Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ksc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A SG CYS 37.A O no hydrogen 3.375 N/A GLN 5.A N ASN 2.A O no hydrogen 2.787 N/A ARG 8.A N GLU 7.A OE1 no hydrogen 2.945 N/A ARG 8.A NE ASP 10.A OD1 no hydrogen 3.268 N/A LEU 9.A N VAL 293.A O no hydrogen 2.824 N/A ASP 10.A N GLN 34.A OE1 no hydrogen 3.037 N/A LEU 12.A N ALA 303.A O no hydrogen 2.739 N/A ASP 15.A N THR 27.A O no hydrogen 2.925 N/A ASN 16.A N THR 27.A O no hydrogen 3.453 N/A ARG 17.A NH2 GLU 19.A OE1 no hydrogen 3.247 N/A ILE 18.A N ILE 25.A O no hydrogen 2.746 N/A SER 20.A N GLY 23.A O no hydrogen 3.073 N/A SER 20.A OG ILE 193.A O no hydrogen 2.982 N/A GLU 21.A N LYS 190.A O no hydrogen 2.998 N/A GLY 22.A N ILE 193.A O no hydrogen 2.959 N/A GLY 23.A N SER 20.A O no hydrogen 3.336 N/A LEU 24.A N THR 46.A O no hydrogen 2.960 N/A ILE 25.A N ILE 18.A O no hydrogen 3.045 N/A GLU 26.A N ARG 44.A O no hydrogen 2.762 N/A THR 27.A N ASN 16.A O no hydrogen 3.070 N/A THR 27.A OG1 GLN 151.A OE1 no hydrogen 3.423 N/A THR 27.A OG1 TYR 152.A OH no hydrogen 2.493 N/A TRP 28.A N LEU 42.A O no hydrogen 3.030 N/A TRP 28.A NE1 LEU 12.A O no hydrogen 2.930 N/A ASN 29.A N ASP 15.A OD2 no hydrogen 2.900 N/A ASN 31.A N ASN 29.A OD1 no hydrogen 2.642 N/A ASN 32.A N ASN 29.A O no hydrogen 3.388 N/A LYS 33.A NZ GLN 5.A O no hydrogen 3.107 N/A GLN 34.A N ASN 32.A OD1 no hydrogen 2.831 N/A GLN 34.A NE2 ASP 10.A O no hydrogen 3.160 N/A PHE 35.A N ASN 32.A O no hydrogen 3.070 N/A ARG 36.A N ASN 32.A O no hydrogen 3.114 N/A CYS 37.A N LYS 33.A O no hydrogen 2.913 N/A ALA 38.A N GLN 34.A O no hydrogen 3.038 N/A GLY 39.A N ARG 36.A O no hydrogen 3.075 N/A VAL 40.A N PHE 35.A O no hydrogen 3.111 N/A ALA 41.A N THR 123.A O no hydrogen 3.058 N/A SER 43.A N SER 121.A O no hydrogen 3.077 N/A ARG 44.A N GLU 26.A O no hydrogen 2.825 N/A ARG 44.A NE GLU 26.A OE1 no hydrogen 2.638 N/A ARG 44.A NH1 TYR 275.A OH no hydrogen 2.834 N/A ARG 44.A NH1 GLY 301.A O no hydrogen 3.355 N/A ARG 44.A NH2 GLU 26.A OE1 no hydrogen 2.930 N/A ARG 44.A NH2 GLU 26.A OE2 no hydrogen 2.916 N/A ALA 45.A N ALA 119.A O no hydrogen 2.720 N/A THR 46.A N LEU 24.A O no hydrogen 2.765 N/A LEU 47.A N VAL 117.A O no hydrogen 2.780 N/A GLN 48.A N GLY 22.A O no hydrogen 2.950 N/A ARG 49.A NE ASP 114.A OD1 no hydrogen 2.856 N/A LEU 52.A N VAL 194.A O no hydrogen 2.779 N/A ARG 53.A N MET 109.A O no hydrogen 2.614 N/A ARG 53.A NH1 TYR 140.A OH no hydrogen 2.657 N/A ARG 54.A N ALA 192.A O no hydrogen 3.276 N/A ARG 54.A NH1 GLU 186.A OE1 no hydrogen 3.247 N/A ARG 54.A NH2 GLU 186.A OE1 no hydrogen 2.833 N/A ARG 54.A NH2 GLY 191.A O no hydrogen 2.603 N/A TYR 56.A N PHE 107.A O no hydrogen 3.195 N/A TYR 57.A N PHE 139.A O no hydrogen 2.912 N/A SER 58.A OG ARG 137.A O no hydrogen 2.513 N/A ASN 59.A ND2 ASN 130.A OD1 no hydrogen 2.756 N/A GLN 62.A N VAL 101.A O no hydrogen 2.793 N/A GLN 62.A NE2 TYR 56.A OH no hydrogen 2.843 N/A GLU 63.A N LEU 122.A O no hydrogen 2.942 N/A ILE 64.A N ILE 99.A O no hydrogen 2.899 N/A PHE 65.A N VAL 120.A O no hydrogen 2.766 N/A ILE 66.A N ASP 97.A O no hydrogen 3.028 N/A GLN 67.A N ILE 118.A O no hydrogen 2.727 N/A GLN 68.A N ILE 118.A O no hydrogen 3.414 N/A GLN 68.A NE2 PRO 116.A O no hydrogen 2.663 N/A GLY 69.A N GLU 95.A OE2 no hydrogen 3.087 N/A GLY 71.A N PHE 93.A O no hydrogen 3.263 N/A TYR 72.A N TYR 110.A O no hydrogen 2.838 N/A PHE 73.A N ASN 91.A O no hydrogen 2.932 N/A GLY 74.A N TRP 108.A O no hydrogen 2.993 N/A VAL 76.A N VAL 106.A O no hydrogen 2.999 N/A PHE 77.A N GLN 88.A OE1 no hydrogen 2.803 N/A CYS 80.A SG PHE 77.A O no hydrogen 3.617 N/A THR 83.A N HIS 87.A O no hydrogen 2.761 N/A THR 83.A OG1 HIS 87.A O no hydrogen 3.530 N/A HIS 87.A N THR 83.A O no hydrogen 3.213 N/A GLN 88.A NE2 PHE 77.A O no hydrogen 2.957 N/A GLN 88.A NE2 CYS 80.A O no hydrogen 3.459 N/A ASN 91.A N PHE 73.A O no hydrogen 2.995 N/A ARG 92.A NH1 ASP 112.A OD2 no hydrogen 3.190 N/A PHE 93.A N GLY 71.A O no hydrogen 3.023 N/A ARG 94.A N ASP 97.A OD2 no hydrogen 2.699 N/A GLY 96.A N ILE 66.A O no hydrogen 2.758 N/A ASP 97.A N ARG 94.A O no hydrogen 2.830 N/A ILE 98.A N LEU 215.A O no hydrogen 2.832 N/A ILE 99.A N ILE 64.A O no hydrogen 2.786 N/A ALA 100.A N LEU 213.A O no hydrogen 2.999 N/A VAL 101.A N GLN 62.A O no hydrogen 2.856 N/A GLY 104.A N SER 58.A O no hydrogen 2.819 N/A ILE 105.A N PRO 102.A O no hydrogen 3.281 N/A PHE 107.A N TYR 56.A O no hydrogen 3.038 N/A TRP 108.A N GLY 74.A O no hydrogen 3.054 N/A MET 109.A N ARG 53.A O no hydrogen 3.204 N/A TYR 110.A N TYR 72.A O no hydrogen 2.721 N/A ASN 111.A N ALA 51.A O no hydrogen 3.010 N/A ASN 111.A ND2 LEU 47.A O no hydrogen 3.048 N/A ASN 111.A ND2 GLN 48.A O no hydrogen 3.248 N/A ASN 111.A ND2 THR 115.A O no hydrogen 2.961 N/A GLN 113.A N ASN 111.A OD1 no hydrogen 3.206 N/A VAL 117.A N LEU 47.A O no hydrogen 2.843 N/A ILE 118.A N GLN 68.A O no hydrogen 2.834 N/A ALA 119.A N ALA 45.A O no hydrogen 2.795 N/A VAL 120.A N PHE 65.A O no hydrogen 2.824 N/A SER 121.A N SER 43.A O no hydrogen 2.733 N/A LEU 122.A N GLU 63.A O no hydrogen 2.759 N/A THR 123.A N ALA 41.A O no hydrogen 2.973 N/A ASP 124.A N PRO 61.A O no hydrogen 2.915 N/A ILE 125.A N THR 123.A O no hydrogen 2.894 N/A ARG 126.A N GLY 39.A O no hydrogen 2.906 N/A ARG 126.A NE ALA 38.A O no hydrogen 2.938 N/A ARG 126.A NH2 CYS 37.A O no hydrogen 3.318 N/A SER 127.A N ASP 124.A O no hydrogen 2.970 N/A ASN 129.A N SER 127.A OG no hydrogen 2.965 N/A ASN 129.A ND2 TRP 246.A O no hydrogen 3.286 N/A ASN 130.A N SER 127.A O no hydrogen 3.228 N/A ASN 130.A ND2 ILE 125.A O no hydrogen 2.886 N/A ASN 130.A ND2 ASP 133.A O no hydrogen 2.842 N/A LEU 132.A N ASN 130.A OD1 no hydrogen 3.079 N/A MET 135.A N ASP 133.A OD1 no hydrogen 3.158 N/A ARG 137.A NH1 ASP 133.A OD1 no hydrogen 2.522 N/A ARG 137.A NH1 MET 135.A O no hydrogen 3.502 N/A ARG 138.A N GLN 147.A OE1 no hydrogen 3.282 N/A ARG 138.A NH1 SER 43.A OG no hydrogen 3.332 N/A ARG 138.A NH1 GLU 148.A OE2 no hydrogen 2.564 N/A PHE 139.A N TYR 57.A O no hydrogen 2.736 N/A TYR 140.A OH GLU 148.A OE1 no hydrogen 2.805 N/A TYR 140.A OH GLU 148.A OE2 no hydrogen 3.153 N/A LEU 141.A N PRO 55.A O no hydrogen 3.317 N/A ASN 144.A ND2 GLY 183.A O no hydrogen 2.815 N/A ASN 144.A ND2 GLU 186.A O no hydrogen 3.150 N/A HIS 145.A ND1 GLU 146.A O no hydrogen 3.072 N/A GLU 146.A N GLU 188.A OE1 no hydrogen 3.204 N/A GLU 146.A N GLU 188.A OE2 no hydrogen 3.404 N/A GLU 148.A N GLU 148.A OE1 no hydrogen 2.535 N/A LEU 150.A N GLN 147.A O no hydrogen 3.004 N/A TYR 152.A N PHE 149.A O no hydrogen 3.297 N/A TYR 152.A OH ASP 15.A OD1 no hydrogen 3.101 N/A TYR 152.A OH ASN 16.A OD1 no hydrogen 2.637 N/A TYR 152.A OH THR 27.A OG1 no hydrogen 2.493 N/A GLN 153.A N LEU 150.A O no hydrogen 2.743 N/A ILE 158.A N TYR 140.A O no hydrogen 3.169 N/A SER 160.A N ASN 157.A O no hydrogen 3.160 N/A SER 160.A OG ASN 157.A O no hydrogen 2.631 N/A GLY 161.A N ILE 158.A O no hydrogen 3.437 N/A PHE 162.A N PHE 159.A O no hydrogen 3.131 N/A ARG 164.A NH1 ASP 179.A OD1 no hydrogen 3.324 N/A LEU 167.A N LYS 163.A O no hydrogen 3.313 N/A GLU 168.A N ARG 164.A O no hydrogen 2.762 N/A ASP 169.A N ASP 165.A O no hydrogen 2.936 N/A ALA 170.A N PHE 166.A O no hydrogen 2.837 N/A PHE 171.A N LEU 167.A O no hydrogen 2.977 N/A ILE 177.A N ASN 174.A OD1 no hydrogen 2.934 N/A VAL 178.A N ASN 174.A O no hydrogen 3.074 N/A ASP 179.A N ARG 175.A O no hydrogen 2.993 N/A ARG 180.A N HIS 176.A O no hydrogen 2.984 N/A LEU 181.A N ILE 177.A O no hydrogen 2.808 N/A GLN 182.A N VAL 178.A O no hydrogen 2.970 N/A GLY 183.A N ARG 180.A O no hydrogen 2.954 N/A ARG 184.A N ASP 179.A O no hydrogen 3.243 N/A GLU 189.A N ASP 187.A OD2 no hydrogen 3.048 N/A LYS 190.A N ASP 187.A O no hydrogen 3.009 N/A LYS 190.A NZ GLU 21.A OE1 no hydrogen 2.909 N/A ILE 193.A N SER 20.A OG no hydrogen 3.175 N/A VAL 194.A N LEU 52.A O no hydrogen 2.974 N/A LYS 195.A N GLU 21.A OE2 no hydrogen 2.755 N/A LYS 195.A NZ ARG 49.A O no hydrogen 2.818 N/A VAL 196.A N ASN 50.A O no hydrogen 2.693 N/A ARG 214.A NE ARG 92.A O no hydrogen 3.343 N/A ARG 214.A NH1 ARG 214.A O no hydrogen 3.559 N/A LEU 215.A N ILE 98.A O no hydrogen 3.098 N/A ASN 216.A ND2 GLU 95.A O no hydrogen 3.031 N/A ASN 216.A ND2 ASP 97.A OD1 no hydrogen 3.023 N/A ILE 217.A N GLY 96.A O no hydrogen 2.890 N/A GLY 218.A N ASN 216.A OD1 no hydrogen 2.808 N/A SER 221.A N GLY 218.A O no hydrogen 3.088 N/A SER 221.A OG GLY 218.A O no hydrogen 2.679 N/A ASP 224.A N ILE 233.A O no hydrogen 2.720 N/A ILE 225.A N ILE 233.A O no hydrogen 3.219 N/A ASN 227.A N GLY 231.A O no hydrogen 2.824 N/A GLU 229.A N ASN 227.A OD1 no hydrogen 3.217 N/A ALA 230.A N ASN 227.A O no hydrogen 2.799 N/A GLY 231.A N ASN 227.A O no hydrogen 2.905 N/A ARG 232.A N SER 255.A O no hydrogen 3.112 N/A ARG 232.A NH2 SER 221.A O no hydrogen 3.363 N/A ILE 233.A N ILE 225.A O no hydrogen 2.939 N/A LYS 234.A N HIS 253.A O no hydrogen 2.879 N/A LYS 234.A NZ SER 222.A O no hydrogen 2.977 N/A THR 235.A N ASP 224.A OD2 no hydrogen 2.738 N/A THR 235.A OG1 ASP 224.A OD2 no hydrogen 2.645 N/A VAL 236.A N ALA 251.A O no hydrogen 2.749 N/A THR 237.A N ASP 240.A OD1 no hydrogen 2.970 N/A THR 237.A OG1 ASP 240.A OD1 no hydrogen 3.335 N/A SER 238.A N ASP 330.A O no hydrogen 3.193 N/A SER 238.A OG ASP 330.A OD2 no hydrogen 2.570 N/A LEU 239.A N THR 237.A OG1 no hydrogen 3.246 N/A ASP 240.A N THR 237.A O no hydrogen 3.066 N/A LEU 241.A N THR 237.A O no hydrogen 2.910 N/A LEU 244.A N LEU 241.A O no hydrogen 2.852 N/A ARG 245.A N PRO 242.A O no hydrogen 3.072 N/A TRP 246.A N VAL 243.A O no hydrogen 3.081 N/A SER 250.A N LYS 327.A O no hydrogen 2.928 N/A SER 250.A OG ASN 329.A O no hydrogen 2.375 N/A ALA 251.A N VAL 236.A O no hydrogen 3.205 N/A GLU 252.A N ALA 325.A O no hydrogen 2.890 N/A HIS 253.A N LYS 234.A O no hydrogen 2.728 N/A GLY 254.A N TYR 323.A O no hydrogen 2.956 N/A SER 255.A N ARG 232.A O no hydrogen 2.838 N/A LEU 256.A N PHE 321.A O no hydrogen 2.678 N/A HIS 257.A N ALA 230.A O no hydrogen 2.690 N/A LYS 258.A NZ LEU 317.A O no hydrogen 3.561 N/A ASN 259.A N SER 316.A O no hydrogen 2.933 N/A ASN 259.A ND2 SER 316.A O no hydrogen 3.440 N/A ALA 260.A N HIS 257.A O no hydrogen 3.141 N/A MET 261.A N VAL 376.A O no hydrogen 2.966 N/A PHE 262.A N ALA 314.A O no hydrogen 3.182 N/A VAL 263.A N PHE 374.A O no hydrogen 2.935 N/A HIS 265.A N VAL 312.A O no hydrogen 3.015 N/A HIS 265.A ND1 VAL 263.A O no hydrogen 2.986 N/A TYR 266.A N ALA 335.A O no hydrogen 3.114 N/A LEU 268.A N GLY 333.A O no hydrogen 2.790 N/A ASN 269.A ND2 ARG 331.A O no hydrogen 3.452 N/A ASN 271.A N THR 328.A OG1 no hydrogen 3.074 N/A ASN 271.A ND2 ALA 38.A O no hydrogen 3.089 N/A SER 272.A N VAL 306.A O no hydrogen 2.982 N/A ILE 273.A N PHE 326.A O no hydrogen 2.842 N/A ILE 274.A N LEU 304.A O no hydrogen 2.787 N/A TYR 275.A N VAL 324.A O no hydrogen 2.988 N/A TYR 275.A OH GLN 67.A OE1 no hydrogen 2.812 N/A ALA 276.A N ARG 302.A O no hydrogen 2.829 N/A LEU 277.A N SER 322.A O no hydrogen 2.755 N/A LYS 278.A N SER 322.A O no hydrogen 3.055 N/A ARG 280.A N SER 318.A OG no hydrogen 2.919 N/A ARG 280.A NH1 GLU 297.A OE1 no hydrogen 3.118 N/A ALA 281.A N LEU 298.A O no hydrogen 3.033 N/A ARG 282.A N LYS 315.A O no hydrogen 2.684 N/A LEU 283.A N GLY 296.A O no hydrogen 2.805 N/A GLN 284.A N ALA 313.A O no hydrogen 2.957 N/A VAL 285.A N PHE 294.A O no hydrogen 3.045 N/A VAL 286.A N ALA 311.A O no hydrogen 2.798 N/A ASN 287.A N ASN 291.A O no hydrogen 3.131 N/A CYS 288.A SG ASN 289.A OD1 no hydrogen 3.377 N/A ASN 289.A N ASN 287.A OD1 no hydrogen 3.024 N/A ASN 291.A N ASN 287.A OD1 no hydrogen 2.895 N/A VAL 293.A N VAL 285.A O no hydrogen 3.066 N/A PHE 294.A N VAL 285.A O no hydrogen 3.336 N/A GLY 296.A N LEU 283.A O no hydrogen 3.029 N/A LEU 298.A N ALA 281.A O no hydrogen 2.785 N/A ALA 300.A N GLY 279.A O no hydrogen 2.746 N/A GLY 301.A N ALA 276.A O no hydrogen 2.681 N/A ARG 302.A N GLU 299.A O no hydrogen 3.143 N/A ALA 303.A N LEU 12.A O no hydrogen 2.946 N/A LEU 304.A N ILE 274.A O no hydrogen 2.726 N/A VAL 306.A N SER 272.A O no hydrogen 2.707 N/A GLN 308.A N ASN 271.A OD1 no hydrogen 3.056 N/A GLN 308.A NE2 LEU 268.A O no hydrogen 2.796 N/A ASN 309.A N ASN 267.A O no hydrogen 2.967 N/A ASN 309.A ND2 ASN 267.A O no hydrogen 2.787 N/A ASN 309.A ND2 LEU 268.A O no hydrogen 2.955 N/A TYR 310.A N PRO 307.A O no hydrogen 3.173 N/A TYR 310.A OH CYS 4.A O no hydrogen 3.244 N/A ALA 311.A N VAL 286.A O no hydrogen 3.033 N/A VAL 312.A N HIS 265.A O no hydrogen 2.763 N/A ALA 313.A N GLN 284.A O no hydrogen 2.895 N/A LYS 315.A N ARG 282.A O no hydrogen 2.715 N/A SER 316.A N ALA 260.A O no hydrogen 3.041 N/A SER 316.A OG SER 318.A O no hydrogen 2.901 N/A LEU 317.A N ARG 280.A O no hydrogen 3.078 N/A SER 318.A N SER 316.A OG no hydrogen 3.193 N/A ARG 320.A NH1 ASP 319.A O no hydrogen 2.540 N/A PHE 321.A N LEU 256.A O no hydrogen 2.892 N/A SER 322.A N LYS 278.A O no hydrogen 3.114 N/A TYR 323.A N GLY 254.A O no hydrogen 2.945 N/A TYR 323.A OH GLU 252.A OE2 no hydrogen 2.887 N/A VAL 324.A N TYR 275.A O no hydrogen 3.051 N/A ALA 325.A N GLU 252.A O no hydrogen 2.663 N/A PHE 326.A N ILE 273.A O no hydrogen 2.858 N/A LYS 327.A N SER 250.A O no hydrogen 2.852 N/A LYS 327.A NZ GLU 252.A OE1 no hydrogen 2.904 N/A LYS 327.A NZ ASN 267.A OD1 no hydrogen 3.129 N/A THR 328.A N ASN 271.A O no hydrogen 3.104 N/A ARG 331.A N ASN 329.A OD1 no hydrogen 2.881 N/A GLY 333.A N ASN 269.A OD1 no hydrogen 3.509 N/A ALA 335.A N TYR 266.A O no hydrogen 2.868 N/A LEU 337.A N PRO 264.A O no hydrogen 2.860 N/A THR 340.A N PHE 372.A O no hydrogen 2.641 N/A THR 340.A OG1 PRO 371.A O no hydrogen 2.774 N/A SER 342.A OG GLY 339.A O no hydrogen 2.901 N/A VAL 343.A N ARG 336.A O no hydrogen 2.914 N/A ASN 345.A ND2 LYS 367.A O no hydrogen 2.752 N/A ASN 346.A N SER 342.A O no hydrogen 3.048 N/A LEU 347.A N ILE 344.A O no hydrogen 2.918 N/A VAL 352.A N PRO 348.A O no hydrogen 3.069 N/A ALA 353.A N LEU 349.A O no hydrogen 2.974 N/A ALA 354.A N ASP 350.A O no hydrogen 2.811 N/A THR 355.A N VAL 351.A O no hydrogen 2.767 N/A THR 355.A OG1 VAL 351.A O no hydrogen 2.645 N/A PHE 356.A N VAL 352.A O no hydrogen 3.166 N/A LEU 358.A N ALA 353.A O no hydrogen 3.005 N/A GLN 359.A N GLU 362.A OE1 no hydrogen 2.838 N/A ASN 361.A ND2 GLN 359.A OE1 no hydrogen 2.800 N/A ALA 363.A N GLN 359.A O no hydrogen 3.063 N/A ARG 364.A N ARG 360.A O no hydrogen 3.093 N/A GLN 365.A N ASN 361.A O no hydrogen 3.227 N/A LEU 366.A N GLU 362.A O no hydrogen 2.879 N/A LYS 367.A N ALA 363.A O no hydrogen 2.971 N/A LYS 367.A NZ ASN 345.A O no hydrogen 2.852 N/A LYS 367.A NZ LEU 347.A O no hydrogen 2.709 N/A SER 368.A N ARG 364.A O no hydrogen 2.783 N/A ASN 369.A N GLN 365.A O no hydrogen 2.940 N/A PHE 372.A N ASN 370.A OD1 no hydrogen 2.899 N/A VAL 376.A N MET 261.A O no hydrogen 2.801 N/A