Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3skf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 6.A N SER 175.A OG no hydrogen 2.922 N/A ASN 7.A ND2 HIS 91.A O no hydrogen 3.060 N/A ASN 7.A ND2 MET 176.A O no hydrogen 2.760 N/A LEU 8.A N GLY 174.A O no hydrogen 3.239 N/A ARG 9.A N TYR 17.A O no hydrogen 3.208 N/A LYS 11.A NZ LEU 163.A O no hydrogen 3.278 N/A GLN 14.A N LYS 11.A O no hydrogen 3.307 N/A TYR 16.A OH GLU 341.A OE2 no hydrogen 2.550 N/A TYR 17.A N ARG 9.A O no hydrogen 2.781 N/A VAL 18.A N ILE 31.A O no hydrogen 2.804 N/A MET 20.A N LEU 29.A O no hydrogen 2.888 N/A THR 21.A N SER 88.A O no hydrogen 2.829 N/A VAL 22.A N GLN 27.A O no hydrogen 2.613 N/A GLY 23.A N LEU 86.A O no hydrogen 2.768 N/A SER 24.A N SER 59.A OG no hydrogen 3.111 N/A GLN 27.A N VAL 22.A O no hydrogen 3.103 N/A GLN 27.A NE2 GLN 55.A O no hydrogen 3.167 N/A LEU 29.A N MET 20.A O no hydrogen 2.860 N/A ASN 30.A N GLU 118.A OE2 no hydrogen 2.767 N/A ASN 30.A ND2 ASN 116.A O no hydrogen 2.885 N/A ASN 30.A ND2 ASN 116.A OD1 no hydrogen 2.609 N/A ILE 31.A N VAL 18.A O no hydrogen 2.870 N/A LEU 32.A N GLY 119.A O no hydrogen 2.688 N/A VAL 33.A N TYR 16.A O no hydrogen 2.861 N/A ASP 34.A N LEU 121.A O no hydrogen 3.079 N/A THR 35.A OG1 VAL 229.A O no hydrogen 2.947 N/A GLY 36.A N ASP 34.A OD1 no hydrogen 2.854 N/A SER 37.A OG ASP 34.A OD2 no hydrogen 2.709 N/A SER 38.A OG TYR 125.A O no hydrogen 2.583 N/A ASN 39.A ND2 ARG 130.A O no hydrogen 3.188 N/A ALA 41.A N ILE 120.A O no hydrogen 2.971 N/A VAL 42.A N ALA 102.A O no hydrogen 2.976 N/A GLY 43.A N GLU 118.A O no hydrogen 2.996 N/A ALA 44.A N ILE 104.A O no hydrogen 3.030 N/A PHE 49.A N HIS 47.A ND1 no hydrogen 2.862 N/A LEU 50.A N HIS 47.A O no hydrogen 2.891 N/A TYR 54.A N GLY 43.A O no hydrogen 2.708 N/A TYR 54.A OH ASP 85.A OD2 no hydrogen 2.547 N/A GLN 55.A N GLN 27.A OE1 no hydrogen 2.496 N/A ARG 56.A NH1 GLU 81.A OE1 no hydrogen 2.831 N/A ARG 56.A NH2 GLU 81.A OE1 no hydrogen 3.083 N/A GLN 57.A N GLN 57.A OE1 no hydrogen 2.706 N/A LEU 58.A N GLN 55.A O no hydrogen 3.303 N/A SER 59.A N ARG 56.A O no hydrogen 2.744 N/A SER 59.A OG ASP 85.A OD1 no hydrogen 3.464 N/A SER 59.A OG ASP 85.A OD2 no hydrogen 2.747 N/A SER 60.A N SER 24.A O no hydrogen 2.787 N/A THR 61.A OG1 ASP 85.A OD1 no hydrogen 3.307 N/A TYR 62.A N SER 59.A O no hydrogen 3.463 N/A ARG 63.A N THR 84.A O no hydrogen 3.082 N/A LEU 65.A N LEU 82.A O no hydrogen 3.149 N/A ARG 66.A N ASP 64.A OD1 no hydrogen 2.619 N/A VAL 69.A N GLY 80.A O no hydrogen 3.090 N/A VAL 71.A N TRP 78.A O no hydrogen 3.086 N/A TYR 73.A N GLY 76.A O no hydrogen 2.809 N/A GLN 75.A NE2 GLN 75.A O no hydrogen 2.793 N/A LYS 77.A N ASP 108.A O no hydrogen 3.156 N/A TRP 78.A N VAL 71.A O no hydrogen 3.280 N/A GLU 79.A N GLU 106.A O no hydrogen 2.808 N/A GLY 80.A N VAL 69.A O no hydrogen 2.784 N/A GLU 81.A N ALA 103.A O no hydrogen 2.893 N/A LEU 82.A N LYS 67.A O no hydrogen 2.843 N/A GLY 83.A N ILE 101.A O no hydrogen 3.223 N/A THR 84.A N ARG 63.A O no hydrogen 2.967 N/A ASP 85.A N ALA 99.A O no hydrogen 3.285 N/A LEU 86.A N ASP 85.A OD1 no hydrogen 2.670 N/A VAL 87.A N VAL 97.A O no hydrogen 2.649 N/A SER 88.A N THR 21.A O no hydrogen 3.108 N/A SER 88.A OG VAL 95.A O no hydrogen 2.914 N/A VAL 95.A N PRO 93.A O no hydrogen 2.810 N/A THR 96.A OG1 SER 88.A OG no hydrogen 2.986 N/A VAL 97.A N VAL 87.A O no hydrogen 2.947 N/A ARG 98.A N GLN 145.A OE1 no hydrogen 3.038 N/A ARG 98.A NH1 THR 61.A O no hydrogen 3.013 N/A ARG 98.A NH1 THR 84.A OG1 no hydrogen 3.034 N/A ARG 98.A NH2 THR 61.A O no hydrogen 2.861 N/A ALA 99.A N ASP 85.A O no hydrogen 3.078 N/A ASN 100.A ND2 GLU 136.A O no hydrogen 2.906 N/A ILE 101.A N GLY 83.A O no hydrogen 2.685 N/A ALA 102.A N PHE 40.A O no hydrogen 2.946 N/A ALA 103.A N GLU 81.A O no hydrogen 2.864 N/A ILE 104.A N VAL 42.A O no hydrogen 2.759 N/A THR 105.A N GLU 79.A O no hydrogen 2.906 N/A THR 105.A OG1 GLU 79.A O no hydrogen 3.350 N/A GLU 106.A N GLU 79.A O no hydrogen 3.062 N/A ASP 108.A N LYS 77.A O no hydrogen 3.069 N/A LYS 109.A NZ ASP 108.A OD2 no hydrogen 2.701 N/A SER 115.A N ILE 112.A O no hydrogen 3.199 N/A SER 115.A OG ILE 112.A O no hydrogen 2.838 N/A TRP 117.A NE1 GLN 14.A O no hydrogen 2.895 N/A GLU 118.A N ASN 30.A O no hydrogen 2.801 N/A ILE 120.A N ALA 41.A O no hydrogen 2.759 N/A LEU 121.A N LEU 32.A O no hydrogen 2.726 N/A GLY 122.A N ASN 39.A O no hydrogen 3.117 N/A LEU 123.A N ASP 34.A O no hydrogen 2.743 N/A ALA 124.A N SER 37.A O no hydrogen 2.703 N/A TYR 125.A N TRP 199.A O no hydrogen 3.076 N/A ILE 128.A N TYR 125.A O no hydrogen 3.095 N/A ALA 129.A N ALA 126.A O no hydrogen 2.882 N/A ARG 130.A N ASN 39.A OD1 no hydrogen 3.111 N/A SER 134.A N ASP 132.A OD2 no hydrogen 2.685 N/A SER 134.A OG ASP 132.A OD1 no hydrogen 2.920 N/A SER 134.A OG ASP 132.A OD2 no hydrogen 2.534 N/A LEU 135.A N ASP 132.A O no hydrogen 3.342 N/A SER 141.A N PRO 137.A O no hydrogen 3.161 N/A SER 141.A OG GLU 136.A OE1 no hydrogen 2.724 N/A LEU 142.A N PHE 138.A O no hydrogen 2.825 N/A VAL 143.A N PHE 139.A O no hydrogen 2.868 N/A LYS 144.A N ASP 140.A O no hydrogen 2.824 N/A GLN 145.A N SER 141.A O no hydrogen 3.041 N/A GLN 145.A NE2 ARG 98.A O no hydrogen 3.024 N/A THR 146.A N LEU 142.A O no hydrogen 3.199 N/A THR 146.A OG1 LEU 142.A O no hydrogen 2.397 N/A LEU 151.A N PRO 149.A O no hydrogen 2.630 N/A PHE 152.A N PHE 347.A O no hydrogen 3.296 N/A SER 153.A N ILE 177.A O no hydrogen 2.874 N/A SER 153.A OG ILE 177.A O no hydrogen 3.439 N/A SER 153.A OG GLY 180.A O no hydrogen 2.741 N/A SER 153.A OG TYR 344.A OH no hydrogen 2.526 N/A LEU 154.A N VAL 345.A O no hydrogen 2.888 N/A GLN 155.A N SER 175.A O no hydrogen 2.915 N/A CYS 157.A N GLY 173.A O no hydrogen 3.055 N/A CYS 157.A SG GLN 155.A O no hydrogen 3.671 N/A ASN 164.A N GLU 167.A OE1 no hydrogen 3.218 N/A SER 166.A OG ASN 164.A OD1 no hydrogen 3.230 N/A GLU 167.A N ASN 164.A O no hydrogen 2.724 N/A GLU 167.A N ASN 164.A OD1 no hydrogen 3.058 N/A VAL 168.A N ASN 164.A O no hydrogen 3.213 N/A LEU 169.A N GLN 165.A O no hydrogen 3.002 N/A ALA 170.A N SER 166.A O no hydrogen 3.259 N/A ALA 170.A N GLU 167.A O no hydrogen 2.919 N/A SER 171.A N GLU 167.A O no hydrogen 2.664 N/A SER 171.A OG VAL 172.A O no hydrogen 3.159 N/A GLY 173.A N LEU 8.A O no hydrogen 2.999 N/A SER 175.A N GLN 155.A O no hydrogen 2.889 N/A MET 176.A N ASN 7.A OD1 no hydrogen 2.634 N/A ILE 177.A N SER 153.A O no hydrogen 2.909 N/A GLY 179.A N LEU 151.A O no hydrogen 2.690 N/A ASP 182.A N TYR 344.A OH no hydrogen 3.027 N/A SER 184.A OG ASP 182.A OD2 no hydrogen 2.681 N/A LEU 185.A N ASP 182.A O no hydrogen 3.335 N/A TYR 186.A OH HIS 183.A ND1 no hydrogen 2.841 N/A THR 187.A N VAL 358.A O no hydrogen 2.990 N/A TRP 191.A N PHE 356.A O no hydrogen 2.757 N/A THR 193.A N ILE 354.A O no hydrogen 2.775 N/A THR 193.A OG1 MET 290.A O no hydrogen 2.874 N/A ILE 195.A N LYS 352.A O no hydrogen 3.124 N/A ARG 196.A N GLU 202.A O no hydrogen 2.812 N/A ARG 196.A NH1 GLU 202.A OE2 no hydrogen 3.362 N/A ARG 196.A NH1 TYR 386.A O no hydrogen 2.691 N/A ARG 196.A NH2 TYR 386.A O no hydrogen 2.889 N/A ARG 197.A NH2 GLU 127.A OE1 no hydrogen 3.358 N/A ARG 197.A NH2 GLU 127.A OE2 no hydrogen 2.382 N/A TRP 199.A NE1 GLU 202.A OE1 no hydrogen 2.986 N/A TYR 201.A OH LEU 123.A O no hydrogen 2.784 N/A VAL 203.A N SER 227.A O no hydrogen 2.860 N/A ILE 205.A N ASN 223.A OD1 no hydrogen 2.630 N/A VAL 206.A N TYR 288.A O no hydrogen 2.675 N/A ARG 207.A NE GLU 209.A OE2 no hydrogen 3.056 N/A ARG 207.A NH2 GLU 209.A OE2 no hydrogen 2.620 N/A GLU 209.A N SER 286.A O no hydrogen 3.102 N/A ILE 210.A N GLN 213.A O no hydrogen 2.882 N/A ASN 211.A N VAL 284.A O no hydrogen 2.873 N/A GLN 213.A N ILE 210.A O no hydrogen 3.045 N/A LEU 215.A N VAL 208.A O no hydrogen 2.919 N/A LYS 216.A N ASP 214.A OD1 no hydrogen 2.795 N/A MET 217.A N TYR 222.A OH no hydrogen 3.189 N/A LYS 220.A N ASP 218.A OD1 no hydrogen 3.198 N/A LYS 220.A NZ ASP 383.A O no hydrogen 2.737 N/A GLU 221.A N ASP 218.A O no hydrogen 2.854 N/A TYR 222.A N CYS 219.A O no hydrogen 2.849 N/A ASN 223.A N LYS 220.A O no hydrogen 2.849 N/A ASN 223.A ND2 ILE 205.A O no hydrogen 2.783 N/A ASN 223.A ND2 CYS 219.A O no hydrogen 3.402 N/A ASN 223.A ND2 CYS 384.A O no hydrogen 3.154 N/A LYS 226.A NZ ASP 225.A OD1 no hydrogen 3.269 N/A LYS 226.A NZ ASP 225.A OD2 no hydrogen 3.321 N/A LYS 226.A NZ THR 331.A O no hydrogen 2.785 N/A SER 227.A OG ASN 223.A OD1 no hydrogen 2.955 N/A ILE 228.A N THR 333.A O no hydrogen 2.983 N/A VAL 229.A N TYR 201.A O no hydrogen 3.014 N/A ASP 230.A N MET 335.A O no hydrogen 2.998 N/A SER 231.A N THR 35.A OG1 no hydrogen 2.681 N/A SER 231.A OG VAL 33.A O no hydrogen 3.057 N/A GLY 232.A N ASP 230.A OD1 no hydrogen 2.632 N/A THR 233.A N ASP 230.A O no hydrogen 3.250 N/A THR 233.A OG1 ASP 230.A OD2 no hydrogen 2.649 N/A THR 234.A OG1 SER 12.A O no hydrogen 2.832 N/A THR 234.A OG1 GLY 13.A O no hydrogen 3.408 N/A ASN 235.A ND2 SER 327.A OG no hydrogen 3.210 N/A LEU 236.A N ALA 325.A O no hydrogen 3.048 N/A ARG 237.A N VAL 334.A O no hydrogen 2.975 N/A ARG 237.A NH2 GLN 328.A O no hydrogen 3.310 N/A LEU 238.A N SER 327.A O no hydrogen 2.999 N/A LYS 240.A N SER 329.A O no hydrogen 3.083 N/A PHE 243.A N PRO 239.A O no hydrogen 2.858 N/A GLU 244.A N LYS 240.A O no hydrogen 3.057 N/A ALA 245.A N LYS 241.A O no hydrogen 3.351 N/A ALA 246.A N VAL 242.A O no hydrogen 2.931 N/A VAL 247.A N PHE 243.A O no hydrogen 2.820 N/A LYS 248.A N GLU 244.A O no hydrogen 2.997 N/A SER 249.A N ALA 245.A O no hydrogen 3.161 N/A ILE 250.A N ALA 246.A O no hydrogen 3.001 N/A LYS 251.A N VAL 247.A O no hydrogen 3.063 N/A ALA 252.A N LYS 248.A O no hydrogen 3.040 N/A ALA 253.A N SER 249.A O no hydrogen 3.290 N/A SER 254.A N ILE 250.A O no hydrogen 3.311 N/A SER 254.A N LYS 251.A O no hydrogen 3.170 N/A SER 254.A OG ILE 250.A O no hydrogen 3.264 N/A SER 254.A OG ILE 281.A O no hydrogen 3.302 N/A SER 255.A N ALA 252.A O no hydrogen 3.221 N/A SER 255.A OG ALA 252.A O no hydrogen 2.532 N/A PHE 263.A N PRO 260.A O no hydrogen 3.112 N/A LEU 265.A N ASP 261.A O no hydrogen 3.264 N/A GLY 266.A N PHE 263.A O no hydrogen 3.029 N/A GLU 267.A N GLY 262.A O no hydrogen 2.995 N/A GLN 268.A N GLY 262.A O no hydrogen 2.673 N/A GLN 268.A NE2 LEU 269.A O no hydrogen 3.648 N/A VAL 270.A N TYR 322.A O no hydrogen 3.007 N/A TRP 272.A N ASP 320.A O no hydrogen 3.139 N/A TRP 272.A NE1 GLU 257.A OE2 no hydrogen 2.967 N/A GLY 275.A N ASP 320.A OD2 no hydrogen 2.966 N/A THR 276.A N GLN 273.A O no hydrogen 2.811 N/A THR 277.A OG1 TYR 322.A OH no hydrogen 3.027 N/A ILE 281.A N PRO 278.A O no hydrogen 3.190 N/A PHE 282.A N TRP 279.A O no hydrogen 3.101 N/A VAL 284.A N ASN 211.A OD1 no hydrogen 2.925 N/A ILE 285.A N ILE 302.A O no hydrogen 2.919 N/A SER 286.A N GLU 209.A O no hydrogen 2.902 N/A SER 286.A OG THR 301.A OG1 no hydrogen 2.866 N/A LEU 287.A N ILE 300.A O no hydrogen 2.804 N/A TYR 288.A N ARG 207.A O no hydrogen 2.912 N/A TYR 288.A OH GLU 209.A OE2 no hydrogen 2.535 N/A LEU 289.A N PHE 298.A O no hydrogen 2.676 N/A MET 290.A N ILE 204.A O no hydrogen 3.100 N/A GLY 291.A N GLN 296.A O no hydrogen 3.106 N/A GLN 296.A N VAL 293.A O no hydrogen 3.087 N/A SER 297.A OG LEU 289.A O no hydrogen 3.444 N/A PHE 298.A N LEU 289.A O no hydrogen 3.100 N/A ARG 299.A N GLU 373.A O no hydrogen 2.985 N/A ARG 299.A NE GLU 373.A OE1 no hydrogen 3.466 N/A ARG 299.A NH1 TYR 288.A OH no hydrogen 2.819 N/A ARG 299.A NH2 GLU 373.A OE1 no hydrogen 3.192 N/A ILE 300.A N LEU 287.A O no hydrogen 2.868 N/A THR 301.A N ALA 371.A O no hydrogen 2.755 N/A THR 301.A OG1 SER 286.A OG no hydrogen 2.866 N/A ILE 302.A N ILE 285.A O no hydrogen 2.766 N/A LEU 303.A N GLN 306.A OE1 no hydrogen 2.885 N/A GLN 305.A N GLN 305.A OE1 no hydrogen 3.001 N/A GLN 305.A NE2 ASP 365.A OD2 no hydrogen 3.107 N/A GLN 306.A N LEU 303.A O no hydrogen 2.877 N/A GLN 306.A NE2 VAL 363.A O no hydrogen 3.079 N/A TYR 307.A N LEU 303.A O no hydrogen 3.350 N/A TYR 307.A OH PRO 283.A O no hydrogen 2.732 N/A LEU 308.A N PRO 304.A O no hydrogen 2.807 N/A ARG 309.A N LYS 323.A O no hydrogen 2.864 N/A VAL 311.A N CYS 321.A O no hydrogen 3.155 N/A SER 317.A OG ASP 313.A OD2 no hydrogen 2.729 N/A ASP 320.A N TRP 272.A O no hydrogen 2.961 N/A CYS 321.A SG ASP 313.A OD1 no hydrogen 3.599 N/A TYR 322.A N VAL 270.A O no hydrogen 2.988 N/A TYR 322.A OH THR 277.A OG1 no hydrogen 3.027 N/A LYS 323.A N ARG 309.A O no hydrogen 2.832 N/A ALA 325.A N TYR 307.A O no hydrogen 2.829 N/A SER 327.A N LEU 236.A O no hydrogen 3.241 N/A SER 329.A N LEU 238.A O no hydrogen 2.833 N/A SER 329.A OG GLY 332.A O no hydrogen 2.763 N/A THR 331.A N SER 329.A OG no hydrogen 3.125 N/A THR 333.A N LYS 226.A O no hydrogen 2.807 N/A THR 333.A OG1 TYR 222.A O no hydrogen 2.696 N/A VAL 334.A N ARG 237.A O no hydrogen 2.933 N/A MET 335.A N ILE 228.A O no hydrogen 2.891 N/A ALA 337.A N THR 233.A O no hydrogen 2.748 N/A VAL 338.A N THR 234.A O no hydrogen 3.064 N/A ILE 339.A N GLY 336.A O no hydrogen 3.160 N/A MET 340.A N GLY 336.A O no hydrogen 3.053 N/A GLU 341.A N ALA 337.A O no hydrogen 2.704 N/A GLY 342.A N ILE 339.A O no hydrogen 2.771 N/A PHE 343.A N MET 340.A O no hydrogen 3.148 N/A TYR 344.A N ALA 357.A O no hydrogen 2.707 N/A TYR 344.A OH SER 153.A OG no hydrogen 2.526 N/A VAL 345.A N LEU 154.A O no hydrogen 3.021 N/A VAL 346.A N GLY 355.A O no hydrogen 2.816 N/A PHE 347.A N PHE 152.A O no hydrogen 2.741 N/A ARG 349.A N PHE 347.A O no hydrogen 2.863 N/A ARG 349.A NE ASN 150.A OD1 no hydrogen 2.845 N/A ARG 349.A NH1 TYR 201.A OH no hydrogen 2.857 N/A ARG 349.A NH2 ASP 140.A OD1 no hydrogen 2.605 N/A ALA 350.A N ASN 150.A O no hydrogen 2.817 N/A ARG 351.A N ASP 348.A O no hydrogen 3.247 N/A ARG 351.A N ASP 348.A OD1 no hydrogen 3.196 N/A LYS 352.A N ARG 349.A O no hydrogen 2.863 N/A ARG 353.A N ASP 348.A O no hydrogen 3.139 N/A ARG 353.A NE ASP 348.A OD2 no hydrogen 2.917 N/A ARG 353.A NH1 GLU 292.A OE1 no hydrogen 3.037 N/A ARG 353.A NH2 ASP 348.A OD2 no hydrogen 2.958 N/A ILE 354.A N THR 193.A O no hydrogen 2.628 N/A GLY 355.A N VAL 346.A O no hydrogen 2.701 N/A PHE 356.A N TRP 191.A O no hydrogen 2.736 N/A ALA 357.A N TYR 344.A O no hydrogen 3.068 N/A SER 359.A N GLY 342.A O no hydrogen 3.081 N/A ALA 360.A N LEU 185.A O no hydrogen 3.151 N/A CYS 361.A N SER 359.A OG no hydrogen 3.184 N/A HIS 362.A N SER 359.A O no hydrogen 3.353 N/A HIS 362.A ND1 SER 359.A O no hydrogen 2.927 N/A HIS 364.A ND1 ASP 365.A O no hydrogen 2.541 N/A PHE 367.A N ASP 365.A OD1 no hydrogen 2.631 N/A ARG 368.A N ASP 365.A OD1 no hydrogen 3.040 N/A ARG 368.A NH1 TRP 279.A O no hydrogen 2.941 N/A ARG 368.A NH1 PHE 282.A O no hydrogen 2.992 N/A ARG 368.A NH2 PHE 282.A O no hydrogen 2.678 N/A THR 369.A OG1 HIS 362.A NE2 no hydrogen 3.406 N/A THR 369.A OG1 ALA 370.A O no hydrogen 3.266 N/A ALA 370.A N HIS 362.A NE2 no hydrogen 3.086 N/A ALA 371.A N THR 301.A O no hydrogen 3.224 N/A GLU 373.A N ARG 299.A O no hydrogen 3.000 N/A PHE 376.A N SER 297.A O no hydrogen 2.901 N/A