Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5fi1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLU 2.A OE1 no hydrogen 2.786 N/A ALA 6.A N GLU 2.A O no hydrogen 2.919 N/A ARG 7.A N PHE 3.A O no hydrogen 2.902 N/A GLU 8.A N ALA 4.A O no hydrogen 2.927 N/A SER 9.A N ALA 5.A O no hydrogen 2.916 N/A GLU 10.A N ALA 6.A O no hydrogen 2.921 N/A ARG 11.A N ARG 7.A O no hydrogen 2.919 N/A ARG 11.A NH2 GLU 8.A OE2 no hydrogen 2.957 N/A GLN 12.A N GLU 8.A O no hydrogen 2.971 N/A GLN 12.A NE2 GLU 8.A OE2 no hydrogen 2.561 N/A ARG 14.A N GLU 10.A O no hydrogen 2.977 N/A ARG 16.A N GLN 12.A O no hydrogen 2.979 N/A ARG 16.A NE SER 93.A O no hydrogen 3.112 N/A ARG 16.A NH2 HIS 95.A O no hydrogen 2.946 N/A ARG 16.A NH2 ASP 185.A OD2 no hydrogen 3.306 N/A LEU 17.A N LEU 13.A O no hydrogen 2.925 N/A CYS 18.A N ARG 14.A O no hydrogen 2.923 N/A CYS 18.A SG ARG 14.A O no hydrogen 3.302 N/A VAL 19.A N LEU 15.A O no hydrogen 2.928 N/A LEU 20.A N ARG 16.A O no hydrogen 2.972 N/A ASN 21.A N LEU 17.A O no hydrogen 2.937 N/A ASN 21.A ND2 LEU 17.A O no hydrogen 2.412 N/A GLU 22.A N CYS 18.A O no hydrogen 2.918 N/A ILE 23.A N VAL 19.A O no hydrogen 2.973 N/A LEU 24.A N LEU 20.A O no hydrogen 2.973 N/A GLY 25.A N ASN 21.A O no hydrogen 2.932 N/A THR 26.A N GLU 22.A O no hydrogen 2.933 N/A THR 26.A OG1 GLU 22.A O no hydrogen 2.545 N/A THR 26.A OG1 ILE 23.A O no hydrogen 2.917 N/A GLU 27.A N ILE 23.A O no hydrogen 2.964 N/A ARG 28.A N LEU 24.A O no hydrogen 2.945 N/A ARG 28.A NE GLU 84.A OE1 no hydrogen 2.664 N/A ARG 28.A NH2 GLU 84.A OE2 no hydrogen 2.741 N/A ASP 29.A N GLY 25.A O no hydrogen 2.904 N/A TYR 30.A N THR 26.A O no hydrogen 2.923 N/A TYR 30.A OH TYR 111.A OH no hydrogen 2.616 N/A VAL 31.A N GLU 27.A O no hydrogen 2.939 N/A GLY 32.A N ARG 28.A O no hydrogen 2.888 N/A THR 33.A N ASP 29.A O no hydrogen 2.902 N/A THR 33.A OG1 ASP 29.A O no hydrogen 2.974 N/A LEU 34.A N TYR 30.A O no hydrogen 2.991 N/A ARG 35.A N VAL 31.A O no hydrogen 2.903 N/A PHE 36.A N GLY 32.A O no hydrogen 2.903 N/A LEU 37.A N THR 33.A O no hydrogen 2.939 N/A GLN 38.A N LEU 34.A O no hydrogen 2.950 N/A SER 39.A N ARG 35.A O no hydrogen 2.906 N/A SER 39.A OG ARG 35.A O no hydrogen 3.047 N/A SER 39.A OG PHE 36.A O no hydrogen 3.434 N/A ALA 40.A N PHE 36.A O no hydrogen 2.906 N/A HIS 43.A N GLN 38.A O no hydrogen 3.035 N/A ILE 45.A N PHE 41.A O no hydrogen 3.031 N/A ARG 46.A N LEU 42.A O no hydrogen 2.929 N/A ARG 46.A NH2 GLU 70.A OE1 no hydrogen 2.886 N/A ARG 46.A NH2 GLU 70.A OE2 no hydrogen 2.756 N/A GLN 47.A N HIS 43.A O no hydrogen 2.918 N/A ASP 51.A N ASN 48.A OD1 no hydrogen 2.895 N/A SER 52.A OG VAL 49.A O no hydrogen 2.695 N/A VAL 53.A N VAL 49.A O no hydrogen 2.911 N/A GLU 54.A N ALA 50.A O no hydrogen 2.896 N/A LYS 55.A N ASP 51.A O no hydrogen 2.900 N/A GLY 56.A N VAL 53.A O no hydrogen 3.116 N/A LEU 57.A N SER 52.A O no hydrogen 2.621 N/A ASN 61.A N THR 58.A O no hydrogen 2.971 N/A VAL 62.A N THR 58.A O no hydrogen 3.357 N/A LYS 63.A N GLU 59.A O no hydrogen 2.901 N/A VAL 64.A N GLU 60.A O no hydrogen 2.921 N/A LEU 65.A N ASN 61.A O no hydrogen 2.855 N/A PHE 66.A N VAL 62.A O no hydrogen 2.951 N/A SER 67.A N LYS 63.A O no hydrogen 3.277 N/A SER 67.A OG ASN 68.A OD1 no hydrogen 3.121 N/A ASN 68.A ND2 VAL 110.A O no hydrogen 2.921 N/A ILE 69.A N PHE 66.A O no hydrogen 3.203 N/A ASP 71.A N ASN 68.A O no hydrogen 3.195 N/A ILE 72.A N ASN 68.A O no hydrogen 3.341 N/A LEU 73.A N ILE 69.A O no hydrogen 2.933 N/A GLU 74.A N GLU 70.A O no hydrogen 2.895 N/A VAL 75.A N ASP 71.A O no hydrogen 2.923 N/A HIS 76.A N ILE 72.A O no hydrogen 2.940 N/A HIS 76.A ND1 GLU 27.A OE2 no hydrogen 3.367 N/A LYS 77.A N LEU 73.A O no hydrogen 2.896 N/A PHE 79.A N VAL 75.A O no hydrogen 2.926 N/A LEU 80.A N HIS 76.A O no hydrogen 2.904 N/A ALA 81.A N LYS 77.A O no hydrogen 2.912 N/A ALA 82.A N ASP 78.A O no hydrogen 2.897 N/A LEU 83.A N PHE 79.A O no hydrogen 2.942 N/A GLU 84.A N LEU 80.A O no hydrogen 2.864 N/A TYR 85.A N ALA 81.A O no hydrogen 2.911 N/A CYS 86.A N ALA 82.A O no hydrogen 2.894 N/A CYS 86.A SG GLU 96.A O no hydrogen 3.162 N/A LEU 87.A N LEU 83.A O no hydrogen 2.839 N/A GLN 92.A N HIS 95.A ND1 no hydrogen 2.919 N/A GLN 92.A NE2 GLU 90.A O no hydrogen 3.455 N/A SER 93.A OG GLN 94.A OE1 no hydrogen 3.508 N/A GLN 94.A N GLN 94.A OE1 no hydrogen 2.537 N/A HIS 95.A N GLN 92.A O no hydrogen 3.218 N/A LEU 97.A N ASP 185.A OD2 no hydrogen 3.176 N/A GLY 98.A N ASP 185.A OD1 no hydrogen 3.369 N/A VAL 100.A N LEU 97.A O no hydrogen 2.600 N/A PHE 101.A N GLY 98.A O no hydrogen 3.223 N/A LEU 102.A N GLY 98.A O no hydrogen 2.934 N/A LYS 103.A N ASN 99.A O no hydrogen 2.885 N/A PHE 104.A N PHE 101.A O no hydrogen 3.279 N/A LYS 105.A N LEU 102.A O no hydrogen 3.445 N/A LYS 105.A NZ LEU 102.A O no hydrogen 3.552 N/A LYS 107.A N PHE 104.A O no hydrogen 3.233 N/A PHE 108.A N LYS 105.A O no hydrogen 2.935 N/A CYS 109.A SG ASP 106.A O no hydrogen 3.281 N/A TYR 111.A N PHE 108.A O no hydrogen 2.945 N/A TYR 111.A OH TYR 30.A OH no hydrogen 2.616 N/A TYR 111.A OH HIS 76.A NE2 no hydrogen 2.553 N/A GLU 112.A N CYS 109.A O no hydrogen 2.915 N/A TYR 114.A OH LEU 158.A O no hydrogen 2.549 N/A CYS 115.A N TYR 111.A O no hydrogen 3.121 N/A CYS 115.A SG TYR 111.A O no hydrogen 3.639 N/A SER 116.A OG GLU 112.A O no hydrogen 3.058 N/A ASN 117.A N GLU 113.A O no hydrogen 3.328 N/A ASN 117.A N TYR 114.A O no hydrogen 2.914 N/A HIS 118.A N TYR 114.A O no hydrogen 2.789 N/A HIS 118.A N CYS 115.A O no hydrogen 2.924 N/A LYS 120.A N ASN 117.A O no hydrogen 2.921 N/A ALA 121.A N ASN 117.A O no hydrogen 3.035 N/A LEU 122.A N HIS 118.A O no hydrogen 3.070 N/A ARG 123.A NE GLU 119.A OE1 no hydrogen 3.373 N/A LEU 124.A N LYS 120.A O no hydrogen 2.710 N/A LEU 125.A N ALA 121.A O no hydrogen 2.762 N/A VAL 126.A N LEU 122.A O no hydrogen 2.995 N/A GLU 127.A N LEU 124.A O no hydrogen 2.935 N/A LEU 128.A N LEU 124.A O no hydrogen 3.109 N/A ASN 129.A N LEU 125.A O no hydrogen 2.893 N/A LYS 130.A N GLU 127.A O no hydrogen 2.925 N/A ILE 131.A N LEU 128.A O no hydrogen 3.258 N/A THR 133.A OG1 LYS 55.A O no hydrogen 2.583 N/A ARG 135.A N ILE 131.A O no hydrogen 3.134 N/A ARG 135.A NE ASN 129.A O no hydrogen 2.842 N/A ALA 136.A N PRO 132.A O no hydrogen 2.919 N/A PHE 137.A N THR 133.A O no hydrogen 2.894 N/A LEU 138.A N VAL 134.A O no hydrogen 2.904 N/A LEU 139.A N ARG 135.A O no hydrogen 2.920 N/A SER 140.A N ALA 136.A O no hydrogen 2.885 N/A CYS 141.A N PHE 137.A O no hydrogen 2.931 N/A CYS 141.A SG PHE 137.A O no hydrogen 3.385 N/A LEU 143.A N LEU 139.A O no hydrogen 2.909 N/A LEU 144.A N SER 140.A O no hydrogen 2.902 N/A GLY 145.A N MET 142.A O no hydrogen 3.323 N/A GLY 146.A N LEU 143.A O no hydrogen 3.049 N/A ARG 147.A NH1 TYR 157.A OH no hydrogen 2.924 N/A LEU 158.A N LEU 154.A O no hydrogen 2.917 N/A LEU 159.A N GLU 155.A O no hydrogen 2.899 N/A SER 160.A OG TYR 157.A O no hydrogen 2.988 N/A ILE 162.A N LEU 159.A O no hydrogen 3.257 N/A GLN 163.A N SER 160.A O no hydrogen 3.195 N/A ARG 164.A N SER 160.A O no hydrogen 2.903 N/A ARG 164.A NE GLU 27.A OE1 no hydrogen 3.151 N/A ARG 164.A NE TYR 168.A OH no hydrogen 3.178 N/A ARG 164.A NH2 THR 26.A OG1 no hydrogen 3.235 N/A ARG 164.A NH2 GLU 27.A OE1 no hydrogen 2.975 N/A ILE 165.A N PRO 161.A O no hydrogen 2.929 N/A CYS 166.A SG ILE 162.A O no hydrogen 3.230 N/A LYS 167.A N ARG 164.A O no hydrogen 3.096 N/A TYR 168.A OH GLU 27.A OE1 no hydrogen 2.151 N/A LEU 171.A N LYS 167.A O no hydrogen 3.206 N/A LEU 172.A N TYR 168.A O no hydrogen 2.907 N/A LYS 173.A N PRO 169.A O no hydrogen 2.884 N/A LYS 173.A N LEU 170.A O no hydrogen 2.988 N/A GLU 174.A N LEU 170.A O no hydrogen 2.939 N/A LEU 175.A N LEU 171.A O no hydrogen 2.908 N/A ALA 176.A N LEU 172.A O no hydrogen 2.880 N/A LYS 177.A N LYS 173.A O no hydrogen 2.922 N/A ARG 178.A N GLU 174.A O no hydrogen 2.934 N/A ARG 178.A NE GLU 174.A OE1 no hydrogen 2.768 N/A ARG 178.A NH2 GLU 174.A OE1 no hydrogen 2.865 N/A THR 179.A OG1 LEU 175.A O no hydrogen 2.575 N/A HIS 183.A N PRO 180.A O no hydrogen 3.336 N/A HIS 183.A NE2 SER 93.A O no hydrogen 3.153 N/A ASP 185.A N HIS 183.A ND1 no hydrogen 3.126 N/A HIS 186.A N HIS 183.A O no hydrogen 3.188 N/A VAL 189.A N ASP 185.A O no hydrogen 2.870 N/A GLN 190.A N HIS 186.A O no hydrogen 2.991 N/A SER 191.A N PRO 187.A O no hydrogen 2.931 N/A ALA 192.A N ALA 188.A O no hydrogen 2.895 N/A LEU 193.A N VAL 189.A O no hydrogen 2.896 N/A GLN 194.A N GLN 190.A O no hydrogen 2.985 N/A GLN 194.A NE2 GLN 190.A O no hydrogen 3.192 N/A ALA 195.A N SER 191.A O no hydrogen 2.933 N/A MET 196.A N ALA 192.A O no hydrogen 2.899 N/A LYS 197.A N LEU 193.A O no hydrogen 2.933 N/A THR 198.A N GLN 194.A O no hydrogen 2.954 N/A THR 198.A OG1 GLN 194.A O no hydrogen 2.746 N/A VAL 199.A N ALA 195.A O no hydrogen 2.939 N/A CYS 200.A N MET 196.A O no hydrogen 3.480 N/A CYS 200.A SG ILE 165.A O no hydrogen 3.282 N/A CYS 200.A SG MET 196.A O no hydrogen 3.580 N/A SER 201.A N LYS 197.A O no hydrogen 2.982 N/A ASN 202.A N THR 198.A O no hydrogen 2.913 N/A ILE 203.A N VAL 199.A O no hydrogen 2.956 N/A ASN 204.A N CYS 200.A O no hydrogen 2.943 N/A GLU 205.A N SER 201.A O no hydrogen 2.952 N/A THR 206.A N ASN 202.A O no hydrogen 2.929 N/A THR 206.A OG1 GLU 112.A OE2 no hydrogen 3.150 N/A THR 206.A OG1 ASN 202.A O no hydrogen 2.501 N/A LYS 207.A N ILE 203.A O no hydrogen 2.973 N/A LYS 207.A NZ GLU 211.A OE2 no hydrogen 3.446 N/A ARG 208.A N ASN 204.A O no hydrogen 2.953 N/A GLN 209.A N GLU 205.A O no hydrogen 2.937 N/A MET 210.A N THR 206.A O no hydrogen 2.962 N/A GLU 211.A N LYS 207.A O no hydrogen 2.929 N/A LYS 212.A N ARG 208.A O no hydrogen 2.945 N/A LEU 213.A N GLN 209.A O no hydrogen 2.926 N/A GLU 214.A N MET 210.A O no hydrogen 2.930 N/A ALA 215.A N GLU 211.A O no hydrogen 2.906 N/A LEU 216.A N LYS 212.A O no hydrogen 2.988 N/A GLU 217.A N LEU 213.A O no hydrogen 2.934 N/A GLN 218.A N GLU 214.A O no hydrogen 2.916 N/A GLN 218.A NE2 HIS 222.A NE2 no hydrogen 3.437 N/A LEU 219.A N ALA 215.A O no hydrogen 2.933 N/A GLN 220.A N LEU 216.A O no hydrogen 2.941 N/A GLN 220.A NE2 ASN 230.A OD1 no hydrogen 3.292 N/A SER 221.A N GLU 217.A O no hydrogen 2.914 N/A SER 221.A OG GLU 217.A O no hydrogen 3.519 N/A SER 221.A OG GLN 218.A O no hydrogen 2.415 N/A HIS 222.A N GLN 218.A O no hydrogen 2.949 N/A HIS 222.A N LEU 219.A O no hydrogen 3.332 N/A ILE 223.A N GLN 220.A O no hydrogen 3.181 N/A GLU 224.A N TYR 273.A O no hydrogen 3.081 N/A TRP 226.A NE1 SER 229.A O no hydrogen 3.028 N/A LEU 231.A N GLN 220.A OE1 no hydrogen 2.492 N/A ASP 233.A N ASN 230.A O no hydrogen 3.240 N/A ILE 234.A N LEU 231.A O no hydrogen 3.260 N/A CYS 235.A N LEU 231.A O no hydrogen 2.687 N/A CYS 235.A SG ASP 261.A O no hydrogen 3.246 N/A THR 236.A N ASP 261.A OD1 no hydrogen 3.107 N/A THR 236.A OG1 ASP 261.A OD2 no hydrogen 2.819 N/A GLN 237.A N ASP 261.A OD1 no hydrogen 3.284 N/A LEU 239.A N LEU 259.A O no hydrogen 2.876 N/A LEU 240.A N LEU 259.A O no hydrogen 3.390 N/A GLY 242.A N PHE 257.A O no hydrogen 3.032 N/A LEU 244.A N ARG 255.A O no hydrogen 2.973 N/A LEU 245.A N MET 321.A O no hydrogen 2.902 N/A LYS 246.A N GLN 253.A O no hydrogen 2.675 N/A ILE 247.A N VAL 319.A O no hydrogen 2.876 N/A SER 248.A N ASN 251.A O no hydrogen 2.939 N/A ASN 251.A N SER 248.A O no hydrogen 2.779 N/A GLN 253.A N LYS 246.A O no hydrogen 2.917 N/A ARG 255.A N LEU 244.A O no hydrogen 2.869 N/A ARG 255.A NH1 GLU 254.A O no hydrogen 3.566 N/A ALA 256.A N CYS 267.A O no hydrogen 2.883 N/A PHE 257.A N GLY 242.A O no hydrogen 2.765 N/A PHE 258.A N VAL 265.A O no hydrogen 2.859 N/A LEU 259.A N LEU 240.A O no hydrogen 2.733 N/A PHE 260.A N LEU 263.A O no hydrogen 2.864 N/A ASN 262.A N GLU 338.A OE2 no hydrogen 2.884 N/A ASN 262.A ND2 ILE 234.A O no hydrogen 2.504 N/A LEU 263.A N PHE 260.A O no hydrogen 2.954 N/A LEU 264.A N ILE 279.A O no hydrogen 2.887 N/A VAL 265.A N PHE 258.A O no hydrogen 2.911 N/A TYR 266.A N GLY 277.A O no hydrogen 2.898 N/A CYS 267.A N ALA 256.A O no hydrogen 2.914 N/A LYS 268.A N ILE 274.A O no hydrogen 2.720 N/A LYS 270.A N LEU 272.A O no hydrogen 3.046 N/A LYS 270.A NZ SER 271.A O no hydrogen 3.277 N/A LEU 272.A N HIS 222.A O no hydrogen 3.132 N/A TYR 273.A N HIS 222.A O no hydrogen 3.333 N/A ILE 274.A N LYS 268.A O no hydrogen 2.794 N/A PHE 275.A N GLU 224.A O no hydrogen 2.942 N/A ARG 276.A N TYR 266.A O no hydrogen 3.041 N/A GLY 277.A N TYR 266.A O no hydrogen 2.925 N/A ARG 278.A NH1 GLU 227.A O no hydrogen 2.886 N/A ARG 278.A NH1 SER 229.A O no hydrogen 3.104 N/A ILE 279.A N LEU 264.A O no hydrogen 2.879 N/A THR 281.A N ASN 262.A O no hydrogen 2.829 N/A THR 281.A OG1 GLU 338.A OE1 no hydrogen 3.319 N/A THR 281.A OG1 GLU 338.A OE2 no hydrogen 3.009 N/A VAL 283.A N ASN 280.A O no hydrogen 2.980 N/A MET 284.A N THR 281.A O no hydrogen 3.283 N/A GLU 285.A N HIS 310.A O no hydrogen 2.913 N/A GLU 287.A N LYS 308.A O no hydrogen 2.893 N/A VAL 289.A N GLY 306.A O no hydrogen 3.301 N/A GLY 292.A N VAL 303.A O no hydrogen 2.501 N/A THR 293.A N GLU 290.A O no hydrogen 3.284 N/A THR 293.A OG1 GLU 290.A O no hydrogen 2.749 N/A SER 298.A N ASP 295.A O no hydrogen 3.188 N/A SER 298.A OG TYR 301.A O no hydrogen 2.898 N/A ASN 299.A N TYR 296.A O no hydrogen 3.117 N/A ASN 299.A ND2 GLY 250.A O no hydrogen 3.485 N/A GLY 300.A N ASP 295.A O no hydrogen 2.851 N/A TYR 301.A N SER 298.A O no hydrogen 2.930 N/A VAL 303.A N THR 293.A O no hydrogen 3.153 N/A ASN 305.A N ASP 291.A OD2 no hydrogen 2.834 N/A TRP 307.A N CYS 320.A O no hydrogen 2.901 N/A LYS 308.A N GLU 287.A O no hydrogen 2.906 N/A ILE 309.A N PHE 318.A O no hydrogen 2.864 N/A HIS 310.A N GLU 285.A O no hydrogen 2.899 N/A ASN 311.A N LYS 316.A O no hydrogen 2.867 N/A THR 312.A N VAL 283.A O no hydrogen 2.988 N/A THR 312.A OG1 VAL 283.A O no hydrogen 3.280 N/A LYS 314.A N ASN 311.A O no hydrogen 3.326 N/A ASN 315.A N THR 312.A O no hydrogen 3.192 N/A LYS 316.A N ASN 311.A O no hydrogen 2.910 N/A LYS 316.A NZ SER 248.A OG no hydrogen 3.401 N/A PHE 318.A N ILE 309.A O no hydrogen 2.980 N/A VAL 319.A N ILE 247.A O no hydrogen 2.912 N/A CYS 320.A N TRP 307.A O no hydrogen 2.896 N/A MET 321.A N LEU 245.A O no hydrogen 2.918 N/A ALA 322.A N ASN 305.A O no hydrogen 2.890 N/A GLU 327.A N THR 324.A OG1 no hydrogen 3.214 N/A LYS 328.A NZ ASN 288.A OD1 no hydrogen 2.871 N/A LYS 328.A NZ VAL 289.A O no hydrogen 3.330 N/A LYS 328.A NZ ASP 291.A OD1 no hydrogen 3.469 N/A LYS 328.A NZ GLY 306.A O no hydrogen 3.175 N/A GLN 329.A N ALA 325.A O no hydrogen 2.929 N/A GLN 329.A NE2 ASP 333.A OD1 no hydrogen 2.735 N/A LYS 330.A N GLU 326.A O no hydrogen 2.870 N/A TRP 331.A N GLU 327.A O no hydrogen 2.929 N/A TRP 331.A NE1 GLU 327.A OE2 no hydrogen 2.554 N/A LEU 332.A N LYS 328.A O no hydrogen 2.929 N/A ASP 333.A N GLN 329.A O no hydrogen 2.919 N/A ALA 334.A N LYS 330.A O no hydrogen 2.913 N/A ILE 335.A N TRP 331.A O no hydrogen 2.928 N/A ILE 336.A N LEU 332.A O no hydrogen 2.931 N/A ARG 337.A N ASP 333.A O no hydrogen 2.907 N/A GLU 338.A N ALA 334.A O no hydrogen 2.926 N/A ARG 339.A N ILE 335.A O no hydrogen 2.921 N/A GLU 340.A N ILE 336.A O no hydrogen 2.900 N/A GLN 341.A N ARG 337.A O no hydrogen 2.925 N/A ARG 342.A N GLU 338.A O no hydrogen 2.934 N/A ARG 342.A NE GLU 338.A OE2 no hydrogen 2.842 N/A