Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4an4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG MET 3.A O no hydrogen 3.324 N/A MET 3.A N HIS 31.A ND1 no hydrogen 3.021 N/A ARG 4.A N ASP 99.A OD2 no hydrogen 2.863 N/A ARG 4.A NE TRP 96.A O no hydrogen 2.871 N/A ARG 4.A NH1 GLU 32.A OE1 no hydrogen 3.259 N/A ARG 4.A NH2 TRP 96.A O no hydrogen 2.911 N/A ALA 5.A N GLU 32.A O no hydrogen 2.839 N/A LEU 6.A N LEU 100.A O no hydrogen 2.866 N/A PHE 7.A N ARG 34.A O no hydrogen 2.712 N/A ILE 8.A N VAL 102.A O no hydrogen 2.659 N/A THR 9.A OG1 SER 10.A O no hydrogen 3.116 N/A THR 9.A OG1 THR 37.A OG1 no hydrogen 3.137 N/A SER 10.A N THR 104.A OG1 no hydrogen 2.995 N/A SER 10.A OG THR 104.A OG1 no hydrogen 3.254 N/A SER 10.A OG THR 106.A OG1 no hydrogen 2.544 N/A LEU 13.A N ASP 40.A OD2 no hydrogen 2.931 N/A HIS 15.A N GLY 12.A O no hydrogen 2.795 N/A ILE 16.A N GLY 12.A O no hydrogen 3.173 N/A ILE 16.A N LEU 13.A O no hydrogen 3.093 N/A LEU 17.A N LEU 13.A O no hydrogen 2.977 N/A THR 19.A N ILE 16.A O no hydrogen 2.964 N/A THR 19.A OG1 ILE 16.A O no hydrogen 2.548 N/A THR 19.A OG1 TYR 35.A OH no hydrogen 2.672 N/A VAL 20.A N LEU 17.A O no hydrogen 3.041 N/A ALA 23.A N THR 19.A O no hydrogen 3.159 N/A GLN 24.A N VAL 20.A O no hydrogen 2.847 N/A ALA 25.A N PRO 21.A O no hydrogen 2.839 N/A LEU 26.A N LEU 22.A O no hydrogen 3.095 N/A ARG 27.A N ALA 23.A O no hydrogen 3.291 N/A ALA 28.A N GLN 24.A O no hydrogen 2.945 N/A LEU 29.A N ALA 25.A O no hydrogen 3.042 N/A GLY 30.A N ARG 27.A O no hydrogen 2.836 N/A HIS 31.A N LEU 26.A O no hydrogen 2.984 N/A GLU 32.A N MET 3.A O no hydrogen 2.964 N/A ARG 34.A N ALA 5.A O no hydrogen 3.093 N/A TYR 35.A N CYS 50.A O no hydrogen 2.915 N/A TYR 35.A OH THR 19.A OG1 no hydrogen 2.672 N/A ALA 36.A N PHE 7.A O no hydrogen 2.676 N/A THR 37.A N VAL 52.A O no hydrogen 3.254 N/A THR 37.A OG1 THR 9.A OG1 no hydrogen 3.137 N/A ASP 40.A N PRO 11.A O no hydrogen 3.040 N/A ALA 43.A N ASP 40.A O no hydrogen 2.996 N/A VAL 44.A N ILE 41.A O no hydrogen 2.907 N/A ALA 45.A N ILE 41.A O no hydrogen 3.450 N/A GLU 46.A N ARG 42.A O no hydrogen 2.725 N/A ALA 47.A N VAL 44.A O no hydrogen 3.056 N/A GLY 48.A N ALA 45.A O no hydrogen 3.126 N/A LEU 49.A N VAL 44.A O no hydrogen 3.195 N/A VAL 52.A N TYR 35.A O no hydrogen 2.891 N/A VAL 54.A N THR 37.A O no hydrogen 2.956 N/A SER 55.A N ASP 53.A OD1 no hydrogen 3.211 N/A SER 55.A OG TYR 60.A OH no hydrogen 2.538 N/A VAL 58.A N SER 55.A O no hydrogen 3.230 N/A TYR 60.A OH SER 55.A OG no hydrogen 2.538 N/A LEU 63.A N TYR 60.A O no hydrogen 2.864 N/A PHE 64.A N TYR 60.A O no hydrogen 3.129 N/A THR 69.A OG1 ASP 68.A O no hydrogen 2.032 N/A PHE 73.A N GLY 70.A O no hydrogen 2.905 N/A PHE 74.A N GLY 70.A O no hydrogen 3.403 N/A ALA 75.A N GLU 71.A O no hydrogen 2.982 N/A GLU 76.A N GLY 72.A O no hydrogen 3.119 N/A MET 77.A N PHE 73.A O no hydrogen 3.045 N/A PHE 78.A N PHE 74.A O no hydrogen 2.843 N/A ALA 79.A N ALA 75.A O no hydrogen 2.805 N/A ARG 80.A N GLU 76.A O no hydrogen 3.153 N/A ARG 80.A NE LEU 63.A O no hydrogen 3.349 N/A ARG 80.A NH2 LEU 63.A O no hydrogen 3.176 N/A VAL 81.A N MET 77.A O no hydrogen 3.015 N/A SER 82.A N PHE 78.A O no hydrogen 2.693 N/A SER 82.A OG PHE 78.A O no hydrogen 2.733 N/A SER 82.A OG GLN 107.A OE1 no hydrogen 3.244 N/A ALA 83.A N ALA 79.A O no hydrogen 2.842 N/A ALA 85.A N SER 82.A O no hydrogen 2.833 N/A VAL 86.A N ALA 83.A O no hydrogen 3.241 N/A ALA 89.A N ALA 85.A O no hydrogen 2.974 N/A LEU 90.A N VAL 86.A O no hydrogen 3.040 N/A ARG 91.A N ASP 87.A O no hydrogen 2.940 N/A THR 92.A N GLY 88.A O no hydrogen 2.862 N/A THR 92.A OG1 ALA 89.A O no hydrogen 3.495 N/A ALA 93.A N ALA 89.A O no hydrogen 2.942 N/A ARG 94.A N LEU 90.A O no hydrogen 2.848 N/A SER 95.A N ARG 91.A O no hydrogen 3.219 N/A SER 95.A OG ARG 91.A O no hydrogen 3.043 N/A SER 95.A OG THR 92.A O no hydrogen 3.283 N/A TRP 96.A N THR 92.A O no hydrogen 2.834 N/A ARG 97.A N ALA 93.A O no hydrogen 2.843 N/A ASP 99.A N ARG 4.A O no hydrogen 2.794 N/A VAL 101.A N PRO 120.A O no hydrogen 3.011 N/A VAL 102.A N LEU 6.A O no hydrogen 2.751 N/A HIS 103.A N VAL 122.A O no hydrogen 2.879 N/A THR 104.A OG1 SER 10.A OG no hydrogen 3.254 N/A THR 106.A OG1 SER 10.A OG no hydrogen 2.544 N/A GLN 107.A N THR 104.A O no hydrogen 3.062 N/A GLN 107.A NE2 THR 9.A O no hydrogen 2.901 N/A GLY 108.A N SER 82.A OG no hydrogen 2.928 N/A ALA 109.A N GLN 107.A OE1 no hydrogen 2.977 N/A GLY 110.A N GLN 107.A O no hydrogen 3.108 N/A LEU 112.A N GLY 108.A O no hydrogen 3.296 N/A THR 113.A N ALA 109.A O no hydrogen 2.922 N/A THR 113.A OG1 ALA 109.A O no hydrogen 2.672 N/A ALA 114.A N GLY 110.A O no hydrogen 2.904 N/A ALA 115.A N PRO 111.A O no hydrogen 2.816 N/A ALA 116.A N LEU 112.A O no hydrogen 2.860 N/A LEU 117.A N THR 113.A O no hydrogen 3.134 N/A GLN 118.A N ALA 115.A O no hydrogen 3.419 N/A GLN 118.A NE2 ALA 115.A O no hydrogen 3.179 N/A GLN 118.A NE2 GLU 155.A O no hydrogen 2.708 N/A LEU 119.A N ALA 114.A O no hydrogen 2.791 N/A CYS 121.A N GLY 158.A O no hydrogen 2.942 N/A CYS 121.A SG HIS 103.A NE2 no hydrogen 2.902 N/A VAL 122.A N VAL 101.A O no hydrogen 2.750 N/A GLU 123.A N VAL 160.A O no hydrogen 2.737 N/A LEU 124.A N HIS 103.A O no hydrogen 2.876 N/A SER 131.A OG GLY 127.A O no hydrogen 3.151 N/A LEU 135.A N GLU 132.A O no hydrogen 2.987 N/A LEU 138.A N GLY 134.A O no hydrogen 2.824 N/A ILE 139.A N LEU 135.A O no hydrogen 2.939 N/A ARG 140.A N GLY 136.A O no hydrogen 2.928 N/A ARG 140.A NH2 GLY 154.A O no hydrogen 2.787 N/A ARG 141.A N ALA 137.A O no hydrogen 3.033 N/A ALA 142.A N LEU 138.A O no hydrogen 2.986 N/A MET 143.A N ILE 139.A O no hydrogen 3.066 N/A MET 143.A N ARG 140.A O no hydrogen 3.109 N/A SER 144.A N ARG 141.A O no hydrogen 3.019 N/A TYR 147.A N MET 143.A O no hydrogen 3.026 N/A GLU 148.A N SER 144.A O no hydrogen 2.954 N/A ARG 149.A N LYS 145.A O no hydrogen 2.846 N/A ARG 149.A NH1 ASP 146.A OD1 no hydrogen 3.050 N/A ARG 149.A NH2 ASP 87.A OD1 no hydrogen 3.301 N/A HIS 150.A N ASP 146.A O no hydrogen 3.211 N/A HIS 150.A NE2 ASP 87.A OD1 no hydrogen 2.877 N/A GLY 151.A N GLU 148.A O no hydrogen 3.013 N/A VAL 152.A N TYR 147.A O no hydrogen 2.736 N/A THR 157.A N LEU 119.A O no hydrogen 3.279 N/A THR 157.A OG1 GLN 118.A O no hydrogen 2.958 N/A VAL 160.A N CYS 121.A O no hydrogen 2.905 N/A ARG 161.A NE GLU 123.A OE1 no hydrogen 2.665 N/A ARG 161.A NH2 GLU 123.A OE1 no hydrogen 2.786 N/A LEU 162.A N GLU 123.A O no hydrogen 2.797 N/A THR 163.A N TRP 183.A O no hydrogen 2.901 N/A SER 168.A N GLU 339.A OE2 no hydrogen 2.773 N/A SER 168.A OG GLU 339.A OE1 no hydrogen 3.197 N/A SER 168.A OG GLU 339.A OE2 no hydrogen 2.618 N/A GLU 170.A N PRO 166.A O no hydrogen 2.946 N/A ALA 171.A N PRO 167.A O no hydrogen 2.727 N/A LEU 172.A N VAL 169.A O no hydrogen 3.192 N/A LEU 173.A N GLU 170.A O no hydrogen 2.999 N/A ARG 177.A N PRO 174.A O no hydrogen 2.883 N/A ARG 178.A N GLU 175.A O no hydrogen 3.375 N/A ARG 178.A NH2 LEU 173.A O no hydrogen 2.454 N/A SER 179.A N GLU 170.A OE2 no hydrogen 2.812 N/A SER 179.A OG GLU 170.A OE2 no hydrogen 3.492 N/A TRP 183.A N ARG 161.A O no hydrogen 2.774 N/A MET 185.A N THR 163.A O no hydrogen 2.794 N/A ARG 186.A N PRO 344.A O no hydrogen 2.676 N/A ARG 186.A NH1 MET 343.A O no hydrogen 2.457 N/A LEU 200.A N PRO 197.A O no hydrogen 3.172 N/A ARG 206.A N ALA 203.A O no hydrogen 3.413 N/A ARG 206.A NH1 ASP 228.A OD1 no hydrogen 3.309 N/A ARG 208.A N ASP 266.A OD1 no hydrogen 3.086 N/A ARG 208.A NE GLU 230.A OE1 no hydrogen 3.399 N/A ARG 208.A NH1 LEU 200.A O no hydrogen 2.817 N/A ARG 208.A NH1 THR 264.A OG1 no hydrogen 2.950 N/A ARG 208.A NH2 TRP 199.A O no hydrogen 3.402 N/A ARG 208.A NH2 GLU 230.A OE1 no hydrogen 3.412 N/A ILE 209.A N GLU 230.A O no hydrogen 2.705 N/A ALA 210.A N ALA 267.A O no hydrogen 2.980 N/A VAL 211.A N VAL 232.A O no hydrogen 2.827 N/A THR 212.A N ILE 269.A O no hydrogen 2.911 N/A THR 212.A OG1 THR 212.A O no hydrogen 2.269 N/A SER 222.A N ALA 218.A O no hydrogen 3.169 N/A VAL 224.A N LEU 220.A O no hydrogen 3.106 N/A ALA 225.A N SER 222.A O no hydrogen 3.312 N/A ASP 226.A N GLU 223.A O no hydrogen 3.373 N/A VAL 227.A N VAL 224.A O no hydrogen 3.265 N/A ALA 229.A N VAL 227.A O no hydrogen 2.990 N/A GLU 230.A N ARG 207.A O no hydrogen 2.885 N/A PHE 231.A N ASN 249.A O no hydrogen 2.872 N/A VAL 232.A N ILE 209.A O no hydrogen 2.867 N/A LEU 233.A N ARG 251.A O no hydrogen 2.862 N/A THR 234.A N VAL 211.A O no hydrogen 2.981 N/A THR 234.A OG1 VAL 211.A O no hydrogen 3.566 N/A LEU 235.A N VAL 253.A O no hydrogen 2.639 N/A GLY 236.A N GLU 254.A O no hydrogen 2.708 N/A ASN 249.A ND2 VAL 224.A O no hydrogen 2.934 N/A ASN 249.A ND2 VAL 227.A O no hydrogen 3.305 N/A ASN 249.A ND2 ALA 229.A O no hydrogen 3.314 N/A VAL 250.A N PRO 247.A O no hydrogen 3.040 N/A ARG 251.A N PHE 231.A O no hydrogen 2.746 N/A ARG 251.A NE GLU 230.A OE2 no hydrogen 2.997 N/A VAL 253.A N LEU 233.A O no hydrogen 2.725 N/A GLY 259.A N ASN 191.A OD1 no hydrogen 3.109 N/A LEU 261.A N PRO 257.A O no hydrogen 3.112 N/A LEU 262.A N LEU 258.A O no hydrogen 2.685 N/A GLU 263.A N GLY 259.A O no hydrogen 3.178 N/A THR 264.A N LEU 261.A O no hydrogen 2.795 N/A THR 264.A OG1 LEU 261.A O no hydrogen 2.551 N/A CYS 265.A N LEU 262.A O no hydrogen 3.273 N/A CYS 265.A SG LEU 261.A O no hydrogen 3.525 N/A ASP 266.A N ARG 208.A O no hydrogen 2.702 N/A ILE 268.A N PRO 286.A O no hydrogen 3.043 N/A ILE 269.A N ALA 210.A O no hydrogen 2.741 N/A HIS 270.A N CYS 288.A O no hydrogen 2.904 N/A HIS 270.A NE2 GLN 287.A OE1 no hydrogen 2.786 N/A HIS 271.A N HIS 271.A ND1 no hydrogen 2.714 N/A GLY 272.A N HIS 270.A ND1 no hydrogen 2.997 N/A LEU 277.A N GLY 273.A O no hydrogen 2.826 N/A LEU 278.A N SER 274.A O no hydrogen 2.899 N/A THR 279.A N GLY 275.A O no hydrogen 2.904 N/A THR 279.A OG1 GLY 275.A O no hydrogen 2.482 N/A ALA 280.A N THR 276.A O no hydrogen 2.945 N/A LEU 281.A N LEU 277.A O no hydrogen 2.843 N/A ALA 282.A N LEU 278.A O no hydrogen 2.788 N/A ALA 283.A N THR 279.A O no hydrogen 3.001 N/A GLY 284.A N ALA 280.A O no hydrogen 2.967 N/A GLY 284.A N LEU 281.A O no hydrogen 3.096 N/A GLN 287.A N ILE 306.A O no hydrogen 3.143 N/A GLN 287.A NE2 LEU 277.A O no hydrogen 3.320 N/A CYS 288.A N ILE 268.A O no hydrogen 2.866 N/A CYS 288.A SG PHE 308.A O no hydrogen 4.017 N/A VAL 289.A N PHE 308.A O no hydrogen 3.083 N/A ILE 290.A N HIS 270.A O no hydrogen 2.829 N/A THR 296.A OG1 ASN 297.A OD1 no hydrogen 3.183 N/A ASN 297.A ND2 GLY 272.A O no hydrogen 2.799 N/A ASN 297.A ND2 SER 274.A OG no hydrogen 3.289 N/A ARG 298.A N ASP 295.A O no hydrogen 3.171 N/A ARG 298.A NH2 ASP 309.A OD2 no hydrogen 2.467 N/A ASP 299.A N THR 296.A O no hydrogen 2.463 N/A VAL 300.A N THR 296.A O no hydrogen 3.047 N/A VAL 300.A N ASN 297.A O no hydrogen 3.276 N/A GLY 303.A N ASP 299.A O no hydrogen 3.094 N/A LEU 304.A N VAL 300.A O no hydrogen 2.734 N/A GLY 305.A N THR 302.A O no hydrogen 3.071 N/A ILE 306.A N LEU 301.A O no hydrogen 3.032 N/A PHE 308.A N GLN 287.A O no hydrogen 3.223 N/A ALA 310.A N VAL 289.A O no hydrogen 3.069 N/A SER 314.A OG SER 314.A O no hydrogen 2.467 N/A GLN 319.A N GLN 319.A OE1 no hydrogen 2.883 N/A CYS 320.A N GLY 316.A O no hydrogen 3.412 N/A CYS 320.A SG GLY 316.A O no hydrogen 3.640 N/A ARG 321.A N ALA 317.A O no hydrogen 3.002 N/A ARG 322.A N GLU 318.A O no hydrogen 3.215 N/A LEU 323.A N GLN 319.A O no hydrogen 3.085 N/A LEU 324.A N CYS 320.A O no hydrogen 3.236 N/A ASP 325.A N ARG 322.A O no hydrogen 3.382 N/A ASP 326.A N ARG 322.A O no hydrogen 2.928 N/A GLY 328.A N ASP 326.A OD1 no hydrogen 2.873 N/A LEU 329.A N ASP 326.A O no hydrogen 3.034 N/A ARG 330.A N ASP 326.A O no hydrogen 3.502 N/A GLU 331.A N ALA 327.A O no hydrogen 3.020 N/A ALA 332.A N GLY 328.A O no hydrogen 3.240 N/A ALA 333.A N LEU 329.A O no hydrogen 2.982 N/A LEU 334.A N ARG 330.A O no hydrogen 2.947 N/A ARG 335.A N GLU 331.A O no hydrogen 2.971 N/A VAL 336.A N ALA 332.A O no hydrogen 3.057 N/A ARG 337.A N ALA 333.A O no hydrogen 2.981 N/A ARG 337.A NE ALA 282.A O no hydrogen 3.339 N/A GLN 338.A N LEU 334.A O no hydrogen 3.061 N/A GLN 338.A NE2 GLU 342.A OE2 no hydrogen 2.764 N/A GLU 339.A N ARG 335.A O no hydrogen 3.119 N/A MET 340.A N VAL 336.A O no hydrogen 2.807 N/A SER 341.A N ARG 337.A O no hydrogen 2.927 N/A SER 341.A OG GLN 338.A O no hydrogen 2.644 N/A GLU 342.A N GLU 339.A O no hydrogen 3.295 N/A MET 343.A N MET 340.A O no hydrogen 3.018 N/A THR 349.A N PRO 345.A O no hydrogen 3.105 N/A THR 349.A OG1 PRO 345.A O no hydrogen 3.541 N/A ALA 350.A N PRO 346.A O no hydrogen 2.746 N/A ALA 351.A N ALA 347.A O no hydrogen 3.181 N/A VAL 353.A N ALA 350.A O no hydrogen 3.047 N/A ALA 354.A N ALA 351.A O no hydrogen 3.282 N/A ALA 356.A N LEU 352.A O no hydrogen 2.949 N/A ALA 356.A N VAL 353.A O no hydrogen 3.024 N/A GLY 357.A N ALA 354.A O no hydrogen 3.345 N/A