydrogen 2.951 N/A VAL 38.A N VAL 13.A O no hydrogen 2.996 N/A VAL 39.A N HIS 63.A O no hydrogen 2.928 N/A THR 40.A N VAL 15.A O no hydrogen 3.012 N/A THR 40.A OG1 ILE 65.A O no hydrogen 2.549 N/A LEU 47.A N SER 43.A O no hydrogen 3.102 N/A GLN 48.A N LYS 44.A O no hydrogen 2.853 N/A LYS 49.A N GLU 45.A O no hydrogen 3.092 N/A VAL 50.A N ALA 46.A O no hydrogen 3.102 N/A VAL 51.A N LEU 47.A O no hydrogen 2.905 N/A ALA 52.A N GLN 48.A O no hydrogen 3.044 N/A ARG 53.A N LYS 49.A O no hydrogen 2.981 N/A ARG 53.A NH1 GLU 56.A OE1 no hydrogen 3.457 N/A CYS 54.A N VAL 50.A O no hydrogen 2.905 N/A CYS 54.A SG VAL 50.A O no hydrogen 3.179 N/A LEU 55.A N VAL 51.A O no hydrogen 3.079 N/A GLU 56.A N ALA 52.A O no hydrogen 3.132 N/A LEU 57.A N ARG 53.A O no hydrogen 2.851 N/A LEU 57.A N CYS 54.A O no hydrogen 3.110 N/A GLY 58.A N CYS 54.A O no hydrogen 3.105 N/A GLY 58.A N LEU 55.A O no hydrogen 3.184 N/A ALA 59.A N CYS 54.A O no hydrogen 3.016 N/A ALA 60.A N ALA 35.A O no hydrogen 2.999 N/A SER 61.A OG HIS 36.A ND1 no hydrogen 2.734 N/A HIS 63.A N VAL 37.A O no hydrogen 3.075 N/A ILE 65.A N VAL 39.A O no hydrogen 3.079 N/A GLY 67.A N ALA 41.A O no hydrogen 2.947 N/A GLU 70.A N SER 68.A OG no hydrogen 3.291 N/A ASP 71.A N SER 68.A O no hydrogen 3.293 N/A THR 73.A N ASP 71.A OD1 no hydrogen 2.906 N/A PHE 74.A N ASP 71.A OD1 no hydrogen 3.354 N/A ALA 75.A N ASP 71.A O no hydrogen 3.166 N/A GLU 76.A N MET 72.A O no hydrogen 3.043 N/A GLU 77.A N THR 73.A O no hydrogen 2.892 N/A PHE 78.A N PHE 74.A O no hydrogen 2.599 N/A VAL 79.A N ALA 75.A O no hydrogen 3.442 N/A GLU 81.A N GLU 77.A O no hydrogen 3.068 N/A ALA 82.A N PHE 78.A O no hydrogen 2.911 N/A GLY 83.A N VAL 79.A O no hydrogen 2.948 N/A ASN 84.A N ALA 80.A O no hydrogen 2.945 N/A LEU 85.A N GLU 81.A O no hydrogen 2.941 N/A MET 86.A N ALA 82.A O no hydrogen 3.149 N/A GLY 88.A N GLY 83.A O no hydrogen 2.871 N/A ASP 90.A N LYS 12.A O no hydrogen 2.721 N/A MET 91.A N LYS 12.A O no hydrogen 3.129 N/A LEU 92.A N SER 140.A O no hydrogen 2.961 N/A ILE 93.A N ILE 14.A O no hydrogen 2.794 N/A LEU 94.A N ALA 142.A O no hydrogen 2.767 N/A ASN 95.A N THR 16.A OG1 no hydrogen 2.974 N/A ASN 95.A ND2 THR 16.A O no hydrogen 3.224 N/A HIS 96.A N THR 16.A OG1 no hydrogen 3.228 N/A HIS 96.A ND1 THR 16.A OG1 no hydrogen 2.750 N/A HIS 96.A NE2 SER 122.A OG no hydrogen 2.738 N/A LEU 98.A N ASN 119.A OD1 no hydrogen 2.850 N/A ARG 101.A NH1 ALA 202.A O no hydrogen 2.808 N/A ARG 101.A NH1 SER 204.A O no hydrogen 3.393 N/A THR 103.A N LEU 155.A O no hydrogen 3.126 N/A THR 103.A OG1 PHE 104.A O no hydrogen 3.020 N/A HIS 106.A N GLU 108.A OE1 no hydrogen 3.297 N/A HIS 106.A N GLU 108.A OE2 no hydrogen 2.886 N/A GLU 108.A N GLU 108.A OE1 no hydrogen 2.632 N/A ILE 109.A N GLY 107.A O no hydrogen 2.633 N/A ASN 111.A ND2 ASN 100.A OD1 no hydrogen 2.916 N/A VAL 112.A N GLU 108.A O no hydrogen 3.243 N/A ARG 113.A N ILE 109.A O no hydrogen 2.956 N/A LYS 114.A N ASP 110.A O no hydrogen 2.965 N/A SER 115.A N ASN 111.A O no hydrogen 2.945 N/A SER 115.A OG ASN 111.A O no hydrogen 2.844 N/A MET 116.A N VAL 112.A O no hydrogen 3.117 N/A GLU 117.A N ARG 113.A O no hydrogen 2.982 N/A VAL 118.A N LYS 114.A O no hydrogen 2.993 N/A ASN 119.A N SER 115.A O no hydrogen 2.841 N/A ASN 119.A ND2 LEU 98.A O no hydrogen 3.689 N/A ASN 119.A ND2 SER 162.A OG no hydrogen 3.056 N/A PHE 120.A N MET 116.A O no hydrogen 3.109 N/A HIS 121.A N MET 116.A O no hydrogen 2.900 N/A SER 122.A N GLU 117.A O no hydrogen 3.111 N/A SER 122.A OG HIS 96.A NE2 no hydrogen 2.738 N/A SER 122.A OG VAL 118.A O no hydrogen 2.743 N/A VAL 124.A N PHE 120.A O no hydrogen 3.178 N/A VAL 125.A N HIS 121.A O no hydrogen 2.938 N/A LEU 126.A N SER 122.A O no hydrogen 2.898 N/A SER 127.A N PHE 123.A O no hydrogen 3.037 N/A SER 127.A OG PHE 123.A O no hydrogen 2.902 N/A VAL 128.A N VAL 124.A O no hydrogen 2.934 N/A ALA 129.A N VAL 125.A O no hydrogen 2.980 N/A ALA 130.A N LEU 126.A O no hydrogen 2.986 N/A ALA 130.A N SER 127.A O no hydrogen 3.153 N/A MET 131.A N VAL 128.A O no hydrogen 3.357 N/A LEU 134.A N ALA 130.A O no hydrogen 2.927 N/A MET 135.A N MET 131.A O no hydrogen 2.787 N/A GLN 136.A N PRO 132.A O no hydrogen 3.084 N/A SER 137.A N MET 133.A O no hydrogen 3.108 N/A SER 137.A OG LEU 89.A O no hydrogen 2.697 N/A SER 137.A OG MET 133.A O no hydrogen 3.255 N/A SER 137.A OG LEU 134.A O no hydrogen 3.395 N/A GLN 138.A N MET 135.A O no hydrogen 3.155 N/A GLY 139.A N LEU 134.A O no hydrogen 2.783 N/A SER 140.A N ASP 90.A O no hydrogen 2.855 N/A SER 140.A OG SER 185.A OG no hydrogen 2.868 N/A ILE 141.A N SER 185.A O no hydrogen 2.775 N/A ALA 142.A N LEU 92.A O no hydrogen 2.870 N/A VAL 143.A N THR 187.A O no hydrogen 2.814 N/A VAL 144.A N LEU 94.A O no hydrogen 2.942 N/A SER 145.A N CYS 189.A O no hydrogen 2.727 N/A VAL 147.A N LEU 191.A O no hydrogen 2.964 N/A ALA 148.A N SER 146.A OG no hydrogen 3.009 N/A GLY 149.A N SER 146.A O no hydrogen 2.656 N/A LYS 150.A N VAL 147.A O no hydrogen 3.084 N/A LYS 150.A NZ ASP 167.A OD2 no hydrogen 3.018 N/A LYS 150.A NZ GLU 231.A OE2 no hydrogen 2.843 N/A ILE 151.A N VAL 147.A O no hydrogen 3.020 N/A SER 160.A N ILE 156.A O no hydrogen 2.913 N/A SER 160.A OG ALA 148.A O no hydrogen 2.811 N/A ALA 161.A N ALA 157.A O no hydrogen 2.960 N/A SER 162.A N PRO 158.A O no hydrogen 3.407 N/A SER 162.A OG TYR 159.A O no hydrogen 2.715 N/A LYS 163.A N TYR 159.A O no hydrogen 3.049 N/A LYS 163.A NZ VAL 144.A O no hydrogen 2.914 N/A PHE 164.A N SER 160.A O no hydrogen 2.841 N/A ALA 165.A N ALA 161.A O no hydrogen 2.909 N/A LEU 166.A N SER 162.A O no hydrogen 3.190 N/A ASP 167.A N LYS 163.A O no hydrogen 3.311 N/A GLY 168.A N PHE 164.A O no hydrogen 3.034 N/A PHE 169.A N ALA 165.A O no hydrogen 2.962 N/A PHE 170.A N LEU 166.A O no hydrogen 2.914 N/A SER 171.A N ASP 167.A O no hydrogen 2.980 N/A SER 171.A OG ASP 167.A O no hydrogen 2.928 N/A SER 171.A OG ASP 167.A OD1 no hydrogen 2.701 N/A THR 172.A N GLY 168.A O no hydrogen 3.333 N/A THR 172.A OG1 GLY 168.A O no hydrogen 2.797 N/A LEU 173.A N PHE 169.A O no hydrogen 2.969 N/A ARG 174.A N PHE 170.A O no hydrogen 2.969 N/A ARG 174.A NE ILE 186.A O no hydrogen 2.857 N/A ARG 174.A NH2 ILE 186.A O no hydrogen 3.103 N/A SER 175.A N SER 171.A O no hydrogen 3.211 N/A SER 175.A OG SER 171.A O no hydrogen 3.246 N/A GLU 176.A N THR 172.A O no hydrogen 3.058 N/A PHE 177.A N LEU 173.A O no hydrogen 2.875 N/A LEU 178.A N ARG 174.A O no hydrogen 2.925 N/A VAL 179.A N SER 175.A O no hydrogen 3.051 N/A ASN 180.A N GLU 176.A O no hydrogen 2.820 N/A LYS 181.A N LEU 178.A O no hydrogen 3.064 N/A VAL 182.A N PHE 177.A O no hydrogen 2.789 N/A ASN 183.A ND2 GLN 138.A OE1 no hydrogen 2.990 N/A SER 185.A N GLY 139.A O no hydrogen 3.154 N/A THR 187.A N ILE 141.A O no hydrogen 2.800 N/A THR 187.A OG1 GLN 229.A O no hydrogen 2.538 N/A LEU 188.A N ASP 230.A O no hydrogen 2.863 N/A CYS 189.A N VAL 143.A O no hydrogen 2.902 N/A ILE 190.A N MET 232.A O no hydrogen 2.765 N/A GLY 192.A N TYR 234.A O no hydrogen 2.907 N/A ASP 195.A N SER 212.A O no hydrogen 2.839 N/A THR 196.A N ILE 194.A O no hydrogen 2.796 N/A ALA 199.A N THR 196.A OG1 no hydrogen 3.232 N/A ILE 200.A N THR 196.A O no hydrogen 3.016 N/A LYS 201.A N GLU 197.A O no hydrogen 3.075 N/A LYS 201.A NZ GLU 197.A OE2 no hydrogen 3.244 N/A ALA 202.A N THR 198.A O no hydrogen 3.117 N/A THR 203.A N ALA 199.A O no hydrogen 3.248 N/A THR 203.A OG1 ALA 199.A O no hydrogen 3.040 N/A SER 204.A N ILE 200.A O no hydrogen 2.900 N/A ILE 206.A N THR 203.A O no hydrogen 2.787 N/A TYR 207.A N THR 203.A O no hydrogen 2.807 N/A SER 212.A N LEU 193.A O no hydrogen 2.734 N/A LYS 214.A N ASP 195.A OD1 no hydrogen 2.902 N/A CYS 217.A N PRO 213.A O no hydrogen 3.254 N/A ALA 218.A N LYS 214.A O no hydrogen 2.960 N/A LEU 219.A N GLU 215.A O no hydrogen 3.252 N/A GLU 220.A N GLU 216.A O no hydrogen 2.913 N/A ILE 221.A N CYS 217.A O no hydrogen 3.020 N/A ILE 222.A N ALA 218.A O no hydrogen 3.145 N/A LYS 223.A N LEU 219.A O no hydrogen 2.921 N/A GLY 224.A N GLU 220.A O no hydrogen 2.992 N/A THR 225.A N ILE 221.A O no hydrogen 3.149 N/A THR 225.A OG1 ILE 221.A O no hydrogen 2.867 N/A ALA 226.A N ILE 222.A O no hydrogen 2.898 N/A LEU 227.A N LYS 223.A O no hydrogen 2.862 N/A ARG 228.A N THR 225.A O no hydrogen 2.887 N/A ARG 228.A NH1 GLN 138.A O no hydrogen 3.187 N/A ARG 228.A NH2 GLN 138.A O no hydrogen 3.335 N/A ARG 228.A NH2 GLY 139.A O no hydrogen 3.476 N/A ARG 228.A NH2 ASN 183.A OD1 no hydrogen 3.358 N/A GLN 229.A N GLY 224.A O no hydrogen 2.984 N/A MET 232.A N LEU 188.A O no hydrogen 2.889 N/A TYR 233.A OH GLU 231.A OE1 no hydrogen 2.823 N/A TYR 234.A N ILE 190.A O no hydrogen 2.962 N/A TYR 234.A OH GLU 216.A OE1 no hydrogen 2.661 N/A TRP 239.A N SER 237.A OG no hydrogen 3.152 N/A VAL 240.A N SER 237.A OG no hydrogen 3.298 N/A TYR 242.A N TRP 239.A O no hydrogen 3.032 N/A LEU 243.A N VAL 240.A O no hydrogen 2.906 N/A LEU 244.A N VAL 240.A O no hydrogen 3.126 N/A LEU 244.A N PRO 241.A O no hydrogen 3.339 N/A GLY 245.A N PRO 241.A O no hydrogen 2.804 N/A ARG 249.A N ASN 246.A O no hydrogen 3.084 N/A ARG 249.A N ASN 246.A OD1 no hydrogen 3.160 N/A ARG 249.A NE GLU 253.A OE2 no hydrogen 2.922 N/A ARG 249.A NH1 ASP 167.A OD1 no hydrogen 3.554 N/A ARG 249.A NH1 ASP 167.A OD2 no hydrogen 2.853 N/A ARG 249.A NH2 ASP 167.A OD1 no hydrogen 2.900 N/A LYS 250.A N ASN 246.A O no hydrogen 3.397 N/A LYS 250.A NZ GLY 245.A O no hydrogen 3.002 N/A ILE 251.A N PRO 247.A O no hydrogen 3.037 N/A MET 252.A N GLY 248.A O no hydrogen 2.953 N/A GLU 253.A N ARG 249.A O no hydrogen 2.892 N/A GLU 254.A N LYS 250.A O no hydrogen 3.061 N/A LEU 255.A N ILE 251.A O no hydrogen 2.929 N/A SER 256.A N MET 252.A O no hydrogen 2.864 N/A SER 256.A OG MET 252.A O no hydrogen 3.285 N/A ALA 258.A N LEU 255.A O no hydrogen 3.159 N/A GLU 259.A N SER 256.A O no hydrogen 3.052 N/A TRP 262.A NE1 ALA 257.A O no hydrogen 3.212 N/A ASP 263.A N ASN 261.A OD1 no hydrogen 3.288 N/A LEU 266.A N TRP 262.A O no hydrogen 3.112 N/A ASN 268.A N VAL 265.A O no hydrogen 2.809 N/A