Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1tht_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 2.A N ASN 278.A OD1 no hydrogen 3.063 N/A THR 4.A N CYS 2.A O no hydrogen 2.552 N/A THR 4.A OG1 GLU 21.A O no hydrogen 3.182 N/A THR 4.A OG1 THR 22.A OG1 no hydrogen 3.137 N/A ILE 5.A N GLU 21.A O no hydrogen 2.898 N/A HIS 7.A N VAL 19.A O no hydrogen 2.764 N/A LEU 9.A N LEU 17.A O no hydrogen 2.896 N/A ARG 10.A N GLU 292.A O no hydrogen 2.747 N/A VAL 11.A N GLN 15.A O no hydrogen 2.882 N/A ASN 12.A N ALA 294.A OXT no hydrogen 3.010 N/A ASN 13.A ND2 GLN 15.A OE1 no hydrogen 2.919 N/A GLY 14.A N VAL 11.A O no hydrogen 3.322 N/A GLN 15.A N VAL 11.A O no hydrogen 3.490 N/A GLU 16.A N HIS 69.A O no hydrogen 2.903 N/A LEU 17.A N LEU 9.A O no hydrogen 2.835 N/A HIS 18.A N ASP 66.A OD1 no hydrogen 2.905 N/A HIS 18.A ND1 ASP 66.A OD2 no hydrogen 2.957 N/A VAL 19.A N HIS 7.A O no hydrogen 2.872 N/A TRP 20.A N ARG 64.A O no hydrogen 2.862 N/A GLU 21.A N ILE 5.A O no hydrogen 2.942 N/A THR 22.A N VAL 62.A O no hydrogen 2.778 N/A THR 22.A OG1 THR 4.A OG1 no hydrogen 3.137 N/A LYS 25.A N SER 56.A O no hydrogen 3.069 N/A LYS 25.A NZ GLU 53.A OE2 no hydrogen 3.416 N/A LYS 25.A NZ SER 56.A OG no hydrogen 3.299 N/A LYS 31.A NZ ASN 58.A O no hydrogen 2.767 N/A ASN 32.A N ASP 254.A OD2 no hydrogen 3.402 N/A ASN 33.A N ASP 254.A OD1 no hydrogen 2.892 N/A ASN 33.A ND2 ASP 254.A OD1 no hydrogen 3.042 N/A THR 34.A N ASN 96.A O no hydrogen 2.959 N/A ILE 35.A N HIS 61.A O no hydrogen 2.964 N/A LEU 36.A N GLY 98.A O no hydrogen 2.957 N/A ILE 37.A N PHE 63.A O no hydrogen 2.939 N/A ALA 38.A N ILE 100.A O no hydrogen 3.367 N/A SER 39.A N TYR 65.A O no hydrogen 2.893 N/A SER 39.A OG TYR 65.A O no hydrogen 2.980 N/A MET 45.A N ALA 42.A O no hydrogen 2.973 N/A ASP 46.A N ARG 43.A O no hydrogen 2.963 N/A HIS 47.A N ALA 42.A O no hydrogen 2.745 N/A HIS 47.A ND1 SER 39.A O no hydrogen 2.942 N/A PHE 48.A N MET 45.A O no hydrogen 2.986 N/A ALA 49.A N ASP 46.A O no hydrogen 3.034 N/A LEU 51.A N PHE 48.A O no hydrogen 3.054 N/A ALA 52.A N PHE 48.A O no hydrogen 3.184 N/A GLU 53.A N ALA 49.A O no hydrogen 3.230 N/A TYR 54.A N GLY 50.A O no hydrogen 3.137 N/A TYR 54.A OH GLU 266.A OE2 no hydrogen 2.657 N/A LEU 55.A N LEU 51.A O no hydrogen 3.023 N/A SER 56.A N ALA 52.A O no hydrogen 2.887 N/A SER 56.A OG ALA 52.A O no hydrogen 2.854 N/A SER 56.A OG GLU 53.A O no hydrogen 3.441 N/A THR 57.A N GLU 53.A O no hydrogen 2.969 N/A ASN 58.A N LEU 55.A O no hydrogen 2.919 N/A ASN 58.A ND2 TYR 54.A O no hydrogen 2.764 N/A ASN 58.A ND2 ILE 265.A O no hydrogen 2.704 N/A GLY 59.A N SER 56.A O no hydrogen 2.992 N/A PHE 60.A N LEU 55.A O no hydrogen 3.150 N/A HIS 61.A NE2 GLU 21.A OE2 no hydrogen 2.748 N/A VAL 62.A N THR 22.A O no hydrogen 2.829 N/A PHE 63.A N ILE 35.A O no hydrogen 2.874 N/A ARG 64.A N TRP 20.A O no hydrogen 2.843 N/A ARG 64.A NH1 HIS 47.A O no hydrogen 3.054 N/A ARG 64.A NH1 GLU 279.A OE1 no hydrogen 3.135 N/A ARG 64.A NH1 GLU 279.A OE2 no hydrogen 3.269 N/A ARG 64.A NH2 GLU 279.A OE2 no hydrogen 2.883 N/A TYR 65.A N ILE 37.A O no hydrogen 3.049 N/A ASP 66.A N HIS 18.A O no hydrogen 3.155 N/A LEU 68.A N SER 81.A OG no hydrogen 2.908 N/A HIS 69.A N GLU 16.A O no hydrogen 3.048 N/A HIS 69.A ND1 SER 67.A O no hydrogen 3.216 N/A THR 74.A OG1 THR 77.A OG1 no hydrogen 3.200 N/A THR 76.A N ASP 169.A OD2 no hydrogen 3.193 N/A THR 76.A OG1 ASP 169.A OD1 no hydrogen 2.916 N/A THR 76.A OG1 ASP 169.A OD2 no hydrogen 2.927 N/A THR 77.A N THR 74.A OG1 no hydrogen 3.214 N/A THR 77.A OG1 THR 74.A OG1 no hydrogen 3.200 N/A GLY 78.A N THR 74.A O no hydrogen 3.471 N/A LYS 79.A N MET 75.A O no hydrogen 3.148 N/A ASN 80.A N THR 76.A O no hydrogen 2.932 N/A SER 81.A N THR 77.A O no hydrogen 2.980 N/A SER 81.A OG THR 77.A O no hydrogen 2.752 N/A LEU 82.A N GLY 78.A O no hydrogen 3.121 N/A CYS 83.A N LYS 79.A O no hydrogen 3.074 N/A CYS 83.A SG LYS 79.A O no hydrogen 3.573 N/A THR 84.A N ASN 80.A O no hydrogen 2.883 N/A THR 84.A OG1 ASN 80.A O no hydrogen 2.775 N/A VAL 85.A N SER 81.A O no hydrogen 2.967 N/A TYR 86.A N LEU 82.A O no hydrogen 3.007 N/A TYR 86.A OH GLU 117.A O no hydrogen 2.608 N/A HIS 87.A N CYS 83.A O no hydrogen 3.067 N/A TRP 88.A N THR 84.A O no hydrogen 3.039 N/A TRP 88.A NE1 GLU 292.A OE1 no hydrogen 3.213 N/A LEU 89.A N VAL 85.A O no hydrogen 2.852 N/A GLN 90.A N TYR 86.A O no hydrogen 3.197 N/A GLN 90.A NE2 THR 94.A O no hydrogen 3.639 N/A THR 91.A N HIS 87.A O no hydrogen 3.127 N/A THR 91.A OG1 HIS 87.A O no hydrogen 3.124 N/A THR 91.A OG1 TRP 88.A O no hydrogen 3.123 N/A LYS 92.A N TRP 88.A O no hydrogen 3.049 N/A LYS 92.A N LEU 89.A O no hydrogen 3.086 N/A GLY 93.A N GLN 90.A O no hydrogen 3.058 N/A THR 94.A N LEU 89.A O no hydrogen 2.837 N/A THR 94.A OG1 LEU 89.A O no hydrogen 3.134 N/A GLY 98.A N THR 34.A O no hydrogen 2.953 N/A LEU 99.A N PHE 120.A O no hydrogen 3.047 N/A ILE 100.A N LEU 36.A O no hydrogen 2.931 N/A ALA 101.A N ILE 122.A O no hydrogen 3.056 N/A SER 103.A N ALA 124.A O no hydrogen 3.084 N/A SER 103.A OG HIS 230.A NE2 no hydrogen 2.723 N/A SER 105.A N ALA 102.A O no hydrogen 3.048 N/A ALA 106.A N SER 103.A O no hydrogen 3.112 N/A ARG 107.A N LEU 104.A O no hydrogen 3.117 N/A ARG 107.A NH1 ARG 107.A O no hydrogen 2.916 N/A ARG 107.A NH1 GLU 111.A OE1 no hydrogen 2.874 N/A ARG 107.A NH2 GLU 111.A OE1 no hydrogen 3.337 N/A ARG 107.A NH2 SER 180.A OG no hydrogen 3.306 N/A ALA 109.A N SER 105.A O no hydrogen 3.093 N/A TYR 110.A N ALA 106.A O no hydrogen 3.001 N/A TYR 110.A OH THR 123.A OG1 no hydrogen 2.824 N/A GLU 111.A N ARG 107.A O no hydrogen 3.177 N/A GLU 111.A N VAL 108.A O no hydrogen 3.327 N/A VAL 112.A N ALA 109.A O no hydrogen 3.068 N/A SER 114.A OG LYS 184.A O no hydrogen 2.871 N/A ASP 115.A N VAL 112.A O no hydrogen 2.950 N/A LEU 116.A N VAL 112.A O no hydrogen 2.823 N/A SER 119.A N ILE 97.A O no hydrogen 2.688 N/A SER 119.A OG ASN 33.A OD1 no hydrogen 2.723 N/A LEU 121.A N PRO 191.A O no hydrogen 2.954 N/A ILE 122.A N LEU 99.A O no hydrogen 2.881 N/A THR 123.A N ILE 193.A O no hydrogen 2.951 N/A THR 123.A OG1 TYR 110.A OH no hydrogen 2.824 N/A ALA 124.A N ALA 101.A O no hydrogen 3.077 N/A VAL 125.A N PHE 195.A O no hydrogen 2.877 N/A VAL 127.A N SER 103.A O no hydrogen 3.243 N/A ASN 129.A ND2 GLU 207.A OE1 no hydrogen 2.945 N/A ASN 129.A ND2 GLU 207.A OE2 no hydrogen 3.374 N/A ARG 131.A N ASP 176.A O no hydrogen 3.036 N/A ARG 131.A NE ASP 141.A OD2 no hydrogen 3.180 N/A ARG 131.A NH2 ASP 141.A OD2 no hydrogen 3.031 N/A ASP 132.A N ASN 129.A OD1 no hydrogen 3.380 N/A THR 133.A N ASN 129.A O no hydrogen 3.115 N/A THR 133.A OG1 ASN 129.A O no hydrogen 3.391 N/A THR 133.A OG1 TRP 202.A O no hydrogen 2.774 N/A LEU 134.A N LEU 130.A O no hydrogen 2.951 N/A GLU 135.A N ARG 131.A O no hydrogen 3.035 N/A LYS 136.A N ASP 132.A O no hydrogen 3.077 N/A LYS 136.A NZ ASP 132.A OD2 no hydrogen 3.324 N/A LYS 136.A NZ ASP 201.A O no hydrogen 3.557 N/A ALA 137.A N THR 133.A O no hydrogen 2.817 N/A LEU 138.A N LEU 134.A O no hydrogen 2.935 N/A GLY 139.A N GLU 135.A O no hydrogen 2.803 N/A SER 144.A N ASP 141.A O no hydrogen 3.137 N/A SER 144.A OG ASP 141.A O no hydrogen 2.761 N/A LEU 145.A N TYR 142.A O no hydrogen 3.030 N/A GLU 149.A N PRO 146.A O no hydrogen 2.795 N/A LEU 154.A N LEU 161.A O no hydrogen 2.825 N/A GLY 158.A N GLU 157.A OE1 no hydrogen 3.121 N/A HIS 159.A N PHE 156.A O no hydrogen 3.141 N/A HIS 159.A NE2 GLY 40.A O no hydrogen 2.703 N/A LYS 160.A NZ ASP 155.A OD1 no hydrogen 3.554 N/A LEU 161.A N LEU 154.A O no hydrogen 2.695 N/A SER 163.A N ASN 152.A O no hydrogen 3.221 N/A SER 163.A OG PRO 151.A O no hydrogen 2.601 N/A PHE 166.A N GLY 162.A O no hydrogen 3.257 N/A VAL 167.A N SER 163.A O no hydrogen 2.887 N/A ARG 168.A N GLU 164.A O no hydrogen 2.807 N/A ASP 169.A N VAL 165.A O no hydrogen 3.113 N/A CYS 170.A N PHE 166.A O no hydrogen 3.188 N/A CYS 170.A SG PHE 166.A O no hydrogen 3.716 N/A PHE 171.A N VAL 167.A O no hydrogen 3.322 N/A PHE 171.A N ARG 168.A O no hydrogen 3.214 N/A GLU 172.A N ARG 168.A O no hydrogen 3.084 N/A HIS 173.A N ASP 169.A O no hydrogen 2.902 N/A HIS 174.A N PHE 171.A O no hydrogen 3.367 N/A TRP 175.A N CYS 170.A O no hydrogen 2.789 N/A TRP 175.A NE1 THR 76.A OG1 no hydrogen 2.973 N/A THR 177.A N SER 180.A OG no hydrogen 3.289 N/A THR 177.A OG1 SER 180.A OG no hydrogen 3.086 N/A SER 180.A N THR 177.A OG1 no hydrogen 3.197 N/A SER 180.A OG THR 177.A O no hydrogen 2.593 N/A SER 180.A OG THR 177.A OG1 no hydrogen 3.086 N/A THR 181.A N LEU 178.A O no hydrogen 3.124 N/A THR 181.A OG1 VAL 128.A O no hydrogen 2.798 N/A LEU 182.A N LEU 178.A O no hydrogen 3.035 N/A ASP 183.A N ASP 179.A O no hydrogen 2.863 N/A LYS 184.A N THR 181.A O no hydrogen 2.858 N/A VAL 185.A N THR 181.A O no hydrogen 2.988 N/A ALA 186.A N LEU 182.A O no hydrogen 3.210 N/A THR 188.A N VAL 185.A O no hydrogen 3.006 N/A THR 188.A OG1 ILE 113.A O no hydrogen 2.671 N/A VAL 190.A N THR 188.A OG1 no hydrogen 3.298 N/A ILE 193.A N LEU 121.A O no hydrogen 3.068 N/A ALA 194.A N LYS 221.A O no hydrogen 2.908 N/A PHE 195.A N THR 123.A O no hydrogen 2.891 N/A THR 196.A N TYR 223.A O no hydrogen 2.924 N/A THR 196.A OG1 GLN 205.A OE1 no hydrogen 2.850 N/A ASN 198.A N LEU 225.A O no hydrogen 3.015 N/A ASN 199.A N SER 228.A O no hydrogen 2.799 N/A TRP 202.A N ASP 200.A OD1 no hydrogen 3.006 N/A VAL 203.A N ASP 200.A OD1 no hydrogen 3.245 N/A LYS 204.A NZ ASP 132.A OD1 no hydrogen 3.292 N/A LYS 204.A NZ GLU 207.A OE2 no hydrogen 3.503 N/A GLU 207.A N LYS 204.A O no hydrogen 2.896 N/A VAL 208.A N LYS 204.A O no hydrogen 3.284 N/A TYR 209.A N GLN 205.A O no hydrogen 2.977 N/A ASP 210.A N GLU 206.A O no hydrogen 2.946 N/A MET 211.A N GLU 207.A O no hydrogen 3.061 N/A LEU 212.A N VAL 208.A O no hydrogen 2.914 N/A ALA 213.A N TYR 209.A O no hydrogen 2.778 N/A HIS 214.A N MET 211.A O no hydrogen 2.906 N/A HIS 214.A ND1 ASP 210.A O no hydrogen 2.495 N/A ILE 215.A N LEU 212.A O no hydrogen 3.081 N/A ARG 216.A N ALA 186.A O no hydrogen 3.209 N/A GLY 218.A N ILE 215.A O no hydrogen 2.999 N/A CYS 220.A SG LEU 212.A O no hydrogen 3.980 N/A LYS 221.A N LEU 192.A O no hydrogen 3.026 N/A TYR 223.A N ALA 194.A O no hydrogen 2.780 N/A TYR 223.A OH LEU 258.A O no hydrogen 2.634 N/A LEU 225.A N THR 196.A O no hydrogen 2.808 N/A SER 228.A OG LEU 226.A O no hydrogen 2.697 N/A SER 229.A N GLU 234.A OE1 no hydrogen 3.447 N/A SER 229.A OG GLU 234.A OE1 no hydrogen 3.187 N/A HIS 230.A ND1 ASP 200.A OD1 no hydrogen 3.169 N/A HIS 230.A ND1 ASP 200.A OD2 no hydrogen 2.974 N/A HIS 230.A NE2 SER 103.A OG no hydrogen 2.723 N/A VAL 238.A N ASN 235.A OD1 no hydrogen 2.900 N/A LEU 239.A N ASN 235.A O no hydrogen 3.095 N/A ARG 240.A N LEU 236.A O no hydrogen 3.138 N/A ARG 240.A NH1 GLU 266.A OE1 no hydrogen 2.783 N/A ARG 240.A NH1 GLU 266.A OE2 no hydrogen 2.857 N/A ASN 241.A N VAL 237.A O no hydrogen 2.989 N/A PHE 242.A N VAL 238.A O no hydrogen 3.168 N/A TYR 243.A N LEU 239.A O no hydrogen 2.937 N/A GLN 244.A N ARG 240.A O no hydrogen 2.898 N/A SER 245.A N ASN 241.A O no hydrogen 3.207 N/A SER 245.A OG ASN 241.A O no hydrogen 2.789 N/A VAL 246.A N PHE 242.A O no hydrogen 3.004 N/A THR 247.A N TYR 243.A O no hydrogen 3.171 N/A THR 247.A N GLN 244.A O no hydrogen 3.237 N/A THR 247.A OG1 TYR 243.A O no hydrogen 2.758 N/A LYS 248.A N GLN 244.A O no hydrogen 3.019 N/A ALA 249.A N SER 245.A O no hydrogen 3.055 N/A ALA 250.A N VAL 246.A O no hydrogen 2.975 N/A ILE 251.A N THR 247.A O no hydrogen 3.033 N/A ALA 252.A N LYS 248.A O no hydrogen 2.878 N/A MET 253.A N ALA 249.A O no hydrogen 3.003 N/A ASP 254.A N ALA 250.A O no hydrogen 2.954 N/A GLY 255.A N ALA 252.A O no hydrogen 2.995 N/A GLY 256.A N MET 253.A O no hydrogen 3.213 N/A SER 257.A N ALA 252.A O no hydrogen 2.928 N/A SER 257.A OG GLU 259.A O no hydrogen 3.563 N/A SER 257.A OG GLU 259.A OE1 no hydrogen 3.024 N/A GLU 259.A N SER 257.A OG no hydrogen 3.218 N/A ILE 265.A N ASN 58.A OD1 no hydrogen 2.940 N/A ASP 268.A N GLN 271.A OE1 no hydrogen 2.958 N/A GLN 271.A N ASP 268.A OD1 no hydrogen 3.130 N/A LEU 272.A N ASP 268.A O no hydrogen 3.100 N/A THR 273.A N PHE 269.A O no hydrogen 2.818 N/A THR 273.A OG1 PHE 269.A O no hydrogen 2.769 N/A ILE 274.A N GLU 270.A O no hydrogen 3.020 N/A ALA 275.A N GLN 271.A O no hydrogen 2.951 N/A THR 276.A N LEU 272.A O no hydrogen 3.051 N/A THR 276.A OG1 ASP 46.A OD2 no hydrogen 3.190 N/A THR 276.A OG1 LEU 272.A O no hydrogen 3.347 N/A VAL 277.A N THR 273.A O no hydrogen 3.015 N/A ASN 278.A N ILE 274.A O no hydrogen 2.872 N/A GLU 279.A N ALA 275.A O no hydrogen 3.183 N/A GLU 279.A N THR 276.A O no hydrogen 3.323 N/A ARG 281.A N VAL 277.A O no hydrogen 3.357 N/A LEU 282.A N ASN 278.A O no hydrogen 3.106 N/A LYS 283.A N GLU 279.A O no hydrogen 3.007 N/A ALA 284.A N ARG 280.A O no hydrogen 3.369 N/A GLU 285.A N ARG 281.A O no hydrogen 3.034 N/A ILE 286.A N LEU 282.A O no hydrogen 2.951 N/A GLU 287.A N ALA 284.A O no hydrogen 2.947 N/A ASN 288.A N GLU 285.A O no hydrogen 3.018 N/A ARG 289.A NE ALA 6.A O no hydrogen 3.369 N/A GLU 292.A N VAL 8.A O no hydrogen 2.698 N/A ALA 294.A N ARG 10.A O no hydrogen 2.874 N/A