Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2x3a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N THR 25.A OG1 no hydrogen 2.949 N/A ASP 3.A N THR 23.A O no hydrogen 2.940 N/A GLN 5.A N THR 21.A O no hydrogen 2.701 N/A LEU 6.A N ASN 112.A OD1 no hydrogen 2.917 N/A THR 7.A N ASN 19.A O no hydrogen 2.847 N/A THR 7.A OG1 ASN 19.A O no hydrogen 3.516 N/A VAL 9.A N ARG 17.A O no hydrogen 2.989 N/A ASP 14.A N THR 140.A OG1 no hydrogen 3.177 N/A ASP 15.A N THR 13.A OG1 no hydrogen 3.351 N/A VAL 16.A N GLU 86.A OE2 no hydrogen 2.928 N/A ARG 17.A NH2 THR 13.A OG1 no hydrogen 2.591 N/A VAL 18.A N ALA 85.A O no hydrogen 2.832 N/A ASN 19.A N THR 7.A O no hydrogen 2.872 N/A ASN 19.A ND2 GLN 84.A OE1 no hydrogen 3.105 N/A LEU 20.A N VAL 83.A O no hydrogen 2.848 N/A THR 21.A N GLN 5.A O no hydrogen 2.789 N/A THR 21.A OG1 THR 82.A OG1 no hydrogen 3.029 N/A LEU 22.A N LEU 81.A O no hydrogen 2.783 N/A THR 23.A N ASP 3.A O no hydrogen 2.908 N/A THR 23.A OG1 SER 80.A OG no hydrogen 2.796 N/A ASN 24.A N GLN 79.A O no hydrogen 2.929 N/A ASN 24.A ND2 LYS 28.A O no hydrogen 2.802 N/A ASN 24.A ND2 LEU 75.A O no hydrogen 3.058 N/A THR 25.A N GLY 1.A O no hydrogen 2.977 N/A GLY 26.A N ASN 24.A OD1 no hydrogen 2.981 N/A ILE 30.A N LEU 75.A O no hydrogen 2.910 N/A ARG 31.A NH1 ASP 69.A OD1 no hydrogen 3.210 N/A LEU 32.A N GLN 73.A O no hydrogen 2.637 N/A LEU 33.A N ALA 107.A O no hydrogen 2.851 N/A LYS 34.A N ASP 71.A O no hydrogen 2.867 N/A LYS 34.A NZ LYS 70.A O no hydrogen 3.281 N/A GLN 36.A N LEU 33.A O no hydrogen 3.007 N/A LEU 37.A N LYS 34.A O no hydrogen 3.070 N/A PHE 46.A N TYR 91.A OH.A no hydrogen 2.709 N/A PHE 46.A N TYR 91.A OH.B no hydrogen 3.073 N/A LEU 47.A N ARG 102.A O no hydrogen 2.717 N/A GLU 49.A N SER 100.A O no hydrogen 3.036 N/A ARG 50.A N GLN 53.A O no hydrogen 2.731 N/A ARG 50.A NE GLN 96.A O no hydrogen 2.945 N/A ARG 50.A NH2 GLN 96.A O no hydrogen 2.608 N/A ASP 51.A N GLN 98.A O no hydrogen 2.811 N/A GLN 53.A N ARG 50.A O no hydrogen 2.941 N/A VAL 55.A N VAL 48.A O no hydrogen 3.126 N/A TYR 57.A OH ALA 60.A O no hydrogen 2.713 N/A GLU 58.A N LEU 90.A O no hydrogen 2.743 N/A ALA 60.A N ASP 42.A OD2 no hydrogen 2.747 N/A ARG 64.A NH2 ASP 41.A OD2 no hydrogen 3.124 N/A THR 68.A N ASP 71.A OD2 no hydrogen 2.717 N/A THR 68.A OG1 ASP 71.A OD2 no hydrogen 2.929 N/A ASP 71.A N THR 68.A O no hydrogen 2.745 N/A PHE 72.A N ASP 69.A O no hydrogen 3.218 N/A GLN 73.A N LEU 32.A O no hydrogen 2.482 N/A LEU 75.A N ILE 30.A O no hydrogen 2.779 N/A LYS 76.A N GLN 79.A OE1 no hydrogen 2.665 N/A GLN 79.A N LYS 76.A O no hydrogen 2.957 N/A SER 80.A OG THR 23.A OG1 no hydrogen 2.796 N/A LEU 81.A N LEU 22.A O no hydrogen 2.708 N/A THR 82.A OG1 THR 21.A OG1 no hydrogen 3.029 N/A VAL 83.A N LEU 20.A O no hydrogen 2.836 N/A ALA 85.A N VAL 18.A O no hydrogen 2.864 N/A VAL 87.A N VAL 16.A O no hydrogen 2.759 N/A SER 88.A N GLU 86.A OE2 no hydrogen 3.013 N/A SER 88.A OG GLU 86.A OE1 no hydrogen 3.499 N/A SER 88.A OG GLU 86.A OE2 no hydrogen 2.498 N/A GLY 89.A N GLU 86.A OE1 no hydrogen 2.912 N/A LEU 90.A N VAL 87.A O no hydrogen 3.072 N/A TYR 91.A N.A VAL 87.A O no hydrogen 3.091 N/A TYR 91.A N.B VAL 87.A O no hydrogen 3.106 N/A TYR 91.A OH.A PHE 46.A O no hydrogen 2.836 N/A ASP 92.A N SER 56.A O no hydrogen 2.858 N/A SER 94.A N ASP 92.A OD1 no hydrogen 3.180 N/A SER 94.A OG ASP 92.A OD1 no hydrogen 2.534 N/A GLY 97.A N VAL 118.A O no hydrogen 2.954 N/A GLN 98.A N ASP 51.A OD2 no hydrogen 3.319 N/A TYR 99.A N LEU 116.A O no hydrogen 2.731 N/A TYR 99.A OH ALA 95.A O no hydrogen 2.494 N/A SER 100.A N GLU 49.A O no hydrogen 2.929 N/A ILE 101.A N ILE 114.A O no hydrogen 2.833 N/A ARG 102.A N LEU 47.A O no hydrogen 3.016 N/A ARG 102.A NH1 SER 111.A O no hydrogen 2.998 N/A TYR 103.A N SER 111.A OG no hydrogen 2.867 N/A TYR 103.A OH GLN 36.A O no hydrogen 2.719 N/A GLN 104.A N LEU 45.A O no hydrogen 2.884 N/A LEU 105.A N SER 109.A O no hydrogen 2.905 N/A ALA 107.A N GLN 36.A OE1 no hydrogen 2.631 N/A SER 111.A N TYR 103.A O no hydrogen 2.818 N/A SER 111.A OG ASN 112.A O no hydrogen 2.647 N/A ASN 112.A ND2 LEU 6.A O no hydrogen 2.952 N/A ASN 112.A ND2 ALA 113.A O no hydrogen 3.626 N/A ILE 114.A N ILE 101.A O no hydrogen 2.829 N/A LEU 116.A N TYR 99.A O no hydrogen 3.033 N/A VAL 118.A N GLY 97.A O no hydrogen 2.754 N/A VAL 121.A N SER 94.A O no hydrogen 2.751 N/A ASN 122.A ND2 GLU 119.A O no hydrogen 2.913 N/A ARG 125.A N ASP 123.A OD2 no hydrogen 2.992 N/A ARG 125.A NE ASP 123.A OD2 no hydrogen 2.853 N/A ARG 125.A NH1 ASP 150.A OD1 no hydrogen 2.716 N/A ARG 125.A NH2 ASP 123.A OD1 no hydrogen 2.844 N/A ARG 125.A NH2 ASP 150.A OD1 no hydrogen 2.896 N/A ARG 125.A NH2 ASP 150.A OD2 no hydrogen 3.327 N/A VAL 126.A N ASP 123.A O no hydrogen 3.209 N/A GLN 127.A N GLU 124.A O no hydrogen 3.171 N/A SER 130.A N LYS 199.A O no hydrogen 3.427 N/A VAL 131.A N ARG 125.A O no hydrogen 2.943 N/A SER 132.A N LEU 201.A O no hydrogen 2.966 N/A SER 134.A N PHE 203.A O no hydrogen 3.020 N/A SER 134.A OG ASP 204.A OD1 no hydrogen 2.908 N/A ARG 136.A NE ASP 42.A OD1 no hydrogen 2.754 N/A ARG 136.A NH1 GLY 39.A O no hydrogen 2.990 N/A ARG 136.A NH2 GLY 39.A O no hydrogen 2.713 N/A ARG 136.A NH2 ASP 42.A OD1 no hydrogen 2.893 N/A CYS 137.A SG SER 134.A O no hydrogen 3.367 N/A CYS 137.A SG PHE 203.A O no hydrogen 3.817 N/A THR 138.A N GLN 141.A OE1 no hydrogen 2.976 N/A THR 138.A OG1 ASP 15.A OD1 no hydrogen 2.940 N/A THR 138.A OG1 GLN 141.A OE1 no hydrogen 3.545 N/A ASN 139.A N SER 88.A OG no hydrogen 2.915 N/A ASN 139.A ND2 MET 93.A O no hydrogen 2.740 N/A THR 140.A OG1 ASP 15.A OD1 no hydrogen 2.556 N/A GLN 141.A N THR 138.A OG1 no hydrogen 3.076 N/A LYS 142.A N THR 138.A O no hydrogen 2.725 N/A SER 143.A N ASN 139.A O no hydrogen 2.842 N/A ASP 144.A N THR 140.A O no hydrogen 2.749 N/A LEU 145.A N GLN 141.A O no hydrogen 2.749 N/A LEU 146.A N LYS 142.A O no hydrogen 2.872 N/A THR 147.A N SER 143.A O no hydrogen 2.910 N/A THR 147.A OG1 SER 143.A O no hydrogen 3.298 N/A ALA 148.A N ASP 144.A O no hydrogen 2.805 N/A LEU 149.A N LEU 145.A O no hydrogen 2.791 N/A ASP 150.A N LEU 146.A O no hydrogen 2.932 N/A ALA 151.A N THR 147.A O no hydrogen 2.924 N/A ALA 152.A N ALA 148.A O no hydrogen 2.766 N/A SER 153.A N LEU 149.A O no hydrogen 2.787 N/A GLY 154.A N ASP 150.A O no hydrogen 2.936 N/A ILE 155.A N ALA 151.A O no hydrogen 2.928 N/A SER 156.A N.A ALA 152.A O no hydrogen 2.925 N/A SER 156.A N.B ALA 152.A O no hydrogen 2.893 N/A SER 156.A OG.A ALA 152.A O no hydrogen 2.743 N/A ASN 157.A N SER 153.A O no hydrogen 2.901 N/A ASN 158.A N GLY 154.A O no hydrogen 3.011 N/A ALA 159.A N ILE 155.A O no hydrogen 2.848 N/A SER 160.A N SER 156.A O.A no hydrogen 3.124 N/A SER 160.A N SER 156.A O.B no hydrogen 2.806 N/A SER 160.A OG SER 156.A O.A no hydrogen 3.002 N/A SER 160.A OG SER 156.A O.B no hydrogen 3.495 N/A SER 161.A N ASN 157.A O no hydrogen 2.857 N/A SER 161.A OG ASN 157.A O no hydrogen 3.037 N/A TYR 162.A N ASN 158.A O no hydrogen 2.986 N/A LEU 163.A N ALA 159.A O no hydrogen 2.968 N/A ALA 164.A N SER 160.A O no hydrogen 3.074 N/A ALA 164.A N SER 161.A O no hydrogen 3.299 N/A GLN 168.A NE2 SER 172.A OG no hydrogen 2.985 N/A ARG 169.A NE PHE 288.A O no hydrogen 3.045 N/A ARG 169.A NH1 ASN 158.A OD1 no hydrogen 2.783 N/A ARG 169.A NH2 ASN 158.A OD1 no hydrogen 2.929 N/A ARG 169.A NH2 PHE 288.A O no hydrogen 3.096 N/A ARG 171.A N GLY 167.A O no hydrogen 2.786 N/A ARG 171.A NH1 GLN 168.A OE1 no hydrogen 2.709 N/A SER 172.A N GLN 168.A O no hydrogen 2.627 N/A SER 172.A OG GLN 168.A O no hydrogen 3.091 N/A TRP 173.A N TYR 170.A O no hydrogen 3.092 N/A PHE 174.A N TYR 170.A O no hydrogen 2.677 N/A GLY 175.A N ARG 171.A O no hydrogen 2.916 N/A TYR 177.A OH ASP 166.A OD2 no hydrogen 3.087 N/A ARG 181.A N SER 178.A OG no hydrogen 2.974 N/A ARG 181.A NH2 ALA 176.A O no hydrogen 3.007 N/A TRP 182.A N SER 178.A O no hydrogen 2.886 N/A TRP 182.A NE1 LEU 163.A O no hydrogen 2.767 N/A ASP 183.A N SER 179.A O no hydrogen 2.865 N/A GLN 184.A N ALA 180.A O no hydrogen 3.086 N/A ALA 185.A N ARG 181.A O no hydrogen 2.952 N/A GLU 186.A N TRP 182.A O no hydrogen 2.864 N/A THR 187.A N ASP 183.A O no hydrogen 2.819 N/A THR 187.A OG1 ASP 183.A O no hydrogen 3.011 N/A ASN 188.A N GLN 184.A O no hydrogen 2.838 N/A ASN 188.A ND2 HIS 285.A NE2 no hydrogen 2.972 N/A PHE 189.A N ALA 185.A O no hydrogen 2.912 N/A SER 190.A N GLU 186.A O no hydrogen 2.893 N/A LYS 191.A N THR 187.A O no hydrogen 3.127 N/A LYS 191.A N ASN 188.A O no hydrogen 3.085 N/A ILE 192.A N ASN 188.A O no hydrogen 3.026 N/A LYS 193.A N PHE 189.A O no hydrogen 2.869 N/A LYS 193.A NZ ASN 157.A OD1 no hydrogen 2.845 N/A LYS 193.A NZ ASP 197.A OD2 no hydrogen 2.691 N/A ASP 194.A N SER 190.A O no hydrogen 2.878 N/A ALA 195.A N LYS 191.A O no hydrogen 2.934 N/A ILE 196.A N ILE 192.A O no hydrogen 2.896 N/A ASP 197.A N LYS 193.A O no hydrogen 2.870 N/A ASN 198.A N ASP 194.A O no hydrogen 2.856 N/A ASN 198.A ND2 ASP 194.A OD1 no hydrogen 2.853 N/A LYS 199.A N ALA 195.A O no hydrogen 3.253 N/A LYS 199.A NZ ASP 194.A OD2 no hydrogen 2.676 N/A LEU 201.A N SER 130.A O no hydrogen 2.980 N/A THR 202.A N TYR 221.A O no hydrogen 3.074 N/A PHE 203.A N SER 132.A O no hydrogen 3.094 N/A ASP 204.A N VAL 223.A O no hydrogen 2.906 N/A CYS 205.A N SER 134.A O no hydrogen 3.106 N/A SER 206.A N ASP 204.A OD2 no hydrogen 2.856 N/A SER 206.A OG ASP 204.A OD2 no hydrogen 2.539 N/A TYR 214.A N TYR 224.A O no hydrogen 2.920 N/A GLN 219.A N TYR 216.A O no hydrogen 2.744 N/A LYS 222.A N GLN 219.A O no hydrogen 3.427 N/A LYS 222.A NZ TYR 224.A OH no hydrogen 3.340 N/A VAL 223.A N THR 202.A O no hydrogen 2.775 N/A TYR 224.A N TYR 214.A O no hydrogen 3.018 N/A LEU 225.A N ASP 204.A O no hydrogen 2.929 N/A CYS 226.A N PHE 212.A O no hydrogen 2.886 N/A LYS 227.A N GLN 209.A O no hydrogen 3.133 N/A SER 228.A N TYR 211.A O no hydrogen 2.925 N/A SER 228.A OG SER 210.A O no hydrogen 2.433 N/A PHE 229.A N CYS 226.A O no hydrogen 2.892 N/A THR 231.A N LYS 227.A O no hydrogen 3.274 N/A THR 231.A OG1 SER 228.A O no hydrogen 3.422 N/A ALA 232.A N PHE 229.A O no hydrogen 3.165 N/A ASP 238.A N GLU 290.A OE1 no hydrogen 2.928 N/A SER 239.A N GLU 290.A OE2 no hydrogen 3.074 N/A SER 239.A OG GLY 236.A O no hydrogen 2.692 N/A SER 239.A OG GLU 290.A OE2 no hydrogen 3.332 N/A ARG 240.A N PRO 233.A O no hydrogen 2.862 N/A ARG 240.A NE PHE 229.A O no hydrogen 3.159 N/A ARG 240.A NE ALA 232.A O no hydrogen 3.157 N/A ARG 240.A NH2 TRP 230.A O no hydrogen 2.791 N/A ALA 241.A N VAL 234.A O no hydrogen 2.962 N/A GLY 242.A N SER 239.A OG no hydrogen 3.050 N/A THR 243.A N SER 239.A O no hydrogen 2.801 N/A THR 243.A OG1 SER 239.A O no hydrogen 2.820 N/A ILE 244.A N ARG 240.A O no hydrogen 3.077 N/A VAL 245.A N ALA 241.A O no hydrogen 3.261 N/A HIS 246.A N GLY 242.A O no hydrogen 2.953 N/A GLN 247.A N THR 243.A O no hydrogen 2.921 N/A LEU 248.A N ILE 244.A O no hydrogen 2.967 N/A SER 249.A N VAL 245.A O no hydrogen 2.953 N/A SER 249.A OG HIS 246.A O no hydrogen 2.569 N/A SER 249.A OG THR 257.A OG1 no hydrogen 2.762 N/A HIS 250.A N GLN 247.A O no hydrogen 2.971 N/A HIS 250.A ND1 THR 257.A O no hydrogen 2.751 N/A HIS 250.A NE2 ASP 259.A OD2.B no hydrogen 2.982 N/A PHE 251.A N LEU 248.A O no hydrogen 3.174 N/A ASN 252.A N PRO 217.A O no hydrogen 2.919 N/A VAL 254.A N PHE 251.A O no hydrogen 2.810 N/A GLY 256.A N PHE 251.A O no hydrogen 2.924 N/A THR 257.A N SER 249.A O no hydrogen 3.036 N/A THR 257.A OG1 SER 249.A OG no hydrogen 2.762 N/A THR 257.A OG1 HIS 250.A ND1 no hydrogen 3.060 N/A ASP 258.A N ASN 280.A O.A no hydrogen 2.709 N/A ASP 258.A N ASN 280.A O.B no hydrogen 2.682 N/A LEU 260.A N ASN 281.A OD1 no hydrogen 2.972 N/A TYR 262.A OH ASP 259.A OD2.A no hydrogen 2.542 N/A GLY 263.A N ASP 283.A OD2 no hydrogen 3.039 N/A ALA 267.A N GLY 263.A O no hydrogen 2.889 N/A ARG 268.A N GLN 264.A O no hydrogen 2.709 N/A ASN 269.A N ALA 265.A O no hydrogen 2.949 N/A LEU 270.A N ASN 266.A O no hydrogen 2.941 N/A ALA 271.A N ALA 267.A O no hydrogen 3.083 N/A LYS 272.A N ARG 268.A O no hydrogen 3.088 N/A THR 273.A N ASN 269.A O no hydrogen 2.686 N/A ASP 274.A N LEU 270.A O no hydrogen 2.579 N/A ALA 278.A N ASP 274.A O no hydrogen 3.123 N/A LEU 279.A N PRO 275.A O no hydrogen 2.935 N/A ASN 280.A N.A LYS 277.A O no hydrogen 2.993 N/A ASN 280.A N.B LYS 277.A O no hydrogen 3.011 N/A ASN 280.A ND2.A VAL 276.A O no hydrogen 2.698 N/A ASN 280.A ND2.B ASP 258.A OD2 no hydrogen 2.430 N/A ASN 281.A N ALA 278.A O no hydrogen 2.939 N/A ASN 281.A ND2 ASN 284.A OD1 no hydrogen 2.695 N/A ALA 282.A N ASP 258.A O no hydrogen 2.986 N/A ASN 284.A ND2 TRP 173.A O no hydrogen 2.721 N/A ASN 284.A ND2 ALA 267.A O no hydrogen 3.012 N/A HIS 285.A N ASN 281.A O no hydrogen 3.473 N/A HIS 285.A ND1 ASN 281.A O no hydrogen 2.909 N/A GLU 286.A N ALA 282.A O no hydrogen 2.973 N/A TYR 287.A N ASP 283.A O no hydrogen 2.737 N/A TYR 287.A OH ASP 238.A OD1 no hydrogen 2.719 N/A PHE 288.A N ASN 284.A O no hydrogen 2.864 N/A ALA 289.A N HIS 285.A O no hydrogen 2.979 N/A GLU 290.A N GLU 286.A O no hydrogen 2.798 N/A ASN 291.A N TYR 287.A O no hydrogen 2.969 N/A THR 292.A OG1 GLU 290.A O no hydrogen 2.754 N/A