Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 9c54_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N GLU 5.A OE1 no hydrogen 2.823 N/A THR 3.A OG1 ASP 238.A OD1 no hydrogen 3.469 N/A THR 3.A OG1 ASP 238.A OD2 no hydrogen 2.909 N/A GLU 5.A N THR 2.A OG1 no hydrogen 2.892 N/A ARG 6.A N THR 2.A O no hydrogen 2.812 N/A GLU 7.A N.A THR 3.A O no hydrogen 3.017 N/A GLU 7.A N.B THR 3.A O no hydrogen 3.019 N/A PHE 8.A N ILE 4.A O no hydrogen 2.937 N/A GLU 9.A N GLU 5.A O no hydrogen 3.255 N/A GLU 10.A N ARG 6.A O no hydrogen 3.215 N/A LEU 11.A N GLU 7.A O.A no hydrogen 3.029 N/A LEU 11.A N GLU 7.A O.B no hydrogen 3.046 N/A ASP 12.A N PHE 8.A O no hydrogen 3.038 N/A THR 13.A N GLU 9.A O no hydrogen 2.876 N/A GLN 14.A N GLU 10.A O no hydrogen 3.276 N/A ARG 15.A N ASP 12.A O no hydrogen 3.193 N/A ARG 16.A N.A LEU 11.A O no hydrogen 2.892 N/A ARG 16.A N.B LEU 11.A O no hydrogen 2.885 N/A ARG 16.A NH2.A GLU 23.A OE2 no hydrogen 3.131 N/A TRP 17.A NE1 ASP 12.A OD1 no hydrogen 2.755 N/A LEU 20.A N ARG 16.A O.A no hydrogen 2.938 N/A LEU 20.A N ARG 16.A O.B no hydrogen 3.206 N/A TYR 21.A N TRP 17.A O no hydrogen 3.026 N/A TYR 21.A OH ILE 256.A O no hydrogen 2.766 N/A LEU 22.A N GLN 18.A O no hydrogen 2.916 N/A GLU 23.A N PRO 19.A O no hydrogen 2.747 N/A ILE 24.A N LEU 20.A O no hydrogen 2.973 N/A ARG 25.A N TYR 21.A O no hydrogen 2.817 N/A ASN 26.A N LEU 22.A O no hydrogen 2.669 N/A GLU 27.A N GLU 23.A O no hydrogen 2.779 N/A SER 28.A N ARG 25.A O no hydrogen 3.440 N/A SER 28.A OG ILE 24.A O no hydrogen 2.568 N/A HIS 33.A ND1 TYR 31.A O no hydrogen 3.042 N/A ARG 34.A N ASP 54.A OD2 no hydrogen 2.825 N/A VAL 35.A N ASP 54.A OD1 no hydrogen 3.081 N/A LYS 37.A N ARG 34.A O no hydrogen 2.898 N/A LYS 37.A NZ ARG 48.A O.A no hydrogen 2.624 N/A LYS 37.A NZ ARG 48.A O.B no hydrogen 2.676 N/A PHE 38.A N VAL 35.A O no hydrogen 3.073 N/A ASN 41.A N PHE 38.A O no hydrogen 2.959 N/A ASN 41.A ND2 VAL 35.A O no hydrogen 2.762 N/A ARG 42.A N PRO 39.A O no hydrogen 3.336 N/A ARG 44.A N ASN 41.A O no hydrogen 3.023 N/A ARG 44.A NH1 ASN 65.A O no hydrogen 3.250 N/A ARG 44.A NH1 TYR 67.A O no hydrogen 2.751 N/A ASN 45.A N ARG 42.A O no hydrogen 3.370 N/A ASN 45.A ND2 ALA 36.A O no hydrogen 2.877 N/A ARG 46.A N GLN 86.A OE1 no hydrogen 2.918 N/A ARG 46.A NE GLY 87.A O no hydrogen 2.803 N/A ARG 46.A NH2 GLY 87.A O no hydrogen 3.048 N/A ARG 46.A NH2 PRO 88.A O no hydrogen 2.765 N/A VAL 50.A N TYR 47.A O no hydrogen 3.459 N/A ASP 54.A N PRO 32.A O no hydrogen 2.801 N/A SER 56.A N TYR 53.A O no hydrogen 3.357 N/A SER 56.A OG TYR 251.A O no hydrogen 2.593 N/A ARG 57.A NH1 ASP 66.A O no hydrogen 3.554 N/A ARG 57.A NH1 ASP 66.A OD1 no hydrogen 3.208 N/A ARG 57.A NH2 ASP 66.A OD1 no hydrogen 3.258 N/A ARG 57.A NH2 ASP 66.A OD2 no hydrogen 3.399 N/A VAL 58.A N ALA 70.A O no hydrogen 2.975 N/A LEU 60.A N ASP 66.A O no hydrogen 2.875 N/A GLN 61.A N GLN 102.A OE1 no hydrogen 2.929 N/A ASN 65.A ND2 ASN 41.A OD1 no hydrogen 2.585 N/A TYR 67.A N ASN 65.A OD1 no hydrogen 2.962 N/A TYR 67.A OH ASN 45.A OD1 no hydrogen 2.473 N/A ASN 69.A ND2 ASN 45.A OD1 no hydrogen 2.943 N/A ASN 69.A ND2 VAL 50.A O no hydrogen 2.962 N/A SER 71.A N LEU 84.A O no hydrogen 2.788 N/A LEU 72.A N SER 56.A O no hydrogen 2.851 N/A VAL 73.A N TYR 82.A O no hydrogen 2.672 N/A ILE 75.A N ARG 80.A O no hydrogen 2.922 N/A GLU 77.A N GLU 77.A OE1 no hydrogen 2.493 N/A ALA 78.A N ILE 75.A O no hydrogen 2.986 N/A GLN 79.A N GLU 76.A O no hydrogen 3.176 N/A ARG 80.A N ILE 75.A O no hydrogen 3.337 N/A ARG 80.A NE TYR 82.A OH no hydrogen 3.327 N/A ARG 80.A NE ASP 229.A OD2 no hydrogen 2.827 N/A ARG 80.A NH2 ASP 229.A OD1 no hydrogen 3.123 N/A ARG 80.A NH2 ASP 229.A OD2 no hydrogen 3.008 N/A TYR 82.A N VAL 73.A O no hydrogen 2.942 N/A TYR 82.A OH ASP 229.A OD2 no hydrogen 2.543 N/A TYR 82.A OH THR 230.A OG1 no hydrogen 3.048 N/A ILE 83.A N ALA 211.A O no hydrogen 2.867 N/A LEU 84.A N SER 71.A O no hydrogen 2.870 N/A THR 85.A N ILE 213.A O no hydrogen 3.023 N/A THR 85.A OG1 ASN 69.A O no hydrogen 2.448 N/A GLN 86.A N ASN 69.A O no hydrogen 3.445 N/A GLN 86.A NE2 ARG 44.A O no hydrogen 2.888 N/A GLY 87.A N SER 216.A O no hydrogen 2.837 N/A LEU 89.A N THR 92.A OG1 no hydrogen 2.950 N/A ASN 91.A ND2 ASN 43.A O no hydrogen 2.942 N/A THR 92.A N LEU 89.A O no hydrogen 3.040 N/A THR 92.A OG1 LEU 89.A O no hydrogen 3.485 N/A CYS 93.A SG LEU 89.A O no hydrogen 3.194 N/A CYS 94.A SG ASN 91.A O no hydrogen 3.589 N/A HIS 95.A NE2 GLU 137.A OE2 no hydrogen 3.065 N/A PHE 96.A N THR 92.A O no hydrogen 2.829 N/A TRP 97.A N CYS 93.A O no hydrogen 3.101 N/A TRP 97.A NE1 TYR 125.A O no hydrogen 2.897 N/A LEU 98.A N CYS 94.A O no hydrogen 2.966 N/A MET 99.A N HIS 95.A O no hydrogen 2.847 N/A VAL 100.A N PHE 96.A O no hydrogen 3.012 N/A TRP 101.A N TRP 97.A O no hydrogen 2.956 N/A GLN 102.A N LEU 98.A O no hydrogen 2.966 N/A GLN 102.A NE2 GLN 61.A O no hydrogen 2.987 N/A GLN 103.A N MET 99.A O no hydrogen 2.901 N/A LYS 104.A N TRP 101.A O no hydrogen 3.069 N/A THR 105.A N VAL 100.A O no hydrogen 3.121 N/A THR 105.A OG1 PRO 210.A O no hydrogen 2.651 N/A LYS 106.A NZ THR 170.A O no hydrogen 3.268 N/A VAL 108.A N SER 172.A O no hydrogen 2.873 N/A VAL 109.A N VAL 212.A O no hydrogen 2.757 N/A MET 110.A N PHE 174.A O no hydrogen 2.747 N/A LEU 111.A N HIS 214.A O no hydrogen 3.028 N/A ASN 112.A ND2 ARG 113.A O.A no hydrogen 2.705 N/A ASN 112.A ND2 ARG 113.A O.B no hydrogen 2.602 N/A ARG 113.A N.A GLU 116.A OE2 no hydrogen 3.000 N/A ARG 113.A N.B GLU 116.A OE2 no hydrogen 2.998 N/A ARG 113.A NE.A THR 177.A O no hydrogen 3.123 N/A ARG 113.A NE.B THR 177.A O no hydrogen 2.571 N/A ARG 113.A NH2.B THR 177.A O no hydrogen 3.181 N/A GLU 116.A N SER 119.A O no hydrogen 2.811 N/A SER 119.A N GLU 116.A O no hydrogen 3.254 N/A SER 119.A OG LYS 117.A O no hydrogen 2.991 N/A LYS 121.A N ILE 114.A O no hydrogen 2.834 N/A LYS 121.A NZ GLU 116.A OE1 no hydrogen 3.093 N/A LYS 121.A NZ ASP 181.A OD2 no hydrogen 3.132 N/A CYS 122.A SG ALA 123.A O no hydrogen 3.462 N/A ALA 123.A N PRO 88.A O no hydrogen 2.910 N/A GLN 124.A NE2 TRP 126.A O no hydrogen 2.851 N/A TYR 125.A OH HIS 173.A NE2 no hydrogen 2.630 N/A TYR 125.A OH HIS 214.A NE2 no hydrogen 2.589 N/A GLN 131.A N ASP 129.A OD1 no hydrogen 3.140 N/A GLN 131.A NE2 ASP 129.A OD2 no hydrogen 2.779 N/A MET 133.A N VAL 142.A O no hydrogen 2.984 N/A PHE 135.A N PHE 140.A O no hydrogen 2.857 N/A THR 138.A OG1 CYS 94.A O no hydrogen 3.002 N/A GLY 139.A N PHE 135.A O no hydrogen 2.964 N/A PHE 140.A N PHE 135.A O no hydrogen 3.091 N/A SER 141.A N GLU 161.A O no hydrogen 2.970 N/A SER 141.A OG GLU 132.A OE2 no hydrogen 2.842 N/A SER 141.A OG GLU 161.A OE1 no hydrogen 3.311 N/A VAL 142.A N MET 133.A O no hydrogen 2.921 N/A LYS 143.A N GLN 159.A O.A no hydrogen 3.048 N/A LYS 143.A N GLN 159.A O.B no hydrogen 3.066 N/A LYS 143.A NZ GLU 132.A OE2 no hydrogen 3.330 N/A LEU 145.A N LEU 157.A O no hydrogen 2.690 N/A SER 146.A N LEU 157.A O no hydrogen 3.321 N/A ASP 148.A N VAL 155.A O no hydrogen 2.759 N/A LYS 150.A N TYR 153.A O no hydrogen 2.775 N/A LYS 150.A NZ ASP 148.A OD1 no hydrogen 2.696 N/A LYS 150.A NZ ASP 148.A OD2 no hydrogen 3.224 N/A SER 151.A N GLU 286.A O no hydrogen 2.872 N/A SER 151.A OG LYS 285.A O no hydrogen 2.653 N/A TYR 152.A OH SER 190.A O no hydrogen 2.628 N/A TYR 153.A OH GLU 286.A OE1 no hydrogen 2.630 N/A THR 154.A N HIS 175.A O no hydrogen 2.883 N/A VAL 155.A N ASP 148.A O no hydrogen 2.960 N/A HIS 156.A N HIS 173.A O no hydrogen 2.821 N/A HIS 156.A ND1 HIS 173.A ND1 no hydrogen 3.047 N/A LEU 157.A N SER 146.A O no hydrogen 2.663 N/A LEU 158.A N ILE 171.A O no hydrogen 2.836 N/A GLN 159.A N.A LYS 143.A O no hydrogen 2.887 N/A GLN 159.A N.B LYS 143.A O no hydrogen 2.889 N/A LEU 160.A N ARG 169.A O no hydrogen 2.842 N/A GLU 161.A N SER 141.A O no hydrogen 2.873 N/A ASN 162.A N GLU 167.A O no hydrogen 2.848 N/A ILE 163.A N GLY 139.A O no hydrogen 3.066 N/A ASN 164.A N ASN 162.A OD1 no hydrogen 3.091 N/A SER 165.A N ASN 162.A OD1 no hydrogen 3.371 N/A GLY 166.A N ASN 162.A O no hydrogen 2.620 N/A GLU 167.A N SER 165.A OG no hydrogen 3.345 N/A ARG 169.A N LEU 160.A O no hydrogen 2.906 N/A ARG 169.A NH1 TRP 101.A O no hydrogen 2.694 N/A ILE 171.A N LEU 158.A O no hydrogen 2.729 N/A SER 172.A N LYS 106.A O no hydrogen 3.079 N/A HIS 173.A N HIS 156.A O no hydrogen 2.853 N/A HIS 173.A ND1 HIS 156.A ND1 no hydrogen 3.047 N/A HIS 173.A NE2 TYR 125.A OH no hydrogen 2.630 N/A PHE 174.A N VAL 108.A O no hydrogen 2.807 N/A HIS 175.A N THR 154.A O no hydrogen 2.743 N/A HIS 175.A NE2 ASN 112.A O no hydrogen 2.708 N/A TYR 176.A N MET 110.A O no hydrogen 2.728 N/A THR 177.A N TYR 152.A O no hydrogen 3.199 N/A THR 177.A OG1 TYR 152.A O no hydrogen 3.302 N/A TRP 179.A NE1 GLY 183.A O no hydrogen 2.965 N/A PHE 182.A N ASP 181.A OD1 no hydrogen 3.002 N/A GLY 183.A N PRO 180.A O no hydrogen 2.941 N/A SER 187.A N SER 190.A OG no hydrogen 3.129 N/A SER 187.A OG SER 190.A OG no hydrogen 2.848 N/A SER 190.A OG SER 187.A O no hydrogen 2.939 N/A SER 190.A OG SER 187.A OG no hydrogen 2.848 N/A PHE 191.A N SER 187.A O no hydrogen 3.312 N/A LEU 192.A N PRO 188.A O no hydrogen 2.863 N/A ASN 193.A N ALA 189.A O no hydrogen 2.776 N/A ASN 193.A ND2 TYR 152.A OH no hydrogen 2.827 N/A ASN 193.A ND2 GLU 286.A OE1 no hydrogen 2.853 N/A PHE 194.A N SER 190.A O no hydrogen 3.139 N/A LEU 195.A N PHE 191.A O no hydrogen 2.818 N/A PHE 196.A N LEU 192.A O no hydrogen 2.835 N/A LYS 197.A N ASN 193.A O no hydrogen 2.997 N/A LYS 197.A NZ TYR 153.A OH no hydrogen 3.033 N/A VAL 198.A N PHE 194.A O no hydrogen 3.054 N/A ARG 199.A N LEU 195.A O no hydrogen 2.876 N/A ARG 199.A NE ASP 229.A OD1 no hydrogen 2.707 N/A ARG 199.A NH2 ASP 229.A O no hydrogen 3.316 N/A ARG 199.A NH2 ASP 229.A OD1 no hydrogen 2.754 N/A GLU 200.A N PHE 196.A O no hydrogen 2.718 N/A SER 201.A N LYS 197.A O no hydrogen 3.354 N/A SER 201.A N VAL 198.A O no hydrogen 3.253 N/A SER 201.A OG VAL 198.A O no hydrogen 2.502 N/A SER 201.A OG SER 203.A OG no hydrogen 3.251 N/A GLY 202.A N ARG 199.A O no hydrogen 3.001 N/A SER 203.A N SER 201.A OG no hydrogen 3.373 N/A SER 203.A OG SER 201.A OG no hydrogen 3.251 N/A ASN 205.A N GLY 202.A O no hydrogen 3.365 N/A HIS 208.A N ASN 205.A O no hydrogen 3.181 N/A GLY 209.A N LYS 104.A O no hydrogen 2.964 N/A VAL 212.A N ALA 107.A O no hydrogen 2.990 N/A ILE 213.A N ILE 83.A O no hydrogen 2.710 N/A HIS 214.A N VAL 109.A O no hydrogen 2.910 N/A HIS 214.A ND1 CYS 215.A O no hydrogen 3.165 N/A HIS 214.A NE2 TYR 125.A OH no hydrogen 2.589 N/A CYS 215.A SG SER 222.A OG no hydrogen 3.188 N/A SER 216.A OG ASP 181.A OD1 no hydrogen 3.219 N/A SER 216.A OG ASP 181.A OD2 no hydrogen 3.039 N/A ARG 221.A NH1 GLU 116.A OE1 no hydrogen 3.357 N/A ARG 221.A NH1 GLU 116.A OE2 no hydrogen 2.686 N/A ARG 221.A NH1 TRP 179.A O no hydrogen 2.772 N/A ARG 221.A NH2 GLU 116.A OE1 no hydrogen 3.261 N/A ARG 221.A NH2 SER 216.A OG no hydrogen 3.063 N/A GLY 223.A N ILE 219.A O no hydrogen 3.089 N/A THR 224.A N GLY 220.A O no hydrogen 3.066 N/A THR 224.A OG1 GLY 220.A O no hydrogen 3.031 N/A PHE 225.A N ARG 221.A O no hydrogen 2.969 N/A SER 226.A N SER 222.A O no hydrogen 3.093 N/A SER 226.A OG SER 222.A O no hydrogen 3.134 N/A LEU 227.A N GLY 223.A O no hydrogen 2.973 N/A VAL 228.A N THR 224.A O no hydrogen 3.137 N/A ASP 229.A N PHE 225.A O no hydrogen 3.130 N/A THR 230.A N SER 226.A O no hydrogen 2.949 N/A THR 230.A OG1 TYR 82.A OH no hydrogen 3.048 N/A THR 230.A OG1 SER 226.A O no hydrogen 2.909 N/A CYS 231.A N LEU 227.A O no hydrogen 2.970 N/A CYS 231.A SG LEU 227.A O no hydrogen 3.365 N/A LEU 232.A N VAL 228.A O no hydrogen 2.900 N/A VAL 233.A N ASP 229.A O no hydrogen 3.056 N/A LEU 234.A N THR 230.A O no hydrogen 2.991 N/A MET 235.A N CYS 231.A O no hydrogen 2.839 N/A GLU 236.A N LEU 232.A O no hydrogen 3.254 N/A GLU 236.A N VAL 233.A O no hydrogen 3.087 N/A LYS 242.A NZ GLU 23.A OE1 no hydrogen 2.942 N/A LYS 242.A NZ GLU 27.A OE2 no hydrogen 2.823 N/A GLN 243.A NE2 ASN 247.A OD1 no hydrogen 2.710 N/A VAL 244.A N ASN 240.A O no hydrogen 2.890 N/A LEU 245.A N ILE 241.A O no hydrogen 2.860 N/A LEU 246.A N LYS 242.A O no hydrogen 2.905 N/A ASN 247.A N GLN 243.A O no hydrogen 2.815 N/A MET 248.A N VAL 244.A O no hydrogen 2.898 N/A ARG 249.A N LEU 245.A O no hydrogen 2.843 N/A ARG 249.A NE LEU 255.A O no hydrogen 2.740 N/A ARG 249.A NH1 SER 28.A OG no hydrogen 2.734 N/A ARG 249.A NH2 LEU 255.A O no hydrogen 2.761 N/A ARG 249.A NH2 ILE 256.A O no hydrogen 3.002 N/A LYS 250.A N LEU 246.A O no hydrogen 3.242 N/A LYS 250.A N ASN 247.A O no hydrogen 3.198 N/A LYS 250.A NZ ASN 247.A OD1 no hydrogen 3.465 N/A TYR 251.A N MET 248.A O no hydrogen 3.026 N/A ARG 252.A NE GLY 218.A O no hydrogen 2.919 N/A ARG 252.A NH1 ASN 69.A OD1 no hydrogen 3.187 N/A ARG 252.A NH1 SER 71.A OG no hydrogen 2.876 N/A ARG 252.A NH2 ASN 69.A OD1 no hydrogen 3.031 N/A ARG 252.A NH2 ALA 217.A O no hydrogen 2.867 N/A ILE 256.A N ILE 219.A O no hydrogen 3.050 N/A GLN 257.A N GLN 261.A OE1 no hydrogen 2.890 N/A GLN 261.A N THR 258.A OG1 no hydrogen 2.960 N/A GLN 261.A NE2 GLY 183.A O no hydrogen 3.023 N/A LEU 262.A N THR 258.A O no hydrogen 3.207 N/A ARG 263.A N PRO 259.A O no hydrogen 2.887 N/A ARG 263.A NE ASP 12.A OD1 no hydrogen 2.835 N/A ARG 263.A NH2 ASP 12.A OD1 no hydrogen 3.466 N/A ARG 263.A NH2 ASP 12.A OD2 no hydrogen 2.715 N/A PHE 264.A N ASP 260.A O no hydrogen 2.818 N/A SER 265.A N GLN 261.A O no hydrogen 2.963 N/A SER 265.A OG GLN 261.A O no hydrogen 2.834 N/A TYR 266.A N LEU 262.A O no hydrogen 3.121 N/A TYR 266.A OH GLU 7.A OE2.B no hydrogen 2.519 N/A MET 267.A N ARG 263.A O no hydrogen 3.067 N/A ALA 268.A N PHE 264.A O no hydrogen 2.795 N/A ILE 269.A N SER 265.A O no hydrogen 2.866 N/A ILE 270.A N TYR 266.A O no hydrogen 2.898 N/A GLU 271.A N MET 267.A O no hydrogen 2.906 N/A GLY 272.A N ALA 268.A O no hydrogen 2.696 N/A ALA 273.A N ILE 269.A O no hydrogen 2.844 N/A LYS 274.A N GLU 271.A O no hydrogen 3.441 N/A LYS 274.A NZ ILE 270.A O no hydrogen 3.001 N/A LYS 274.A NZ GLU 271.A OE1 no hydrogen 3.238 N/A CYS 275.A N GLY 272.A O no hydrogen 3.152 N/A TRP 280.A N ILE 276.A O no hydrogen 2.965 N/A TRP 280.A NE1 GLU 271.A OE2 no hydrogen 3.332 N/A LYS 281.A N GLN 277.A O no hydrogen 3.062 N/A GLU 282.A N LYS 278.A O no hydrogen 3.184 N/A LEU 283.A N ARG 279.A O no hydrogen 2.996 N/A SER 284.A N TRP 280.A O no hydrogen 2.726 N/A SER 284.A OG TRP 280.A O no hydrogen 3.376 N/A SER 284.A OG LYS 281.A O no hydrogen 2.652 N/A LYS 285.A N GLU 282.A O no hydrogen 3.074 N/A