Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7aac_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N ASP 127.A OD2 no hydrogen 2.825 N/A SER 2.A OG ASP 130.A OD1 no hydrogen 2.730 N/A LEU 4.A N SER 2.A OG no hydrogen 3.117 N/A GLN 9.A N PRO 5.A O no hydrogen 3.055 N/A GLN 9.A NE2 SER 2.A O no hydrogen 3.554 N/A GLN 9.A NE2 LEU 4.A O no hydrogen 2.788 N/A ASP 10.A N LYS 6.A O no hydrogen 2.951 N/A LEU 11.A N PRO 7.A O no hydrogen 2.976 N/A ILE 12.A N VAL 8.A O no hydrogen 2.944 N/A LYS 13.A N GLN 9.A O no hydrogen 2.928 N/A LYS 13.A NZ ASP 10.A OD1 no hydrogen 3.540 N/A MET 14.A N ASP 10.A O no hydrogen 3.015 N/A ILE 15.A N LEU 11.A O no hydrogen 3.102 N/A PHE 16.A N ILE 12.A O no hydrogen 3.128 N/A SER 20.A N ASP 17.A OD1 no hydrogen 3.023 N/A MET 21.A N ASP 17.A O no hydrogen 3.330 N/A LYS 22.A N VAL 18.A O no hydrogen 3.079 N/A LYS 22.A NZ GLU 19.A OE2 no hydrogen 3.004 N/A LYS 23.A N GLU 19.A O no hydrogen 2.937 N/A LYS 23.A NZ ASP 253.A OD2 no hydrogen 3.429 N/A ALA 24.A N SER 20.A O no hydrogen 2.955 N/A MET 25.A N MET 21.A O no hydrogen 3.094 N/A VAL 26.A N LYS 22.A O no hydrogen 2.938 N/A GLU 27.A N LYS 23.A O no hydrogen 2.948 N/A TYR 28.A N ALA 24.A O no hydrogen 3.242 N/A TYR 28.A N MET 25.A O no hydrogen 3.143 N/A GLU 29.A N VAL 26.A O no hydrogen 2.851 N/A ILE 30.A N MET 25.A O no hydrogen 3.175 N/A ASP 31.A N PRO 80.A O no hydrogen 2.980 N/A GLN 33.A N ASP 31.A OD1 no hydrogen 3.141 N/A LYS 34.A N ASP 31.A OD1 no hydrogen 3.406 N/A LYS 34.A NZ ASP 31.A OD2 no hydrogen 2.928 N/A MET 35.A N ASP 31.A O no hydrogen 2.787 N/A LYS 39.A N PRO 36.A O no hydrogen 2.886 N/A LEU 40.A N LEU 37.A O no hydrogen 3.477 N/A GLN 44.A N SER 41.A OG no hydrogen 3.251 N/A GLN 44.A NE2 LYS 39.A O no hydrogen 2.809 N/A GLN 44.A NE2 SER 41.A OG no hydrogen 2.855 N/A ILE 45.A N SER 41.A O no hydrogen 3.056 N/A GLN 46.A N LYS 42.A O no hydrogen 2.733 N/A GLN 46.A NE2 GLU 222.A OE2 no hydrogen 3.449 N/A ALA 47.A N ARG 43.A O no hydrogen 3.009 N/A ALA 48.A N GLN 44.A O no hydrogen 3.014 N/A TYR 49.A N ILE 45.A O no hydrogen 2.896 N/A TYR 49.A OH ASP 105.A OD1 no hydrogen 2.620 N/A SER 50.A N GLN 46.A O no hydrogen 3.000 N/A ILE 51.A N ALA 47.A O no hydrogen 3.014 N/A LEU 52.A N ALA 48.A O no hydrogen 2.913 N/A SER 53.A N TYR 49.A O no hydrogen 2.917 N/A SER 53.A OG TYR 49.A O no hydrogen 3.295 N/A SER 53.A OG GLU 222.A O no hydrogen 2.815 N/A GLU 54.A N SER 50.A O no hydrogen 3.070 N/A VAL 55.A N ILE 51.A O no hydrogen 2.917 N/A GLN 56.A N LEU 52.A O no hydrogen 2.895 N/A GLN 57.A N SER 53.A O no hydrogen 3.035 N/A ALA 58.A N GLU 54.A O no hydrogen 3.151 N/A VAL 59.A N VAL 55.A O no hydrogen 2.913 N/A SER 60.A N GLN 56.A O no hydrogen 2.976 N/A SER 60.A OG GLN 56.A O no hydrogen 3.477 N/A SER 60.A OG GLN 57.A O no hydrogen 3.394 N/A GLN 61.A N GLN 57.A O no hydrogen 3.045 N/A GLY 62.A N VAL 59.A O no hydrogen 3.068 N/A SER 63.A N ALA 58.A O no hydrogen 3.030 N/A SER 63.A OG ALA 58.A O no hydrogen 3.176 N/A SER 64.A OG SER 66.A OG no hydrogen 2.830 N/A SER 66.A OG SER 64.A OG no hydrogen 2.830 N/A GLN 67.A N SER 64.A OG no hydrogen 3.226 N/A ILE 68.A N SER 64.A O no hydrogen 2.970 N/A LEU 69.A N ASP 65.A O no hydrogen 3.066 N/A SER 72.A N ILE 68.A O no hydrogen 2.800 N/A ASN 73.A N LEU 69.A O no hydrogen 2.807 N/A ARG 74.A N ASP 70.A O no hydrogen 2.853 N/A PHE 75.A N LEU 71.A O no hydrogen 3.285 N/A TYR 76.A N SER 72.A O no hydrogen 3.349 N/A TYR 76.A OH PRO 89.A O no hydrogen 2.745 N/A THR 77.A N ASN 73.A O no hydrogen 2.983 N/A THR 77.A OG1 ASN 73.A O no hydrogen 2.903 N/A LEU 78.A N ARG 74.A O no hydrogen 3.217 N/A ILE 79.A N PHE 75.A O no hydrogen 2.974 N/A HIS 81.A ND1 ILE 79.A O no hydrogen 2.758 N/A ASP 82.A N GLU 29.A O no hydrogen 2.720 N/A LYS 86.A N PHE 83.A O no hydrogen 3.021 N/A LYS 86.A NZ PHE 83.A O no hydrogen 3.427 N/A LEU 91.A N SER 72.A OG no hydrogen 3.009 N/A ASN 92.A ND2 ASP 65.A OD1 no hydrogen 2.814 N/A ASN 93.A N SER 96.A OG no hydrogen 3.276 N/A SER 96.A N ASN 93.A OD1 no hydrogen 2.928 N/A SER 96.A OG ASN 93.A O no hydrogen 2.724 N/A SER 96.A OG ASN 93.A OD1 no hydrogen 3.319 N/A VAL 97.A N ASN 93.A O no hydrogen 3.117 N/A GLN 98.A N ALA 94.A O no hydrogen 2.862 N/A ALA 99.A N ASP 95.A O no hydrogen 2.959 N/A LYS 100.A N SER 96.A O no hydrogen 2.978 N/A LYS 100.A NZ HIS 81.A NE2 no hydrogen 2.857 N/A ALA 101.A N VAL 97.A O no hydrogen 2.811 N/A GLU 102.A N GLN 98.A O no hydrogen 3.004 N/A MET 103.A N ALA 99.A O no hydrogen 3.111 N/A LEU 104.A N LYS 100.A O no hydrogen 2.945 N/A ASP 105.A N ALA 101.A O no hydrogen 2.997 N/A ASN 106.A N GLU 102.A O no hydrogen 3.164 N/A ASN 106.A ND2 GLU 102.A O no hydrogen 2.818 N/A LEU 107.A N MET 103.A O no hydrogen 2.924 N/A LEU 108.A N LEU 104.A O no hydrogen 2.865 N/A ASP 109.A N ASP 105.A O no hydrogen 3.375 N/A ILE 110.A N ASN 106.A O no hydrogen 2.992 N/A GLU 111.A N LEU 107.A O no hydrogen 2.901 N/A VAL 112.A N LEU 108.A O no hydrogen 3.202 N/A ALA 113.A N ASP 109.A O no hydrogen 3.032 N/A TYR 114.A N ILE 110.A O no hydrogen 2.890 N/A SER 115.A N GLU 111.A O no hydrogen 2.907 N/A SER 115.A OG GLU 111.A O no hydrogen 2.742 N/A LEU 116.A N VAL 112.A O no hydrogen 3.084 N/A LEU 117.A N ALA 113.A O no hydrogen 3.167 N/A ARG 118.A N TYR 114.A O no hydrogen 3.023 N/A ARG 118.A NE TYR 114.A OH no hydrogen 3.159 N/A GLY 119.A N SER 115.A O no hydrogen 2.801 N/A SER 125.A N ASP 123.A OD1 no hydrogen 3.087 N/A SER 125.A OG ASP 123.A OD1 no hydrogen 2.707 N/A SER 125.A OG ASP 123.A OD2 no hydrogen 3.286 N/A LYS 126.A N ASP 123.A O no hydrogen 3.178 N/A ILE 129.A N ASP 127.A OD1 no hydrogen 2.967 N/A VAL 131.A N ASP 127.A O no hydrogen 3.114 N/A ASN 132.A N PRO 128.A O no hydrogen 2.794 N/A TYR 133.A N ILE 129.A O no hydrogen 2.898 N/A GLU 134.A N ASP 130.A O no hydrogen 3.064 N/A LYS 135.A N ASN 132.A O no hydrogen 3.162 N/A LEU 136.A N TYR 133.A O no hydrogen 3.160 N/A LYS 137.A N GLU 134.A O no hydrogen 3.363 N/A THR 138.A OG1 LEU 136.A O no hydrogen 2.741 N/A ASP 139.A N GLU 179.A O no hydrogen 2.884 N/A ILE 140.A N TYR 133.A OH no hydrogen 2.932 N/A LYS 141.A N LYS 177.A O no hydrogen 2.905 N/A VAL 143.A N ILE 175.A O no hydrogen 2.865 N/A ASP 146.A N ASP 144.A OD1 no hydrogen 3.081 N/A SER 147.A N ASP 144.A O no hydrogen 3.050 N/A SER 147.A OG ASP 144.A O no hydrogen 2.715 N/A ALA 150.A N SER 147.A OG no hydrogen 3.332 N/A GLU 151.A N SER 147.A O no hydrogen 3.064 N/A ILE 152.A N GLU 148.A O no hydrogen 2.958 N/A ILE 153.A N GLU 149.A O no hydrogen 2.985 N/A ARG 154.A N ALA 150.A O no hydrogen 2.824 N/A ARG 154.A NH1 ARG 145.A O no hydrogen 2.803 N/A ARG 154.A NH2 ARG 145.A O no hydrogen 3.183 N/A LYS 155.A N GLU 151.A O no hydrogen 3.077 N/A TYR 156.A N ILE 152.A O no hydrogen 2.950 N/A TYR 156.A OH LEU 198.A O no hydrogen 2.715 N/A VAL 157.A N ILE 153.A O no hydrogen 3.032 N/A LYS 158.A N ARG 154.A O no hydrogen 2.816 N/A ASN 159.A N LYS 155.A O no hydrogen 2.852 N/A ASN 159.A ND2 LEU 310.A O no hydrogen 2.967 N/A THR 160.A N TYR 156.A O no hydrogen 3.239 N/A THR 160.A OG1 TYR 156.A O no hydrogen 2.827 N/A HIS 161.A NE2 HIS 165.A O no hydrogen 2.763 N/A ALA 162.A N SER 241.A OG no hydrogen 2.816 N/A THR 164.A OG1 TYR 325.A OH no hydrogen 2.730 N/A HIS 165.A N ALA 162.A O no hydrogen 2.906 N/A HIS 165.A ND1 SER 241.A OG no hydrogen 2.764 N/A ASN 166.A N THR 163.A O no hydrogen 3.220 N/A ASP 169.A N ASN 347.A O no hydrogen 2.900 N/A GLU 171.A N LYS 345.A O no hydrogen 2.944 N/A ILE 173.A N LYS 343.A O no hydrogen 2.773 N/A ASP 174.A N LYS 343.A O no hydrogen 3.415 N/A PHE 176.A N LEU 341.A O no hydrogen 2.775 N/A LYS 177.A N LYS 141.A O no hydrogen 2.779 N/A LYS 177.A NZ GLU 149.A OE1 no hydrogen 2.938 N/A LYS 177.A NZ TYR 340.A OH no hydrogen 3.388 N/A ILE 178.A N LYS 339.A O no hydrogen 2.986 N/A GLU 179.A N ASP 139.A O no hydrogen 2.933 N/A ARG 180.A NE LEU 212.A O no hydrogen 2.795 N/A ARG 180.A NH1 SER 213.A O no hydrogen 2.943 N/A ARG 180.A NH2 GLU 183.A OE2 no hydrogen 2.845 N/A GLU 181.A N LYS 137.A O no hydrogen 2.893 N/A GLU 183.A N ARG 180.A O no hydrogen 3.113 N/A ARG 186.A N GLY 182.A O no hydrogen 3.020 N/A TYR 187.A N GLU 183.A O no hydrogen 2.897 N/A TYR 187.A OH GLU 262.A OE2 no hydrogen 2.743 N/A LYS 188.A N GLN 185.A O no hydrogen 3.398 N/A PHE 190.A N TYR 187.A O no hydrogen 2.817 N/A LYS 191.A N LYS 188.A O no hydrogen 3.300 N/A LEU 193.A N PHE 190.A O no hydrogen 3.109 N/A ASN 195.A ND2 GLY 266.A O no hydrogen 3.224 N/A ARG 196.A NE LEU 193.A O no hydrogen 2.810 N/A ARG 196.A NH1 GLU 262.A OE2 no hydrogen 3.369 N/A ARG 197.A N VAL 263.A O no hydrogen 2.970 N/A ARG 197.A NE ASN 195.A OD1 no hydrogen 3.152 N/A ARG 197.A NH2 ASN 195.A OD1 no hydrogen 2.764 N/A LEU 198.A N ASP 307.A O no hydrogen 2.801 N/A LEU 199.A N GLY 261.A O no hydrogen 2.930 N/A TRP 200.A N ALA 237.A O no hydrogen 2.924 N/A HIS 201.A N LEU 259.A O no hydrogen 3.001 N/A HIS 201.A ND1 TYR 235.A O no hydrogen 2.734 N/A ARG 204.A NH1 GLU 27.A OE1 no hydrogen 2.860 N/A ARG 204.A NH2 GLU 27.A OE1 no hydrogen 2.827 N/A ASN 207.A N ARG 204.A O no hydrogen 2.901 N/A ASN 207.A ND2 ASN 106.A OD1 no hydrogen 2.746 N/A ASN 207.A ND2 SER 203.A OG no hydrogen 2.806 N/A PHE 208.A N THR 205.A O no hydrogen 3.109 N/A ILE 211.A N ASN 207.A O no hydrogen 2.992 N/A LEU 212.A N PHE 208.A O no hydrogen 2.884 N/A SER 213.A N ALA 209.A O no hydrogen 3.006 N/A SER 213.A OG ALA 209.A O no hydrogen 2.886 N/A SER 213.A OG GLY 210.A O no hydrogen 3.282 N/A GLN 214.A N GLY 210.A O no hydrogen 2.758 N/A GLY 215.A N ILE 211.A O no hydrogen 2.728 N/A ARG 217.A NH2 ASP 109.A OD1 no hydrogen 3.063 N/A GLU 222.A N GLU 222.A OE2 no hydrogen 2.930 N/A ALA 223.A N PRO 220.A O no hydrogen 3.002 N/A THR 226.A N GLN 56.A OE1 no hydrogen 3.479 N/A THR 226.A OG1 GLN 56.A OE1 no hydrogen 2.733 N/A GLY 227.A N PRO 224.A O no hydrogen 3.135 N/A TYR 228.A N VAL 225.A O no hydrogen 3.456 N/A TYR 228.A OH ASP 105.A OD1 no hydrogen 2.704 N/A PHE 230.A N TYR 235.A OH no hydrogen 2.863 N/A GLY 231.A N TYR 228.A O no hydrogen 3.094 N/A LYS 232.A NZ PRO 220.A O no hydrogen 2.959 N/A LYS 232.A NZ ALA 223.A O no hydrogen 2.947 N/A GLY 233.A N GLY 231.A O no hydrogen 3.183 N/A ILE 234.A N VAL 330.A O no hydrogen 2.846 N/A TYR 235.A OH GLY 231.A O no hydrogen 2.671 N/A PHE 236.A N TYR 328.A O no hydrogen 2.807 N/A ALA 237.A N TRP 200.A O no hydrogen 2.943 N/A VAL 240.A N THR 160.A OG1 no hydrogen 2.932 N/A SER 241.A OG HIS 165.A ND1 no hydrogen 2.764 N/A LYS 242.A NZ TYR 325.A O no hydrogen 2.970 N/A LYS 242.A NZ ASN 326.A O no hydrogen 3.135 N/A LYS 242.A NZ GLU 327.A OE2 no hydrogen 2.807 N/A SER 243.A N MET 239.A O no hydrogen 3.421 N/A ALA 244.A N VAL 240.A O no hydrogen 2.757 N/A ASN 245.A N SER 241.A O no hydrogen 3.030 N/A TYR 246.A N SER 243.A O no hydrogen 2.976 N/A CYS 247.A N ALA 244.A O no hydrogen 2.997 N/A CYS 247.A SG SER 203.A O no hydrogen 4.016 N/A CYS 247.A SG ALA 244.A O no hydrogen 3.449 N/A CYS 247.A SG LEU 257.A O no hydrogen 3.243 N/A HIS 248.A N ASN 245.A O no hydrogen 3.363 N/A SER 250.A N ASP 253.A O no hydrogen 3.050 N/A GLN 251.A N GLN 251.A OE1 no hydrogen 2.783 N/A ASP 253.A N SER 250.A O no hydrogen 3.075 N/A GLY 256.A N LEU 344.A O no hydrogen 2.980 N/A ILE 258.A N LEU 342.A O no hydrogen 2.984 N/A LEU 259.A N HIS 201.A O no hydrogen 2.885 N/A LEU 260.A N TYR 340.A O no hydrogen 2.935 N/A GLY 261.A N LEU 199.A O no hydrogen 2.887 N/A GLU 262.A N ASN 337.A O no hydrogen 2.818 N/A VAL 263.A N ARG 197.A O no hydrogen 2.828 N/A ALA 264.A N GLN 335.A O no hydrogen 2.988 N/A LEU 265.A N ASN 195.A O no hydrogen 3.079 N/A GLY 266.A N HIS 194.A O no hydrogen 3.179 N/A ASN 267.A N HIS 285.A ND1 no hydrogen 2.890 N/A ASN 267.A ND2 GLY 283.A O no hydrogen 2.856 N/A TYR 269.A N SER 286.A O no hydrogen 2.788 N/A LEU 271.A N LYS 288.A O no hydrogen 2.927 N/A LYS 272.A NZ ASN 319.A O no hydrogen 3.253 N/A HIS 273.A ND1 SER 322.A OG no hydrogen 2.896 N/A SER 275.A N MET 229.A O no hydrogen 3.051 N/A HIS 276.A ND1 TYR 228.A O no hydrogen 2.793 N/A ILE 277.A N SER 275.A O no hydrogen 2.983 N/A LYS 284.A N PRO 281.A O no hydrogen 3.077 N/A LYS 284.A NZ ASN 267.A OD1 no hydrogen 3.054 N/A LYS 284.A NZ MET 268.A O no hydrogen 2.906 N/A HIS 285.A N ASN 267.A O no hydrogen 2.836 N/A SER 286.A OG LEU 265.A O no hydrogen 2.757 N/A VAL 287.A N ILE 329.A O no hydrogen 2.879 N/A LYS 288.A N TYR 269.A O no hydrogen 2.960 N/A GLY 289.A N GLU 327.A O no hydrogen 2.737 N/A LEU 290.A N LEU 271.A O no hydrogen 2.858 N/A GLY 291.A N ASN 326.A OD1 no hydrogen 2.842 N/A LYS 292.A N LEU 323.A O no hydrogen 3.032 N/A THR 293.A N LEU 324.A O no hydrogen 2.937 N/A THR 294.A N ILE 314.A O no hydrogen 2.943 N/A ASP 296.A N THR 312.A O no hydrogen 2.915 N/A SER 298.A N ASP 296.A OD1 no hydrogen 3.188 N/A SER 298.A OG ASP 296.A OD1 no hydrogen 2.728 N/A ALA 299.A N ASP 296.A O no hydrogen 3.165 N/A ASN 300.A N PRO 297.A O no hydrogen 3.316 N/A ILE 301.A N VAL 308.A O no hydrogen 3.230 N/A LEU 303.A N VAL 306.A O no hydrogen 2.949 N/A VAL 306.A N LEU 303.A O no hydrogen 3.087 N/A ASP 307.A N ARG 196.A O no hydrogen 3.269 N/A VAL 308.A N ILE 301.A O no hydrogen 2.734 N/A LEU 310.A N VAL 308.A O no hydrogen 2.888 N/A ILE 314.A N THR 294.A O no hydrogen 2.895 N/A SER 316.A N LYS 292.A O no hydrogen 2.801 N/A SER 316.A OG GLY 291.A O no hydrogen 2.712 N/A SER 316.A OG LYS 292.A O no hydrogen 2.999 N/A GLY 317.A N SER 315.A OG no hydrogen 3.366 N/A VAL 318.A N SER 316.A OG no hydrogen 3.115 N/A THR 321.A OG1 LYS 272.A O no hydrogen 3.228 N/A THR 321.A OG1 LEU 290.A O no hydrogen 2.610 N/A SER 322.A N LYS 272.A O no hydrogen 2.848 N/A SER 322.A OG HIS 273.A ND1 no hydrogen 2.896 N/A TYR 325.A OH THR 164.A OG1 no hydrogen 2.730 N/A ASN 326.A ND2 ASP 238.A OD2 no hydrogen 2.916 N/A ASN 326.A ND2 THR 294.A OG1 no hydrogen 3.054 N/A GLU 327.A N GLY 289.A O no hydrogen 3.098 N/A TYR 328.A N PHE 236.A O no hydrogen 2.879 N/A TYR 328.A OH ASP 238.A OD2 no hydrogen 2.681 N/A ILE 329.A N VAL 287.A O no hydrogen 2.830 N/A VAL 330.A N ILE 234.A O no hydrogen 3.107 N/A TYR 331.A OH PHE 230.A O no hydrogen 2.660 N/A ALA 334.A N ASP 332.A OD1 no hydrogen 2.978 N/A GLN 335.A N ASP 332.A O no hydrogen 3.060 N/A GLN 335.A NE2 ALA 264.A O no hydrogen 2.822 N/A GLN 335.A NE2 HIS 285.A O no hydrogen 2.788 N/A ASN 337.A N GLU 262.A O no hydrogen 2.929 N/A ASN 337.A ND2 GLU 183.A OE1 no hydrogen 3.237 N/A LEU 338.A N GLU 183.A OE1 no hydrogen 2.742 N/A LYS 339.A N LEU 260.A O no hydrogen 2.960 N/A LYS 339.A NZ ASN 337.A OD1 no hydrogen 3.020 N/A TYR 340.A N LEU 260.A O no hydrogen 3.051 N/A TYR 340.A OH GLU 149.A OE1 no hydrogen 2.905 N/A LEU 341.A N PHE 176.A O no hydrogen 2.860 N/A LEU 342.A N ILE 258.A O no hydrogen 2.790 N/A LYS 343.A N ASP 174.A O no hydrogen 2.935 N/A LEU 344.A N GLY 256.A O no hydrogen 2.808 N/A LYS 345.A N GLU 171.A O no hydrogen 2.803 N/A PHE 346.A N PRO 254.A O no hydrogen 2.814 N/A ASN 347.A N ASP 169.A O no hydrogen 2.895 N/A ASN 347.A ND2 ASP 169.A OD1 no hydrogen 3.462 N/A ASN 347.A ND2 ASP 169.A OD2 no hydrogen 3.507 N/A LYS 349.A N ALA 167.A O no hydrogen 2.790 N/A LYS 349.A NZ ASP 169.A OD2 no hydrogen 2.821 N/A