Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cd8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASP 1.A O no hydrogen 3.333 N/A LEU 5.A N LEU 2.A O no hydrogen 3.437 N/A GLU 8.A N ASN 6.A OD1 no hydrogen 3.331 N/A LEU 9.A N ASN 6.A O no hydrogen 2.781 N/A ALA 12.A N LEU 9.A O no hydrogen 3.032 N/A VAL 13.A N VAL 10.A O no hydrogen 3.390 N/A GLN 14.A NE2 GLN 11.A O no hydrogen 3.232 N/A HIS 15.A N ALA 12.A O no hydrogen 3.232 N/A VAL 16.A N VAL 13.A O no hydrogen 3.172 N/A VAL 17.A N VAL 13.A O no hydrogen 3.095 N/A ILE 18.A N ILE 83.A O no hydrogen 2.655 N/A SER 22.A N GLY 19.A O no hydrogen 2.754 N/A SER 22.A OG GLY 19.A O no hydrogen 3.093 N/A ILE 24.A N THR 43.A O no hydrogen 2.897 N/A HIS 26.A N HIS 41.A O no hydrogen 2.825 N/A ILE 31.A N VAL 39.A O no hydrogen 2.923 N/A GLY 34.A N GLY 37.A O no hydrogen 2.986 N/A HIS 35.A N MET 162.A O no hydrogen 3.282 N/A PHE 36.A N ASP 161.A OD1 no hydrogen 3.064 N/A PHE 36.A N ASP 161.A OD2 no hydrogen 2.901 N/A GLY 37.A N GLY 34.A O no hydrogen 3.316 N/A VAL 39.A N GLY 32.A O no hydrogen 2.763 N/A TYR 40.A N VAL 50.A O no hydrogen 2.851 N/A HIS 41.A ND1 HIS 47.A NE2 no hydrogen 3.077 N/A GLY 42.A N CYS 48.A O no hydrogen 2.826 N/A THR 43.A N ILE 24.A O no hydrogen 2.852 N/A LEU 44.A N ILE 46.A O no hydrogen 2.874 N/A ILE 46.A N LEU 44.A O no hydrogen 2.999 N/A HIS 47.A NE2 HIS 41.A ND1 no hydrogen 3.077 N/A CYS 48.A N GLY 42.A O no hydrogen 2.792 N/A CYS 48.A SG GLY 42.A O no hydrogen 3.324 N/A ALA 49.A N LEU 90.A O no hydrogen 2.666 N/A VAL 50.A N TYR 40.A O no hydrogen 2.833 N/A LYS 51.A N VAL 88.A O no hydrogen 2.762 N/A LYS 51.A NZ ASP 161.A OD2 no hydrogen 2.438 N/A LYS 51.A NZ TYR 163.A OH no hydrogen 3.492 N/A SER 52.A N CYS 38.A O no hydrogen 2.772 N/A ASN 54.A N SER 52.A OG no hydrogen 3.344 N/A ARG 55.A N PHE 36.A O no hydrogen 3.189 N/A ARG 55.A NH1 HIS 35.A O no hydrogen 2.996 N/A ILE 56.A N LEU 53.A O no hydrogen 3.359 N/A SER 60.A OG ALA 4.A O no hydrogen 3.300 N/A PHE 62.A N GLU 58.A O no hydrogen 3.065 N/A LEU 63.A N VAL 59.A O no hydrogen 3.066 N/A THR 64.A N SER 60.A O no hydrogen 3.049 N/A THR 64.A OG1 GLN 61.A O no hydrogen 2.679 N/A THR 64.A OG1 GLN 61.A OE1 no hydrogen 2.856 N/A GLU 65.A N GLN 61.A O no hydrogen 2.930 N/A GLY 66.A N PHE 62.A O no hydrogen 3.155 N/A ILE 67.A N LEU 63.A O no hydrogen 2.891 N/A ILE 68.A N THR 64.A O no hydrogen 2.963 N/A MET 69.A N GLU 65.A O no hydrogen 3.118 N/A LYS 70.A N GLY 66.A O no hydrogen 2.966 N/A LYS 70.A NZ HIS 15.A O no hydrogen 3.463 N/A SER 73.A N TYR 127.A OH no hydrogen 2.968 N/A ASN 76.A N HIS 74.A ND1 no hydrogen 3.143 N/A ASN 76.A ND2 VAL 151.A O no hydrogen 2.992 N/A VAL 77.A N HIS 74.A O no hydrogen 3.087 N/A LEU 78.A N VAL 153.A O no hydrogen 2.941 N/A LEU 81.A N VAL 89.A O no hydrogen 2.935 N/A GLY 82.A N VAL 89.A O no hydrogen 3.378 N/A ILE 83.A N VAL 16.A O no hydrogen 2.797 N/A CYS 84.A N LEU 87.A O no hydrogen 2.945 N/A CYS 84.A SG ILE 18.A O no hydrogen 3.490 N/A LEU 87.A N CYS 84.A O no hydrogen 2.813 N/A VAL 88.A N LYS 51.A O no hydrogen 2.954 N/A VAL 89.A N GLY 82.A O no hydrogen 2.896 N/A LEU 90.A N ALA 49.A O no hydrogen 2.866 N/A TYR 92.A N HIS 47.A O no hydrogen 3.358 N/A HIS 95.A N LEU 145.A O no hydrogen 3.083 N/A GLY 96.A N MET 93.A O no hydrogen 3.125 N/A LEU 98.A N CYS 143.A O no hydrogen 2.810 N/A ARG 99.A N ALA 140.A O no hydrogen 3.255 N/A ARG 99.A NE GLY 212.A O no hydrogen 3.191 N/A ARG 99.A NH2 GLY 212.A O no hydrogen 2.948 N/A ASN 100.A N ASP 97.A OD2 no hydrogen 3.158 N/A PHE 101.A N ASP 97.A O no hydrogen 3.141 N/A ILE 102.A N LEU 98.A O no hydrogen 3.040 N/A ARG 103.A N ARG 99.A O no hydrogen 3.085 N/A ARG 103.A N ASN 100.A O no hydrogen 3.211 N/A ARG 103.A NH2 GLY 212.A O no hydrogen 2.826 N/A ASN 104.A N ASN 100.A O no hydrogen 2.935 N/A THR 106.A N ASN 104.A OD1 no hydrogen 2.820 N/A THR 110.A N ASP 113.A OD2 no hydrogen 2.919 N/A THR 110.A OG1 ASP 113.A OD2 no hydrogen 3.099 N/A THR 110.A OG1 GLY 278.A O no hydrogen 2.952 N/A LYS 112.A NZ PHE 273.A O no hydrogen 2.769 N/A LYS 112.A NZ PHE 276.A O no hydrogen 3.110 N/A ASP 113.A N THR 110.A OG1 no hydrogen 3.102 N/A LEU 114.A N THR 110.A O no hydrogen 2.962 N/A ILE 115.A N VAL 111.A O no hydrogen 2.995 N/A GLY 116.A N LYS 112.A O no hydrogen 2.924 N/A PHE 117.A N ASP 113.A O no hydrogen 2.870 N/A GLY 118.A N LEU 114.A O no hydrogen 3.186 N/A LEU 119.A N ILE 115.A O no hydrogen 2.830 N/A GLN 120.A N GLY 116.A O no hydrogen 3.007 N/A GLN 120.A NE2 GLY 116.A O no hydrogen 3.257 N/A VAL 121.A N PHE 117.A O no hydrogen 3.131 N/A ALA 122.A N GLY 118.A O no hydrogen 2.992 N/A LYS 123.A N LEU 119.A O no hydrogen 2.984 N/A GLY 124.A N GLN 120.A O no hydrogen 3.016 N/A MET 125.A N VAL 121.A O no hydrogen 2.910 N/A LYS 126.A N ALA 122.A O no hydrogen 2.846 N/A TYR 127.A N LYS 123.A O no hydrogen 3.048 N/A LEU 128.A N GLY 124.A O no hydrogen 2.997 N/A ALA 129.A N MET 125.A O no hydrogen 2.845 N/A SER 130.A N LYS 126.A O no hydrogen 3.080 N/A SER 130.A N TYR 127.A O no hydrogen 3.143 N/A SER 130.A OG TYR 127.A O no hydrogen 2.685 N/A LYS 131.A N TYR 127.A O no hydrogen 3.135 N/A LYS 131.A NZ TYR 127.A OH no hydrogen 3.091 N/A LYS 132.A N ALA 129.A O no hydrogen 3.094 N/A PHE 133.A N LEU 128.A O no hydrogen 3.002 N/A HIS 135.A N ASP 197.A OD2 no hydrogen 2.849 N/A HIS 135.A NE2 ALA 154.A O no hydrogen 2.637 N/A ARG 136.A N ASP 197.A OD1 no hydrogen 3.002 N/A ASP 137.A N HIS 135.A ND1 no hydrogen 3.067 N/A ALA 140.A N GLU 207.A OE1 no hydrogen 3.039 N/A ARG 141.A NE TYR 168.A OH no hydrogen 3.055 N/A ARG 141.A NH1 ASP 137.A OD1 no hydrogen 3.298 N/A ARG 141.A NH1 TYR 168.A OH no hydrogen 3.485 N/A ASN 142.A N ALA 139.A O no hydrogen 3.011 N/A ASN 142.A ND2 ASP 137.A O no hydrogen 2.739 N/A ASN 142.A ND2 TYR 168.A OH no hydrogen 3.559 N/A CYS 143.A N ALA 140.A O no hydrogen 3.368 N/A CYS 143.A SG ALA 139.A O no hydrogen 3.599 N/A MET 144.A N LYS 152.A O no hydrogen 2.858 N/A LEU 145.A N GLY 96.A O no hydrogen 2.922 N/A ASP 146.A N THR 150.A O no hydrogen 3.212 N/A GLU 147.A N GLU 147.A OE1 no hydrogen 2.775 N/A LYS 148.A N ASP 146.A OD1 no hydrogen 2.971 N/A PHE 149.A N ASP 146.A O no hydrogen 3.162 N/A THR 150.A N ASP 146.A OD1 no hydrogen 2.794 N/A VAL 151.A N GLN 120.A OE1 no hydrogen 2.795 N/A LYS 152.A N MET 144.A O no hydrogen 2.770 N/A LYS 152.A NZ PRO 75.A O no hydrogen 2.683 N/A VAL 153.A N ASN 76.A O no hydrogen 2.812 N/A ALA 154.A N ASN 142.A O no hydrogen 3.032 N/A ALA 159.A N PHE 156.A O no hydrogen 3.108 N/A ARG 160.A N GLY 157.A O no hydrogen 3.295 N/A ASP 161.A N ASP 155.A OD1 no hydrogen 2.899 N/A MET 162.A N ASP 161.A OD1 no hydrogen 2.664 N/A TYR 163.A OH ALA 159.A O no hydrogen 2.567 N/A TYR 167.A N ASP 164.A O no hydrogen 3.266 N/A TYR 168.A N LYS 165.A O no hydrogen 3.278 N/A TYR 168.A OH ASP 137.A OD1 no hydrogen 3.375 N/A TYR 168.A OH ASP 137.A OD2 no hydrogen 2.475 N/A SER 169.A N LEU 177.A O no hydrogen 2.881 N/A HIS 171.A N ALA 175.A O no hydrogen 3.028 N/A LEU 177.A N SER 169.A O no hydrogen 2.869 N/A LYS 180.A NZ TYR 216.A O no hydrogen 2.732 N/A LYS 180.A NZ VAL 219.A O no hydrogen 2.793 N/A TRP 181.A N PRO 178.A O no hydrogen 2.887 N/A TRP 181.A NE1 GLU 207.A OE1 no hydrogen 2.914 N/A MET 182.A N VAL 179.A O no hydrogen 3.269 N/A GLU 185.A N GLU 185.A OE2 no hydrogen 2.795 N/A SER 186.A N ALA 183.A O no hydrogen 3.043 N/A SER 186.A OG LYS 191.A O no hydrogen 2.698 N/A LEU 187.A N ALA 183.A O no hydrogen 3.126 N/A GLN 188.A N LEU 184.A O no hydrogen 3.313 N/A THR 189.A N GLU 185.A O no hydrogen 2.906 N/A THR 189.A OG1 GLU 185.A O no hydrogen 2.726 N/A GLN 190.A N SER 186.A O no hydrogen 2.652 N/A LYS 191.A N THR 189.A OG1 no hydrogen 3.241 N/A THR 193.A N SER 196.A OG no hydrogen 2.769 N/A LYS 195.A NZ ARG 259.A O no hydrogen 2.854 N/A SER 196.A N THR 193.A OG1 no hydrogen 3.159 N/A SER 196.A OG THR 193.A O no hydrogen 2.800 N/A ASP 197.A N THR 193.A O no hydrogen 2.981 N/A VAL 198.A N THR 194.A O no hydrogen 3.035 N/A TRP 199.A N LYS 195.A O no hydrogen 3.299 N/A SER 200.A N SER 196.A O no hydrogen 3.153 N/A SER 200.A OG TRP 181.A O no hydrogen 2.701 N/A SER 200.A OG SER 196.A O no hydrogen 3.189 N/A PHE 201.A N ASP 197.A O no hydrogen 2.803 N/A GLY 202.A N VAL 198.A O no hydrogen 3.160 N/A VAL 203.A N TRP 199.A O no hydrogen 3.227 N/A LEU 204.A N SER 200.A O no hydrogen 2.933 N/A LEU 205.A N PHE 201.A O no hydrogen 2.871 N/A TRP 206.A N GLY 202.A O no hydrogen 3.101 N/A TRP 206.A NE1 LEU 235.A O no hydrogen 2.769 N/A GLU 207.A N VAL 203.A O no hydrogen 2.940 N/A LEU 208.A N LEU 204.A O no hydrogen 2.929 N/A MET 209.A N LEU 205.A O no hydrogen 2.999 N/A THR 210.A N TRP 206.A O no hydrogen 3.040 N/A THR 210.A OG1 TRP 206.A O no hydrogen 2.870 N/A THR 210.A OG1 GLU 207.A O no hydrogen 3.042 N/A ARG 211.A N LEU 208.A O no hydrogen 3.154 N/A ARG 211.A NE ILE 102.A O no hydrogen 2.883 N/A ARG 211.A NH1 ILE 102.A O no hydrogen 3.370 N/A ARG 211.A NH1 HIS 107.A O no hydrogen 3.266 N/A GLY 212.A N GLU 207.A O no hydrogen 2.735 N/A ALA 213.A N THR 210.A OG1 no hydrogen 3.325 N/A VAL 219.A N TYR 216.A O no hydrogen 3.197 N/A ASP 223.A N ASN 220.A O no hydrogen 3.038 N/A ILE 224.A N THR 221.A O no hydrogen 3.271 N/A TYR 227.A N ASP 223.A O no hydrogen 3.110 N/A LEU 228.A N ILE 224.A O no hydrogen 2.879 N/A LEU 229.A N THR 225.A O no hydrogen 2.952 N/A GLN 230.A N VAL 226.A O no hydrogen 3.127 N/A GLY 231.A N LEU 228.A O no hydrogen 2.885 N/A ARG 232.A N LEU 228.A O no hydrogen 3.201 N/A ARG 232.A NE GLN 230.A OE1 no hydrogen 2.738 N/A ARG 232.A NH1 GLN 230.A OE1 no hydrogen 3.192 N/A ARG 233.A NE TRP 252.A O no hydrogen 3.243 N/A ARG 233.A NH1 ARG 232.A O no hydrogen 2.803 N/A ARG 233.A NH2 TRP 252.A O no hydrogen 2.856 N/A GLN 236.A NE2 CYS 240.A O no hydrogen 2.767 N/A GLN 236.A NE2 ASP 242.A OD1 no hydrogen 2.999 N/A CYS 240.A N PRO 237.A O no hydrogen 3.121 N/A CYS 240.A SG PRO 241.A O no hydrogen 3.370 N/A TYR 245.A N PRO 241.A O no hydrogen 3.022 N/A TYR 245.A OH LEU 234.A O no hydrogen 2.642 N/A GLU 246.A N ASP 242.A O no hydrogen 2.976 N/A VAL 247.A N PRO 243.A O no hydrogen 3.093 N/A MET 248.A N LEU 244.A O no hydrogen 3.103 N/A LEU 249.A N TYR 245.A O no hydrogen 3.001 N/A LYS 250.A N GLU 246.A O no hydrogen 3.119 N/A CYS 251.A N VAL 247.A O no hydrogen 2.966 N/A CYS 251.A SG VAL 247.A O no hydrogen 3.461 N/A TRP 252.A N MET 248.A O no hydrogen 3.061 N/A HIS 253.A N LYS 250.A O no hydrogen 3.206 N/A LYS 255.A N HIS 253.A ND1 no hydrogen 3.114 N/A GLU 257.A N GLU 257.A OE1 no hydrogen 2.788 N/A MET 258.A N LYS 255.A O no hydrogen 2.901 N/A ARG 259.A N ALA 256.A O no hydrogen 3.171 N/A ARG 259.A NE HIS 253.A O no hydrogen 2.802 N/A ARG 259.A NH1 GLU 185.A OE1 no hydrogen 2.850 N/A ARG 259.A NH1 LYS 195.A O no hydrogen 3.097 N/A ARG 259.A NH2 GLU 185.A OE1 no hydrogen 3.452 N/A ARG 259.A NH2 GLU 185.A OE2 no hydrogen 2.770 N/A ARG 259.A NH2 HIS 253.A O no hydrogen 3.095 N/A GLU 264.A N SER 261.A OG no hydrogen 3.195 N/A LEU 265.A N SER 261.A O no hydrogen 3.052 N/A VAL 266.A N PHE 262.A O no hydrogen 2.910 N/A SER 267.A N SER 263.A O no hydrogen 3.002 N/A ARG 268.A N GLU 264.A O no hydrogen 2.875 N/A ARG 268.A NE GLU 264.A OE2 no hydrogen 2.836 N/A ARG 268.A NH1 GLU 264.A OE2 no hydrogen 3.538 N/A ILE 269.A N LEU 265.A O no hydrogen 2.958 N/A SER 270.A N VAL 266.A O no hydrogen 2.949 N/A SER 270.A OG.A VAL 266.A O no hydrogen 2.563 N/A SER 270.A OG.B VAL 266.A O no hydrogen 3.241 N/A SER 270.A OG.B SER 267.A O no hydrogen 2.776 N/A ALA 271.A N SER 267.A O no hydrogen 3.317 N/A ILE 272.A N ARG 268.A O no hydrogen 3.220 N/A PHE 273.A N ILE 269.A O no hydrogen 2.850 N/A SER 274.A N SER 270.A O no hydrogen 2.952 N/A SER 274.A OG SER 270.A O no hydrogen 3.544 N/A SER 274.A OG ALA 271.A O no hydrogen 2.609 N/A THR 275.A N ILE 272.A O no hydrogen 3.066 N/A THR 275.A OG1 ILE 272.A O no hydrogen 2.664 N/A PHE 276.A N PHE 273.A O no hydrogen 3.170 N/A