Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dog_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 3.A OE1 no hydrogen 2.106 N/A SER 1.A N GLU 3.A OE2 no hydrogen 3.078 N/A GLN 6.A N ARG 23.A O no hydrogen 2.921 N/A GLN 6.A NE2 LYS 7.A O no hydrogen 3.477 N/A VAL 8.A N LYS 21.A O no hydrogen 2.681 N/A LYS 10.A NZ GLU 13.A OE2 no hydrogen 3.011 N/A ILE 11.A N VAL 19.A O no hydrogen 2.845 N/A GLY 12.A N VAL 19.A O no hydrogen 3.363 N/A THR 15.A N ASP 145.A OD2 no hydrogen 3.078 N/A THR 15.A OG1 ASP 145.A OD1 no hydrogen 3.139 N/A THR 15.A OG1 ASP 145.A OD2 no hydrogen 2.890 N/A TYR 16.A OH GLU 51.A OE1 no hydrogen 2.619 N/A VAL 18.A N LYS 35.A O no hydrogen 2.878 N/A VAL 19.A N GLY 12.A O no hydrogen 2.931 N/A TYR 20.A N LEU 33.A O no hydrogen 2.894 N/A LYS 21.A N GLU 9.A O no hydrogen 2.849 N/A ALA 22.A N VAL 31.A O no hydrogen 2.931 N/A ARG 23.A N GLN 6.A O no hydrogen 3.042 N/A ASN 24.A N GLU 29.A O no hydrogen 2.733 N/A LYS 25.A N ASN 4.A O no hydrogen 2.716 N/A LYS 25.A NZ GLU 3.A O no hydrogen 2.927 N/A LEU 26.A N ASN 24.A OD1 no hydrogen 2.969 N/A THR 27.A N ASN 24.A OD1 no hydrogen 3.007 N/A GLY 28.A N ASN 24.A O no hydrogen 2.984 N/A GLU 29.A N THR 27.A OG1 no hydrogen 3.213 N/A VAL 31.A N ALA 22.A O no hydrogen 2.777 N/A ALA 32.A N PHE 80.A O no hydrogen 3.050 N/A LEU 33.A N TYR 20.A O no hydrogen 2.720 N/A LYS 34.A N LEU 78.A O no hydrogen 2.863 N/A LYS 34.A NZ GLU 51.A OE1 no hydrogen 2.572 N/A LYS 34.A NZ GLU 51.A OE2 no hydrogen 3.452 N/A LYS 34.A NZ ASP 145.A OD1 no hydrogen 3.312 N/A LYS 35.A N VAL 18.A O no hydrogen 2.808 N/A ILE 36.A N LEU 76.A O no hydrogen 2.898 N/A THR 41.A N THR 39.A O no hydrogen 2.406 N/A THR 41.A OG1 THR 39.A O no hydrogen 2.679 N/A ILE 49.A N PRO 45.A O no hydrogen 3.061 N/A ARG 50.A N SER 46.A O no hydrogen 2.757 N/A GLU 51.A N THR 47.A O no hydrogen 2.882 N/A ILE 52.A N ALA 48.A O no hydrogen 2.808 N/A SER 53.A N ILE 49.A O no hydrogen 3.156 N/A SER 53.A OG ILE 49.A O no hydrogen 2.806 N/A SER 53.A OG ARG 50.A O no hydrogen 3.235 N/A LEU 54.A N ARG 50.A O no hydrogen 3.087 N/A LEU 55.A N GLU 51.A O no hydrogen 2.889 N/A LYS 56.A N ILE 52.A O no hydrogen 3.074 N/A GLU 57.A N LEU 54.A O no hydrogen 3.062 N/A LEU 58.A N LEU 54.A O no hydrogen 3.256 N/A ASN 59.A N GLU 57.A O no hydrogen 3.226 N/A ASN 62.A ND2 GLN 110.A OE1 no hydrogen 2.964 N/A ASN 62.A ND2 ILE 141.A O no hydrogen 3.203 N/A ILE 63.A N HIS 60.A O no hydrogen 3.218 N/A VAL 64.A N LEU 143.A O no hydrogen 3.034 N/A LYS 65.A N GLU 81.A OE2 no hydrogen 2.893 N/A LEU 67.A N VAL 79.A O no hydrogen 2.749 N/A ASP 68.A N VAL 79.A O no hydrogen 3.309 N/A VAL 69.A N ASP 68.A OD1 no hydrogen 2.779 N/A ILE 70.A N TYR 77.A O no hydrogen 2.799 N/A THR 72.A N LYS 75.A O no hydrogen 3.088 N/A LEU 76.A N ILE 36.A O no hydrogen 3.040 N/A TYR 77.A N ILE 70.A O no hydrogen 2.644 N/A LEU 78.A N LYS 34.A O no hydrogen 2.836 N/A VAL 79.A N ASP 68.A O no hydrogen 2.872 N/A PHE 80.A N ALA 32.A O no hydrogen 2.794 N/A GLU 81.A N LYS 65.A O no hydrogen 3.029 N/A HIS 84.A N ILE 135.A O no hydrogen 3.161 N/A GLN 85.A N ILE 135.A O no hydrogen 3.304 N/A LEU 87.A N LEU 133.A O no hydrogen 2.712 N/A LYS 89.A N ASP 86.A OD1 no hydrogen 2.767 N/A PHE 90.A N ASP 86.A O no hydrogen 3.171 N/A MET 91.A N LEU 87.A O no hydrogen 2.928 N/A ASP 92.A N LYS 88.A O no hydrogen 3.230 N/A ALA 93.A N LYS 89.A O no hydrogen 3.258 N/A SER 94.A N PHE 90.A O no hydrogen 3.014 N/A SER 94.A OG PHE 90.A O no hydrogen 3.121 N/A ALA 95.A N ASP 92.A O no hydrogen 3.095 N/A THR 97.A OG1 GLY 98.A O no hydrogen 3.219 N/A GLY 98.A N SER 94.A O no hydrogen 2.617 N/A LEU 103.A N PRO 100.A O no hydrogen 2.890 N/A ILE 104.A N PRO 100.A O no hydrogen 3.234 N/A LYS 105.A N LEU 101.A O no hydrogen 2.821 N/A LYS 105.A NZ ASP 287.A OD1 no hydrogen 2.942 N/A SER 106.A N PRO 102.A O no hydrogen 2.871 N/A SER 106.A OG THR 289.A O no hydrogen 3.310 N/A TYR 107.A N LEU 103.A O no hydrogen 2.808 N/A LEU 108.A N ILE 104.A O no hydrogen 2.763 N/A PHE 109.A N LYS 105.A O no hydrogen 2.972 N/A GLN 110.A N SER 106.A O no hydrogen 3.098 N/A GLN 110.A NE2 SER 106.A O no hydrogen 3.360 N/A GLN 110.A NE2 SER 106.A OG no hydrogen 2.961 N/A GLN 110.A NE2 GLY 139.A O no hydrogen 2.908 N/A LEU 111.A N TYR 107.A O no hydrogen 2.935 N/A LEU 112.A N LEU 108.A O no hydrogen 2.928 N/A GLN 113.A N PHE 109.A O no hydrogen 2.986 N/A GLY 114.A N GLN 110.A O no hydrogen 2.964 N/A LEU 115.A N LEU 111.A O no hydrogen 2.898 N/A ALA 116.A N LEU 112.A O no hydrogen 2.812 N/A PHE 117.A N GLN 113.A O no hydrogen 2.883 N/A CYS 118.A N GLY 114.A O no hydrogen 2.972 N/A CYS 118.A SG GLY 114.A O no hydrogen 3.307 N/A HIS 119.A N LEU 115.A O no hydrogen 2.776 N/A HIS 119.A NE2 ASP 184.A OD2 no hydrogen 2.906 N/A SER 120.A N ALA 116.A O no hydrogen 2.790 N/A SER 120.A OG ALA 116.A O no hydrogen 2.925 N/A HIS 121.A N CYS 118.A O no hydrogen 2.880 N/A HIS 121.A ND1 PHE 117.A O no hydrogen 2.574 N/A ARG 122.A N HIS 119.A O no hydrogen 3.226 N/A ARG 122.A NH1 GLU 57.A OE1 no hydrogen 2.881 N/A ARG 122.A NH1 HIS 121.A O no hydrogen 2.752 N/A ARG 122.A NH2 GLU 57.A OE1 no hydrogen 2.981 N/A ARG 122.A NH2 GLU 57.A OE2 no hydrogen 3.271 N/A VAL 123.A N CYS 118.A O no hydrogen 3.136 N/A LEU 124.A N ARG 150.A O no hydrogen 2.977 N/A HIS 125.A N ASP 184.A OD2 no hydrogen 2.817 N/A HIS 125.A NE2 ALA 144.A O no hydrogen 2.784 N/A ARG 126.A N ASP 184.A OD1 no hydrogen 2.900 N/A ARG 126.A NE LEU 148.A O no hydrogen 2.926 N/A ARG 126.A NH1 TYR 179.A OH no hydrogen 2.795 N/A ARG 126.A NH2 LEU 148.A O no hydrogen 2.770 N/A ASP 127.A N HIS 125.A ND1 no hydrogen 3.091 N/A GLN 131.A N GLN 131.A OE1 no hydrogen 2.790 N/A ASN 132.A N LYS 129.A O no hydrogen 2.755 N/A ASN 132.A ND2 ASP 127.A O no hydrogen 2.941 N/A ASN 132.A ND2 ASP 127.A OD2 no hydrogen 3.283 N/A LEU 133.A N PRO 130.A O no hydrogen 3.149 N/A LEU 134.A N LYS 142.A O no hydrogen 2.900 N/A ILE 135.A N GLN 85.A O no hydrogen 2.730 N/A ASN 136.A N ALA 140.A O no hydrogen 3.035 N/A GLU 138.A N ASN 136.A OD1 no hydrogen 2.741 N/A GLY 139.A N ASN 136.A OD1 no hydrogen 2.925 N/A ALA 140.A N ASN 136.A OD1 no hydrogen 3.047 N/A ILE 141.A N GLN 110.A OE1 no hydrogen 3.241 N/A LYS 142.A N LEU 134.A O no hydrogen 2.719 N/A LYS 142.A NZ GLU 81.A OE1 no hydrogen 2.806 N/A LYS 142.A NZ GLU 81.A OE2 no hydrogen 2.850 N/A LEU 143.A N ASN 62.A O no hydrogen 2.930 N/A ALA 144.A N ASN 132.A O no hydrogen 2.798 N/A PHE 146.A N GLU 51.A OE2 no hydrogen 2.783 N/A GLY 147.A N ASP 145.A OD1 no hydrogen 3.355 N/A ALA 149.A N PHE 146.A O no hydrogen 3.006 N/A ARG 150.A N LEU 124.A O no hydrogen 3.033 N/A PHE 152.A N ARG 122.A O no hydrogen 2.712 N/A GLY 153.A N TYR 159.A OH no hydrogen 3.249 N/A ARG 157.A N TYR 159.A OH no hydrogen 3.275 N/A THR 158.A OG1 LYS 177.A O no hydrogen 3.442 N/A THR 164.A N ASP 127.A OD1 no hydrogen 3.352 N/A THR 164.A OG1 ASP 127.A OD1 no hydrogen 3.082 N/A TRP 166.A NE1 GLY 204.A O no hydrogen 2.784 N/A TYR 167.A N THR 164.A O no hydrogen 2.723 N/A TYR 167.A OH GLU 194.A OE1 no hydrogen 2.436 N/A ARG 168.A N LEU 165.A O no hydrogen 3.310 N/A ARG 168.A NE VAL 163.A O no hydrogen 2.999 N/A ARG 168.A NH2 VAL 163.A O no hydrogen 2.860 N/A GLU 171.A N GLU 171.A OE2 no hydrogen 2.764 N/A ILE 172.A N ALA 169.A O no hydrogen 3.145 N/A LEU 173.A N ALA 169.A O no hydrogen 3.319 N/A LEU 174.A N PRO 170.A O no hydrogen 2.822 N/A GLY 175.A N ILE 172.A O no hydrogen 2.869 N/A CYS 176.A N GLU 171.A O no hydrogen 3.018 N/A CYS 176.A SG TYR 178.A O no hydrogen 3.453 N/A LYS 177.A NZ TYR 178.A OH no hydrogen 3.463 N/A THR 181.A N SER 180.A OG no hydrogen 2.598 N/A VAL 183.A N SER 180.A O no hydrogen 3.148 N/A ASP 184.A N THR 181.A O no hydrogen 3.028 N/A TRP 186.A N ALA 182.A O no hydrogen 3.123 N/A SER 187.A N VAL 183.A O no hydrogen 3.358 N/A SER 187.A OG TYR 167.A O no hydrogen 2.809 N/A SER 187.A OG VAL 183.A O no hydrogen 3.546 N/A LEU 188.A N ASP 184.A O no hydrogen 3.141 N/A GLY 189.A N ILE 185.A O no hydrogen 2.794 N/A CYS 190.A N TRP 186.A O no hydrogen 3.003 N/A CYS 190.A SG TRP 186.A O no hydrogen 3.486 N/A ILE 191.A N SER 187.A O no hydrogen 2.919 N/A PHE 192.A N LEU 188.A O no hydrogen 2.818 N/A ALA 193.A N GLY 189.A O no hydrogen 3.048 N/A GLU 194.A N CYS 190.A O no hydrogen 2.897 N/A MET 195.A N ILE 191.A O no hydrogen 2.760 N/A VAL 196.A N PHE 192.A O no hydrogen 3.386 N/A THR 197.A N ALA 193.A O no hydrogen 3.006 N/A THR 197.A OG1 ALA 193.A O no hydrogen 3.198 N/A ARG 198.A N GLU 194.A O no hydrogen 2.615 N/A ARG 199.A N THR 197.A OG1 no hydrogen 3.166 N/A GLY 204.A N PHE 202.A O no hydrogen 3.022 N/A GLY 204.A N GLN 210.A OE1 no hydrogen 2.897 N/A ASP 205.A N ASP 209.A OD2 no hydrogen 2.913 N/A ASP 209.A N SER 206.A OG no hydrogen 3.371 N/A GLN 210.A N SER 206.A O no hydrogen 2.818 N/A GLN 210.A NE2 PHE 202.A O no hydrogen 2.860 N/A LEU 211.A N GLU 207.A O no hydrogen 3.003 N/A PHE 212.A N ILE 208.A O no hydrogen 2.863 N/A ARG 213.A N ASP 209.A O no hydrogen 2.879 N/A ARG 213.A NE ASP 209.A OD2 no hydrogen 3.448 N/A ILE 214.A N GLN 210.A O no hydrogen 3.025 N/A PHE 215.A N LEU 211.A O no hydrogen 2.818 N/A ARG 216.A N PHE 212.A O no hydrogen 2.886 N/A THR 217.A N ILE 214.A O no hydrogen 3.181 N/A THR 217.A OG1 ARG 213.A O no hydrogen 3.050 N/A LEU 218.A N ILE 214.A O no hydrogen 2.842 N/A THR 220.A N TRP 242.A O no hydrogen 2.931 N/A THR 220.A OG1 PRO 240.A O no hydrogen 2.727 N/A VAL 225.A N ASP 222.A OD1 no hydrogen 3.129 N/A TRP 226.A N ASP 222.A O no hydrogen 2.803 N/A GLY 228.A N GLU 223.A OE1 no hydrogen 2.554 N/A VAL 229.A N TRP 226.A O no hydrogen 3.127 N/A THR 230.A N GLU 223.A OE2 no hydrogen 2.987 N/A THR 230.A OG1 GLU 223.A OE2 no hydrogen 2.542 N/A SER 231.A N GLY 228.A O no hydrogen 3.025 N/A MET 232.A N VAL 229.A O no hydrogen 2.952 N/A ASP 234.A N LEU 174.A O no hydrogen 3.162 N/A TYR 235.A N MET 232.A O no hydrogen 3.031 N/A PHE 239.A N LYS 236.A O no hydrogen 2.892 N/A LYS 241.A NZ PRO 237.A O no hydrogen 3.180 N/A LYS 241.A NZ PHE 239.A O no hydrogen 3.115 N/A TRP 242.A N THR 220.A OG1 no hydrogen 2.675 N/A ARG 244.A NH1 LEU 218.A O no hydrogen 3.341 N/A GLN 245.A N THR 217.A O no hydrogen 3.377 N/A SER 248.A N ASP 246.A OD2 no hydrogen 3.172 N/A SER 248.A OG ASP 246.A OD2 no hydrogen 2.726 N/A LYS 249.A N ASP 246.A O no hydrogen 2.786 N/A LEU 254.A N VAL 251.A O no hydrogen 2.983 N/A GLY 258.A N ASP 255.A OD2 no hydrogen 3.020 N/A ARG 259.A N ASP 255.A O no hydrogen 2.896 N/A ARG 259.A NH1 LEU 254.A O no hydrogen 3.043 N/A SER 260.A N GLU 256.A O no hydrogen 3.059 N/A SER 260.A OG HIS 282.A NE2 no hydrogen 2.975 N/A LEU 261.A N ASP 257.A O no hydrogen 2.934 N/A LEU 262.A N GLY 258.A O no hydrogen 2.823 N/A SER 263.A N ARG 259.A O no hydrogen 2.907 N/A SER 263.A OG SER 260.A O no hydrogen 2.815 N/A GLN 264.A N SER 260.A O no hydrogen 3.254 N/A GLN 264.A N LEU 261.A O no hydrogen 3.043 N/A MET 265.A N LEU 261.A O no hydrogen 2.982 N/A LEU 266.A N LEU 262.A O no hydrogen 2.861 N/A TYR 268.A OH GLY 219.A O no hydrogen 2.691 N/A ASN 271.A N ASP 269.A OD1 no hydrogen 3.214 N/A LYS 272.A N ASP 269.A O no hydrogen 3.042 N/A ARG 273.A N ASP 269.A O no hydrogen 3.045 N/A ARG 273.A NE HIS 267.A O no hydrogen 2.928 N/A ARG 273.A NH1 GLU 171.A OE1 no hydrogen 2.938 N/A ARG 273.A NH1 ALA 182.A O no hydrogen 2.904 N/A ARG 273.A NH2 GLU 171.A OE1 no hydrogen 3.478 N/A ARG 273.A NH2 GLU 171.A OE2 no hydrogen 2.824 N/A ARG 273.A NH2 HIS 267.A O no hydrogen 3.238 N/A ARG 273.A NH2 TYR 268.A O no hydrogen 3.198 N/A ILE 274.A N GLN 264.A O no hydrogen 3.064 N/A ALA 278.A N SER 275.A OG no hydrogen 3.004 N/A ALA 279.A N SER 275.A O no hydrogen 2.804 N/A LEU 280.A N ALA 276.A O no hydrogen 3.331 N/A ALA 281.A N ALA 278.A O no hydrogen 3.232 N/A HIS 282.A N ALA 279.A O no hydrogen 2.978 N/A HIS 282.A NE2 SER 260.A OG no hydrogen 2.975 N/A PHE 284.A N HIS 282.A ND1 no hydrogen 2.962 N/A PHE 285.A N HIS 282.A O no hydrogen 2.937 N/A GLN 286.A N PRO 283.A O no hydrogen 2.875 N/A GLN 286.A NE2 PRO 283.A O no hydrogen 3.482 N/A VAL 288.A N PHE 285.A O no hydrogen 3.227 N/A LYS 290.A NZ.B SER 106.A OG no hydrogen 3.332 N/A LYS 290.A NZ.B THR 289.A O no hydrogen 3.067 N/A