Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1tda_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N MET 1.A O no hydrogen 3.354 N/A GLN 4.A NE2 ASP 8.A OD1 no hydrogen 2.989 N/A TYR 6.A N GLU 3.A O no hydrogen 2.991 N/A TYR 6.A OH ILE 222.A O no hydrogen 2.609 N/A LEU 7.A N GLU 3.A O no hydrogen 3.493 N/A ASP 8.A N GLN 4.A O no hydrogen 2.888 N/A LEU 9.A N PRO 5.A O no hydrogen 3.392 N/A ALA 10.A N TYR 6.A O no hydrogen 3.418 N/A LYS 11.A N LEU 7.A O no hydrogen 2.992 N/A LYS 12.A N ASP 8.A O no hydrogen 2.873 N/A VAL 13.A N LEU 9.A O no hydrogen 2.921 N/A LEU 14.A N ALA 10.A O no hydrogen 2.990 N/A ASP 15.A N LYS 11.A O no hydrogen 3.055 N/A GLU 16.A N LYS 12.A O no hydrogen 2.566 N/A GLY 17.A N VAL 13.A O no hydrogen 2.656 N/A HIS 18.A ND1 SER 30.A O no hydrogen 2.888 N/A LYS 20.A N THR 28.A O no hydrogen 3.189 N/A LYS 20.A NZ ASP 257.A OD2 no hydrogen 3.007 N/A ASP 22.A N HIS 25.A O no hydrogen 3.367 N/A ARG 23.A N HIS 25.A O no hydrogen 3.356 N/A THR 28.A OG1 LYS 20.A O no hydrogen 3.318 N/A THR 28.A OG1 ASP 22.A OD2 no hydrogen 2.356 N/A TYR 29.A N LEU 260.A O no hydrogen 2.979 N/A SER 30.A N HIS 18.A O no hydrogen 2.868 N/A SER 30.A OG HIS 18.A O no hydrogen 3.488 N/A ILE 31.A N ALA 258.A O no hydrogen 3.122 N/A GLY 33.A N GLY 256.A O no hydrogen 2.615 N/A HIS 34.A N PHE 255.A O no hydrogen 3.009 N/A ARG 37.A NH1 GLU 250.A OE1 no hydrogen 2.585 N/A PHE 38.A N PHE 251.A O no hydrogen 2.851 N/A LEU 40.A N GLY 249.A O no hydrogen 2.868 N/A SER 41.A N ASP 39.A OD1 no hydrogen 3.038 N/A SER 41.A OG ASP 39.A OD1 no hydrogen 2.665 N/A SER 41.A OG ASP 39.A OD2 no hydrogen 3.114 N/A LYS 42.A N ASP 39.A O no hydrogen 3.067 N/A LYS 42.A NZ SER 41.A O no hydrogen 2.877 N/A LYS 42.A NZ SER 41.A OG no hydrogen 3.081 N/A PHE 44.A N PRO 280.A O no hydrogen 3.022 N/A LEU 46.A N PHE 44.A O no hydrogen 2.786 N/A THR 48.A OG1 GLU 3.A OE2 no hydrogen 2.623 N/A THR 49.A N GLU 3.A OE2 no hydrogen 2.816 N/A THR 49.A OG1 GLU 3.A OE1 no hydrogen 3.182 N/A THR 49.A OG1 GLU 3.A OE2 no hydrogen 3.183 N/A THR 49.A OG1 GLN 271.A OE1 no hydrogen 3.116 N/A LYS 50.A NZ PHE 223.A O no hydrogen 3.484 N/A LYS 51.A N TYR 307.A O no hydrogen 3.136 N/A VAL 52.A N TYR 304.A OH no hydrogen 2.664 N/A LEU 56.A N PRO 53.A O no hydrogen 3.123 N/A ILE 57.A N PHE 54.A O no hydrogen 3.061 N/A LYS 58.A N PHE 54.A O no hydrogen 2.795 N/A LYS 58.A NZ ILE 299.A O no hydrogen 2.682 N/A SER 59.A N GLY 55.A O no hydrogen 2.886 N/A GLU 60.A N LEU 56.A O no hydrogen 3.252 N/A LEU 61.A N ILE 57.A O no hydrogen 2.950 N/A LEU 62.A N LYS 58.A O no hydrogen 3.423 N/A TRP 63.A N SER 59.A O no hydrogen 3.243 N/A TRP 63.A N GLU 60.A O no hydrogen 3.283 N/A TRP 63.A NE1 ASN 70.A O no hydrogen 2.782 N/A PHE 64.A N GLU 60.A O no hydrogen 3.200 N/A LEU 65.A N LEU 61.A O no hydrogen 2.959 N/A HIS 66.A N LEU 62.A O no hydrogen 2.839 N/A HIS 66.A NE2 PHE 294.A O no hydrogen 3.097 N/A GLY 67.A N PHE 64.A O no hydrogen 2.744 N/A ASP 68.A N TRP 63.A O no hydrogen 3.104 N/A THR 69.A N ASP 68.A OD1 no hydrogen 2.755 N/A THR 69.A OG1 ASP 141.A OD1 no hydrogen 2.807 N/A ASN 70.A N ASP 68.A OD1 no hydrogen 3.144 N/A ASN 70.A ND2 ALA 136.A O no hydrogen 3.139 N/A ILE 71.A N GLY 140.A O no hydrogen 2.754 N/A ARG 72.A N ASN 70.A OD1 no hydrogen 2.946 N/A ARG 72.A NE VAL 129.A O no hydrogen 3.186 N/A ARG 72.A NH1 ASP 133.A OD1 no hydrogen 3.424 N/A ARG 72.A NH2 VAL 129.A O no hydrogen 3.087 N/A ARG 72.A NH2 ASP 133.A OD1 no hydrogen 3.507 N/A PHE 73.A N ASN 70.A O no hydrogen 3.506 N/A LEU 74.A N ILE 71.A O no hydrogen 2.829 N/A LEU 75.A N ILE 71.A O no hydrogen 3.135 N/A GLN 76.A N ARG 72.A O no hydrogen 2.997 N/A GLN 76.A NE2 ARG 72.A O no hydrogen 3.223 N/A HIS 77.A N LEU 74.A O no hydrogen 2.703 N/A HIS 77.A ND1 PHE 73.A O no hydrogen 2.730 N/A ASN 79.A N LEU 74.A O no hydrogen 2.932 N/A ASN 79.A ND2 LEU 56.A O no hydrogen 2.992 N/A HIS 80.A ND1 ASP 83.A OD2 no hydrogen 2.818 N/A ILE 81.A N ASN 79.A OD1 no hydrogen 3.406 N/A TRP 82.A NE1 GLU 60.A OE2 no hydrogen 2.722 N/A TRP 85.A N TRP 82.A O no hydrogen 3.131 N/A ALA 86.A N TRP 82.A O no hydrogen 3.511 N/A PHE 87.A N ASP 83.A O no hydrogen 2.938 N/A GLU 88.A N GLU 84.A O no hydrogen 2.925 N/A LYS 89.A N TRP 85.A O no hydrogen 3.375 N/A LYS 89.A NZ ALA 86.A O no hydrogen 3.361 N/A LYS 89.A NZ TYR 139.A O no hydrogen 2.535 N/A TRP 90.A N PHE 87.A O no hydrogen 2.838 N/A VAL 91.A N PHE 87.A O no hydrogen 2.817 N/A LYS 92.A NZ SER 93.A O no hydrogen 2.968 N/A SER 93.A OG ASP 94.A OD2 no hydrogen 2.141 N/A ASP 100.A N GLY 98.A O no hydrogen 2.834 N/A HIS 106.A N PHE 104.A O no hydrogen 2.649 N/A ARG 107.A N ASP 103.A O no hydrogen 2.870 N/A ARG 107.A NH1 THR 102.A O no hydrogen 2.602 N/A SER 108.A N PHE 104.A O no hydrogen 2.690 N/A SER 108.A OG PHE 104.A O no hydrogen 2.860 N/A GLN 109.A N HIS 106.A O no hydrogen 2.728 N/A LYS 110.A N HIS 106.A O no hydrogen 2.342 N/A VAL 117.A N GLU 113.A O no hydrogen 3.168 N/A TYR 118.A N PHE 114.A O no hydrogen 3.413 N/A HIS 119.A N ALA 115.A O no hydrogen 2.840 N/A HIS 119.A ND1 ALA 115.A O no hydrogen 2.689 N/A GLU 120.A N ALA 116.A O no hydrogen 3.003 N/A GLU 120.A N VAL 117.A O no hydrogen 2.871 N/A GLU 121.A N VAL 117.A O no hydrogen 2.667 N/A MET 122.A N TYR 118.A O no hydrogen 2.726 N/A LYS 124.A N GLU 120.A O no hydrogen 2.857 N/A LYS 124.A NZ GLU 121.A OE1 no hydrogen 2.868 N/A PHE 125.A N GLU 121.A O no hydrogen 3.032 N/A ASP 126.A N MET 122.A O no hydrogen 2.870 N/A ASP 127.A N ALA 123.A O no hydrogen 3.156 N/A ARG 128.A N LYS 124.A O no hydrogen 2.933 N/A ARG 128.A NE GLU 95.A OE2 no hydrogen 2.928 N/A ARG 128.A NH2 GLU 95.A OE1 no hydrogen 2.782 N/A ARG 128.A NH2 GLU 95.A OE2 no hydrogen 2.943 N/A VAL 129.A N PHE 125.A O no hydrogen 2.921 N/A LEU 130.A N ASP 126.A O no hydrogen 3.007 N/A HIS 131.A N ASP 127.A O no hydrogen 3.242 N/A HIS 131.A ND1 ASP 127.A OD1 no hydrogen 2.916 N/A ASP 132.A N ARG 128.A O no hydrogen 3.010 N/A PHE 135.A N ASP 132.A O no hydrogen 2.676 N/A ALA 136.A N ASP 132.A O no hydrogen 2.691 N/A ALA 137.A N ASP 133.A O no hydrogen 2.891 N/A TYR 139.A N PHE 135.A O no hydrogen 2.686 N/A ASP 141.A N ALA 136.A O no hydrogen 3.125 N/A LEU 142.A N THR 69.A O no hydrogen 3.138 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 2.928 N/A SER 148.A OG GLY 143.A O no hydrogen 2.813 N/A GLN 149.A N TYR 146.A O no hydrogen 2.710 N/A TRP 150.A N TYR 146.A O no hydrogen 2.986 N/A ARG 151.A N GLY 147.A O no hydrogen 3.405 N/A ARG 151.A NE ASP 162.A OD1 no hydrogen 3.078 N/A ARG 151.A NE ASP 162.A OD2 no hydrogen 3.191 N/A ARG 151.A NH2 ASP 162.A OD2 no hydrogen 3.419 N/A ALA 152.A N SER 148.A O no hydrogen 2.835 N/A TRP 153.A N ILE 161.A O no hydrogen 2.927 N/A THR 155.A N ASP 159.A O no hydrogen 2.994 N/A THR 155.A OG1 ASP 159.A O no hydrogen 3.283 N/A GLY 158.A N THR 155.A O no hydrogen 2.747 N/A ILE 161.A N TRP 153.A O no hydrogen 3.032 N/A GLN 163.A NE2 SER 183.A O no hydrogen 2.779 N/A LEU 164.A N TRP 150.A O no hydrogen 3.269 N/A GLY 165.A N ASP 162.A OD1 no hydrogen 3.035 N/A ASP 166.A N ASP 162.A O no hydrogen 3.136 N/A VAL 167.A N GLN 163.A O no hydrogen 3.221 N/A ILE 168.A N LEU 164.A O no hydrogen 2.740 N/A GLU 169.A N GLY 165.A O no hydrogen 2.948 N/A GLN 170.A N ASP 166.A O no hydrogen 2.871 N/A GLN 170.A NE2 THR 173.A OG1 no hydrogen 3.369 N/A ILE 171.A N VAL 167.A O no hydrogen 2.931 N/A LYS 172.A NZ GLU 243.A OE1 no hydrogen 3.166 N/A THR 173.A N GLN 170.A O no hydrogen 3.078 N/A THR 173.A OG1 GLU 169.A O no hydrogen 2.698 N/A HIS 174.A N GLN 170.A O no hydrogen 2.594 N/A SER 177.A N HIS 174.A O no hydrogen 2.948 N/A ARG 179.A N SER 177.A OG no hydrogen 2.971 N/A ILE 181.A N ARG 179.A O no hydrogen 2.792 N/A VAL 182.A N TYR 202.A O no hydrogen 2.810 N/A SER 183.A N GLN 163.A OE1 no hydrogen 2.844 N/A ALA 184.A N THR 200.A O no hydrogen 3.054 N/A TRP 185.A N SER 183.A OG no hydrogen 3.318 N/A GLU 188.A N ASN 186.A OD1 no hydrogen 3.005 N/A ASP 189.A N ASN 186.A O no hydrogen 3.015 N/A VAL 190.A N ASN 186.A O no hydrogen 3.001 N/A THR 192.A N ASP 189.A O no hydrogen 2.706 N/A THR 192.A OG1 ASP 189.A O no hydrogen 3.087 N/A MET 193.A N ASP 189.A O no hydrogen 3.188 N/A HIS 199.A N TYR 146.A OH no hydrogen 3.272 N/A HIS 199.A NE2 GLN 217.A OE1 no hydrogen 2.775 N/A THR 200.A N CYS 198.A O no hydrogen 2.605 N/A THR 200.A OG1 CYS 198.A O no hydrogen 2.673 N/A THR 200.A OG1 TYR 216.A O no hydrogen 2.552 N/A TYR 202.A N VAL 182.A O no hydrogen 2.767 N/A GLN 203.A N GLN 214.A O no hydrogen 3.047 N/A PHE 204.A N LEU 180.A O no hydrogen 3.029 N/A ASN 207.A N LYS 210.A O no hydrogen 3.197 N/A ASN 207.A ND2 TYR 205.A OH no hydrogen 3.124 N/A LYS 210.A N ASN 207.A O no hydrogen 2.977 N/A LYS 210.A NZ ASP 208.A O no hydrogen 3.203 N/A LEU 211.A N GLU 247.A O no hydrogen 2.751 N/A SER 212.A N TYR 205.A O no hydrogen 3.040 N/A LEU 213.A N GLU 250.A O no hydrogen 2.680 N/A GLN 214.A N GLN 203.A O no hydrogen 2.860 N/A LEU 215.A N ILE 252.A O no hydrogen 3.269 N/A TYR 216.A N LEU 201.A O no hydrogen 3.006 N/A GLN 217.A N THR 254.A O no hydrogen 2.868 N/A GLN 217.A NE2 SER 219.A O no hydrogen 2.972 N/A GLN 217.A NE2 ASN 229.A OD1 no hydrogen 3.063 N/A ARG 218.A N CYS 198.A O no hydrogen 2.982 N/A SER 219.A OG ARG 218.A O no hydrogen 2.941 N/A ILE 222.A N HIS 259.A O no hydrogen 2.723 N/A LEU 224.A N ASP 221.A OD1 no hydrogen 2.970 N/A GLY 225.A N ASP 221.A O no hydrogen 2.906 N/A VAL 226.A N ASP 221.A O no hydrogen 2.891 N/A PHE 228.A N GLY 225.A O no hydrogen 2.777 N/A ASN 229.A N GLY 225.A O no hydrogen 3.122 N/A ILE 230.A N VAL 226.A O no hydrogen 3.024 N/A ALA 231.A N PHE 228.A O no hydrogen 3.262 N/A SER 232.A N PHE 228.A O no hydrogen 3.364 N/A SER 232.A N ASN 229.A O no hydrogen 3.185 N/A TYR 233.A N ASN 229.A O no hydrogen 3.433 N/A ALA 234.A N ILE 230.A O no hydrogen 2.938 N/A LEU 235.A N ALA 231.A O no hydrogen 2.913 N/A LEU 236.A N SER 232.A O no hydrogen 2.993 N/A THR 237.A N TYR 233.A O no hydrogen 3.027 N/A THR 237.A OG1 TYR 233.A O no hydrogen 2.671 N/A HIS 238.A N ALA 234.A O no hydrogen 3.020 N/A HIS 238.A ND1 ALA 234.A O no hydrogen 3.183 N/A LEU 239.A N LEU 235.A O no hydrogen 2.990 N/A LEU 239.A N LEU 236.A O no hydrogen 2.905 N/A VAL 240.A N LEU 236.A O no hydrogen 3.112 N/A ALA 241.A N THR 237.A O no hydrogen 3.336 N/A HIS 242.A N HIS 238.A O no hydrogen 2.893 N/A HIS 242.A NE2 LYS 288.A O no hydrogen 3.090 N/A GLU 243.A N LEU 239.A O no hydrogen 2.783 N/A CYS 244.A N VAL 240.A O no hydrogen 2.951 N/A CYS 244.A SG VAL 240.A O no hydrogen 3.213 N/A GLY 245.A N HIS 242.A O no hydrogen 3.343 N/A LEU 246.A N ALA 241.A O no hydrogen 2.858 N/A GLU 247.A N GLY 209.A O no hydrogen 3.194 N/A GLY 249.A N LEU 211.A O no hydrogen 2.954 N/A PHE 251.A N PHE 38.A O no hydrogen 3.025 N/A ILE 252.A N LEU 213.A O no hydrogen 2.938 N/A HIS 253.A N MET 36.A O no hydrogen 2.759 N/A HIS 253.A NE2 GLN 217.A OE1 no hydrogen 2.860 N/A THR 254.A N LEU 215.A O no hydrogen 3.116 N/A THR 254.A OG1 GLN 35.A OE1 no hydrogen 2.832 N/A PHE 255.A N HIS 34.A O no hydrogen 2.959 N/A GLY 256.A N GLN 217.A O no hydrogen 2.958 N/A ALA 258.A N ILE 31.A O no hydrogen 2.903 N/A HIS 259.A ND1 ASP 257.A OD1 no hydrogen 2.787 N/A HIS 259.A NE2 TYR 261.A OH no hydrogen 2.965 N/A LEU 260.A N TYR 29.A O no hydrogen 3.173 N/A TYR 261.A OH HIS 259.A NE2 no hydrogen 2.965 N/A VAL 262.A N GLY 27.A O no hydrogen 2.975 N/A HIS 264.A N TYR 261.A O no hydrogen 3.046 N/A LEU 265.A N VAL 262.A O no hydrogen 3.174 N/A GLN 267.A N GLN 267.A OE1 no hydrogen 2.777 N/A GLN 267.A NE2 LYS 311.A O no hydrogen 3.082 N/A ILE 268.A N HIS 264.A O no hydrogen 3.010 N/A LYS 269.A N LEU 265.A O no hydrogen 2.735 N/A GLU 270.A N ASP 266.A O no hydrogen 2.945 N/A GLN 271.A N GLN 267.A O no hydrogen 2.759 N/A LEU 272.A N ILE 268.A O no hydrogen 3.211 N/A SER 273.A N GLU 270.A O no hydrogen 2.992 N/A SER 273.A OG GLU 270.A O no hydrogen 2.713 N/A ARG 274.A N GLN 271.A O no hydrogen 3.032 N/A ARG 274.A NH1 THR 49.A O no hydrogen 2.718 N/A ARG 274.A NH1 PRO 308.A O no hydrogen 2.708 N/A ARG 274.A NH2 PRO 308.A O no hydrogen 3.488 N/A THR 275.A N TYR 307.A OH no hydrogen 3.097 N/A ARG 277.A N THR 48.A OG1 no hydrogen 3.217 N/A THR 281.A N LEU 302.A O no hydrogen 2.747 N/A GLN 283.A N LYS 300.A O no hydrogen 2.857 N/A GLN 283.A NE2 GLN 283.A O no hydrogen 3.172 N/A ASN 285.A N ASP 298.A O no hydrogen 2.932 N/A LYS 288.A N ASN 285.A O no hydrogen 3.418 N/A LYS 288.A NZ ASP 293.A O no hydrogen 2.835 N/A LYS 288.A NZ ASP 298.A OD1 no hydrogen 3.361 N/A LYS 288.A NZ ASP 298.A OD2 no hydrogen 2.787 N/A ILE 291.A N GLU 243.A OE2 no hydrogen 3.210 N/A ASP 293.A N ASP 290.A O no hydrogen 2.929 N/A PHE 294.A N ILE 291.A O no hydrogen 3.042 N/A ASP 295.A N ASP 298.A OD2 no hydrogen 2.776 N/A ASP 298.A N ASP 295.A O no hydrogen 2.681 N/A ILE 299.A N MET 296.A O no hydrogen 3.282 N/A LYS 300.A N GLN 283.A O no hydrogen 3.057 N/A LEU 302.A N THR 281.A O no hydrogen 2.933 N/A TYR 304.A OH LEU 47.A O no hydrogen 2.719 N/A TYR 304.A OH LYS 50.A O no hydrogen 3.309 N/A TYR 307.A N THR 48.A O no hydrogen 3.159 N/A