Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tqq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG SER 24.A O no hydrogen 3.025 N/A LEU 2.A N HIS 25.A ND1 no hydrogen 2.859 N/A LYS 3.A N ASP 70.A OD2 no hydrogen 2.656 N/A ILE 4.A N ARG 26.A O no hydrogen 2.763 N/A VAL 5.A N VAL 71.A O no hydrogen 3.041 N/A PHE 6.A N ALA 29.A O no hydrogen 2.979 N/A ALA 7.A N VAL 72.A O no hydrogen 2.867 N/A GLY 8.A N TYR 31.A O no hydrogen 2.957 N/A ALA 13.A N PRO 10.A O no hydrogen 3.130 N/A VAL 14.A N GLN 11.A O no hydrogen 2.987 N/A LEU 17.A N ALA 13.A O no hydrogen 3.155 N/A ARG 18.A N VAL 14.A O no hydrogen 2.734 N/A ALA 19.A N PRO 15.A O no hydrogen 2.841 N/A LEU 20.A N THR 16.A O no hydrogen 3.021 N/A ILE 21.A N LEU 17.A O no hydrogen 2.795 N/A ASP 22.A N ARG 18.A O no hydrogen 2.767 N/A SER 23.A N LEU 20.A O no hydrogen 3.232 N/A SER 23.A OG LEU 20.A O no hydrogen 2.693 N/A HIS 25.A N SER 23.A OG no hydrogen 3.138 N/A ARG 26.A N LEU 2.A O no hydrogen 2.643 N/A LEU 28.A N ILE 4.A O no hydrogen 2.772 N/A VAL 30.A N PRO 49.A O no hydrogen 2.990 N/A TYR 31.A N PHE 6.A O no hydrogen 2.675 N/A THR 32.A N ILE 51.A O no hydrogen 3.066 N/A GLN 33.A N THR 9.A OG1 no hydrogen 2.994 N/A VAL 39.A N THR 9.A O no hydrogen 3.416 N/A LYS 40.A N SER 37.A OG no hydrogen 3.127 N/A LYS 40.A NZ ASP 35.A OD1 no hydrogen 3.322 N/A LYS 40.A NZ ASP 35.A OD2 no hydrogen 2.733 N/A LYS 40.A NZ GLN 52.A OE1 no hydrogen 2.837 N/A GLU 41.A N SER 37.A O no hydrogen 3.201 N/A ILE 42.A N PRO 38.A O no hydrogen 3.198 N/A ALA 43.A N VAL 39.A O no hydrogen 3.022 N/A ARG 44.A N LYS 40.A O no hydrogen 2.941 N/A ARG 44.A NH1 GLU 36.A OE1 no hydrogen 2.769 N/A ARG 44.A NH2 GLU 36.A OE1 no hydrogen 3.225 N/A ARG 44.A NH2 GLU 36.A OE2 no hydrogen 2.483 N/A GLN 45.A N GLU 41.A O no hydrogen 3.074 N/A ASN 46.A N ALA 43.A O no hydrogen 3.072 N/A ASN 46.A ND2 ILE 42.A O no hydrogen 2.856 N/A GLU 47.A N ARG 44.A O no hydrogen 3.348 N/A ILE 48.A N ALA 43.A O no hydrogen 3.005 N/A ILE 51.A N VAL 30.A O no hydrogen 2.855 N/A GLN 52.A NE2 GLN 33.A O no hydrogen 2.753 N/A GLN 52.A NE2 ASP 35.A OD1 no hydrogen 3.139 N/A ARG 57.A N SER 55.A OG no hydrogen 3.163 N/A GLN 62.A N ASP 58.A O no hydrogen 2.944 N/A GLN 62.A NE2 LEU 56.A O no hydrogen 3.368 N/A GLU 63.A N GLU 59.A O no hydrogen 3.037 N/A LYS 64.A N VAL 60.A O no hydrogen 2.986 N/A LEU 65.A N GLU 61.A O no hydrogen 3.137 N/A ILE 66.A N GLN 62.A O no hydrogen 3.119 N/A ALA 67.A N GLU 63.A O no hydrogen 2.985 N/A ASP 70.A N LYS 3.A O no hydrogen 2.686 N/A VAL 71.A N LYS 3.A O no hydrogen 3.253 N/A VAL 73.A N VAL 93.A O no hydrogen 2.863 N/A VAL 74.A N ALA 7.A O no hydrogen 2.875 N/A LEU 85.A N PRO 81.A O no hydrogen 3.139 N/A ASN 86.A N LYS 82.A O no hydrogen 3.171 N/A ASN 86.A N LYS 83.A O no hydrogen 3.079 N/A ALA 87.A N ALA 84.A O no hydrogen 3.314 N/A ARG 89.A NE ASP 70.A OD1 no hydrogen 3.175 N/A ARG 89.A NH1 GLU 171.A OE2 no hydrogen 3.441 N/A ARG 89.A NH2 ASP 70.A OD1 no hydrogen 3.547 N/A LEU 90.A N ASP 70.A O no hydrogen 2.894 N/A GLY 91.A N PHE 88.A O no hydrogen 2.900 N/A CYS 92.A SG ALA 84.A O no hydrogen 3.597 N/A ASN 94.A ND2 VAL 73.A O no hydrogen 2.756 N/A VAL 95.A N VAL 73.A O no hydrogen 3.239 N/A HIS 96.A N SER 123.A O no hydrogen 2.922 N/A SER 98.A OG ARG 102.A O no hydrogen 2.567 N/A SER 98.A OG TRP 103.A O no hydrogen 3.047 N/A LEU 100.A N SER 123.A OG no hydrogen 3.049 N/A ARG 102.A N LEU 99.A O no hydrogen 3.087 N/A ARG 102.A NE ASP 117.A OD2 no hydrogen 2.842 N/A ARG 102.A NH2 ASP 117.A OD1 no hydrogen 2.913 N/A TRP 103.A N THR 186.A OG1 no hydrogen 2.839 N/A TRP 103.A NE1 ASP 117.A OD2 no hydrogen 2.837 N/A ARG 104.A N THR 186.A O no hydrogen 2.859 N/A ARG 104.A NH1 GLN 180.A OE1 no hydrogen 2.753 N/A ARG 104.A NH2 GLU 182.A OE2 no hydrogen 2.608 N/A ARG 104.A NH2 TYR 187.A OH no hydrogen 2.861 N/A GLY 105.A N ASP 130.A OD2 no hydrogen 2.856 N/A ALA 107.A N ALA 188.A O no hydrogen 2.791 N/A ARG 111.A N ALA 107.A O no hydrogen 2.939 N/A ARG 111.A NE SER 189.A O no hydrogen 3.009 N/A ARG 111.A NH1 GLU 195.A OE2 no hydrogen 2.997 N/A ARG 111.A NH2 SER 189.A O no hydrogen 3.037 N/A ARG 111.A NH2 LYS 190.A O no hydrogen 3.326 N/A ARG 111.A NH2 GLU 195.A OE1 no hydrogen 2.823 N/A ARG 111.A NH2 GLU 195.A OE2 no hydrogen 3.303 N/A ALA 112.A N PRO 108.A O no hydrogen 3.038 N/A ILE 113.A N ILE 109.A O no hydrogen 3.268 N/A LEU 114.A N GLN 110.A O no hydrogen 2.903 N/A ALA 115.A N ARG 111.A O no hydrogen 3.027 N/A GLY 116.A N ILE 113.A O no hydrogen 2.926 N/A ASP 117.A N ALA 112.A O no hydrogen 3.057 N/A THR 120.A N CYS 140.A O no hydrogen 3.005 N/A GLY 121.A N THR 120.A OG1 no hydrogen 2.686 N/A ILE 122.A N SER 138.A O no hydrogen 2.933 N/A SER 123.A N HIS 96.A O no hydrogen 2.920 N/A SER 123.A OG SER 98.A O no hydrogen 2.657 N/A ILE 124.A N ALA 136.A O no hydrogen 2.940 N/A GLN 125.A NE2 LEU 90.A O no hydrogen 3.088 N/A ASN 126.A ND2 THR 131.A OG1 no hydrogen 3.297 N/A GLY 128.A N ASN 126.A OD1 no hydrogen 2.798 N/A THR 131.A OG1 ASN 126.A OD1 no hydrogen 3.201 N/A VAL 134.A N GLU 178.A O no hydrogen 2.911 N/A LEU 135.A N ILE 124.A O no hydrogen 2.718 N/A LYS 137.A NZ LEU 100.A O no hydrogen 2.527 N/A LYS 137.A NZ SER 123.A OG no hydrogen 2.786 N/A SER 138.A N ILE 122.A O no hydrogen 3.154 N/A CYS 140.A N THR 120.A O no hydrogen 2.899 N/A CYS 140.A SG VAL 141.A O no hydrogen 3.997 N/A ILE 142.A N ARG 118.A O no hydrogen 2.871 N/A SER 143.A N ASP 146.A OD2 no hydrogen 2.804 N/A SER 143.A OG ASP 146.A OD2 no hydrogen 2.807 N/A ASP 146.A N SER 143.A O no hydrogen 2.943 N/A THR 147.A N ASP 150.A OD2 no hydrogen 3.012 N/A ALA 148.A N ARG 212.A O no hydrogen 3.260 N/A ALA 149.A N ASN 215.A O no hydrogen 3.384 N/A ASP 150.A N THR 147.A OG1 no hydrogen 3.221 N/A LEU 151.A N THR 147.A O no hydrogen 3.089 N/A HIS 152.A N ALA 148.A O no hydrogen 2.776 N/A HIS 152.A ND1 ASP 153.A OD1 no hydrogen 2.822 N/A ASP 153.A N ALA 149.A O no hydrogen 3.055 N/A ARG 154.A N ASP 150.A O no hydrogen 3.070 N/A ARG 154.A NH1 VAL 141.A O no hydrogen 3.120 N/A ARG 154.A NH1 ASP 146.A OD2 no hydrogen 2.973 N/A ARG 154.A NH2 ASP 146.A OD1 no hydrogen 2.956 N/A ARG 154.A NH2 ASP 146.A OD2 no hydrogen 3.499 N/A LEU 155.A N LEU 151.A O no hydrogen 2.884 N/A SER 156.A N HIS 152.A O no hydrogen 2.915 N/A SER 156.A OG HIS 152.A O no hydrogen 3.555 N/A SER 156.A OG ASP 153.A O no hydrogen 2.588 N/A LEU 157.A N ASP 153.A O no hydrogen 3.464 N/A ILE 158.A N ARG 154.A O no hydrogen 3.211 N/A GLY 159.A N LEU 155.A O no hydrogen 2.769 N/A ALA 160.A N SER 156.A O no hydrogen 3.332 N/A ASP 161.A N LEU 157.A O no hydrogen 3.231 N/A LEU 162.A N ILE 158.A O no hydrogen 2.962 N/A LEU 163.A N GLY 159.A O no hydrogen 2.846 N/A LEU 164.A N ALA 160.A O no hydrogen 3.092 N/A GLU 165.A N ASP 161.A O no hydrogen 2.976 N/A SER 166.A N LEU 162.A O no hydrogen 2.816 N/A SER 166.A OG LEU 162.A O no hydrogen 2.758 N/A LEU 167.A N LEU 163.A O no hydrogen 2.915 N/A ALA 168.A N LEU 164.A O no hydrogen 3.252 N/A LYS 169.A N GLU 165.A O no hydrogen 3.249 N/A LEU 170.A N SER 166.A O no hydrogen 2.805 N/A GLU 171.A N LEU 167.A O no hydrogen 3.165 N/A LYS 172.A N ALA 168.A O no hydrogen 3.324 N/A LYS 172.A N LYS 169.A O no hydrogen 3.235 N/A ASP 174.A N LYS 169.A O no hydrogen 2.839 N/A GLU 178.A N VAL 134.A O no hydrogen 2.917 N/A LYS 179.A NZ ASP 133.A OD1 no hydrogen 2.970 N/A LYS 179.A NZ ASP 133.A OD2 no hydrogen 3.327 N/A GLN 180.A NE2 ASP 130.A O no hydrogen 2.993 N/A GLN 180.A NE2 GLY 132.A O no hydrogen 2.915 N/A SER 184.A N ASP 181.A O no hydrogen 2.996 N/A SER 184.A OG ASP 181.A OD2 no hydrogen 3.127 N/A ALA 185.A N GLU 182.A O no hydrogen 3.154 N/A THR 186.A N PRO 101.A O no hydrogen 3.205 N/A ALA 188.A N ARG 104.A O no hydrogen 2.561 N/A LYS 190.A NZ GLN 192.A OE1 no hydrogen 3.301 N/A GLN 192.A N GLU 195.A OE1 no hydrogen 2.933 N/A GLU 195.A N GLN 192.A O no hydrogen 2.979 N/A ALA 196.A N LYS 193.A O no hydrogen 2.874 N/A LEU 197.A N GLN 194.A O no hydrogen 3.216 N/A ILE 198.A N PHE 221.A O no hydrogen 2.838 N/A TRP 200.A NE1 THR 222.A OG1 no hydrogen 2.898 N/A ARG 201.A N ASP 199.A OD1 no hydrogen 3.100 N/A ARG 201.A NE ASP 199.A OD1 no hydrogen 2.994 N/A ARG 201.A NH2 ASP 199.A OD2 no hydrogen 3.033 N/A LYS 202.A N ASP 199.A O no hydrogen 3.053 N/A ALA 204.A N SER 261.A O no hydrogen 2.957 N/A GLU 206.A N SER 203.A OG no hydrogen 2.922 N/A ILE 207.A N SER 203.A O no hydrogen 3.010 N/A ALA 208.A N ALA 204.A O no hydrogen 2.902 N/A ARG 209.A N VAL 205.A O no hydrogen 3.165 N/A GLN 210.A N GLU 206.A O no hydrogen 3.154 N/A GLN 210.A NE2 GLU 195.A O no hydrogen 2.822 N/A GLN 210.A NE2 LEU 197.A O no hydrogen 2.988 N/A VAL 211.A N ILE 207.A O no hydrogen 2.887 N/A ARG 212.A N ALA 208.A O no hydrogen 3.013 N/A ALA 213.A N ARG 209.A O no hydrogen 2.717 N/A PHE 214.A N GLN 210.A O no hydrogen 3.026 N/A ASN 215.A N ARG 212.A O no hydrogen 3.279 N/A ASN 215.A ND2 TRP 231.A O no hydrogen 2.997 N/A ILE 219.A N PHE 214.A O no hydrogen 2.620 N/A PHE 221.A N ALA 196.A O no hydrogen 2.952 N/A TYR 223.A N THR 222.A OG1 no hydrogen 2.652 N/A PHE 224.A N GLN 227.A O no hydrogen 2.768 N/A GLN 227.A N PHE 224.A O no hydrogen 3.133 N/A ARG 229.A NE GLN 270.A OE1 no hydrogen 3.127 N/A ARG 229.A NH2 GLN 270.A OE1 no hydrogen 3.109 N/A ILE 230.A N ALA 220.A O no hydrogen 2.828 N/A TRP 231.A N GLN 268.A O no hydrogen 2.873 N/A TRP 231.A NE1 GLN 270.A OE1 no hydrogen 2.873 N/A ARG 232.A N GLN 268.A O no hydrogen 3.193 N/A THR 234.A N ARG 265.A O no hydrogen 2.979 N/A THR 234.A OG1 HIS 267.A NE2 no hydrogen 2.590 N/A VAL 236.A N ILE 263.A O no hydrogen 2.857 N/A GLU 238.A N VAL 236.A O no hydrogen 2.884 N/A GLY 245.A N ALA 258.A O no hydrogen 2.729 N/A VAL 246.A N GLU 243.A O no hydrogen 3.130 N/A VAL 248.A N SER 256.A O no hydrogen 2.800 N/A ASP 249.A N SER 256.A O no hydrogen 3.315 N/A ASP 251.A N GLY 254.A O no hydrogen 3.025 N/A LYS 253.A N ASP 251.A OD2 no hydrogen 2.795 N/A GLY 254.A N ASP 251.A O no hydrogen 2.775 N/A ILE 255.A N LEU 266.A O no hydrogen 2.918 N/A SER 256.A N ASP 249.A O no hydrogen 2.798 N/A ILE 257.A N LEU 264.A O no hydrogen 2.791 N/A ALA 258.A N VAL 246.A O no hydrogen 2.913 N/A ALA 259.A N GLY 262.A O no hydrogen 3.243 N/A GLY 260.A N LYS 202.A O no hydrogen 3.044 N/A ILE 263.A N VAL 236.A O no hydrogen 2.970 N/A LEU 264.A N ILE 257.A O no hydrogen 2.898 N/A ARG 265.A N THR 234.A O no hydrogen 2.842 N/A ARG 265.A NE THR 234.A OG1 no hydrogen 3.419 N/A ARG 265.A NH2 THR 234.A OG1 no hydrogen 3.283 N/A LEU 266.A N ILE 255.A O no hydrogen 2.827 N/A HIS 267.A N ARG 232.A O no hydrogen 2.855 N/A HIS 267.A NE2 THR 234.A OG1 no hydrogen 2.590 N/A GLN 268.A N ARG 232.A O no hydrogen 3.322 N/A LEU 269.A N CYS 277.A O no hydrogen 2.915 N/A GLN 270.A N ARG 229.A O no hydrogen 2.863 N/A GLN 270.A NE2 LYS 274.A O no hydrogen 2.858 N/A LYS 274.A N LEU 271.A O no hydrogen 3.052 N/A CYS 277.A N LEU 269.A O no hydrogen 2.793 N/A CYS 277.A SG LEU 269.A O no hydrogen 3.732 N/A CYS 277.A SG SER 278.A O no hydrogen 3.914 N/A ALA 279.A N HIS 267.A O no hydrogen 2.989 N/A ASP 281.A N SER 278.A OG no hydrogen 2.973 N/A PHE 282.A N SER 278.A O no hydrogen 3.061 N/A ILE 283.A N ALA 279.A O no hydrogen 3.036 N/A ASN 284.A N GLY 280.A O no hydrogen 3.042 N/A ALA 285.A N ASP 281.A O no hydrogen 3.063 N/A HIS 286.A N PHE 282.A O no hydrogen 2.796 N/A LYS 289.A N HIS 286.A O no hydrogen 2.919 N/A LEU 290.A N GLY 287.A O no hydrogen 2.932 N/A ILE 291.A N THR 295.A OG1 no hydrogen 2.625 N/A GLY 293.A N LEU 247.A O no hydrogen 2.796 N/A LYS 294.A N ILE 291.A O no hydrogen 2.916 N/A THR 295.A N ILE 291.A O no hydrogen 2.872 N/A THR 295.A OG1 LYS 289.A O no hydrogen 3.128 N/A THR 295.A OG1 ILE 291.A O no hydrogen 3.399 N/A PHE 297.A N GLY 245.A O no hydrogen 2.642 N/A GLY 298.A N TYR 223.A O no hydrogen 2.907 N/A