Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3t9t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N VAL 69.A O no hydrogen 2.912 N/A ASP 4.A N.A GLU 7.A OE1 no hydrogen 3.138 N/A ASP 4.A N.B GLU 7.A OE1 no hydrogen 3.100 N/A SER 6.A N ASP 4.A OD1.B no hydrogen 3.069 N/A SER 6.A OG ASP 4.A OD1.B no hydrogen 2.862 N/A GLU 7.A N ASP 4.A O.A no hydrogen 2.876 N/A GLU 7.A N ASP 4.A O.B no hydrogen 2.896 N/A LEU 8.A N PRO 5.A O no hydrogen 3.256 N/A THR 9.A N TYR 26.A O no hydrogen 3.016 N/A VAL 11.A N LEU 24.A O no hydrogen 2.883 N/A GLN 12.A N LEU 24.A O no hydrogen 3.233 N/A ILE 14.A N VAL 22.A O no hydrogen 2.802 N/A GLY 15.A N VAL 22.A O no hydrogen 3.379 N/A GLY 17.A N GLY 20.A O no hydrogen 2.910 N/A GLY 20.A N GLY 17.A O no hydrogen 3.102 N/A VAL 22.A N GLY 15.A O no hydrogen 2.714 N/A HIS 23.A N ILE 35.A O no hydrogen 2.840 N/A LEU 24.A N GLN 12.A O no hydrogen 2.725 N/A GLY 25.A N VAL 33.A O no hydrogen 2.944 N/A TYR 26.A N THR 9.A O no hydrogen 3.044 N/A TRP 27.A N ASP 31.A O no hydrogen 2.834 N/A LEU 28.A N GLU 7.A O no hydrogen 2.792 N/A LYS 30.A N TRP 27.A O no hydrogen 3.020 N/A ASP 31.A N TRP 27.A O no hydrogen 3.250 N/A LYS 32.A N ASP 31.A OD1 no hydrogen 2.812 N/A VAL 33.A N GLY 25.A O no hydrogen 2.860 N/A ALA 34.A N THR 80.A O no hydrogen 2.914 N/A ILE 35.A N HIS 23.A O no hydrogen 2.870 N/A LYS 36.A N LEU 78.A O no hydrogen 2.747 N/A LYS 36.A NZ GLN 18.A O no hydrogen 2.753 N/A THR 37.A N LEU 21.A O no hydrogen 2.908 N/A ILE 38.A N ILE 76.A O no hydrogen 2.885 N/A ARG 39.A N PHE 19.A O no hydrogen 2.781 N/A ALA 42.A N ARG 39.A O no hydrogen 3.217 N/A SER 44.A N PHE 151.A O no hydrogen 2.722 N/A SER 44.A OG ASP 47.A OD2 no hydrogen 3.038 N/A PHE 48.A N SER 44.A O no hydrogen 3.073 N/A ILE 49.A N GLU 45.A O no hydrogen 2.872 N/A GLU 50.A N GLU 46.A O no hydrogen 3.072 N/A GLU 51.A N PHE 48.A O no hydrogen 2.844 N/A ALA 52.A N ILE 49.A O no hydrogen 3.295 N/A MET 55.A N GLU 51.A O no hydrogen 2.968 N/A MET 56.A N ALA 52.A O no hydrogen 2.937 N/A LYS 57.A N VAL 54.A O no hydrogen 3.253 N/A LEU 58.A N MET 55.A O no hydrogen 3.131 N/A SER 59.A N TYR 117.A OH no hydrogen 3.075 N/A SER 59.A OG GLN 65.A OE1 no hydrogen 2.973 N/A LYS 62.A N HIS 60.A ND1 no hydrogen 2.948 N/A LYS 62.A NZ ASP 110.A OD1 no hydrogen 3.188 N/A LYS 62.A NZ GLU 113.A OE1.A no hydrogen 3.303 N/A LYS 62.A NZ GLU 113.A OE1.B no hydrogen 2.711 N/A LEU 63.A N HIS 60.A O no hydrogen 3.025 N/A VAL 64.A N VAL 143.A O no hydrogen 2.914 N/A GLN 65.A N GLU 81.A OE1 no hydrogen 2.911 N/A GLN 65.A NE2 MET 56.A O no hydrogen 3.111 N/A GLN 65.A NE2 LEU 58.A O no hydrogen 3.283 N/A GLN 65.A NE2 LEU 66.A O no hydrogen 3.009 N/A TYR 67.A N VAL 79.A O no hydrogen 2.712 N/A GLY 68.A N VAL 79.A O no hydrogen 3.404 N/A VAL 69.A N TRP 1.A O no hydrogen 2.876 N/A CYS 70.A N CYS 77.A O no hydrogen 2.858 N/A CYS 70.A SG ILE 3.A O no hydrogen 3.203 N/A GLN 73.A NE2 GLU 72.A OE2 no hydrogen 3.453 N/A CYS 77.A N CYS 70.A O no hydrogen 2.957 N/A CYS 77.A SG THR 37.A OG1 no hydrogen 3.658 N/A LEU 78.A N LYS 36.A O no hydrogen 2.857 N/A VAL 79.A N GLY 68.A O no hydrogen 2.990 N/A THR 80.A N ALA 34.A O no hydrogen 2.964 N/A THR 80.A OG1 GLU 81.A O no hydrogen 2.840 N/A GLU 81.A N GLN 65.A O no hydrogen 3.218 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.584 N/A HIS 85.A N VAL 135.A O no hydrogen 2.889 N/A HIS 85.A ND1 GLY 136.A O no hydrogen 3.080 N/A CYS 87.A SG ARG 131.A O no hydrogen 3.246 N/A LEU 88.A N CYS 133.A O no hydrogen 2.716 N/A SER 89.A N ALA 130.A O no hydrogen 3.332 N/A TYR 91.A N CYS 87.A O no hydrogen 2.885 N/A LEU 92.A N LEU 88.A O no hydrogen 2.928 N/A ARG 93.A N SER 89.A O no hydrogen 3.068 N/A ARG 93.A NE GLY 200.A O no hydrogen 2.685 N/A ARG 93.A NH2 GLY 200.A O no hydrogen 3.486 N/A THR 94.A N ASP 90.A O no hydrogen 2.874 N/A THR 94.A OG1 ASP 90.A O no hydrogen 2.996 N/A THR 94.A OG1 TYR 91.A O no hydrogen 3.505 N/A GLN 95.A N LEU 92.A O no hydrogen 3.300 N/A GLN 95.A NE2 TYR 91.A O no hydrogen 2.887 N/A ARG 96.A NE GLU 199.A O no hydrogen 3.010 N/A ARG 96.A NH2 GLU 199.A O no hydrogen 2.813 N/A GLY 97.A N GLU 199.A OE2 no hydrogen 2.815 N/A LEU 98.A N GLN 95.A O no hydrogen 3.069 N/A THR 103.A N ALA 100.A O no hydrogen 2.924 N/A LEU 104.A N ALA 100.A O no hydrogen 3.150 N/A LEU 105.A N ALA 101.A O no hydrogen 2.894 N/A GLY 106.A N GLU 102.A O no hydrogen 2.997 N/A MET 107.A N THR 103.A O no hydrogen 2.931 N/A CYS 108.A N LEU 104.A O no hydrogen 3.174 N/A CYS 108.A SG LEU 104.A O no hydrogen 3.536 N/A LEU 109.A N LEU 105.A O no hydrogen 2.919 N/A ASP 110.A N GLY 106.A O no hydrogen 3.033 N/A VAL 111.A N MET 107.A O no hydrogen 3.204 N/A CYS 112.A N CYS 108.A O no hydrogen 2.848 N/A CYS 112.A SG PHE 250.A O no hydrogen 3.827 N/A GLU 113.A N.A LEU 109.A O no hydrogen 2.865 N/A GLU 113.A N.A ASP 110.A O no hydrogen 3.186 N/A GLU 113.A N.B LEU 109.A O no hydrogen 2.853 N/A GLY 114.A N ASP 110.A O no hydrogen 3.071 N/A MET 115.A N VAL 111.A O no hydrogen 2.878 N/A ALA 116.A N CYS 112.A O no hydrogen 2.818 N/A TYR 117.A N GLU 113.A O.A no hydrogen 3.211 N/A TYR 117.A N GLU 113.A O.B no hydrogen 3.227 N/A LEU 118.A N GLY 114.A O no hydrogen 3.058 N/A GLU 119.A N MET 115.A O no hydrogen 2.790 N/A GLU 120.A N ALA 116.A O no hydrogen 3.011 N/A ALA 121.A N TYR 117.A O no hydrogen 2.972 N/A CYS 122.A N GLU 119.A O no hydrogen 2.969 N/A VAL 123.A N LEU 118.A O no hydrogen 2.903 N/A HIS 125.A N ASP 185.A OD2 no hydrogen 2.729 N/A HIS 125.A NE2 SER 144.A O no hydrogen 2.922 N/A ARG 126.A N ASP 185.A OD1 no hydrogen 2.952 N/A ARG 126.A NE THR 149.A OG1 no hydrogen 2.934 N/A ASP 127.A N HIS 125.A ND1 no hydrogen 3.037 N/A ALA 129.A N ASN 132.A OD1 no hydrogen 3.289 N/A ALA 130.A N GLU 195.A OE1 no hydrogen 2.877 N/A ARG 131.A NH1 ASP 127.A OD1 no hydrogen 2.833 N/A ARG 131.A NH1 ASP 127.A OD2 no hydrogen 3.461 N/A ARG 131.A NH2 ASP 127.A OD2 no hydrogen 2.864 N/A ASN 132.A N ALA 129.A O no hydrogen 2.997 N/A ASN 132.A ND2 ASP 127.A O no hydrogen 2.796 N/A CYS 133.A N ALA 130.A O no hydrogen 3.161 N/A CYS 133.A SG ALA 129.A O no hydrogen 3.619 N/A LEU 134.A N LYS 142.A O no hydrogen 2.942 N/A VAL 135.A N GLY 86.A O no hydrogen 2.875 N/A GLY 136.A N VAL 140.A O no hydrogen 2.873 N/A VAL 140.A N GLU 137.A O no hydrogen 3.039 N/A ILE 141.A N ASP 110.A OD2 no hydrogen 3.006 N/A LYS 142.A N LEU 134.A O no hydrogen 2.920 N/A LYS 142.A NZ PRO 61.A O no hydrogen 3.169 N/A LYS 142.A NZ GLU 81.A OE1 no hydrogen 3.428 N/A LYS 142.A NZ GLU 81.A OE2 no hydrogen 2.754 N/A VAL 143.A N LYS 62.A O no hydrogen 2.893 N/A SER 144.A N ASN 132.A O no hydrogen 3.218 N/A SER 144.A OG ASP 145.A OD2 no hydrogen 3.168 N/A GLY 147.A N HIS 125.A O no hydrogen 2.836 N/A MET 148.A N ASP 145.A O no hydrogen 3.129 N/A ARG 150.A N GLY 147.A O no hydrogen 3.102 N/A ARG 150.A NE GLY 147.A O no hydrogen 2.981 N/A PHE 151.A N MET 148.A O no hydrogen 2.972 N/A VAL 152.A N THR 149.A O no hydrogen 3.359 N/A LEU 153.A N ALA 42.A O no hydrogen 3.086 N/A GLN 156.A N ASP 154.A OD1 no hydrogen 3.054 N/A TYR 157.A N ASP 154.A O no hydrogen 2.882 N/A TYR 157.A OH ASP 127.A OD2 no hydrogen 2.593 N/A THR 158.A N ASP 154.A O no hydrogen 3.195 N/A THR 158.A OG1 ASP 154.A O no hydrogen 3.559 N/A SER 159.A N ASP 155.A O no hydrogen 3.140 N/A SER 159.A OG THR 161.A OG1 no hydrogen 3.050 N/A THR 161.A N SER 159.A OG no hydrogen 3.299 N/A THR 161.A OG1 SER 159.A OG no hydrogen 3.050 N/A GLY 162.A N SER 159.A O no hydrogen 2.810 N/A THR 163.A N GLN 156.A OE1 no hydrogen 2.830 N/A THR 163.A OG1 GLN 156.A OE1 no hydrogen 3.363 N/A LYS 164.A N GLN 156.A O no hydrogen 2.880 N/A LYS 164.A NZ ASP 154.A OD2 no hydrogen 2.907 N/A PHE 165.A N GLY 162.A O no hydrogen 3.322 N/A VAL 167.A N PHE 165.A O no hydrogen 2.714 N/A LYS 168.A NZ PRO 203.A O no hydrogen 2.865 N/A LYS 168.A NZ TYR 204.A O no hydrogen 3.195 N/A TRP 169.A N PRO 166.A O no hydrogen 3.198 N/A TRP 169.A NE1 GLU 195.A OE1 no hydrogen 2.943 N/A ALA 170.A N VAL 167.A O no hydrogen 3.006 N/A GLU 173.A N GLU 173.A OE1 no hydrogen 2.794 N/A PHE 175.A N SER 171.A O no hydrogen 2.924 N/A SER 176.A N PRO 172.A O no hydrogen 2.864 N/A SER 176.A OG PRO 172.A O no hydrogen 2.817 N/A PHE 177.A N GLU 173.A O no hydrogen 2.975 N/A SER 178.A N VAL 174.A O no hydrogen 2.833 N/A ARG 179.A N GLU 173.A O no hydrogen 3.083 N/A SER 181.A N SER 184.A OG no hydrogen 2.890 N/A LYS 183.A NZ PRO 244.A O no hydrogen 3.346 N/A LYS 183.A NZ ARG 247.A O no hydrogen 2.714 N/A SER 184.A N SER 181.A OG no hydrogen 3.078 N/A SER 184.A OG SER 181.A O no hydrogen 2.858 N/A ASP 185.A N SER 181.A O no hydrogen 3.059 N/A VAL 186.A N SER 182.A O no hydrogen 2.914 N/A TRP 187.A N LYS 183.A O no hydrogen 3.288 N/A SER 188.A N SER 184.A O no hydrogen 3.200 N/A SER 188.A OG TRP 169.A O no hydrogen 2.735 N/A SER 188.A OG SER 184.A O no hydrogen 3.230 N/A PHE 189.A N ASP 185.A O no hydrogen 2.696 N/A GLY 190.A N VAL 186.A O no hydrogen 3.014 N/A VAL 191.A N TRP 187.A O no hydrogen 3.140 N/A LEU 192.A N SER 188.A O no hydrogen 2.874 N/A MET 193.A N PHE 189.A O no hydrogen 2.848 N/A TRP 194.A N GLY 190.A O no hydrogen 3.019 N/A TRP 194.A NE1 TYR 223.A O.A no hydrogen 2.708 N/A TRP 194.A NE1 TYR 223.A O.B no hydrogen 2.712 N/A GLU 195.A N VAL 191.A O no hydrogen 2.872 N/A VAL 196.A N LEU 192.A O no hydrogen 2.833 N/A PHE 197.A N MET 193.A O no hydrogen 2.891 N/A SER 198.A N.A TRP 194.A O no hydrogen 2.890 N/A SER 198.A N.B TRP 194.A O no hydrogen 2.896 N/A SER 198.A OG.A TRP 194.A O no hydrogen 2.707 N/A SER 198.A OG.B TRP 194.A O no hydrogen 2.898 N/A SER 198.A OG.B GLU 195.A O no hydrogen 2.852 N/A GLU 199.A N VAL 196.A O no hydrogen 2.890 N/A GLY 200.A N GLU 195.A O no hydrogen 2.753 N/A LYS 201.A N SER 198.A O.A no hydrogen 3.412 N/A LYS 201.A N SER 198.A OG.B no hydrogen 3.284 N/A ARG 207.A N TYR 204.A O no hydrogen 2.931 N/A ARG 207.A NE ASP 215.A OD2 no hydrogen 2.919 N/A ARG 207.A NH2 ASP 215.A OD1 no hydrogen 2.919 N/A ARG 207.A NH2 ASP 215.A OD2 no hydrogen 3.074 N/A SER 208.A N GLU 211.A OE2 no hydrogen 2.848 N/A SER 208.A OG SER 210.A OG no hydrogen 3.258 N/A ASN 209.A ND2 PHE 165.A O no hydrogen 2.987 N/A SER 210.A OG SER 208.A OG no hydrogen 3.258 N/A GLU 211.A N SER 208.A OG no hydrogen 3.124 N/A VAL 212.A N SER 208.A O no hydrogen 2.973 N/A VAL 213.A N ASN 209.A O no hydrogen 3.055 N/A GLU 214.A N SER 210.A O no hydrogen 2.972 N/A ASP 215.A N GLU 211.A O no hydrogen 2.853 N/A ILE 216.A N VAL 212.A O no hydrogen 2.862 N/A SER 217.A N VAL 213.A O no hydrogen 2.951 N/A SER 217.A OG VAL 213.A O no hydrogen 2.705 N/A THR 218.A N GLU 214.A O no hydrogen 3.059 N/A THR 218.A N ASP 215.A O no hydrogen 3.176 N/A THR 218.A OG1 GLU 214.A O no hydrogen 2.952 N/A THR 218.A OG1 ASP 215.A O no hydrogen 3.257 N/A GLY 219.A N ILE 216.A O no hydrogen 3.089 N/A PHE 220.A N ASP 215.A O no hydrogen 2.920 N/A ARG 221.A NE TRP 240.A O no hydrogen 3.001 N/A ARG 221.A NH1 ILE 216.A O no hydrogen 3.092 N/A ARG 221.A NH1 PHE 220.A O no hydrogen 2.765 N/A ARG 221.A NH2 TRP 240.A O no hydrogen 3.003 N/A LYS 224.A NZ PRO 225.A O no hydrogen 3.414 N/A LYS 224.A NZ ALA 228.A O no hydrogen 2.933 N/A ALA 228.A N PRO 225.A O no hydrogen 3.020 N/A VAL 232.A N SER 229.A OG no hydrogen 3.025 N/A TYR 233.A N SER 229.A O no hydrogen 2.957 N/A TYR 233.A OH LEU 222.A O no hydrogen 2.654 N/A GLN 234.A N THR 230.A O no hydrogen 2.983 N/A ILE 235.A N HIS 231.A O no hydrogen 3.210 N/A MET 236.A N VAL 232.A O no hydrogen 2.985 N/A ASN 237.A N TYR 233.A O no hydrogen 2.951 N/A ASN 237.A ND2 TYR 233.A O no hydrogen 3.146 N/A HIS 238.A N GLN 234.A O no hydrogen 2.973 N/A CYS 239.A N ILE 235.A O no hydrogen 3.230 N/A CYS 239.A N MET 236.A O no hydrogen 2.920 N/A CYS 239.A SG ILE 235.A O no hydrogen 3.528 N/A TRP 240.A N ASN 237.A O no hydrogen 3.096 N/A ARG 241.A NH1 ASP 246.A O no hydrogen 2.952 N/A GLU 245.A N GLU 245.A OE1 no hydrogen 2.815 N/A ASP 246.A N ARG 243.A O no hydrogen 2.922 N/A ARG 247.A N PRO 244.A O no hydrogen 3.067 N/A ARG 247.A NE ARG 241.A O no hydrogen 2.782 N/A ARG 247.A NH1 GLU 173.A OE2 no hydrogen 2.882 N/A ARG 247.A NH1 LYS 183.A O no hydrogen 2.894 N/A ARG 247.A NH2 GLU 173.A OE1 no hydrogen 2.916 N/A ARG 247.A NH2 ARG 241.A O no hydrogen 3.155 N/A ARG 247.A NH2 GLU 242.A O no hydrogen 3.063 N/A PHE 250.A N GLU 119.A OE2 no hydrogen 2.863 N/A SER 251.A N GLU 119.A OE1 no hydrogen 3.043 N/A LEU 253.A N ALA 249.A O no hydrogen 2.853 N/A LEU 254.A N PHE 250.A O no hydrogen 2.844 N/A ARG 255.A N SER 251.A O no hydrogen 3.385 N/A GLN 256.A N ARG 252.A O no hydrogen 3.041 N/A LEU 257.A N LEU 253.A O no hydrogen 2.795 N/A ALA 258.A N LEU 254.A O no hydrogen 2.902 N/A GLU 259.A N ARG 255.A O no hydrogen 3.074 N/A ILE 260.A N GLN 256.A O no hydrogen 3.094 N/A ALA 261.A N LEU 257.A O no hydrogen 2.910 N/A GLU 262.A N ALA 258.A O no hydrogen 2.810 N/A SER 263.A OG GLU 259.A O no hydrogen 2.991 N/A SER 263.A OG ILE 260.A O no hydrogen 3.326 N/A SER 263.A OG SER 263.A O no hydrogen 2.267 N/A