Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ptd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 6.A OE1 no hydrogen 3.086 N/A ALA 1.A N GLU 6.A OE2 no hydrogen 3.177 N/A SER 2.A N GLU 6.A OE2 no hydrogen 3.300 N/A SER 3.A N GLU 6.A OE2 no hydrogen 2.914 N/A ASN 5.A N SER 3.A OG no hydrogen 3.120 N/A GLU 6.A N SER 3.A O no hydrogen 3.295 N/A LEU 7.A N VAL 4.A O no hydrogen 3.109 N/A GLU 8.A N ASN 5.A O no hydrogen 3.178 N/A ASN 9.A N GLU 6.A O no hydrogen 3.294 N/A SER 11.A OG ASP 60.A OD1 no hydrogen 3.284 N/A LYS 12.A N ASN 9.A O no hydrogen 3.293 N/A LYS 12.A NZ ASP 104.A O no hydrogen 3.385 N/A LYS 12.A NZ ASN 105.A OD1 no hydrogen 2.721 N/A TRP 13.A NE1 GLY 62.A O no hydrogen 2.922 N/A MET 14.A N GLU 108.A OE1 no hydrogen 3.150 N/A MET 14.A N GLU 108.A OE2 no hydrogen 2.997 N/A GLN 15.A N LYS 12.A O no hydrogen 3.023 N/A ILE 21.A N PRO 18.A O no hydrogen 3.249 N/A LEU 23.A N ILE 149.A O no hydrogen 2.950 N/A ARG 25.A N PRO 22.A O no hydrogen 3.124 N/A ARG 25.A NE ARG 25.A O no hydrogen 2.693 N/A ARG 25.A NH1 ALA 266.A O no hydrogen 3.558 N/A ARG 25.A NH2 ARG 25.A O no hydrogen 2.962 N/A ARG 25.A NH2 ALA 266.A O no hydrogen 2.750 N/A ILE 26.A N LEU 23.A O no hydrogen 3.166 N/A SER 27.A N ASN 292.A OD1 no hydrogen 2.893 N/A ILE 28.A N GLY 269.A O no hydrogen 3.246 N/A GLY 30.A N VAL 271.A O no hydrogen 2.905 N/A THR 31.A N ILE 65.A O no hydrogen 3.094 N/A THR 31.A OG1 SER 34.A OG no hydrogen 2.663 N/A THR 31.A OG1 GLN 58.A OE1 no hydrogen 2.962 N/A HIS 32.A N GLN 273.A O no hydrogen 2.930 N/A ASP 33.A N ASP 67.A OD2 no hydrogen 2.755 N/A SER 34.A OG THR 31.A O no hydrogen 3.009 N/A SER 34.A OG THR 31.A OG1 no hydrogen 2.663 N/A THR 36.A N ASP 33.A O no hydrogen 3.257 N/A THR 36.A OG1 ASP 33.A O no hydrogen 3.082 N/A THR 36.A OG1 THR 50.A OG1 no hydrogen 3.140 N/A LYS 38.A NZ TYR 88.A O no hydrogen 2.942 N/A LYS 38.A NZ GLU 93.A OE1 no hydrogen 3.292 N/A LYS 38.A NZ GLU 93.A OE2 no hydrogen 2.666 N/A LEU 39.A N THR 36.A O no hydrogen 3.259 N/A GLN 40.A NE2 LYS 38.A O no hydrogen 3.661 N/A GLN 45.A N ASN 41.A O no hydrogen 2.847 N/A GLN 45.A NE2 LEU 39.A O no hydrogen 3.221 N/A TRP 47.A N LYS 44.A O no hydrogen 3.346 N/A GLY 48.A N LYS 44.A O no hydrogen 2.782 N/A MET 49.A N GLN 45.A O no hydrogen 3.339 N/A THR 50.A N THR 36.A OG1 no hydrogen 3.011 N/A THR 50.A OG1 HIS 32.A O no hydrogen 2.679 N/A THR 50.A OG1 THR 36.A OG1 no hydrogen 3.140 N/A GLN 51.A NE2 HIS 32.A O no hydrogen 3.364 N/A GLN 51.A NE2 GLN 273.A O no hydrogen 3.244 N/A ARG 56.A NE ASP 60.A OD1 no hydrogen 3.247 N/A ARG 56.A NE ASP 60.A OD2 no hydrogen 3.071 N/A ARG 56.A NH1 ASP 104.A OD2 no hydrogen 3.512 N/A ARG 56.A NH2 ASP 104.A OD2 no hydrogen 3.127 N/A TYR 57.A N ASP 54.A OD1 no hydrogen 2.957 N/A GLN 58.A N ASP 54.A O no hydrogen 3.095 N/A GLN 58.A NE2 SER 34.A O no hydrogen 3.283 N/A GLN 58.A NE2 TYR 53.A O no hydrogen 2.838 N/A MET 59.A N PHE 55.A O no hydrogen 2.923 N/A ASP 60.A N ARG 56.A O no hydrogen 2.882 N/A HIS 61.A N GLN 58.A O no hydrogen 3.212 N/A HIS 61.A ND1 TYR 57.A O no hydrogen 2.805 N/A HIS 61.A NE2 GLU 278.A OE2 no hydrogen 3.145 N/A GLY 62.A N MET 59.A O no hydrogen 3.131 N/A ALA 63.A N GLN 58.A O no hydrogen 3.112 N/A ARG 64.A N PRO 29.A O no hydrogen 3.032 N/A ARG 64.A NE GLU 108.A OE1 no hydrogen 2.722 N/A ARG 64.A NH1 MET 59.A O no hydrogen 2.771 N/A ARG 64.A NH1 ALA 63.A O no hydrogen 2.895 N/A ARG 64.A NH2 TRP 10.A O no hydrogen 2.888 N/A ARG 64.A NH2 GLU 108.A OE1 no hydrogen 2.647 N/A PHE 66.A N ILE 111.A O no hydrogen 2.850 N/A ASP 67.A N THR 31.A O no hydrogen 3.204 N/A ASP 67.A N SER 34.A OG no hydrogen 3.050 N/A ILE 68.A N SER 113.A O no hydrogen 2.899 N/A ARG 69.A NE ASP 67.A OD1 no hydrogen 2.884 N/A ARG 69.A NH1 GLU 117.A OE1 no hydrogen 3.192 N/A GLY 70.A N LYS 115.A O no hydrogen 2.872 N/A ARG 71.A N VAL 79.A O no hydrogen 2.775 N/A ARG 71.A NE GLU 119.A O no hydrogen 2.522 N/A ARG 71.A NH2 GLU 119.A O no hydrogen 2.920 N/A THR 73.A N THR 77.A O no hydrogen 2.883 N/A THR 73.A OG1 THR 77.A O no hydrogen 2.955 N/A THR 73.A OG1 THR 77.A OG1 no hydrogen 2.671 N/A ASN 76.A N THR 73.A O no hydrogen 3.193 N/A THR 77.A N THR 73.A OG1 no hydrogen 3.252 N/A THR 77.A OG1 THR 73.A OG1 no hydrogen 2.671 N/A ILE 78.A N TYR 136.A OH no hydrogen 3.187 N/A VAL 79.A N ARG 71.A O no hydrogen 3.010 N/A LEU 80.A N VAL 89.A O no hydrogen 2.890 N/A HIS 81.A N ARG 69.A O no hydrogen 3.104 N/A HIS 82.A N LEU 85.A O no hydrogen 2.916 N/A GLY 83.A N GLU 117.A OE2 no hydrogen 2.843 N/A LEU 85.A N HIS 82.A O no hydrogen 3.149 N/A LEU 87.A N LEU 80.A O no hydrogen 2.822 N/A THR 90.A N GLU 93.A OE1 no hydrogen 3.435 N/A LEU 91.A N ILE 78.A O no hydrogen 3.110 N/A GLU 93.A N THR 90.A OG1 no hydrogen 3.084 N/A PHE 94.A N THR 90.A O no hydrogen 3.329 N/A ILE 95.A N LEU 91.A O no hydrogen 2.964 N/A ASN 96.A N HIS 92.A O no hydrogen 2.897 N/A GLU 97.A N GLU 93.A O no hydrogen 3.326 N/A ALA 98.A N PHE 94.A O no hydrogen 3.004 N/A LYS 99.A N ILE 95.A O no hydrogen 3.056 N/A LYS 99.A NZ ASP 139.A OD2 no hydrogen 2.789 N/A GLN 100.A N ASN 96.A O no hydrogen 3.239 N/A PHE 101.A N GLU 97.A O no hydrogen 3.132 N/A LEU 102.A N ALA 98.A O no hydrogen 3.047 N/A LYS 103.A N LYS 99.A O no hydrogen 2.842 N/A LYS 103.A N GLN 100.A O no hydrogen 3.067 N/A ASP 104.A N GLN 100.A O no hydrogen 2.960 N/A ASN 105.A N PHE 101.A O no hydrogen 2.730 N/A ASN 105.A ND2 PHE 101.A O no hydrogen 3.060 N/A SER 107.A OG GLU 108.A OE2 no hydrogen 3.012 N/A GLU 108.A N ASN 105.A O no hydrogen 3.035 N/A THR 109.A OG1 ALA 154.A O no hydrogen 2.943 N/A THR 109.A OG1 LYS 157.A O no hydrogen 3.065 N/A ILE 110.A N LYS 157.A O no hydrogen 3.480 N/A ILE 111.A N ARG 64.A O no hydrogen 2.770 N/A MET 112.A N VAL 159.A O no hydrogen 2.663 N/A SER 113.A N PHE 66.A O no hydrogen 2.916 N/A LEU 114.A N LEU 161.A O no hydrogen 3.014 N/A LYS 115.A N ILE 68.A O no hydrogen 2.929 N/A LYS 116.A NZ SER 165.A O no hydrogen 3.347 N/A GLU 117.A N GLY 70.A O no hydrogen 2.893 N/A ASP 120.A N GLU 119.A OE2 no hydrogen 3.087 N/A MET 121.A N LEU 72.A O no hydrogen 2.923 N/A GLY 123.A N ASP 74.A OD1 no hydrogen 3.289 N/A ALA 124.A N MET 121.A O no hydrogen 3.316 N/A GLU 125.A N ASN 76.A OD1 no hydrogen 3.029 N/A SER 127.A N ASP 126.A OD1 no hydrogen 3.109 N/A SER 127.A N SER 130.A OG no hydrogen 3.264 N/A SER 127.A OG SER 130.A OG no hydrogen 2.748 N/A SER 129.A OG GLY 166.A O no hydrogen 3.404 N/A SER 130.A OG SER 127.A O no hydrogen 3.188 N/A SER 130.A OG SER 127.A OG no hydrogen 2.748 N/A THR 131.A N SER 127.A O no hydrogen 2.948 N/A THR 131.A OG1 SER 127.A O no hydrogen 2.774 N/A PHE 132.A N PHE 128.A O no hydrogen 2.980 N/A GLU 133.A N SER 129.A O no hydrogen 2.948 N/A LYS 134.A N SER 130.A O no hydrogen 2.861 N/A LYS 134.A NZ ASP 126.A OD2 no hydrogen 3.011 N/A LYS 135.A N THR 131.A O no hydrogen 3.047 N/A LYS 135.A NZ ASN 76.A O no hydrogen 2.848 N/A TYR 136.A N PHE 132.A O no hydrogen 3.039 N/A PHE 137.A N PHE 132.A O no hydrogen 2.905 N/A ASP 139.A N TYR 136.A O no hydrogen 2.852 N/A ILE 141.A N ASP 139.A OD1 no hydrogen 3.161 N/A PHE 142.A N ASP 139.A O no hydrogen 3.377 N/A LEU 143.A N ILE 158.A O no hydrogen 3.223 N/A LYS 144.A NZ PHE 137.A O no hydrogen 3.104 N/A LYS 144.A NZ ASP 139.A O no hydrogen 3.010 N/A LYS 144.A NZ PHE 142.A O no hydrogen 2.892 N/A LEU 151.A N ILE 21.A O no hydrogen 2.860 N/A GLY 152.A N ASP 19.A O no hydrogen 2.873 N/A ALA 154.A N LEU 151.A O no hydrogen 3.202 N/A ARG 155.A N LEU 151.A O no hydrogen 3.188 N/A ARG 155.A NE SER 107.A O no hydrogen 3.044 N/A ARG 155.A NH1 ILE 17.A O no hydrogen 3.374 N/A ARG 155.A NH2 GLN 15.A O no hydrogen 3.334 N/A ARG 155.A NH2 SER 107.A O no hydrogen 3.454 N/A GLY 156.A N GLU 108.A O no hydrogen 2.822 N/A LYS 157.A N ALA 154.A O no hydrogen 2.997 N/A ILE 158.A N ILE 141.A O no hydrogen 2.706 N/A VAL 159.A N ILE 110.A O no hydrogen 2.728 N/A LEU 161.A N MET 112.A O no hydrogen 2.762 N/A LYS 162.A N TYR 173.A O no hydrogen 3.074 N/A LYS 162.A NZ SER 167.A OG no hydrogen 3.180 N/A LYS 162.A NZ GLU 169.A O no hydrogen 2.922 N/A LYS 162.A NZ GLY 171.A O no hydrogen 3.269 N/A ARG 163.A N LEU 114.A O no hydrogen 2.915 N/A TYR 164.A OH GLU 133.A OE2 no hydrogen 2.829 N/A SER 167.A OG GLU 133.A OE2 no hydrogen 2.616 N/A ASN 168.A N GLU 133.A OE1 no hydrogen 3.014 N/A GLU 169.A N GLU 133.A OE1 no hydrogen 3.208 N/A GLY 171.A N GLU 146.A OE2 no hydrogen 3.058 N/A GLY 172.A N THR 145.A O no hydrogen 3.141 N/A TYR 173.A N LEU 160.A O no hydrogen 2.787 N/A TRP 178.A NE1 ASP 198.A OD2 no hydrogen 2.854 N/A ASN 181.A ND2 LYS 201.A O no hydrogen 3.000 N/A PHE 184.A N VAL 196.A O no hydrogen 2.926 N/A THR 185.A OG1 THR 195.A OG1 no hydrogen 3.304 N/A THR 186.A N VAL 194.A O no hydrogen 2.836 N/A ASN 193.A N ASN 226.A O no hydrogen 2.904 N/A VAL 194.A N THR 186.A O no hydrogen 2.576 N/A THR 195.A N LEU 228.A O no hydrogen 2.742 N/A THR 195.A OG1 THR 185.A OG1 no hydrogen 3.304 N/A THR 195.A OG1 HIS 227.A NE2 no hydrogen 2.634 N/A VAL 196.A N PHE 184.A O no hydrogen 3.029 N/A GLN 197.A N ILE 230.A O no hydrogen 2.900 N/A ASP 198.A N GLU 182.A O no hydrogen 2.899 N/A LYS 199.A NZ GLU 206.A OE2 no hydrogen 3.552 N/A TYR 200.A OH ASP 180.A OD1 no hydrogen 2.512 N/A TYR 200.A OH ASP 180.A OD2 no hydrogen 3.034 N/A GLU 206.A N SER 203.A OG no hydrogen 3.110 N/A LYS 207.A N SER 203.A O no hydrogen 2.785 N/A LYS 207.A NZ LYS 199.A O no hydrogen 2.949 N/A LYS 207.A NZ PHE 232.A O no hydrogen 2.842 N/A LYS 207.A NZ SER 234.A O no hydrogen 2.975 N/A VAL 208.A N TYR 204.A O no hydrogen 2.942 N/A LYS 209.A N ASP 205.A O no hydrogen 3.244 N/A LYS 209.A NZ ASP 213.A OD2 no hydrogen 2.802 N/A SER 210.A N GLU 206.A O no hydrogen 2.990 N/A SER 210.A OG GLU 206.A O no hydrogen 2.738 N/A ILE 211.A N LYS 207.A O no hydrogen 2.997 N/A LYS 212.A N VAL 208.A O no hydrogen 3.066 N/A LYS 212.A NZ GLU 255.A OE2 no hydrogen 2.870 N/A ASP 213.A N LYS 209.A O no hydrogen 2.779 N/A THR 214.A N SER 210.A O no hydrogen 2.962 N/A THR 214.A OG1 SER 210.A O no hydrogen 3.109 N/A MET 215.A N ILE 211.A O no hydrogen 2.822 N/A ASP 216.A N LYS 212.A O no hydrogen 2.873 N/A GLU 217.A N ASP 213.A O no hydrogen 3.294 N/A THR 218.A N THR 214.A O no hydrogen 3.184 N/A THR 218.A OG1 ARG 267.A O no hydrogen 3.052 N/A MET 219.A N MET 215.A O no hydrogen 3.135 N/A ASN 220.A N ASP 216.A O no hydrogen 3.087 N/A ASN 221.A N THR 218.A O no hydrogen 3.289 N/A SER 222.A OG GLU 223.A OE2 no hydrogen 3.156 N/A ASP 224.A N ASN 221.A O no hydrogen 3.166 N/A ASN 226.A N ASP 224.A OD1 no hydrogen 3.192 N/A ASN 226.A ND2 ASN 148.A OD1 no hydrogen 3.515 N/A ASN 226.A ND2 ASN 191.A O no hydrogen 3.279 N/A HIS 227.A N ASP 224.A O no hydrogen 3.463 N/A HIS 227.A NE2 THR 195.A OG1 no hydrogen 2.634 N/A LEU 228.A N ASN 193.A O no hydrogen 2.628 N/A TYR 229.A OH GLU 217.A OE2 no hydrogen 2.685 N/A TYR 229.A OH ASN 221.A OD1 no hydrogen 2.891 N/A ILE 230.A N THR 195.A O no hydrogen 2.863 N/A ASN 231.A N TRP 270.A O no hydrogen 2.683 N/A ASN 231.A ND2 ILE 211.A O no hydrogen 3.141 N/A PHE 232.A N GLN 197.A O no hydrogen 3.098 N/A THR 233.A N ILE 272.A O no hydrogen 3.006 N/A SER 237.A OG TYR 248.A OH no hydrogen 3.120 N/A ASN 243.A N ALA 241.A O no hydrogen 2.707 N/A ASN 243.A ND2 GLY 238.A O no hydrogen 3.503 N/A TYR 247.A N SER 244.A O no hydrogen 3.019 N/A TYR 248.A N SER 244.A O no hydrogen 3.274 N/A TYR 248.A OH SER 237.A OG no hydrogen 3.120 N/A ALA 249.A N PRO 245.A O no hydrogen 3.022 N/A SER 250.A N TYR 246.A O no hydrogen 2.975 N/A SER 250.A OG TYR 247.A O no hydrogen 2.587 N/A TYR 251.A N TYR 248.A O no hydrogen 3.110 N/A ILE 252.A N TYR 248.A O no hydrogen 2.768 N/A ASN 253.A N ALA 249.A O no hydrogen 3.085 N/A ASN 253.A ND2 SER 274.A O no hydrogen 3.512 N/A GLU 255.A N TYR 251.A O no hydrogen 3.185 N/A ILE 256.A N ILE 252.A O no hydrogen 2.950 N/A ALA 257.A N ASN 253.A O no hydrogen 2.752 N/A ASN 258.A N PRO 254.A O no hydrogen 2.834 N/A ASN 258.A ND2 PRO 254.A O no hydrogen 3.102 N/A TYR 259.A N GLU 255.A O no hydrogen 3.069 N/A TYR 259.A OH ASP 216.A OD1 no hydrogen 2.547 N/A TYR 259.A OH ASP 216.A OD2 no hydrogen 3.133 N/A ILE 260.A N ILE 256.A O no hydrogen 3.071 N/A LYS 261.A N ALA 257.A O no hydrogen 3.010 N/A LYS 261.A NZ GLU 287.A OE2 no hydrogen 3.208 N/A GLN 262.A N ASN 258.A O no hydrogen 2.767 N/A LYS 263.A N TYR 259.A O no hydrogen 3.270 N/A ASN 264.A N ILE 260.A O no hydrogen 3.098 N/A ARG 267.A NH1 HIS 227.A O no hydrogen 3.267 N/A ARG 267.A NH2 ASN 221.A O no hydrogen 3.394 N/A ARG 267.A NH2 HIS 227.A O no hydrogen 3.273 N/A VAL 268.A N SER 27.A OG no hydrogen 3.034 N/A TRP 270.A N TYR 229.A O no hydrogen 2.739 N/A TRP 270.A NE1 LEU 23.A O no hydrogen 3.064 N/A VAL 271.A N ILE 28.A O no hydrogen 2.980 N/A ILE 272.A N ASN 231.A O no hydrogen 3.028 N/A GLN 273.A N GLY 30.A O no hydrogen 2.966 N/A GLN 273.A NE2 SER 274.A O no hydrogen 3.308 N/A TYR 275.A N THR 50.A O no hydrogen 2.746 N/A TYR 275.A OH MET 49.A O no hydrogen 2.590 N/A ILE 276.A N GLN 51.A OE1 no hydrogen 3.086 N/A ASN 277.A ND2 GLU 52.A OE2 no hydrogen 3.099 N/A LYS 279.A N ASN 277.A OD1 no hydrogen 2.968 N/A LYS 279.A NZ GLU 52.A OE1 no hydrogen 2.972 N/A LYS 279.A NZ GLU 52.A OE2 no hydrogen 3.085 N/A LYS 279.A NZ TYR 246.A OH no hydrogen 3.106 N/A TYR 285.A OH ASN 277.A O no hydrogen 2.598 N/A GLN 286.A NE2 GLU 8.A OE1 no hydrogen 3.322 N/A GLU 287.A N LEU 283.A O no hydrogen 3.212 N/A VAL 288.A N LEU 284.A O no hydrogen 2.916 N/A ILE 289.A N TYR 285.A O no hydrogen 3.017 N/A ARG 290.A N GLN 286.A O no hydrogen 3.067 N/A ARG 290.A NE GLU 8.A OE2 no hydrogen 3.053 N/A ARG 290.A NH1 GLU 287.A OE2 no hydrogen 2.989 N/A ARG 290.A NH2 GLU 8.A OE1 no hydrogen 3.132 N/A ALA 291.A N GLU 287.A O no hydrogen 3.205 N/A ASN 292.A N ILE 289.A O no hydrogen 3.080 N/A ASN 292.A ND2 SER 27.A O no hydrogen 2.789 N/A ASN 292.A ND2 ILE 289.A O no hydrogen 2.926 N/A LYS 293.A N ARG 290.A O no hydrogen 3.012 N/A LYS 293.A NZ ASN 264.A OD1 no hydrogen 2.850 N/A SER 294.A OG ALA 266.A O no hydrogen 3.070 N/A LEU 295.A N ASN 292.A O no hydrogen 2.855 N/A ILE 296.A N LYS 293.A O no hydrogen 3.287 N/A