Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7htw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N LYS 11.A O no hydrogen 3.060 N/A SER 2.A OG LEU 3.A O no hydrogen 3.173 N/A THR 4.A N SER 9.A O no hydrogen 2.881 N/A THR 4.A OG1 ASP 6.A OD1 no hydrogen 3.201 N/A THR 4.A OG1 SER 9.A O no hydrogen 3.532 N/A THR 4.A OG1 SER 9.A OG no hydrogen 2.985 N/A GLY 7.A N THR 4.A O no hydrogen 2.830 N/A LEU 8.A N ASP 6.A OD1 no hydrogen 3.162 N/A SER 9.A OG THR 4.A OG1 no hydrogen 2.985 N/A SER 9.A OG GLU 85.A OE2 no hydrogen 2.717 N/A TYR 10.A N THR 86.A O no hydrogen 2.930 N/A LYS 11.A N SER 2.A O no hydrogen 3.027 N/A GLU 12.A N ILE 84.A O no hydrogen 3.059 N/A PHE 14.A N VAL 82.A O no hydrogen 3.011 N/A VAL 16.A N ASP 80.A O no hydrogen 3.029 N/A ARG 17.A N GLU 20.A OE1 no hydrogen 2.844 N/A ARG 17.A NH1 TYR 19.A OH no hydrogen 2.850 N/A GLU 20.A N ARG 17.A O no hydrogen 2.991 N/A GLY 22.A N THR 26.A O no hydrogen 3.006 N/A LYS 25.A N GLY 22.A O no hydrogen 3.222 N/A ALA 27.A N PRO 76.A O no hydrogen 2.873 N/A THR 28.A N GLU 20.A O no hydrogen 3.278 N/A THR 28.A OG1 THR 31.A OG1 no hydrogen 3.261 N/A THR 31.A N THR 28.A OG1 no hydrogen 3.063 N/A THR 31.A OG1 GLU 20.A O no hydrogen 2.787 N/A THR 31.A OG1 THR 28.A OG1 no hydrogen 3.261 N/A ILE 32.A N THR 28.A O no hydrogen 3.187 N/A ALA 33.A N VAL 29.A O no hydrogen 2.923 N/A ASN 34.A N GLU 30.A O no hydrogen 2.978 N/A LEU 35.A N THR 31.A O no hydrogen 2.886 N/A LEU 36.A N ILE 32.A O no hydrogen 2.830 N/A GLN 37.A N ALA 33.A O no hydrogen 2.993 N/A GLN 37.A NE2 ASN 190.A OD1 no hydrogen 3.066 N/A GLU 38.A N ASN 34.A O no hydrogen 2.922 N/A VAL 39.A N LEU 35.A O no hydrogen 3.012 N/A GLY 40.A N LEU 36.A O no hydrogen 3.074 N/A CYS 41.A N.A GLN 37.A O no hydrogen 2.921 N/A CYS 41.A N.B GLN 37.A O no hydrogen 2.933 N/A CYS 41.A N.C GLN 37.A O no hydrogen 2.921 N/A CYS 41.A SG.A GLN 37.A O no hydrogen 3.087 N/A CYS 41.A SG.C GLN 37.A O no hydrogen 3.087 N/A ASN 42.A N GLU 38.A O no hydrogen 3.016 N/A ASN 42.A ND2 GLU 12.A OE1 no hydrogen 3.009 N/A ASN 42.A ND2 GLU 38.A OE2 no hydrogen 2.612 N/A HIS 43.A N VAL 39.A O no hydrogen 3.103 N/A HIS 43.A N GLY 40.A O no hydrogen 3.249 N/A ALA 44.A N GLY 40.A O no hydrogen 3.177 N/A GLN 45.A N CYS 41.A O.A no hydrogen 3.171 N/A GLN 45.A N CYS 41.A O.B no hydrogen 3.109 N/A GLN 45.A N CYS 41.A O.C no hydrogen 3.171 N/A SER 46.A N.A ASN 42.A O no hydrogen 3.070 N/A SER 46.A N.B ASN 42.A O no hydrogen 3.071 N/A SER 46.A N.C ASN 42.A O no hydrogen 3.070 N/A SER 46.A OG.B ASN 42.A O no hydrogen 3.274 N/A SER 46.A OG.B HIS 43.A O no hydrogen 2.801 N/A GLY 48.A N GLN 45.A O no hydrogen 3.455 N/A PHE 49.A N ALA 44.A O no hydrogen 3.017 N/A THR 53.A OG1 GLU 138.A OE1 no hydrogen 2.861 N/A THR 55.A OG1 GLU 138.A OE1 no hydrogen 3.314 N/A THR 55.A OG1 GLU 138.A OE2 no hydrogen 3.130 N/A MET 56.A N.A THR 53.A O no hydrogen 3.197 N/A MET 56.A N.B THR 53.A O no hydrogen 3.195 N/A MET 56.A N.C THR 53.A O no hydrogen 3.197 N/A ARG 57.A N THR 53.A O no hydrogen 3.225 N/A LEU 59.A N THR 55.A O no hydrogen 3.305 N/A HIS 60.A N ARG 57.A O no hydrogen 3.161 N/A LEU 61.A N MET 56.A O.A no hydrogen 2.846 N/A LEU 61.A N MET 56.A O.B no hydrogen 2.854 N/A LEU 61.A N MET 56.A O.C no hydrogen 2.846 N/A ILE 62.A N MET 121.A O no hydrogen 2.916 N/A VAL 64.A N VAL 119.A O no hydrogen 2.837 N/A ALA 66.A N LYS 117.A O no hydrogen 2.881 N/A ARG 67.A N LYS 117.A O no hydrogen 3.419 N/A ARG 67.A NE ASP 218.A OD1 no hydrogen 2.790 N/A ARG 67.A NH1 SER 158.A O no hydrogen 2.879 N/A ARG 67.A NH1 LYS 160.A O no hydrogen 3.260 N/A ARG 67.A NH2 LYS 160.A O no hydrogen 3.048 N/A ARG 67.A NH2 ASP 218.A OD1 no hydrogen 3.332 N/A ARG 67.A NH2 ASP 218.A OD2 no hydrogen 3.186 N/A MET 68.A N LEU 217.A O no hydrogen 2.902 N/A HIS 69.A N THR 115.A O no hydrogen 2.941 N/A HIS 69.A ND1 THR 216.A OG1 no hydrogen 2.582 N/A ILE 70.A N ILE 215.A O no hydrogen 2.878 N/A GLU 71.A N ARG 113.A O no hydrogen 2.911 N/A ILE 72.A N GLN 213.A O no hydrogen 2.952 N/A TYR 73.A N THR 111.A O no hydrogen 2.914 N/A LYS 74.A N THR 111.A O no hydrogen 3.083 N/A LYS 74.A NZ GLU 109.A OE2 no hydrogen 3.089 N/A TYR 75.A OH LEU 212.A O no hydrogen 2.754 N/A ALA 77.A N ASP 80.A OD2 no hydrogen 3.227 N/A TRP 78.A N LYS 25.A O no hydrogen 3.028 N/A GLY 79.A N VAL 16.A O no hydrogen 3.189 N/A ASP 80.A N ALA 77.A O no hydrogen 2.956 N/A VAL 82.A N PHE 14.A O no hydrogen 2.893 N/A GLU 83.A N LYS 103.A O no hydrogen 3.089 N/A ILE 84.A N GLU 12.A O no hydrogen 2.901 N/A GLU 85.A N ILE 101.A O no hydrogen 2.959 N/A THR 86.A N TYR 10.A O no hydrogen 2.854 N/A THR 86.A OG1 ASP 99.A O no hydrogen 2.894 N/A TRP 87.A N ASP 99.A O no hydrogen 3.260 N/A TRP 87.A NE1 ARG 148.A O no hydrogen 2.949 N/A GLN 89.A N ARG 97.A O no hydrogen 2.912 N/A GLN 89.A NE2 ARG 148.A O no hydrogen 3.360 N/A GLU 91.A N GLY 95.A O no hydrogen 3.027 N/A GLY 92.A N SER 90.A OG no hydrogen 3.216 N/A ILE 94.A N GLU 91.A O no hydrogen 3.090 N/A THR 96.A N TRP 118.A O no hydrogen 2.946 N/A ARG 97.A N GLN 89.A O no hydrogen 2.815 N/A ARG 97.A NE ASP 99.A OD1 no hydrogen 2.824 N/A ARG 97.A NE ASP 99.A OD2 no hydrogen 3.201 N/A ARG 97.A NH1 ASP 99.A OD2 no hydrogen 2.924 N/A ARG 98.A N SER 116.A O no hydrogen 3.130 N/A ARG 98.A NH1 HIS 43.A ND1 no hydrogen 3.344 N/A ARG 98.A NH2 HIS 43.A ND1 no hydrogen 3.098 N/A ARG 98.A NH2 THR 86.A OG1 no hydrogen 2.948 N/A ASP 99.A N TRP 87.A O no hydrogen 2.945 N/A TRP 100.A N ALA 114.A O no hydrogen 2.921 N/A TRP 100.A NE1 LEU 36.A O no hydrogen 2.865 N/A ILE 101.A N GLU 85.A O no hydrogen 2.885 N/A LEU 102.A N GLY 112.A O no hydrogen 2.873 N/A LYS 103.A N GLU 83.A O no hydrogen 2.834 N/A ASP 104.A N GLU 109.A O no hydrogen 2.902 N/A SER 105.A N VAL 81.A O no hydrogen 3.358 N/A VAL 106.A N ASP 104.A OD1 no hydrogen 3.223 N/A THR 107.A OG1 ASP 104.A OD2 no hydrogen 3.209 N/A GLY 108.A N ASP 104.A O no hydrogen 2.830 N/A THR 111.A N LEU 102.A O no hydrogen 2.889 N/A ARG 113.A N GLU 71.A O no hydrogen 2.914 N/A ARG 113.A NH2 GLU 71.A OE2 no hydrogen 3.152 N/A ARG 113.A NH2 GLU 153.A OE2 no hydrogen 3.029 N/A ALA 114.A N TRP 100.A O no hydrogen 3.067 N/A THR 115.A N HIS 69.A O no hydrogen 2.933 N/A THR 115.A OG1 ASP 99.A OD1 no hydrogen 2.584 N/A SER 116.A OG ARG 98.A O no hydrogen 2.837 N/A LYS 117.A N ARG 67.A O no hydrogen 2.997 N/A LYS 117.A NZ GLU 91.A OE2 no hydrogen 2.701 N/A TRP 118.A N THR 96.A O no hydrogen 2.840 N/A TRP 118.A NE1 SER 116.A OG no hydrogen 2.738 N/A VAL 119.A N VAL 64.A O no hydrogen 2.900 N/A MET 121.A N ILE 62.A O no hydrogen 2.897 N/A ASN 122.A N ARG 127.A O no hydrogen 3.394 N/A GLN 123.A N HIS 60.A O no hydrogen 2.890 N/A ASP 124.A N ASN 122.A OD1 no hydrogen 2.896 N/A THR 125.A N ASN 122.A OD1 no hydrogen 3.083 N/A ARG 126.A N ASN 122.A O no hydrogen 3.044 N/A ARG 126.A NE GLN 123.A O no hydrogen 3.044 N/A ARG 126.A NH2 GLN 123.A O no hydrogen 3.198 N/A ARG 127.A N THR 125.A OG1 no hydrogen 3.291 N/A GLN 129.A N MET 120.A O no hydrogen 2.874 N/A VAL 131.A N ARG 93.A O no hydrogen 2.880 N/A ARG 136.A N SER 132.A O no hydrogen 3.108 N/A ASP 137.A N ASP 133.A O no hydrogen 3.274 N/A GLU 138.A N VAL 135.A O no hydrogen 3.102 N/A LEU 140.A N ARG 136.A O no hydrogen 3.216 N/A PHE 142.A N TYR 139.A O no hydrogen 3.219 N/A CYS 143.A N LEU 140.A O no hydrogen 3.508 N/A CYS 143.A SG CYS 88.A O no hydrogen 3.310 N/A CYS 143.A SG TYR 139.A O no hydrogen 3.736 N/A ARG 148.A NH1 GLU 85.A OE2 no hydrogen 3.298 N/A ARG 148.A NH2 GLU 85.A OE1 no hydrogen 3.395 N/A ALA 150.A N ASP 99.A OD2 no hydrogen 2.949 N/A ASN 156.A N GLU 153.A O no hydrogen 3.226 N/A ASN 156.A ND2 GLU 153.A O no hydrogen 2.845 N/A SER 158.A OG ASN 156.A OD1 no hydrogen 2.379 N/A LEU 159.A N ASN 156.A O no hydrogen 3.245 N/A LYS 160.A N ARG 157.A O no hydrogen 3.507 N/A LYS 164.A NZ GLU 254.A OE2 no hydrogen 3.555 N/A GLN 170.A N THR 234.A OG1 no hydrogen 2.976 N/A TYR 171.A N THR 233.A O no hydrogen 2.785 N/A MET 173.A N SER 231.A O no hydrogen 2.880 N/A GLY 175.A N ASP 230.A OD1 no hydrogen 3.108 N/A LEU 176.A N VAL 229.A O no hydrogen 2.908 N/A ARG 179.A N ASP 182.A OD2 no hydrogen 3.058 N/A ASP 182.A N ARG 179.A O no hydrogen 3.077 N/A LEU 183.A N ARG 180.A O no hydrogen 2.999 N/A ASP 184.A N HIS 188.A O no hydrogen 2.824 N/A ASN 186.A N ASP 184.A OD1 no hydrogen 3.091 N/A GLN 187.A N ASP 184.A O no hydrogen 3.221 N/A HIS 188.A N ASP 184.A OD1 no hydrogen 2.841 N/A ASN 190.A N ASP 182.A O no hydrogen 2.971 N/A VAL 192.A N ASN 190.A OD1 no hydrogen 3.041 N/A THR 193.A N ASN 190.A O no hydrogen 2.988 N/A THR 193.A OG1 ASP 182.A O no hydrogen 3.460 N/A THR 193.A OG1 ASP 182.A OD1 no hydrogen 3.298 N/A THR 193.A OG1 ASN 190.A O no hydrogen 3.287 N/A ILE 195.A N VAL 192.A O no hydrogen 3.093 N/A GLY 196.A N VAL 192.A O no hydrogen 3.279 N/A TRP 197.A N THR 193.A O no hydrogen 2.874 N/A VAL 198.A N TYR 194.A O no hydrogen 2.887 N/A LEU 199.A N ILE 195.A O no hydrogen 3.069 N/A GLU 200.A N GLY 196.A O no hydrogen 3.095 N/A GLU 200.A N TRP 197.A O no hydrogen 3.251 N/A SER 201.A OG VAL 198.A O no hydrogen 3.294 N/A SER 201.A OG SER 231.A OG no hydrogen 2.472 N/A SER 201.A OG THR 233.A OG1 no hydrogen 2.678 N/A ILE 202.A N LEU 199.A O no hydrogen 3.111 N/A GLN 204.A NE2 ASP 208.A OD1 no hydrogen 3.369 N/A ILE 206.A N PRO 203.A O no hydrogen 3.074 N/A VAL 207.A N PRO 203.A O no hydrogen 3.402 N/A ASP 208.A N GLN 204.A O no hydrogen 2.903 N/A THR 209.A N GLU 205.A O no hydrogen 3.212 N/A THR 209.A OG1 GLU 205.A O no hydrogen 2.838 N/A THR 209.A OG1 HIS 210.A ND1 no hydrogen 2.899 N/A HIS 210.A N ILE 206.A O no hydrogen 2.845 N/A HIS 210.A ND1 THR 209.A OG1 no hydrogen 2.899 N/A GLU 211.A N ARG 263.A O no hydrogen 2.872 N/A GLN 213.A N LEU 261.A O no hydrogen 2.807 N/A VAL 214.A N LEU 261.A O no hydrogen 3.107 N/A ILE 215.A N ILE 70.A O no hydrogen 3.037 N/A THR 216.A N THR 259.A O no hydrogen 3.099 N/A THR 216.A OG1 HIS 69.A ND1 no hydrogen 2.582 N/A LEU 217.A N MET 68.A O no hydrogen 2.894 N/A ASP 218.A N ARG 257.A O no hydrogen 2.855 N/A TYR 219.A N ALA 66.A O no hydrogen 2.864 N/A TYR 219.A OH ASN 191.A O no hydrogen 2.949 N/A ARG 220.A N ILE 255.A O no hydrogen 2.891 N/A ARG 221.A N ILE 255.A O no hydrogen 3.235 N/A CYS 223.A N TYR 194.A OH no hydrogen 2.871 N/A CYS 223.A SG GLN 224.A O no hydrogen 3.474 N/A GLN 224.A N ASP 227.A OD2 no hydrogen 2.910 N/A ASP 227.A N GLN 224.A O no hydrogen 2.876 N/A VAL 229.A N LEU 176.A O no hydrogen 2.798 N/A ASP 230.A N ARG 247.A O no hydrogen 2.774 N/A SER 231.A N MET 173.A O no hydrogen 2.853 N/A SER 231.A OG TRP 197.A O no hydrogen 2.863 N/A SER 231.A OG VAL 198.A O no hydrogen 3.400 N/A SER 231.A OG SER 201.A OG no hydrogen 2.472 N/A LEU 232.A N LEU 245.A O no hydrogen 2.938 N/A THR 233.A N TYR 171.A O no hydrogen 2.988 N/A THR 233.A OG1 SER 201.A OG no hydrogen 2.678 N/A THR 233.A OG1 HIS 244.A ND1 no hydrogen 2.825 N/A THR 234.A N LEU 243.A O no hydrogen 3.075 N/A THR 235.A N GLN 170.A OE1 no hydrogen 2.876 N/A THR 235.A OG1 GLN 170.A OE1 no hydrogen 2.811 N/A THR 236.A N GLN 241.A O no hydrogen 2.881 N/A SER 240.A N TRP 262.A O no hydrogen 2.893 N/A GLN 241.A N SER 237.A OG no hydrogen 2.987 N/A PHE 242.A N THR 260.A O no hydrogen 3.021 N/A LEU 243.A N THR 234.A O no hydrogen 2.959 N/A HIS 244.A N GLY 258.A O no hydrogen 2.802 N/A HIS 244.A ND1 THR 233.A OG1 no hydrogen 2.825 N/A HIS 244.A NE2 THR 260.A OG1 no hydrogen 2.812 N/A LEU 245.A N LEU 232.A O no hydrogen 2.975 N/A LEU 246.A N ASN 256.A O no hydrogen 2.904 N/A ARG 247.A N ASP 230.A O no hydrogen 3.034 N/A ARG 247.A NH1 ASP 167.A OD1 no hydrogen 3.193 N/A ARG 247.A NH2 ASP 167.A OD1 no hydrogen 3.196 N/A LEU 248.A N GLN 253.A O no hydrogen 2.907 N/A SER 249.A N VAL 228.A O no hydrogen 2.804 N/A SER 249.A OG VAL 228.A O no hydrogen 2.964 N/A SER 249.A OG ASP 230.A OD1 no hydrogen 3.411 N/A GLY 252.A N LEU 248.A O no hydrogen 2.922 N/A GLN 253.A N ASP 251.A OD1 no hydrogen 3.277 N/A ILE 255.A N LEU 246.A O no hydrogen 2.996 N/A ASN 256.A N LEU 246.A O no hydrogen 3.317 N/A ASN 256.A ND2 ASP 218.A O no hydrogen 3.060 N/A ARG 257.A N ASP 218.A O no hydrogen 3.316 N/A ARG 257.A NE GLU 254.A OE1 no hydrogen 2.867 N/A ARG 257.A NH1 ILE 162.A O no hydrogen 2.915 N/A ARG 257.A NH2 GLU 254.A OE2 no hydrogen 3.212 N/A GLY 258.A N HIS 244.A O no hydrogen 3.048 N/A THR 259.A N THR 216.A O no hydrogen 3.150 N/A THR 260.A N PHE 242.A O no hydrogen 3.170 N/A THR 260.A OG1 HIS 244.A NE2 no hydrogen 2.812 N/A LEU 261.A N VAL 214.A O no hydrogen 2.887 N/A TRP 262.A N SER 240.A O no hydrogen 2.884 N/A TRP 262.A NE1 THR 260.A OG1 no hydrogen 2.919 N/A ARG 263.A N GLU 211.A O no hydrogen 2.980 N/A LYS 265.A N THR 209.A O no hydrogen 3.168 N/A LYS 265.A NZ ASP 208.A O no hydrogen 2.786 N/A