Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tiy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N GLU 1.A OE1 no hydrogen 3.103 N/A ASN 2.A ND2 ASN 22.A OD1 no hydrogen 2.906 N/A GLN 4.A N ARG 21.A O no hydrogen 3.180 N/A GLU 7.A N LYS 19.A O no hydrogen 3.403 N/A ILE 9.A N VAL 17.A O no hydrogen 2.986 N/A GLY 12.A N GLY 15.A O no hydrogen 2.710 N/A THR 13.A OG1 ASP 122.A OD2 no hydrogen 3.538 N/A THR 13.A OG1 ASP 140.A OD2 no hydrogen 3.363 N/A TYR 14.A OH GLY 148.A O no hydrogen 3.062 N/A GLY 15.A N GLY 12.A O no hydrogen 3.336 N/A VAL 17.A N GLY 10.A O no hydrogen 2.997 N/A TYR 18.A N LEU 31.A O no hydrogen 2.750 N/A LYS 19.A N GLU 7.A O no hydrogen 2.897 N/A ALA 20.A N VAL 29.A O no hydrogen 2.923 N/A ASN 22.A N GLU 27.A O no hydrogen 2.652 N/A LYS 23.A N ASN 2.A O no hydrogen 3.036 N/A LYS 23.A NZ GLU 1.A O no hydrogen 3.375 N/A LEU 24.A N ASN 22.A OD1 no hydrogen 3.194 N/A THR 25.A OG1 GLU 27.A OE2 no hydrogen 3.505 N/A GLY 26.A N ASN 22.A O no hydrogen 2.739 N/A GLU 27.A N THR 25.A OG1 no hydrogen 3.385 N/A VAL 29.A N ALA 20.A O no hydrogen 2.804 N/A ALA 30.A N PHE 75.A O no hydrogen 2.866 N/A LEU 31.A N TYR 18.A O no hydrogen 2.725 N/A LYS 32.A N LEU 73.A O no hydrogen 2.821 N/A LYS 32.A NZ ASP 140.A OD1 no hydrogen 2.979 N/A LYS 33.A N VAL 16.A O no hydrogen 3.060 N/A ILE 34.A N LEU 71.A O no hydrogen 2.912 N/A ARG 35.A NH2 TYR 154.A O no hydrogen 3.197 N/A ARG 45.A N SER 41.A O no hydrogen 3.200 N/A GLU 46.A N THR 42.A O no hydrogen 2.984 N/A ILE 47.A N ALA 43.A O no hydrogen 2.685 N/A SER 48.A N ILE 44.A O no hydrogen 2.917 N/A SER 48.A OG ILE 44.A O no hydrogen 2.687 N/A LEU 49.A N ARG 45.A O no hydrogen 3.019 N/A LEU 50.A N ILE 47.A O no hydrogen 2.729 N/A LYS 51.A N SER 48.A O no hydrogen 3.223 N/A GLU 52.A N LEU 49.A O no hydrogen 2.971 N/A LEU 53.A N LEU 50.A O no hydrogen 2.823 N/A ASN 57.A N HIS 55.A ND1 no hydrogen 2.939 N/A ASN 57.A ND2 GLN 105.A OE1 no hydrogen 3.079 N/A ASN 57.A ND2 ILE 136.A O no hydrogen 2.986 N/A ILE 58.A N HIS 55.A O no hydrogen 2.968 N/A VAL 59.A N LEU 138.A O no hydrogen 2.880 N/A LYS 60.A N GLU 76.A OE2 no hydrogen 2.810 N/A LYS 60.A NZ LYS 51.A O no hydrogen 3.483 N/A LYS 60.A NZ LEU 61.A O no hydrogen 2.495 N/A LEU 62.A N VAL 74.A O no hydrogen 2.689 N/A ASP 63.A N VAL 74.A O no hydrogen 3.303 N/A ILE 65.A N TYR 72.A O no hydrogen 2.875 N/A HIS 66.A ND1 LYS 70.A O no hydrogen 3.329 N/A LYS 70.A N THR 67.A O no hydrogen 2.994 N/A LYS 70.A NZ ILE 34.A O no hydrogen 2.315 N/A LYS 70.A NZ LEU 71.A O no hydrogen 3.357 N/A TYR 72.A N ILE 65.A O no hydrogen 2.830 N/A LEU 73.A N LYS 32.A O no hydrogen 2.702 N/A VAL 74.A N ASP 63.A O no hydrogen 2.892 N/A PHE 75.A N ALA 30.A O no hydrogen 2.776 N/A GLU 76.A N LYS 60.A O no hydrogen 3.016 N/A LEU 82.A N LEU 128.A O no hydrogen 2.723 N/A LYS 84.A N ASP 81.A OD1 no hydrogen 2.794 N/A PHE 85.A N ASP 81.A O no hydrogen 3.087 N/A MET 86.A N LEU 82.A O no hydrogen 2.780 N/A ASP 87.A N LYS 83.A O no hydrogen 3.018 N/A ALA 88.A N LYS 84.A O no hydrogen 2.866 N/A SER 89.A N PHE 85.A O no hydrogen 2.827 N/A SER 89.A N MET 86.A O no hydrogen 3.133 N/A SER 89.A OG PHE 85.A O no hydrogen 2.845 N/A ALA 90.A N ASP 87.A O no hydrogen 3.214 N/A GLY 93.A N SER 89.A O no hydrogen 2.657 N/A LEU 98.A N PRO 95.A O no hydrogen 2.922 N/A ILE 99.A N PRO 95.A O no hydrogen 3.044 N/A LYS 100.A N LEU 96.A O no hydrogen 2.788 N/A LYS 100.A NZ PHE 280.A O no hydrogen 3.007 N/A LYS 100.A NZ ASP 283.A OD1 no hydrogen 2.675 N/A SER 101.A N PRO 97.A O no hydrogen 2.980 N/A TYR 102.A N LEU 98.A O no hydrogen 2.888 N/A LEU 103.A N ILE 99.A O no hydrogen 2.877 N/A PHE 104.A N LYS 100.A O no hydrogen 2.926 N/A GLN 105.A N SER 101.A O no hydrogen 2.919 N/A GLN 105.A NE2 SER 101.A O no hydrogen 3.608 N/A GLN 105.A NE2 SER 101.A OG no hydrogen 3.047 N/A GLN 105.A NE2 GLY 134.A O no hydrogen 2.866 N/A LEU 106.A N TYR 102.A O no hydrogen 2.900 N/A LEU 107.A N LEU 103.A O no hydrogen 2.965 N/A GLN 108.A N PHE 104.A O no hydrogen 3.038 N/A GLY 109.A N GLN 105.A O no hydrogen 2.990 N/A LEU 110.A N LEU 106.A O no hydrogen 2.846 N/A ALA 111.A N LEU 107.A O no hydrogen 2.791 N/A PHE 112.A N GLN 108.A O no hydrogen 2.984 N/A CYS 113.A N GLY 109.A O no hydrogen 3.032 N/A CYS 113.A SG GLY 109.A O no hydrogen 3.512 N/A HIS 114.A N LEU 110.A O no hydrogen 2.724 N/A HIS 114.A NE2 ASP 180.A OD2 no hydrogen 2.910 N/A SER 115.A N ALA 111.A O no hydrogen 2.999 N/A SER 115.A OG ALA 111.A O no hydrogen 3.304 N/A SER 115.A OG PHE 112.A O no hydrogen 3.000 N/A SER 115.A OG HIS 116.A ND1 no hydrogen 3.393 N/A HIS 116.A N PHE 112.A O no hydrogen 3.162 N/A HIS 116.A N CYS 113.A O no hydrogen 2.955 N/A HIS 116.A ND1 PHE 112.A O no hydrogen 3.087 N/A ARG 117.A N HIS 114.A O no hydrogen 3.118 N/A VAL 118.A N CYS 113.A O no hydrogen 2.920 N/A HIS 120.A N ASP 180.A OD2 no hydrogen 2.833 N/A HIS 120.A NE2 ALA 139.A O no hydrogen 2.723 N/A ARG 121.A N ASP 180.A OD1 no hydrogen 2.765 N/A ASP 122.A N HIS 120.A ND1 no hydrogen 3.103 N/A LYS 124.A N ASN 127.A OD1 no hydrogen 3.193 N/A LYS 124.A NZ THR 13.A OG1 no hydrogen 3.261 N/A LYS 124.A NZ ASP 122.A OD2 no hydrogen 3.068 N/A ASN 127.A N LYS 124.A O no hydrogen 2.961 N/A ASN 127.A ND2 ASP 122.A O no hydrogen 3.023 N/A LEU 128.A N PRO 125.A O no hydrogen 3.155 N/A LEU 129.A N LYS 137.A O no hydrogen 2.861 N/A ILE 130.A N GLN 80.A O no hydrogen 2.813 N/A ASN 131.A N ALA 135.A O no hydrogen 3.325 N/A GLU 133.A N ASN 131.A OD1 no hydrogen 2.929 N/A GLY 134.A N ASN 131.A O no hydrogen 3.427 N/A ALA 135.A N ASN 131.A OD1 no hydrogen 3.036 N/A ILE 136.A N GLN 105.A OE1 no hydrogen 3.086 N/A LYS 137.A N LEU 129.A O no hydrogen 2.803 N/A LYS 137.A NZ GLU 76.A OE1 no hydrogen 3.056 N/A LYS 137.A NZ GLU 76.A OE2 no hydrogen 3.282 N/A LEU 138.A N ASN 57.A O no hydrogen 2.888 N/A ALA 139.A N ASN 127.A O no hydrogen 2.922 N/A ALA 144.A N PHE 141.A O no hydrogen 3.243 N/A PHE 147.A N LEU 143.A O no hydrogen 2.850 N/A TYR 163.A OH GLU 190.A OE1 no hydrogen 2.617 N/A ARG 164.A N LEU 161.A O no hydrogen 3.085 N/A ARG 164.A NH1.B ASP 122.A OD1 no hydrogen 3.256 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.725 N/A ILE 168.A N ALA 165.A O no hydrogen 3.174 N/A LEU 169.A N ALA 165.A O no hydrogen 3.316 N/A LEU 170.A N PRO 166.A O no hydrogen 2.872 N/A GLY 171.A N ILE 168.A O no hydrogen 3.033 N/A CYS 172.A N GLU 167.A O no hydrogen 2.869 N/A CYS 172.A SG.B TYR 174.A O no hydrogen 3.505 N/A ALA 178.A N SER 176.A OG no hydrogen 3.115 N/A VAL 179.A N SER 176.A O no hydrogen 2.979 N/A ASP 180.A N THR 177.A O no hydrogen 3.040 N/A TRP 182.A N ALA 178.A O no hydrogen 3.106 N/A SER 183.A N VAL 179.A O no hydrogen 3.214 N/A SER 183.A OG TYR 163.A O no hydrogen 2.700 N/A SER 183.A OG VAL 179.A O no hydrogen 3.214 N/A LEU 184.A N ASP 180.A O no hydrogen 2.982 N/A GLY 185.A N ILE 181.A O no hydrogen 2.875 N/A CYS 186.A N TRP 182.A O no hydrogen 2.991 N/A CYS 186.A SG TRP 182.A O no hydrogen 3.508 N/A ILE 187.A N SER 183.A O no hydrogen 3.004 N/A PHE 188.A N LEU 184.A O no hydrogen 2.837 N/A ALA 189.A N GLY 185.A O no hydrogen 3.056 N/A GLU 190.A N CYS 186.A O no hydrogen 3.084 N/A MET 191.A N ILE 187.A O no hydrogen 2.891 N/A VAL 192.A N PHE 188.A O no hydrogen 3.146 N/A THR 193.A N ALA 189.A O no hydrogen 2.952 N/A THR 193.A OG1 ALA 189.A O no hydrogen 3.148 N/A ARG 194.A N GLU 190.A O no hydrogen 2.891 N/A ARG 194.A NH2 ALA 90.A O no hydrogen 3.362 N/A ARG 195.A N THR 193.A OG1 no hydrogen 3.326 N/A GLY 200.A N PHE 198.A O no hydrogen 2.877 N/A GLY 200.A N GLN 206.A OE1 no hydrogen 2.778 N/A ASP 201.A N ASP 205.A OD2 no hydrogen 2.964 N/A ASP 205.A N SER 202.A OG no hydrogen 3.009 N/A GLN 206.A N SER 202.A O no hydrogen 2.804 N/A GLN 206.A NE2 TRP 162.A O no hydrogen 3.134 N/A GLN 206.A NE2 PHE 198.A O no hydrogen 2.904 N/A LEU 207.A N GLU 203.A O no hydrogen 3.065 N/A PHE 208.A N ILE 204.A O no hydrogen 2.820 N/A ARG 209.A N ASP 205.A O no hydrogen 2.896 N/A ARG 209.A NE ASP 205.A OD2 no hydrogen 2.932 N/A ILE 210.A N GLN 206.A O no hydrogen 3.135 N/A PHE 211.A N LEU 207.A O no hydrogen 2.954 N/A ARG 212.A N PHE 208.A O no hydrogen 2.765 N/A ARG 212.A NH2 ASP 205.A OD1 no hydrogen 3.385 N/A THR 213.A N ARG 209.A O no hydrogen 3.254 N/A THR 213.A OG1 ARG 209.A O no hydrogen 3.504 N/A LEU 214.A N ILE 210.A O no hydrogen 2.791 N/A GLY 215.A N PHE 211.A O no hydrogen 2.751 N/A THR 216.A N TRP 238.A O no hydrogen 2.920 N/A THR 216.A OG1 PRO 236.A O no hydrogen 2.693 N/A VAL 221.A N ASP 218.A OD1 no hydrogen 3.136 N/A TRP 222.A N ASP 218.A O no hydrogen 2.850 N/A GLY 224.A N GLU 219.A OE1 no hydrogen 2.791 N/A VAL 225.A N TRP 222.A O no hydrogen 2.950 N/A THR 226.A N GLU 219.A OE2 no hydrogen 3.047 N/A THR 226.A OG1 GLU 219.A OE2 no hydrogen 2.678 N/A SER 227.A N GLY 224.A O no hydrogen 3.021 N/A MET 228.A N VAL 225.A O no hydrogen 3.083 N/A ASP 230.A N LEU 170.A O no hydrogen 2.879 N/A TYR 231.A N MET 228.A O no hydrogen 3.078 N/A PHE 235.A N LYS 232.A O no hydrogen 3.010 N/A TRP 238.A N THR 216.A OG1 no hydrogen 2.844 N/A ARG 240.A NH1 LEU 214.A O no hydrogen 3.071 N/A GLN 241.A N THR 213.A O no hydrogen 2.894 N/A SER 244.A OG ASP 242.A OD2 no hydrogen 2.495 N/A LYS 245.A N ASP 242.A O no hydrogen 3.353 N/A VAL 246.A N PHE 243.A O no hydrogen 3.146 N/A LEU 250.A N VAL 247.A O no hydrogen 2.869 N/A GLY 254.A N ASP 251.A OD1 no hydrogen 2.980 N/A ARG 255.A N ASP 251.A O no hydrogen 2.878 N/A ARG 255.A NH1 LEU 250.A O no hydrogen 3.162 N/A ARG 255.A NH2 GLU 252.A OE1 no hydrogen 2.714 N/A SER 256.A N GLU 252.A O no hydrogen 2.866 N/A SER 256.A OG HIS 278.A NE2 no hydrogen 3.201 N/A LEU 257.A N ASP 253.A O no hydrogen 3.043 N/A LEU 258.A N GLY 254.A O no hydrogen 2.889 N/A SER 259.A N ARG 255.A O no hydrogen 2.864 N/A SER 259.A OG SER 256.A O no hydrogen 2.839 N/A GLN 260.A N SER 256.A O no hydrogen 3.142 N/A MET 261.A N LEU 257.A O no hydrogen 3.074 N/A LEU 262.A N LEU 258.A O no hydrogen 2.960 N/A TYR 264.A OH GLY 215.A O no hydrogen 2.641 N/A ASN 267.A N ASP 265.A OD1 no hydrogen 2.939 N/A ASN 267.A ND2 ASP 265.A OD1 no hydrogen 3.147 N/A LYS 268.A N ASP 265.A O no hydrogen 2.792 N/A LYS 268.A NZ VAL 221.A O no hydrogen 3.185 N/A LYS 268.A NZ ASP 265.A OD2 no hydrogen 2.967 N/A ARG 269.A N ASP 265.A O no hydrogen 3.051 N/A ARG 269.A NE HIS 263.A O no hydrogen 2.872 N/A ARG 269.A NH1 GLU 167.A OE1 no hydrogen 3.390 N/A ARG 269.A NH1 GLU 167.A OE2 no hydrogen 2.808 N/A ARG 269.A NH1 ALA 178.A O no hydrogen 2.984 N/A ARG 269.A NH2 GLU 167.A OE1 no hydrogen 2.890 N/A ARG 269.A NH2 HIS 263.A O no hydrogen 3.153 N/A ARG 269.A NH2 TYR 264.A O no hydrogen 2.920 N/A ILE 270.A N GLN 260.A O no hydrogen 3.035 N/A ALA 274.A N SER 271.A OG no hydrogen 3.048 N/A ALA 275.A N SER 271.A O no hydrogen 2.840 N/A LEU 276.A N ALA 272.A O no hydrogen 3.063 N/A ALA 277.A N ALA 274.A O no hydrogen 3.025 N/A HIS 278.A N ALA 275.A O no hydrogen 2.972 N/A HIS 278.A NE2 SER 256.A OG no hydrogen 3.201 N/A PHE 280.A N HIS 278.A ND1 no hydrogen 3.017 N/A PHE 281.A N HIS 278.A O no hydrogen 2.990 N/A GLN 282.A N PRO 279.A O no hydrogen 3.095 N/A VAL 284.A N PHE 281.A O no hydrogen 3.246 N/A