Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mjr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 58.A OE2.B no hydrogen 2.852 N/A LYS 2.A N GLU 58.A O no hydrogen 3.027 N/A PHE 3.A N VAL 84.A O no hydrogen 3.056 N/A VAL 5.A N ILE 82.A O no hydrogen 2.936 N/A ARG 7.A N ALA 80.A O no hydrogen 2.830 N/A ARG 7.A NE CYS 73.A O no hydrogen 2.825 N/A ARG 7.A NH2 ARG 74.A O no hydrogen 2.839 N/A HIS 9.A N GLU 6.A O no hydrogen 3.001 N/A LEU 10.A N ARG 7.A O no hydrogen 2.876 N/A LEU 14.A N LEU 10.A O no hydrogen 2.890 N/A GLN 15.A N LEU 11.A O no hydrogen 3.042 N/A GLN 16.A N LYS 12.A O no hydrogen 3.029 N/A GLN 16.A NE2 ARG 199.A O no hydrogen 3.097 N/A VAL 17.A N PRO 13.A O no hydrogen 2.978 N/A SER 18.A N LEU 14.A O no hydrogen 3.028 N/A SER 18.A OG LEU 14.A O no hydrogen 2.952 N/A GLY 19.A N GLN 16.A O no hydrogen 3.319 N/A GLY 25.A N PRO 22.A O no hydrogen 2.935 N/A ASN 26.A N ILE 23.A O no hydrogen 3.019 N/A ASN 26.A ND2 THR 63.A OG1 no hydrogen 2.995 N/A LEU 27.A N VAL 64.A O no hydrogen 2.775 N/A LEU 28.A N THR 39.A O no hydrogen 2.943 N/A LEU 29.A N THR 62.A O no hydrogen 2.852 N/A GLN 30.A N SER 37.A O no hydrogen 3.042 N/A VAL 31.A N GLY 60.A O no hydrogen 2.754 N/A ALA 32.A N THR 35.A O no hydrogen 3.026 N/A THR 35.A N ALA 32.A O no hydrogen 2.964 N/A THR 35.A OG1.A ASP 33.A O no hydrogen 3.002 N/A THR 35.A OG1.B ALA 32.A O no hydrogen 2.837 N/A LEU 36.A N VAL 51.A O no hydrogen 2.790 N/A SER 37.A N GLN 30.A O no hydrogen 2.876 N/A LEU 38.A N ALA 49.A O no hydrogen 2.811 N/A THR 39.A N LEU 28.A O no hydrogen 2.896 N/A GLY 40.A N MET 47.A O no hydrogen 3.053 N/A THR 41.A OG1 MET 45.A O no hydrogen 2.686 N/A ASP 42.A N MET 45.A O no hydrogen 3.166 N/A LEU 43.A N THR 41.A OG1 no hydrogen 3.106 N/A GLU 44.A N ASP 42.A OD1 no hydrogen 2.900 N/A MET 45.A N ASP 42.A OD1 no hydrogen 2.870 N/A GLU 46.A N THR 227.A O no hydrogen 2.784 N/A MET 47.A N GLY 40.A O no hydrogen 2.877 N/A VAL 48.A N ILE 225.A O no hydrogen 2.852 N/A ALA 49.A N LEU 38.A O no hydrogen 2.878 N/A ARG 50.A N ASP 223.A O no hydrogen 3.098 N/A ARG 50.A NH1.B SER 37.A OG no hydrogen 2.761 N/A VAL 51.A N LEU 36.A O no hydrogen 2.815 N/A LEU 53.A N GLY 34.A O no hydrogen 2.942 N/A GLN 55.A NE2 GLU 81.A OE2 no hydrogen 2.786 N/A HIS 57.A ND1 GLN 55.A O no hydrogen 2.810 N/A GLU 58.A N LYS 2.A O no hydrogen 2.824 N/A GLY 60.A N VAL 31.A O no hydrogen 3.114 N/A THR 62.A N LEU 29.A O no hydrogen 3.031 N/A THR 63.A N LEU 105.A O no hydrogen 3.155 N/A THR 63.A OG1 LEU 105.A O no hydrogen 2.696 N/A VAL 64.A N LEU 27.A O no hydrogen 3.010 N/A ALA 66.A N GLY 25.A O no hydrogen 2.940 N/A PHE 69.A N PRO 65.A O no hydrogen 2.996 N/A PHE 70.A N ALA 66.A O no hydrogen 2.805 N/A ASP 71.A N ARG 67.A O no hydrogen 2.728 N/A ILE 72.A N LYS 68.A O no hydrogen 2.927 N/A CYS 73.A N PHE 69.A O no hydrogen 3.032 N/A CYS 73.A SG PHE 69.A O no hydrogen 3.405 N/A ARG 74.A N PHE 70.A O no hydrogen 2.888 N/A ARG 74.A NH2 ASP 71.A OD1 no hydrogen 2.734 N/A GLY 75.A N ASP 71.A O no hydrogen 2.915 N/A LEU 76.A N ILE 72.A O no hydrogen 3.188 N/A LEU 76.A N CYS 73.A O no hydrogen 3.316 N/A ALA 80.A N PRO 77.A O no hydrogen 3.064 N/A ILE 82.A N VAL 5.A O no hydrogen 2.792 N/A ALA 83.A N ARG 94.A O no hydrogen 2.843 N/A VAL 84.A N PHE 3.A O no hydrogen 2.816 N/A GLN 85.A N LEU 92.A O no hydrogen 3.048 N/A LEU 86.A N MET 1.A O no hydrogen 2.977 N/A GLU 87.A N ARG 90.A O no hydrogen 2.779 N/A ARG 90.A N GLU 87.A O no hydrogen 3.171 N/A MET 91.A N LEU 102.A O no hydrogen 2.773 N/A LEU 92.A N GLN 85.A O no hydrogen 2.838 N/A VAL 93.A N PHE 100.A O no hydrogen 2.832 N/A ARG 94.A N ALA 83.A O no hydrogen 2.812 N/A SER 95.A N SER 98.A O no hydrogen 2.970 N/A SER 95.A OG GLU 81.A O no hydrogen 2.568 N/A SER 98.A N SER 95.A O no hydrogen 2.869 N/A PHE 100.A N VAL 93.A O no hydrogen 2.811 N/A LEU 102.A N MET 91.A O no hydrogen 2.889 N/A THR 104.A N GLU 89.A O no hydrogen 3.247 N/A THR 104.A OG1 GLY 88.A O no hydrogen 3.128 N/A LEU 105.A N THR 63.A O no hydrogen 3.182 N/A ASP 109.A N PRO 106.A O no hydrogen 2.971 N/A PHE 110.A N ALA 107.A O no hydrogen 2.873 N/A GLN 117.A NE2.A SER 118.A O no hydrogen 2.680 N/A SER 118.A OG GLU 121.A OE2 no hydrogen 2.705 N/A GLU 119.A N ILE 212.A O no hydrogen 2.772 N/A VAL 120.A N ILE 212.A O no hydrogen 3.003 N/A PHE 122.A N VAL 210.A O no hydrogen 3.148 N/A LEU 124.A N LEU 208.A O no hydrogen 2.948 N/A GLN 126.A N ASN 206.A O no hydrogen 2.905 N/A GLN 126.A NE2 ASP 202.A OD1 no hydrogen 2.777 N/A GLN 126.A NE2 GLY 204.A O no hydrogen 2.948 N/A THR 128.A N PRO 125.A O no hydrogen 2.959 N/A MET 129.A N PRO 125.A O no hydrogen 3.392 N/A LYS 130.A N GLN 126.A O no hydrogen 2.862 N/A LYS 130.A NZ MET 198.A O no hydrogen 3.230 N/A LYS 130.A NZ LEU 201.A O no hydrogen 2.515 N/A ARG 131.A N ALA 127.A O no hydrogen 3.043 N/A LEU 132.A N THR 128.A O no hydrogen 3.037 N/A ILE 133.A N MET 129.A O no hydrogen 3.091 N/A GLU 134.A N LYS 130.A O no hydrogen 2.874 N/A ALA 135.A N ARG 131.A O no hydrogen 3.048 N/A THR 136.A N ILE 133.A O no hydrogen 3.123 N/A THR 136.A OG1 LEU 132.A O no hydrogen 3.041 N/A THR 136.A OG1 ILE 133.A O no hydrogen 3.498 N/A THR 136.A OG1 THR 163.A OG1 no hydrogen 3.264 N/A GLN 137.A N ILE 133.A O no hydrogen 2.882 N/A SER 139.A N THR 136.A O no hydrogen 3.066 N/A MET 140.A N GLN 137.A O no hydrogen 3.083 N/A ALA 141.A N LEU 149.A O no hydrogen 3.051 N/A ASP 144.A N ASN 150.A OD1 no hydrogen 2.948 N/A ARG 146.A N ASP 144.A OD1 no hydrogen 2.720 N/A ARG 146.A NE ASP 144.A OD1 no hydrogen 2.933 N/A ARG 146.A NH2 ASP 144.A OD2 no hydrogen 3.111 N/A TYR 147.A N VAL 145.A O no hydrogen 2.889 N/A TYR 147.A OH ASP 232.A O no hydrogen 3.173 N/A LEU 149.A N ARG 146.A O no hydrogen 2.908 N/A ASN 150.A N TYR 147.A O no hydrogen 3.119 N/A ASN 150.A ND2 ASP 144.A O no hydrogen 2.937 N/A MET 152.A N VAL 189.A O no hydrogen 2.878 N/A LEU 153.A N VAL 164.A O no hydrogen 2.839 N/A PHE 154.A N VAL 187.A O no hydrogen 2.780 N/A GLU 155.A N ARG 162.A O no hydrogen 2.822 N/A THR 156.A N HIS 185.A O no hydrogen 2.819 N/A THR 156.A OG1 PRO 183.A O no hydrogen 2.638 N/A THR 156.A OG1 HIS 185.A O no hydrogen 3.365 N/A GLU 157.A N GLU 160.A O no hydrogen 3.046 N/A GLU 160.A N GLU 157.A O no hydrogen 3.002 N/A LEU 161.A N MET 176.A O no hydrogen 2.997 N/A ARG 162.A N GLU 155.A O no hydrogen 2.810 N/A ARG 162.A NE SER 175.A OG no hydrogen 2.990 N/A ARG 162.A NH1 GLU 155.A OE1 no hydrogen 2.931 N/A ARG 162.A NH1 GLU 157.A OE1 no hydrogen 2.778 N/A ARG 162.A NH2 GLU 157.A OE1 no hydrogen 3.117 N/A THR 163.A N CYS 174.A O no hydrogen 2.914 N/A THR 163.A OG1 LEU 132.A O no hydrogen 2.844 N/A THR 163.A OG1 THR 136.A OG1 no hydrogen 3.264 N/A VAL 164.A N LEU 153.A O no hydrogen 3.026 N/A ALA 165.A N ALA 172.A O no hydrogen 2.962 N/A THR 166.A OG1 ARG 170.A O no hydrogen 2.812 N/A ASP 167.A N ARG 170.A O no hydrogen 3.311 N/A GLY 168.A N THR 166.A OG1 no hydrogen 3.357 N/A HIS 169.A N ASP 167.A OD1 no hydrogen 2.946 N/A ARG 170.A N ASP 167.A OD1 no hydrogen 3.035 N/A ARG 170.A NE ASP 167.A OD2 no hydrogen 2.928 N/A ARG 170.A NH1 ASP 320.A OD2 no hydrogen 2.932 N/A LEU 171.A N VAL 354.A O no hydrogen 2.804 N/A ALA 172.A N ALA 165.A O no hydrogen 2.836 N/A VAL 173.A N ALA 352.A O no hydrogen 2.920 N/A CYS 174.A N THR 163.A O no hydrogen 2.995 N/A CYS 174.A SG SER 350.A O no hydrogen 3.690 N/A SER 175.A N SER 350.A O no hydrogen 2.954 N/A MET 176.A N LEU 161.A O no hydrogen 2.837 N/A ILE 178.A N GLU 159.A O no hydrogen 2.823 N/A LEU 182.A N GLY 158.A O no hydrogen 2.645 N/A HIS 185.A N THR 156.A O no hydrogen 3.181 N/A VAL 187.A N PHE 154.A O no hydrogen 3.035 N/A VAL 189.A N MET 152.A O no hydrogen 2.845 N/A ARG 191.A N ASN 150.A O no hydrogen 2.996 N/A ARG 191.A NH1 ALA 141.A O no hydrogen 2.809 N/A LYS 192.A NZ ASP 42.A OD2 no hydrogen 2.694 N/A VAL 194.A N PRO 190.A O no hydrogen 2.975 N/A ILE 195.A N ARG 191.A O no hydrogen 3.081 N/A GLU 196.A N LYS 192.A O no hydrogen 3.064 N/A LEU 197.A N GLY 193.A O no hydrogen 2.786 N/A MET 198.A N VAL 194.A O no hydrogen 2.849 N/A ARG 199.A N ILE 195.A O no hydrogen 2.964 N/A MET 200.A N GLU 196.A O no hydrogen 3.105 N/A MET 200.A N LEU 197.A O no hydrogen 3.038 N/A LEU 201.A N MET 198.A O no hydrogen 3.139 N/A GLY 204.A N ASP 202.A OD1 no hydrogen 2.998 N/A LEU 208.A N LEU 124.A O no hydrogen 2.789 N/A ARG 209.A N HIS 220.A O no hydrogen 2.950 N/A ARG 209.A NH1 THR 123.A OG1 no hydrogen 3.087 N/A ARG 209.A NH2 GLU 121.A OE1 no hydrogen 2.992 N/A VAL 210.A N PHE 122.A O no hydrogen 2.898 N/A GLN 211.A N ARG 218.A O no hydrogen 2.916 N/A GLN 211.A NE2 GLU 121.A OE2 no hydrogen 2.937 N/A ILE 212.A N VAL 120.A O no hydrogen 2.787 N/A GLY 213.A N ASN 216.A O no hydrogen 2.765 N/A SER 214.A OG ASN 215.A OD1 no hydrogen 2.904 N/A ILE 217.A N SER 228.A O no hydrogen 2.871 N/A ARG 218.A N GLN 211.A O no hydrogen 2.784 N/A ARG 218.A NE THR 227.A OG1 no hydrogen 2.926 N/A ARG 218.A NH2 THR 227.A OG1 no hydrogen 3.189 N/A ALA 219.A N PHE 226.A O no hydrogen 2.806 N/A HIS 220.A N ARG 209.A O no hydrogen 2.865 N/A VAL 221.A N PHE 224.A O no hydrogen 3.068 N/A PHE 224.A N VAL 221.A O no hydrogen 2.903 N/A ILE 225.A N VAL 48.A O no hydrogen 2.828 N/A PHE 226.A N ALA 219.A O no hydrogen 2.903 N/A THR 227.A N GLU 46.A O no hydrogen 2.939 N/A SER 228.A N ILE 217.A O no hydrogen 2.896 N/A SER 228.A OG LYS 229.A O no hydrogen 2.740 N/A LYS 229.A N GLU 44.A O no hydrogen 2.822 N/A LYS 229.A NZ LEU 43.A O no hydrogen 3.257 N/A LYS 229.A NZ GLU 44.A OE2 no hydrogen 3.311 N/A LEU 230.A N ASN 215.A O no hydrogen 2.962 N/A VAL 231.A N ILE 188.A O no hydrogen 2.884 N/A ARG 239.A N ASP 237.A OD1 no hydrogen 3.025 N/A ARG 239.A NE.B ASP 237.A OD1 no hydrogen 3.092 N/A ARG 239.A NE.B ASP 237.A OD2 no hydrogen 3.318 N/A ARG 239.A NH1.A ASP 237.A OD1 no hydrogen 2.624 N/A ARG 239.A NH2.A GLU 155.A OE1 no hydrogen 3.527 N/A ARG 239.A NH2.A GLU 155.A OE2 no hydrogen 2.724 N/A ARG 239.A NH2.B ASP 237.A OD2 no hydrogen 2.868 N/A ARG 240.A N ASP 237.A O no hydrogen 2.920 N/A VAL 241.A N TYR 238.A O no hydrogen 2.904 N/A LEU 242.A N TYR 238.A O no hydrogen 3.069 N/A LYS 248.A N LEU 334.A O no hydrogen 3.029 N/A LYS 248.A NZ ASP 247.A OD1 no hydrogen 2.967 N/A LYS 248.A NZ THR 335.A O no hydrogen 2.820 N/A HIS 249.A N SER 305.A O no hydrogen 3.027 N/A LEU 250.A N MET 332.A O no hydrogen 2.876 N/A GLU 251.A N THR 303.A O no hydrogen 2.785 N/A ALA 252.A N VAL 330.A O no hydrogen 3.091 N/A CYS 254.A N GLU 328.A O no hydrogen 2.924 N/A CYS 254.A SG LEU 322.A O no hydrogen 3.561 N/A LEU 257.A N GLY 253.A O no hydrogen 2.937 N/A LYS 258.A N CYS 254.A O no hydrogen 2.924 N/A LYS 258.A NZ ASP 255.A OD1 no hydrogen 3.507 N/A LYS 258.A NZ ASN 323.A OD1 no hydrogen 3.102 N/A GLN 259.A N ASP 255.A O no hydrogen 2.895 N/A GLN 259.A NE2 ASP 255.A OD1 no hydrogen 3.258 N/A GLN 259.A NE2 ASP 255.A OD2 no hydrogen 3.161 N/A ALA 260.A N LEU 256.A O no hydrogen 3.064 N/A PHE 261.A N LEU 257.A O no hydrogen 2.966 N/A ALA 262.A N LYS 258.A O no hydrogen 2.922 N/A ARG 263.A N GLN 259.A O no hydrogen 2.986 N/A ARG 263.A NE GLU 298.A OE2 no hydrogen 2.731 N/A ARG 263.A NH2 GLU 298.A OE1 no hydrogen 2.897 N/A ARG 263.A NH2 GLU 298.A OE2 no hydrogen 3.547 N/A ALA 264.A N ALA 260.A O no hydrogen 2.988 N/A ALA 265.A N PHE 261.A O no hydrogen 2.938 N/A ILE 266.A N ARG 263.A O no hydrogen 3.062 N/A LEU 267.A N ALA 264.A O no hydrogen 3.070 N/A SER 268.A N ALA 265.A O no hydrogen 3.078 N/A SER 268.A OG ALA 265.A O no hydrogen 2.656 N/A LYS 271.A N ASN 269.A OD1 no hydrogen 2.946 N/A PHE 272.A N ASN 269.A O no hydrogen 2.958 N/A ARG 273.A NH1 ALA 265.A O no hydrogen 2.969 N/A VAL 275.A N PHE 313.A O no hydrogen 2.946 N/A ARG 276.A N THR 287.A O no hydrogen 2.868 N/A ARG 276.A NH2 LEU 360.A O no hydrogen 2.792 N/A LEU 277.A N ILE 311.A O no hydrogen 2.689 N/A TYR 278.A N LYS 285.A O no hydrogen 2.776 N/A VAL 279.A N MET 309.A O no hydrogen 2.933 N/A SER 280.A N GLN 283.A O no hydrogen 3.186 N/A GLN 283.A N SER 280.A O no hydrogen 3.176 N/A LEU 284.A N LEU 300.A O no hydrogen 2.979 N/A LYS 285.A N TYR 278.A O no hydrogen 2.927 N/A ILE 286.A N GLU 298.A O no hydrogen 2.813 N/A THR 287.A N ARG 276.A O no hydrogen 2.821 N/A ALA 288.A N ALA 296.A O no hydrogen 3.076 N/A ASN 290.A N GLU 294.A O no hydrogen 3.305 N/A ASN 290.A ND2 GLU 294.A OE1 no hydrogen 2.831 N/A GLU 292.A N GLU 292.A OE1 no hydrogen 2.695 N/A GLN 293.A N ASN 290.A O no hydrogen 2.868 N/A GLU 294.A N ASN 290.A OD1 no hydrogen 3.025 N/A ALA 296.A N ALA 288.A O no hydrogen 2.891 N/A GLU 298.A N ILE 286.A O no hydrogen 2.837 N/A LEU 300.A N LEU 284.A O no hydrogen 2.830 N/A VAL 302.A N ASN 282.A O no hydrogen 3.137 N/A THR 303.A N GLU 251.A O no hydrogen 2.949 N/A TYR 304.A OH ALA 307.A O no hydrogen 2.608 N/A SER 305.A N HIS 249.A O no hydrogen 3.047 N/A MET 309.A N VAL 279.A O no hydrogen 3.208 N/A ILE 311.A N LEU 277.A O no hydrogen 2.857 N/A PHE 313.A N VAL 275.A O no hydrogen 2.937 N/A VAL 315.A N ARG 273.A O no hydrogen 3.049 N/A SER 316.A OG ASN 314.A OD1 no hydrogen 2.690 N/A TYR 317.A N ASN 314.A OD1 no hydrogen 3.044 N/A VAL 318.A N ASN 314.A O no hydrogen 3.396 N/A LEU 319.A N VAL 315.A O no hydrogen 2.851 N/A ASP 320.A N SER 316.A O no hydrogen 2.815 N/A VAL 321.A N TYR 317.A O no hydrogen 3.357 N/A LEU 322.A N VAL 318.A O no hydrogen 2.983 N/A ASN 323.A N LEU 319.A O no hydrogen 2.907 N/A ALA 324.A N ASP 320.A O no hydrogen 3.066 N/A LEU 325.A N VAL 321.A O no hydrogen 2.967 N/A LYS 326.A N LEU 322.A O no hydrogen 3.282 N/A CYS 327.A SG ASN 329.A O no hydrogen 3.415 N/A VAL 330.A N ALA 252.A O no hydrogen 2.864 N/A ARG 331.A N GLU 344.A O no hydrogen 2.764 N/A MET 332.A N LEU 250.A O no hydrogen 2.726 N/A MET 333.A N GLN 342.A O no hydrogen 2.775 N/A LEU 334.A N LYS 248.A O no hydrogen 2.744 N/A VAL 338.A N ASP 336.A OD1 no hydrogen 3.095 N/A SER 339.A N ASP 336.A O no hydrogen 3.410 N/A SER 339.A OG ASP 336.A OD1 no hydrogen 2.750 N/A VAL 341.A N VAL 355.A O no hydrogen 2.949 N/A GLN 342.A N MET 333.A O no hydrogen 3.100 N/A GLN 342.A NE2 GLU 344.A OE2 no hydrogen 2.433 N/A ILE 343.A N TYR 353.A O no hydrogen 2.780 N/A GLU 344.A N ARG 331.A O no hydrogen 2.971 N/A ALA 346.A N ASN 329.A O no hydrogen 2.865 N/A ALA 347.A N ASP 345.A OD1 no hydrogen 2.849 N/A SER 348.A N ASP 345.A O no hydrogen 3.391 N/A ALA 352.A N VAL 173.A O no hydrogen 2.866 N/A TYR 353.A N ILE 343.A O no hydrogen 3.035 N/A TYR 353.A OH ALA 135.A O no hydrogen 2.729 N/A VAL 354.A N LEU 171.A O no hydrogen 2.900 N/A VAL 355.A N VAL 341.A O no hydrogen 2.934 N/A MET 356.A N HIS 169.A O no hydrogen 3.009 N/A MET 358.A N GLY 312.A O no hydrogen 2.840 N/A