Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4x59_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A N SER 3.A OG no hydrogen 3.229 N/A GLN 6.A NE2 VAL 1.A O no hydrogen 3.408 N/A ILE 7.A N SER 3.A O no hydrogen 2.976 N/A LEU 8.A N TRP 4.A O no hydrogen 2.732 N/A GLY 9.A N PRO 5.A O no hydrogen 2.853 N/A ARG 10.A N GLN 6.A O no hydrogen 3.036 N/A ARG 10.A NE ASP 16.A O no hydrogen 2.918 N/A ARG 10.A NH2 ASP 16.A O no hydrogen 3.414 N/A LEU 11.A N ILE 7.A O no hydrogen 3.157 N/A THR 12.A N LEU 8.A O no hydrogen 2.935 N/A THR 12.A OG1 LEU 8.A O no hydrogen 3.265 N/A THR 12.A OG1 GLY 9.A O no hydrogen 2.981 N/A ASP 13.A N GLY 9.A O no hydrogen 3.061 N/A ASN 14.A N LEU 11.A O no hydrogen 2.892 N/A ARG 15.A N ARG 10.A O no hydrogen 3.113 N/A LEU 17.A N GLU 55.A OE2 no hydrogen 2.835 N/A ALA 18.A N GLN 21.A OE1 no hydrogen 2.902 N/A GLY 20.A N GLU 58.A OE2 no hydrogen 2.863 N/A GLN 21.A N ALA 18.A O no hydrogen 3.037 N/A GLN 21.A NE2 GLN 6.A OE1 no hydrogen 3.313 N/A ALA 23.A N GLU 58.A OE1 no hydrogen 2.872 N/A TRP 24.A N GLY 20.A O no hydrogen 2.948 N/A ALA 25.A N GLN 21.A O no hydrogen 3.047 N/A MET 26.A N ALA 22.A O no hydrogen 2.946 N/A ASP 27.A N ALA 23.A O no hydrogen 2.879 N/A GLN 28.A N TRP 24.A O no hydrogen 2.967 N/A ILE 29.A N ALA 25.A O no hydrogen 3.088 N/A MET 30.A N MET 26.A O no hydrogen 2.784 N/A THR 31.A N ASP 27.A O no hydrogen 2.813 N/A THR 31.A OG1 ASP 27.A O no hydrogen 2.839 N/A THR 31.A OG1 GLN 28.A O no hydrogen 3.428 N/A GLY 32.A N ILE 29.A O no hydrogen 3.331 N/A ASN 33.A N GLN 28.A O no hydrogen 2.944 N/A ASN 33.A ND2 THR 31.A OG1 no hydrogen 2.884 N/A ARG 35.A N GLN 38.A OE1 no hydrogen 2.650 N/A ILE 39.A N ARG 35.A O no hydrogen 3.100 N/A ALA 40.A N PRO 36.A O no hydrogen 2.939 N/A ALA 41.A N ALA 37.A O no hydrogen 2.884 N/A PHE 42.A N GLN 38.A O no hydrogen 3.089 N/A ALA 43.A N ILE 39.A O no hydrogen 2.930 N/A VAL 44.A N ALA 40.A O no hydrogen 3.014 N/A ALA 45.A N ALA 41.A O no hydrogen 2.902 N/A MET 46.A N PHE 42.A O no hydrogen 2.832 N/A THR 47.A N ALA 43.A O no hydrogen 3.162 N/A THR 47.A OG1 ALA 43.A O no hydrogen 2.626 N/A MET 48.A N VAL 44.A O no hydrogen 2.798 N/A LYS 49.A N ALA 45.A O no hydrogen 2.811 N/A LYS 49.A NZ ASP 16.A OD1 no hydrogen 2.825 N/A LYS 49.A NZ ALA 50.A O no hydrogen 2.793 N/A LYS 49.A NZ GLU 55.A OE1 no hydrogen 2.674 N/A LYS 49.A NZ GLU 55.A OE2 no hydrogen 3.124 N/A THR 52.A N GLU 55.A OE1 no hydrogen 3.016 N/A GLU 55.A N THR 52.A OG1 no hydrogen 3.308 N/A VAL 56.A N THR 52.A O no hydrogen 3.069 N/A GLY 57.A N ALA 53.A O no hydrogen 2.921 N/A GLU 58.A N ASP 54.A O no hydrogen 2.998 N/A LEU 59.A N GLU 55.A O no hydrogen 2.970 N/A ALA 60.A N VAL 56.A O no hydrogen 2.952 N/A GLY 61.A N GLY 57.A O no hydrogen 2.883 N/A VAL 62.A N GLU 58.A O no hydrogen 3.112 N/A MET 63.A N LEU 59.A O no hydrogen 3.055 N/A LEU 64.A N ALA 60.A O no hydrogen 2.855 N/A SER 65.A N GLY 61.A O no hydrogen 2.786 N/A SER 65.A OG VAL 62.A O no hydrogen 2.930 N/A HIS 66.A N VAL 62.A O no hydrogen 3.207 N/A HIS 66.A N MET 63.A O no hydrogen 3.098 N/A HIS 66.A NE2 ASP 27.A OD1 no hydrogen 2.681 N/A ALA 67.A N LEU 64.A O no hydrogen 3.073 N/A HIS 68.A N PHE 156.A O no hydrogen 3.095 N/A THR 74.A N PRO 71.A O no hydrogen 3.266 N/A THR 74.A OG1 PRO 71.A O no hydrogen 2.636 N/A ALA 79.A N PRO 76.A O no hydrogen 3.104 N/A VAL 80.A N PRO 106.A O no hydrogen 2.860 N/A ASP 81.A N ALA 190.A O no hydrogen 2.988 N/A VAL 83.A N LEU 192.A O no hydrogen 3.203 N/A THR 85.A N GLY 194.A O no hydrogen 2.960 N/A THR 85.A OG1 GLY 86.A O no hydrogen 3.113 N/A GLY 86.A N ASP 225.A OD2 no hydrogen 2.843 N/A ASN 88.A N GLY 265.A O no hydrogen 3.121 N/A VAL 90.A N ASN 88.A OD1 no hydrogen 3.267 N/A ASN 91.A ND2 LEU 263.A O no hydrogen 3.456 N/A ASN 91.A ND2 ALA 264.A O no hydrogen 3.699 N/A LEU 92.A N THR 89.A O no hydrogen 2.770 N/A SER 93.A N THR 89.A O no hydrogen 3.351 N/A THR 94.A N VAL 90.A O no hydrogen 3.066 N/A THR 94.A OG1 VAL 90.A O no hydrogen 2.815 N/A MET 95.A N ASN 91.A O no hydrogen 3.099 N/A ALA 96.A N LEU 92.A O no hydrogen 2.945 N/A ALA 97.A N SER 93.A O no hydrogen 2.878 N/A ILE 98.A N THR 94.A O no hydrogen 3.229 N/A VAL 99.A N MET 95.A O no hydrogen 3.042 N/A VAL 100.A N ALA 96.A O no hydrogen 2.839 N/A ALA 101.A N ALA 97.A O no hydrogen 3.042 N/A ALA 102.A N ILE 98.A O no hydrogen 2.934 N/A ALA 103.A N VAL 99.A O no hydrogen 2.944 N/A GLY 104.A N ALA 101.A O no hydrogen 2.941 N/A VAL 105.A N VAL 100.A O no hydrogen 3.187 N/A VAL 107.A N GLY 147.A O no hydrogen 3.301 N/A VAL 108.A N VAL 80.A O no hydrogen 3.093 N/A LYS 109.A N GLY 149.A O no hydrogen 2.956 N/A LYS 109.A NZ VAL 82.A O no hydrogen 2.708 N/A GLY 111.A N CYS 151.A O no hydrogen 3.184 N/A ARG 113.A NE GLU 126.A OE1 no hydrogen 3.011 N/A ARG 113.A NH2 GLU 126.A OE2 no hydrogen 2.738 N/A ALA 114.A N ASP 123.A OD2 no hydrogen 2.605 N/A SER 119.A N GLY 266.A O no hydrogen 3.119 N/A SER 119.A OG GLY 120.A O no hydrogen 2.396 N/A SER 119.A OG THR 124.A OG1 no hydrogen 2.627 N/A GLY 120.A N ASP 123.A OD2 no hydrogen 2.885 N/A THR 124.A OG1 SER 119.A OG no hydrogen 2.627 N/A LEU 125.A N GLY 121.A O no hydrogen 3.478 N/A GLU 126.A N ALA 122.A O no hydrogen 3.019 N/A ALA 127.A N ASP 123.A O no hydrogen 3.016 N/A LEU 128.A N THR 124.A O no hydrogen 3.103 N/A GLY 129.A N GLU 126.A O no hydrogen 2.799 N/A VAL 130.A N LEU 125.A O no hydrogen 2.964 N/A ARG 131.A NH1 GLY 341.A O no hydrogen 2.923 N/A LEU 138.A N GLY 135.A O no hydrogen 2.938 N/A VAL 139.A N GLY 135.A O no hydrogen 3.001 N/A ALA 140.A N PRO 136.A O no hydrogen 3.031 N/A ARG 141.A N ASP 137.A O no hydrogen 3.120 N/A SER 142.A N LEU 138.A O no hydrogen 2.753 N/A SER 142.A OG ILE 148.A O no hydrogen 2.675 N/A LEU 143.A N VAL 139.A O no hydrogen 2.894 N/A ALA 144.A N ALA 140.A O no hydrogen 2.955 N/A GLU 145.A N ARG 141.A O no hydrogen 2.820 N/A VAL 146.A N SER 142.A O no hydrogen 2.750 N/A GLY 147.A N SER 142.A O no hydrogen 3.223 N/A GLY 147.A N LEU 143.A O no hydrogen 3.046 N/A GLY 149.A N VAL 107.A O no hydrogen 3.021 N/A CYS 151.A N LYS 109.A O no hydrogen 2.769 N/A ALA 153.A N GLY 111.A O no hydrogen 2.962 N/A ARG 155.A N PHE 152.A O no hydrogen 3.020 N/A ARG 155.A NH1 ASP 133.A OD1 no hydrogen 2.852 N/A PHE 156.A N PHE 152.A O no hydrogen 2.973 N/A HIS 157.A N ALA 153.A O no hydrogen 2.678 N/A HIS 157.A NE2 THR 183.A O no hydrogen 2.926 N/A TYR 160.A N HIS 157.A O no hydrogen 3.023 N/A ARG 161.A N PRO 158.A O no hydrogen 3.410 N/A ALA 164.A N TYR 160.A O no hydrogen 2.962 N/A ALA 165.A N ARG 161.A O no hydrogen 3.079 N/A VAL 166.A N HIS 162.A O no hydrogen 3.141 N/A ARG 167.A N ALA 163.A O no hydrogen 2.910 N/A ARG 168.A N ALA 164.A O no hydrogen 3.174 N/A GLU 169.A N ALA 165.A O no hydrogen 3.034 N/A ILE 170.A N VAL 166.A O no hydrogen 2.981 N/A GLY 171.A N ARG 167.A O no hydrogen 2.947 N/A THR 174.A N ASN 177.A OD1 no hydrogen 2.814 N/A VAL 175.A N THR 47.A OG1 no hydrogen 2.757 N/A PHE 176.A N THR 174.A OG1 no hydrogen 3.079 N/A ASN 177.A N THR 174.A O no hydrogen 2.774 N/A LEU 178.A N VAL 175.A O no hydrogen 2.942 N/A LEU 179.A N PHE 176.A O no hydrogen 3.192 N/A LEU 182.A N LEU 179.A O no hydrogen 2.956 N/A THR 183.A N GLY 180.A O no hydrogen 3.266 N/A THR 183.A OG1 LEU 179.A O no hydrogen 2.728 N/A THR 183.A OG1 GLY 180.A O no hydrogen 3.505 N/A ASN 184.A ND2 ASP 81.A OD2 no hydrogen 3.150 N/A ASN 184.A ND2 VAL 108.A O no hydrogen 2.906 N/A ALA 186.A N ASN 184.A OD1 no hydrogen 2.842 N/A ARG 187.A N ASN 184.A O no hydrogen 2.947 N/A ARG 187.A NH2 LEU 64.A O no hydrogen 3.477 N/A ARG 189.A NH1 ASP 77.A O no hydrogen 2.883 N/A GLY 191.A N SER 214.A O no hydrogen 3.116 N/A LEU 192.A N ASP 81.A O no hydrogen 3.011 N/A ILE 193.A N LEU 216.A O no hydrogen 2.817 N/A GLY 194.A N VAL 83.A O no hydrogen 2.863 N/A CYS 195.A N VAL 218.A O no hydrogen 2.986 N/A CYS 195.A SG PHE 197.A O no hydrogen 3.339 N/A ALA 196.A N THR 85.A OG1 no hydrogen 3.105 N/A LEU 200.A N PHE 197.A O no hydrogen 2.947 N/A ALA 201.A N PHE 197.A O no hydrogen 3.171 N/A MET 204.A N LEU 200.A O no hydrogen 2.973 N/A ALA 205.A N ALA 201.A O no hydrogen 2.865 N/A GLY 206.A N GLU 202.A O no hydrogen 3.053 N/A VAL 207.A N VAL 203.A O no hydrogen 3.168 N/A PHE 208.A N MET 204.A O no hydrogen 3.117 N/A ALA 209.A N ALA 205.A O no hydrogen 2.846 N/A ALA 210.A N GLY 206.A O no hydrogen 3.135 N/A ARG 211.A N VAL 207.A O no hydrogen 3.315 N/A ARG 211.A NH1 LEU 182.A O no hydrogen 3.131 N/A ARG 211.A NH2 LEU 182.A O no hydrogen 2.711 N/A ARG 212.A N ALA 209.A O no hydrogen 2.997 N/A SER 213.A N PHE 208.A O no hydrogen 3.100 N/A SER 214.A N ARG 189.A O no hydrogen 2.768 N/A SER 214.A OG ALA 300.A O no hydrogen 2.570 N/A VAL 215.A N VAL 238.A O no hydrogen 3.009 N/A LEU 216.A N GLY 191.A O no hydrogen 3.050 N/A VAL 217.A N TRP 236.A O no hydrogen 2.949 N/A VAL 218.A N ILE 193.A O no hydrogen 2.769 N/A HIS 219.A N THR 234.A O no hydrogen 2.899 N/A HIS 219.A ND1 CYS 195.A O no hydrogen 2.737 N/A GLY 220.A N LEU 224.A O no hydrogen 2.959 N/A ASP 221.A N THR 232.A O no hydrogen 2.906 N/A GLY 223.A N GLY 220.A O no hydrogen 2.819 N/A LEU 224.A N ASP 222.A OD1 no hydrogen 3.297 N/A LEU 227.A N ASN 293.A OD1 no hydrogen 2.926 N/A THR 228.A N SER 233.A OG no hydrogen 3.182 N/A THR 228.A OG1 ASP 222.A OD2 no hydrogen 2.765 N/A THR 228.A OG1 THR 230.A OG1 no hydrogen 3.279 N/A THR 230.A N THR 228.A OG1 no hydrogen 3.045 N/A THR 230.A OG1 ASP 222.A OD2 no hydrogen 2.621 N/A THR 230.A OG1 THR 228.A OG1 no hydrogen 3.279 N/A THR 232.A N THR 231.A OG1 no hydrogen 2.715 N/A THR 232.A OG1 ASP 221.A OD2 no hydrogen 2.548 N/A SER 233.A N PHE 248.A O no hydrogen 2.931 N/A THR 234.A N HIS 219.A O no hydrogen 2.800 N/A THR 234.A OG1 ASP 221.A OD1 no hydrogen 2.830 N/A ILE 235.A N LEU 246.A O no hydrogen 2.862 N/A TRP 236.A N VAL 217.A O no hydrogen 2.686 N/A ARG 237.A N ASP 244.A O no hydrogen 2.920 N/A VAL 238.A N VAL 215.A O no hydrogen 2.788 N/A ALA 239.A N SER 242.A O no hydrogen 3.103 N/A SER 242.A N ALA 239.A O no hydrogen 2.974 N/A SER 242.A OG ALA 239.A O no hydrogen 2.986 N/A ASP 244.A N ARG 237.A O no hydrogen 3.051 N/A LEU 246.A N ILE 235.A O no hydrogen 2.776 N/A PHE 248.A N SER 233.A O no hydrogen 2.777 N/A ALA 251.A N ASP 249.A OD1 no hydrogen 2.799 N/A GLY 252.A N ASP 249.A O no hydrogen 3.183 N/A PHE 253.A N PRO 250.A O no hydrogen 2.948 N/A GLY 254.A N ALA 251.A O no hydrogen 2.734 N/A PHE 255.A N PRO 250.A O no hydrogen 3.362 N/A ARG 257.A NH1 ASP 249.A OD1 no hydrogen 2.937 N/A ARG 257.A NH2 ASP 249.A OD1 no hydrogen 3.428 N/A ARG 257.A NH2 ASP 249.A OD2 no hydrogen 2.858 N/A ALA 258.A N THR 229.A O no hydrogen 3.149 N/A GLN 259.A N GLN 262.A OE1 no hydrogen 2.877 N/A GLN 262.A N GLN 259.A O no hydrogen 3.148 N/A LEU 263.A N LEU 260.A O no hydrogen 2.906 N/A GLY 265.A N ASN 88.A O no hydrogen 2.553 N/A GLY 266.A N ASN 271.A OD1 no hydrogen 3.072 N/A ASN 271.A N ASP 267.A O no hydrogen 2.861 N/A ASN 271.A ND2 THR 124.A OG1 no hydrogen 3.168 N/A ALA 272.A N ALA 268.A O no hydrogen 2.823 N/A ALA 273.A N GLN 269.A O no hydrogen 3.169 N/A ALA 274.A N ALA 270.A O no hydrogen 2.988 N/A VAL 275.A N ASN 271.A O no hydrogen 2.936 N/A ARG 276.A N ALA 272.A O no hydrogen 3.112 N/A ALA 277.A N ALA 273.A O no hydrogen 3.063 N/A VAL 278.A N ALA 274.A O no hydrogen 2.876 N/A LEU 279.A N VAL 275.A O no hydrogen 2.837 N/A GLY 280.A N ARG 276.A O no hydrogen 2.990 N/A GLY 281.A N VAL 278.A O no hydrogen 3.027 N/A ALA 282.A N ALA 277.A O no hydrogen 2.914 N/A ARG 287.A NH1 ASP 326.A OD1 no hydrogen 3.190 N/A ARG 287.A NH2 ASP 326.A OD1 no hydrogen 2.843 N/A ARG 287.A NH2 ASP 326.A OD2 no hydrogen 3.272 N/A ASP 288.A N GLY 284.A O no hydrogen 3.123 N/A ALA 289.A N PRO 285.A O no hydrogen 3.157 N/A VAL 290.A N VAL 286.A O no hydrogen 2.991 N/A VAL 291.A N ARG 287.A O no hydrogen 2.856 N/A LEU 292.A N ASP 288.A O no hydrogen 2.873 N/A ASN 293.A N ALA 289.A O no hydrogen 2.975 N/A ASN 293.A ND2 LEU 227.A O no hydrogen 3.011 N/A ASN 293.A ND2 ALA 289.A O no hydrogen 2.765 N/A ALA 294.A N VAL 290.A O no hydrogen 2.882 N/A ALA 295.A N VAL 291.A O no hydrogen 2.933 N/A GLY 296.A N LEU 292.A O no hydrogen 2.952 N/A ALA 297.A N ASN 293.A O no hydrogen 3.095 N/A ILE 298.A N ALA 294.A O no hydrogen 3.015 N/A VAL 299.A N ALA 295.A O no hydrogen 2.827 N/A ALA 300.A N GLY 296.A O no hydrogen 3.020 N/A HIS 301.A N ALA 297.A O no hydrogen 2.993 N/A HIS 301.A NE2 ASP 78.A OD2 no hydrogen 2.712 N/A ALA 302.A N ILE 298.A O no hydrogen 2.942 N/A GLY 303.A N VAL 299.A O no hydrogen 2.953 N/A LEU 304.A N HIS 301.A O no hydrogen 3.119 N/A SER 305.A N ALA 302.A O no hydrogen 2.954 N/A ALA 313.A N GLU 309.A O no hydrogen 2.873 N/A TRP 314.A N TRP 310.A O no hydrogen 2.997 N/A GLU 315.A N LEU 311.A O no hydrogen 3.040 N/A GLU 316.A N PRO 312.A O no hydrogen 3.067 N/A GLY 317.A N ALA 313.A O no hydrogen 2.916 N/A LEU 318.A N TRP 314.A O no hydrogen 2.849 N/A ARG 319.A N GLU 315.A O no hydrogen 3.075 N/A ARG 320.A N GLU 316.A O no hydrogen 2.859 N/A ARG 320.A NH1 GLU 316.A OE1 no hydrogen 2.974 N/A ARG 320.A NH2 ALA 103.A O no hydrogen 3.187 N/A ALA 321.A N GLY 317.A O no hydrogen 2.891 N/A SER 322.A N LEU 318.A O no hydrogen 3.001 N/A SER 322.A OG LEU 318.A O no hydrogen 2.929 N/A ALA 323.A N ARG 319.A O no hydrogen 2.936 N/A ALA 324.A N ARG 320.A O no hydrogen 2.977 N/A ILE 325.A N ALA 321.A O no hydrogen 3.226 N/A ASP 326.A N SER 322.A O no hydrogen 2.793 N/A THR 327.A N ALA 323.A O no hydrogen 2.935 N/A THR 327.A OG1 ALA 323.A O no hydrogen 2.764 N/A GLY 328.A N ILE 325.A O no hydrogen 2.928 N/A ALA 329.A N THR 327.A OG1 no hydrogen 3.245 N/A ALA 330.A N ALA 324.A O no hydrogen 2.854 N/A GLN 332.A N GLY 328.A O no hydrogen 2.900 N/A LEU 333.A N ALA 329.A O no hydrogen 2.842 N/A LEU 334.A N ALA 330.A O no hydrogen 3.120 N/A ALA 335.A N GLU 331.A O no hydrogen 3.102 N/A ARG 336.A N GLN 332.A O no hydrogen 2.808 N/A TRP 337.A N LEU 333.A O no hydrogen 2.754 N/A VAL 338.A N LEU 334.A O no hydrogen 2.873 N/A ARG 339.A N ALA 335.A O no hydrogen 2.962 N/A PHE 340.A N ARG 336.A O no hydrogen 2.967 N/A GLY 341.A N TRP 337.A O no hydrogen 3.407 N/A ARG 342.A N VAL 338.A O no hydrogen 3.310 N/A GLN 343.A N ARG 339.A O no hydrogen 3.134 N/A GLN 343.A N PHE 340.A O no hydrogen 3.273 N/A