Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5etc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A NE2 ILE 349.A O no hydrogen 3.506 N/A ARG 8.A NH2 PRO 95.A O no hydrogen 2.852 N/A TYR 12.A N VAL 23.A O no hydrogen 2.928 N/A TYR 12.A OH TYR 27.A O no hydrogen 2.741 N/A ARG 13.A NH1 GLU 22.A OE2 no hydrogen 3.352 N/A GLN 14.A N TRP 21.A O no hydrogen 3.051 N/A LEU 16.A N THR 19.A O no hydrogen 2.671 N/A THR 19.A OG1 ILE 20.A O no hydrogen 3.448 N/A TRP 21.A N GLN 14.A O no hydrogen 2.799 N/A GLU 22.A N TYR 106.A OH no hydrogen 3.142 N/A VAL 23.A N TYR 12.A O no hydrogen 3.281 N/A GLU 25.A N THR 10.A O no hydrogen 2.933 N/A ARG 26.A NE ASP 46.A OD1 no hydrogen 2.889 N/A ARG 26.A NH2 ASP 46.A OD2 no hydrogen 3.386 N/A TYR 27.A N PRO 24.A O no hydrogen 2.978 N/A TYR 27.A OH ASP 91.A OD2 no hydrogen 2.648 N/A GLN 28.A N PHE 45.A O no hydrogen 2.897 N/A GLN 28.A NE2 GLU 25.A O no hydrogen 2.757 N/A SER 31.A N ALA 43.A O no hydrogen 2.992 N/A VAL 33.A N VAL 41.A O no hydrogen 3.084 N/A SER 35.A OG GLY 39.A O no hydrogen 2.963 N/A ALA 37.A N SER 35.A OG no hydrogen 3.195 N/A TYR 38.A OH THR 71.A OG1 no hydrogen 2.296 N/A VAL 41.A N GLY 34.A O no hydrogen 3.207 N/A CYS 42.A N VAL 55.A O no hydrogen 2.887 N/A ALA 43.A N SER 31.A O no hydrogen 2.879 N/A ALA 44.A N VAL 53.A O no hydrogen 2.991 N/A PHE 45.A N GLN 28.A O no hydrogen 2.856 N/A ASP 46.A N LEU 51.A O no hydrogen 2.848 N/A THR 47.A N ARG 26.A O no hydrogen 3.168 N/A THR 47.A OG1 ARG 26.A O no hydrogen 2.821 N/A LYS 48.A N ASP 46.A OD1 no hydrogen 3.212 N/A THR 49.A N ASP 46.A O no hydrogen 3.072 N/A THR 49.A OG1 ASP 46.A O no hydrogen 3.513 N/A THR 49.A OG1 ASP 46.A OD2 no hydrogen 2.540 N/A GLY 50.A N ASP 46.A O no hydrogen 2.756 N/A VAL 53.A N ALA 44.A O no hydrogen 2.858 N/A ALA 54.A N THR 109.A O no hydrogen 2.762 N/A VAL 55.A N CYS 42.A O no hydrogen 2.851 N/A LYS 56.A N LEU 107.A O no hydrogen 2.768 N/A LYS 57.A N SER 40.A O no hydrogen 3.040 N/A LYS 57.A NZ ILE 20.A O no hydrogen 3.221 N/A LYS 57.A NZ ASP 104.A OD2 no hydrogen 3.294 N/A LEU 58.A N VAL 105.A O no hydrogen 2.985 N/A SER 59.A N TYR 38.A O no hydrogen 2.737 N/A SER 64.A OG HIS 67.A ND1 no hydrogen 2.914 N/A HIS 67.A N SER 64.A OG no hydrogen 3.253 N/A HIS 67.A ND1 SER 64.A OG no hydrogen 2.914 N/A ALA 68.A N SER 64.A O no hydrogen 2.798 N/A LYS 69.A N ILE 65.A O no hydrogen 2.994 N/A LYS 69.A NZ GLU 331.A O no hydrogen 3.045 N/A ARG 70.A N ILE 66.A O no hydrogen 2.955 N/A THR 71.A N HIS 67.A O no hydrogen 2.933 N/A THR 71.A OG1 TYR 38.A OH no hydrogen 2.296 N/A THR 71.A OG1 PRO 61.A O no hydrogen 2.740 N/A THR 71.A OG1 HIS 67.A O no hydrogen 3.036 N/A TYR 72.A N ALA 68.A O no hydrogen 3.224 N/A ARG 73.A N LYS 69.A O no hydrogen 2.792 N/A ARG 73.A NE GLU 331.A OE1 no hydrogen 3.315 N/A ARG 73.A NE GLU 331.A OE2 no hydrogen 2.764 N/A ARG 73.A NH2 GLU 331.A OE1 no hydrogen 2.855 N/A GLU 74.A N ARG 70.A O no hydrogen 2.853 N/A LEU 75.A N THR 71.A O no hydrogen 3.036 N/A ARG 76.A N TYR 72.A O no hydrogen 2.985 N/A ARG 76.A NH1 TYR 72.A OH no hydrogen 3.207 N/A ARG 76.A NH2 ASP 327.A O no hydrogen 2.921 N/A LEU 77.A N ARG 73.A O no hydrogen 3.097 N/A LEU 78.A N GLU 74.A O no hydrogen 3.036 N/A LYS 79.A N LEU 75.A O no hydrogen 3.051 N/A LYS 79.A NZ GLU 347.A O no hydrogen 2.889 N/A LYS 79.A NZ GLU 347.A OE1 no hydrogen 2.710 N/A HIS 80.A N LEU 77.A O no hydrogen 2.866 N/A MET 81.A N LEU 77.A O no hydrogen 3.308 N/A LYS 82.A N TYR 143.A OH no hydrogen 2.839 N/A ASN 85.A N HIS 83.A ND1 no hydrogen 3.020 N/A ASN 85.A ND2 GLN 136.A OE1 no hydrogen 3.537 N/A ASN 85.A ND2 LEU 167.A O no hydrogen 2.972 N/A VAL 86.A N HIS 83.A O no hydrogen 3.261 N/A ILE 87.A N ILE 169.A O no hydrogen 2.958 N/A LEU 90.A N VAL 108.A O no hydrogen 2.932 N/A ASP 91.A N VAL 108.A O no hydrogen 3.428 N/A PHE 93.A N TYR 106.A O no hydrogen 3.267 N/A THR 94.A OG1 ASP 104.A O no hydrogen 3.231 N/A ALA 96.A N THR 94.A OG1 no hydrogen 3.064 N/A ARG 97.A N GLU 101.A OE1 no hydrogen 3.293 N/A SER 98.A OG GLU 101.A OE2 no hydrogen 3.183 N/A GLU 100.A N SER 98.A OG no hydrogen 3.146 N/A GLU 101.A N SER 98.A O no hydrogen 3.133 N/A PHE 102.A N LEU 99.A O no hydrogen 3.289 N/A TYR 106.A N PHE 93.A O no hydrogen 3.070 N/A LEU 107.A N LYS 56.A O no hydrogen 2.734 N/A VAL 108.A N ASP 91.A O no hydrogen 2.891 N/A THR 109.A N ALA 54.A O no hydrogen 3.042 N/A LEU 111.A N ARG 52.A O no hydrogen 3.082 N/A ASP 115.A N ASN 118.A OD1 no hydrogen 3.147 N/A LEU 116.A N PRO 156.A O no hydrogen 3.328 N/A ASN 118.A N ASP 115.A OD1 no hydrogen 2.965 N/A ILE 119.A N ASP 115.A O no hydrogen 3.103 N/A VAL 120.A N LEU 116.A O no hydrogen 2.955 N/A LYS 121.A N ASN 117.A O no hydrogen 2.982 N/A CYS 122.A N ILE 119.A O no hydrogen 3.265 N/A CYS 122.A SG ASN 118.A O no hydrogen 3.285 N/A THR 126.A N HIS 129.A ND1 no hydrogen 3.432 N/A HIS 129.A N THR 126.A OG1 no hydrogen 2.896 N/A VAL 130.A N THR 126.A O no hydrogen 3.103 N/A GLN 131.A N ASP 127.A O no hydrogen 2.799 N/A PHE 132.A N ASP 128.A O no hydrogen 3.097 N/A LEU 133.A N HIS 129.A O no hydrogen 2.980 N/A ILE 134.A N VAL 130.A O no hydrogen 3.034 N/A TYR 135.A N GLN 131.A O no hydrogen 2.972 N/A TYR 135.A OH GLU 320.A OE2 no hydrogen 2.740 N/A GLN 136.A N PHE 132.A O no hydrogen 3.118 N/A GLN 136.A NE2 PHE 132.A O no hydrogen 2.894 N/A GLN 136.A NE2 CYS 165.A O no hydrogen 2.880 N/A ILE 137.A N LEU 133.A O no hydrogen 3.110 N/A LEU 138.A N ILE 134.A O no hydrogen 2.927 N/A ARG 139.A N TYR 135.A O no hydrogen 2.773 N/A ARG 139.A NE ASN 85.A OD1 no hydrogen 2.964 N/A ARG 139.A NH1 ASP 319.A O no hydrogen 2.398 N/A GLY 140.A N GLN 136.A O no hydrogen 2.962 N/A LEU 141.A N ILE 137.A O no hydrogen 2.929 N/A LYS 142.A N LEU 138.A O no hydrogen 2.891 N/A LYS 142.A NZ GLU 320.A O no hydrogen 3.178 N/A TYR 143.A N ARG 139.A O no hydrogen 3.395 N/A TYR 143.A OH HIS 80.A O no hydrogen 3.372 N/A ILE 144.A N GLY 140.A O no hydrogen 2.899 N/A HIS 145.A N LEU 141.A O no hydrogen 2.787 N/A HIS 145.A NE2 ASP 208.A OD2 no hydrogen 3.008 N/A SER 146.A N LYS 142.A O no hydrogen 2.944 N/A SER 146.A OG LYS 142.A O no hydrogen 2.760 N/A ALA 147.A N ILE 144.A O no hydrogen 3.236 N/A ASP 148.A N HIS 145.A O no hydrogen 2.813 N/A ILE 149.A N ILE 144.A O no hydrogen 3.261 N/A HIS 151.A N ASP 208.A OD2 no hydrogen 3.038 N/A HIS 151.A NE2 LEU 170.A O no hydrogen 2.904 N/A ARG 152.A N ASP 208.A OD1 no hydrogen 2.900 N/A ASP 153.A N HIS 151.A ND1 no hydrogen 3.059 N/A ASN 158.A N LYS 155.A O no hydrogen 2.980 N/A ASN 158.A ND2 ASP 153.A O no hydrogen 2.788 N/A ASN 158.A ND2 ASP 153.A OD2 no hydrogen 3.379 N/A LEU 159.A N PRO 156.A O no hydrogen 3.070 N/A ALA 160.A N LYS 168.A O no hydrogen 2.948 N/A VAL 161.A N ALA 114.A O no hydrogen 2.698 N/A ASN 162.A N GLU 166.A O no hydrogen 2.974 N/A ASN 162.A ND2 GLU 166.A OE1 no hydrogen 2.767 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.617 N/A ASP 164.A N ASN 162.A OD1 no hydrogen 2.789 N/A CYS 165.A N ASN 162.A O no hydrogen 2.841 N/A GLU 166.A N ASN 162.A OD1 no hydrogen 2.957 N/A LEU 167.A N GLN 136.A OE1 no hydrogen 2.885 N/A LYS 168.A N ALA 160.A O no hydrogen 2.980 N/A ILE 169.A N ASN 85.A O no hydrogen 2.897 N/A LEU 170.A N ASN 158.A O no hydrogen 2.917 N/A HIS 177.A NE2 ASP 153.A OD2 no hydrogen 3.204 N/A THR 178.A N GLU 181.A OE1 no hydrogen 2.755 N/A GLU 181.A N THR 178.A OG1 no hydrogen 3.301 N/A MET 182.A N THR 178.A O no hydrogen 3.276 N/A MET 182.A N ASP 179.A O no hydrogen 3.077 N/A THR 183.A N ASP 180.A O no hydrogen 3.268 N/A THR 183.A OG1 ASP 179.A O no hydrogen 2.722 N/A THR 188.A OG1 GLU 181.A O no hydrogen 2.687 N/A ARG 189.A N VAL 186.A O no hydrogen 3.243 N/A ARG 189.A NE GLN 234.A OE1 no hydrogen 2.872 N/A ARG 189.A NH1 MET 182.A O no hydrogen 2.755 N/A ARG 189.A NH1 GLY 184.A O no hydrogen 2.759 N/A ARG 189.A NH2 GLY 184.A O no hydrogen 3.039 N/A ARG 189.A NH2 GLN 234.A OE1 no hydrogen 3.005 N/A TRP 190.A NE1 GLY 228.A O no hydrogen 2.953 N/A TYR 191.A OH GLU 218.A OE1 no hydrogen 2.610 N/A TYR 191.A OH GLU 218.A OE2 no hydrogen 3.319 N/A ARG 192.A N ARG 189.A O no hydrogen 3.093 N/A ARG 192.A NH2 ASP 153.A OD1 no hydrogen 3.308 N/A ILE 196.A N ALA 193.A O no hydrogen 3.115 N/A MET 197.A N ALA 193.A O no hydrogen 3.168 N/A LEU 198.A N PRO 194.A O no hydrogen 3.200 N/A TRP 200.A N GLU 195.A O no hydrogen 2.834 N/A THR 206.A N ASN 204.A OD1 no hydrogen 3.471 N/A THR 206.A OG1 ASN 204.A OD1 no hydrogen 2.965 N/A VAL 207.A N ASN 204.A O no hydrogen 2.951 N/A ASP 208.A N GLN 205.A O no hydrogen 3.050 N/A ILE 209.A N THR 206.A O no hydrogen 3.080 N/A SER 211.A N VAL 207.A O no hydrogen 3.327 N/A SER 211.A OG TYR 191.A O no hydrogen 3.044 N/A SER 211.A OG VAL 207.A O no hydrogen 3.196 N/A VAL 212.A N ASP 208.A O no hydrogen 2.980 N/A GLY 213.A N ILE 209.A O no hydrogen 2.916 N/A CYS 214.A N TRP 210.A O no hydrogen 3.027 N/A CYS 214.A SG TRP 210.A O no hydrogen 3.459 N/A ILE 215.A N SER 211.A O no hydrogen 2.947 N/A MET 216.A N VAL 212.A O no hydrogen 2.840 N/A ALA 217.A N GLY 213.A O no hydrogen 3.034 N/A GLU 218.A N CYS 214.A O no hydrogen 3.122 N/A LEU 219.A N ILE 215.A O no hydrogen 2.956 N/A LEU 220.A N MET 216.A O no hydrogen 3.144 N/A LEU 220.A N ALA 217.A O no hydrogen 3.157 N/A THR 221.A N ALA 217.A O no hydrogen 2.893 N/A THR 221.A OG1 ALA 217.A O no hydrogen 2.991 N/A GLY 222.A N GLU 218.A O no hydrogen 2.685 N/A ARG 223.A N THR 221.A OG1 no hydrogen 3.020 N/A GLY 228.A N PHE 226.A O no hydrogen 2.869 N/A THR 229.A N ASP 233.A OD2 no hydrogen 2.900 N/A THR 229.A OG1 ASP 233.A OD2 no hydrogen 3.135 N/A ASP 233.A N ASP 230.A OD1 no hydrogen 2.780 N/A GLN 234.A N ASP 230.A O no hydrogen 2.878 N/A GLN 234.A NE2 ARG 189.A O no hydrogen 2.809 N/A LEU 235.A N HIS 231.A O no hydrogen 3.045 N/A LYS 236.A N ILE 232.A O no hydrogen 2.995 N/A LEU 237.A N ASP 233.A O no hydrogen 3.041 N/A ILE 238.A N GLN 234.A O no hydrogen 3.035 N/A LEU 239.A N LEU 235.A O no hydrogen 2.906 N/A ARG 240.A N LYS 236.A O no hydrogen 2.981 N/A VAL 242.A N ILE 238.A O no hydrogen 2.796 N/A GLY 243.A N LEU 239.A O no hydrogen 2.651 N/A THR 244.A N MET 268.A O no hydrogen 3.179 N/A THR 244.A OG1 MET 268.A O no hydrogen 3.188 N/A LEU 250.A N GLY 246.A O no hydrogen 3.353 N/A LYS 251.A N ALA 247.A O no hydrogen 3.390 N/A LYS 252.A N LEU 249.A O no hydrogen 2.947 N/A LYS 252.A NZ ASP 295.A OD1 no hydrogen 3.529 N/A LYS 252.A NZ ASP 295.A OD2 no hydrogen 2.784 N/A ILE 253.A N LEU 250.A O no hydrogen 3.086 N/A SER 255.A OG SER 257.A OG no hydrogen 2.993 N/A SER 257.A OG SER 255.A OG no hydrogen 2.993 N/A ALA 258.A N SER 255.A OG no hydrogen 3.243 N/A ARG 259.A N SER 255.A O no hydrogen 3.407 N/A ARG 259.A NH1 ILE 253.A O no hydrogen 3.116 N/A ASN 260.A N GLU 256.A O no hydrogen 2.960 N/A ASN 260.A ND2 GLU 256.A O no hydrogen 3.048 N/A TYR 261.A N SER 257.A O no hydrogen 2.858 N/A ILE 262.A N ALA 258.A O no hydrogen 2.808 N/A GLN 263.A N ARG 259.A O no hydrogen 3.125 N/A SER 264.A N TYR 261.A O no hydrogen 2.816 N/A SER 264.A OG TYR 261.A O no hydrogen 2.401 N/A LEU 265.A N ILE 262.A O no hydrogen 2.890 N/A MET 268.A N THR 244.A OG1 no hydrogen 2.799 N/A MET 271.A N LEU 241.A O no hydrogen 3.022 N/A ALA 274.A N ASN 272.A OD1 no hydrogen 2.864 N/A ASN 275.A N ASN 272.A O no hydrogen 2.980 N/A VAL 276.A N ASN 272.A O no hydrogen 3.217 N/A VAL 276.A N PHE 273.A O no hydrogen 2.953 N/A PHE 277.A N PHE 273.A O no hydrogen 2.799 N/A ALA 280.A N PHE 277.A O no hydrogen 3.137 N/A ASN 281.A ND2 ASP 127.A OD2 no hydrogen 3.099 N/A LEU 283.A N ASN 281.A OD1 no hydrogen 3.015 N/A ALA 284.A N ASN 281.A O no hydrogen 2.845 N/A VAL 285.A N ASN 281.A O no hydrogen 3.139 N/A ASP 286.A N PRO 282.A O no hydrogen 3.147 N/A LEU 287.A N LEU 283.A O no hydrogen 3.069 N/A LEU 288.A N ALA 284.A O no hydrogen 2.882 N/A GLU 289.A N VAL 285.A O no hydrogen 3.060 N/A LYS 290.A N ASP 286.A O no hydrogen 3.204 N/A LYS 290.A N LEU 287.A O no hydrogen 2.786 N/A LYS 290.A NZ ASP 286.A OD1 no hydrogen 3.417 N/A LYS 290.A NZ ASP 286.A OD2 no hydrogen 2.512 N/A MET 291.A N LEU 287.A O no hydrogen 2.930 N/A MET 291.A N LEU 288.A O no hydrogen 2.912 N/A LEU 292.A N LEU 288.A O no hydrogen 2.782 N/A ASP 297.A N ASP 295.A OD1 no hydrogen 3.006 N/A LYS 298.A N ASP 295.A O no hydrogen 3.180 N/A LYS 298.A NZ GLU 248.A OE1 no hydrogen 2.980 N/A ARG 299.A N SER 296.A O no hydrogen 3.259 N/A ARG 299.A NE VAL 293.A O no hydrogen 2.780 N/A ARG 299.A NH1 GLU 195.A OE1 no hydrogen 2.853 N/A ARG 299.A NH1 GLU 195.A OE2 no hydrogen 3.123 N/A ARG 299.A NH1 THR 206.A O no hydrogen 3.410 N/A ARG 299.A NH2 GLU 195.A OE2 no hydrogen 2.535 N/A ARG 299.A NH2 VAL 293.A O no hydrogen 3.155 N/A ILE 300.A N LYS 290.A O no hydrogen 3.083 N/A THR 301.A N GLN 304.A OE1 no hydrogen 3.140 N/A GLN 304.A N THR 301.A OG1 no hydrogen 3.366 N/A ALA 305.A N THR 301.A O no hydrogen 2.865 N/A LEU 306.A N ALA 302.A O no hydrogen 2.971 N/A ALA 307.A N GLN 304.A O no hydrogen 2.974 N/A HIS 308.A N ALA 305.A O no hydrogen 3.012 N/A HIS 308.A NE2 ASP 286.A OD2 no hydrogen 2.881 N/A TYR 310.A N HIS 308.A ND1 no hydrogen 3.243 N/A TYR 310.A OH ASP 127.A OD1 no hydrogen 2.771 N/A PHE 311.A N HIS 308.A O no hydrogen 3.062 N/A ALA 312.A N ALA 309.A O no hydrogen 3.102 N/A TYR 314.A N PHE 311.A O no hydrogen 2.889 N/A TYR 314.A OH ASP 128.A OD1 no hydrogen 2.492 N/A HIS 315.A N PHE 311.A O no hydrogen 2.793 N/A HIS 315.A ND1 GLU 320.A OE2 no hydrogen 2.819 N/A ASP 316.A N GLU 320.A OE2 no hydrogen 3.276 N/A ASP 318.A N ASP 316.A OD1 no hydrogen 2.911 N/A ASP 319.A N ASP 316.A O no hydrogen 2.777 N/A GLN 328.A NE2 ASP 148.A O no hydrogen 3.231 N/A SER 329.A N ASP 327.A OD1 no hydrogen 2.858 N/A SER 329.A OG ASP 327.A OD1 no hydrogen 2.703 N/A GLU 331.A N GLN 328.A O no hydrogen 2.956 N/A SER 332.A N SER 329.A O no hydrogen 2.955 N/A SER 332.A OG SER 329.A O no hydrogen 3.309 N/A ARG 333.A N PHE 330.A O no hydrogen 3.018 N/A LEU 336.A N GLU 339.A OE1 no hydrogen 2.876 N/A GLU 339.A N LEU 336.A O no hydrogen 2.984 N/A TRP 340.A N LEU 336.A O no hydrogen 3.136 N/A LYS 341.A N ILE 337.A O no hydrogen 2.927 N/A LYS 341.A NZ PHE 102.A O no hydrogen 2.916 N/A SER 342.A N ASP 338.A O no hydrogen 3.113 N/A LEU 343.A N GLU 339.A O no hydrogen 3.128 N/A THR 344.A N TRP 340.A O no hydrogen 2.868 N/A THR 344.A OG1 TRP 340.A O no hydrogen 2.885 N/A TYR 345.A N LYS 341.A O no hydrogen 2.918 N/A ASP 346.A N SER 342.A O no hydrogen 2.880 N/A GLU 347.A N LEU 343.A O no hydrogen 3.130 N/A VAL 348.A N THR 344.A O no hydrogen 2.952 N/A ILE 349.A N TYR 345.A O no hydrogen 3.225 N/A SER 350.A OG ASP 346.A O no hydrogen 2.873 N/A SER 350.A OG GLU 347.A O no hydrogen 3.359 N/A PHE 351.A N VAL 348.A O no hydrogen 3.253 N/A