Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5m5j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 THR 101.A O no hydrogen 3.648 N/A ARG 2.A NE GLU 75.A OE1 no hydrogen 2.974 N/A ARG 2.A NH1 GLU 100.A OE2 no hydrogen 2.843 N/A ARG 2.A NH1 THR 102.A OG1 no hydrogen 3.133 N/A ARG 2.A NH2 GLU 75.A OE2 no hydrogen 3.466 N/A HIS 3.A NE2 ASP 105.A OD1 no hydrogen 2.563 N/A VAL 4.A N LEU 103.A O no hydrogen 2.935 N/A ARG 5.A N LYS 28.A O no hydrogen 2.751 N/A ILE 6.A N LYS 28.A O no hydrogen 3.197 N/A GLY 7.A N ALA 106.A O no hydrogen 2.711 N/A ILE 8.A N CYS 30.A O no hydrogen 3.096 N/A ILE 9.A N ILE 108.A O no hydrogen 2.802 N/A GLY 10.A N PHE 32.A O no hydrogen 2.779 N/A LEU 16.A N GLY 12.A O no hydrogen 2.739 N/A THR 17.A N PRO 13.A O no hydrogen 3.205 N/A THR 17.A OG1 PRO 13.A O no hydrogen 2.642 N/A ALA 18.A N ALA 14.A O no hydrogen 2.997 N/A GLY 19.A N GLY 15.A O no hydrogen 3.063 N/A ILE 20.A N LEU 16.A O no hydrogen 2.964 N/A TYR 21.A N THR 17.A O no hydrogen 3.018 N/A ALA 22.A N ALA 18.A O no hydrogen 2.838 N/A SER 23.A N GLY 19.A O no hydrogen 2.902 N/A SER 23.A OG GLY 19.A O no hydrogen 3.097 N/A ARG 24.A N ILE 20.A O no hydrogen 3.016 N/A ALA 25.A N TYR 21.A O no hydrogen 3.036 N/A ASN 26.A N SER 23.A O no hydrogen 2.871 N/A LEU 27.A N ALA 22.A O no hydrogen 3.242 N/A THR 29.A OG1 LEU 27.A O no hydrogen 2.913 N/A VAL 31.A N GLU 75.A O no hydrogen 2.718 N/A PHE 32.A N ILE 8.A O no hydrogen 2.861 N/A VAL 33.A N LEU 77.A O no hydrogen 2.787 N/A ILE 35.A N ASP 80.A OD1 no hydrogen 2.785 N/A GLU 36.A N ASP 80.A OD1 no hydrogen 3.190 N/A GLU 36.A N ASP 80.A OD2 no hydrogen 3.243 N/A HIS 37.A ND1 ASP 80.A OD1 no hydrogen 3.307 N/A GLN 40.A NE2 ALA 113.A O no hydrogen 3.417 N/A MET 41.A N SER 39.A OG no hydrogen 3.344 N/A PHE 42.A N SER 39.A O no hydrogen 3.153 N/A THR 43.A N GLN 40.A O no hydrogen 3.054 N/A THR 43.A OG1 GLN 40.A O no hydrogen 2.590 N/A THR 44.A N MET 41.A O no hydrogen 3.462 N/A THR 44.A OG1 GLN 128.A OE1 no hydrogen 3.094 N/A THR 45.A N GLN 128.A OE1 no hydrogen 3.119 N/A THR 45.A OG1 GLN 128.A OE1 no hydrogen 3.258 N/A VAL 47.A N ILE 56.A O no hydrogen 2.737 N/A SER 52.A OG PRO 51.A O no hydrogen 2.603 N/A HIS 53.A N PHE 50.A O no hydrogen 3.273 N/A ILE 56.A N VAL 47.A O no hydrogen 3.030 N/A LYS 57.A NZ ASP 46.A OD1 no hydrogen 3.143 N/A GLY 58.A N THR 45.A O no hydrogen 2.963 N/A LEU 61.A N LYS 57.A O no hydrogen 2.869 N/A MET 62.A N GLY 58.A O no hydrogen 3.056 N/A GLU 63.A N PRO 59.A O no hydrogen 2.849 N/A ALA 64.A N ALA 60.A O no hydrogen 3.050 N/A ILE 65.A N LEU 61.A O no hydrogen 3.090 N/A GLN 66.A N MET 62.A O no hydrogen 2.865 N/A ASN 67.A N GLU 63.A O no hydrogen 2.942 N/A ASN 67.A ND2 GLU 63.A OE1 no hydrogen 3.303 N/A GLN 68.A N ALA 64.A O no hydrogen 3.199 N/A ALA 69.A N ILE 65.A O no hydrogen 2.988 N/A GLU 70.A N GLN 66.A O no hydrogen 2.907 N/A HIS 71.A N ASN 67.A O no hydrogen 2.808 N/A CYS 72.A N GLN 68.A O no hydrogen 2.820 N/A CYS 72.A SG GLN 68.A O no hydrogen 3.542 N/A GLY 73.A N ALA 69.A O no hydrogen 3.246 N/A GLY 73.A N GLU 70.A O no hydrogen 3.068 N/A ALA 74.A N ALA 69.A O no hydrogen 2.989 N/A GLU 75.A N THR 29.A O no hydrogen 3.035 N/A LEU 77.A N VAL 31.A O no hydrogen 2.820 N/A HIS 82.A N VAL 94.A O no hydrogen 2.762 N/A HIS 82.A NE2 GLY 96.A O no hydrogen 2.798 N/A SER 83.A N VAL 94.A O no hydrogen 3.486 N/A ASP 85.A N LYS 92.A O no hydrogen 2.922 N/A SER 87.A N ASP 85.A OD1 no hydrogen 3.161 N/A SER 87.A OG ASP 85.A OD1 no hydrogen 2.842 N/A ARG 89.A NH1.B VAL 86.A O no hydrogen 2.558 N/A ARG 89.A NH2.B ASP 273.A OD1.B no hydrogen 3.038 N/A PHE 91.A N ALA 104.A O no hydrogen 2.807 N/A LYS 92.A N ASP 85.A O no hydrogen 3.269 N/A LYS 92.A NZ ASP 85.A OD2 no hydrogen 3.179 N/A LYS 92.A NZ SER 88.A OG no hydrogen 2.826 N/A ILE 93.A N THR 102.A O no hydrogen 2.705 N/A VAL 94.A N SER 83.A O no hydrogen 2.923 N/A HIS 95.A N GLU 100.A O no hydrogen 3.004 N/A HIS 95.A ND1 GLU 79.A OE1 no hydrogen 2.908 N/A HIS 95.A NE2 THR 102.A OG1 no hydrogen 2.708 N/A GLY 96.A N ASP 80.A O no hydrogen 2.917 N/A THR 102.A N ILE 93.A O no hydrogen 2.906 N/A THR 102.A OG1 HIS 95.A NE2 no hydrogen 2.708 N/A LEU 103.A N ARG 2.A O no hydrogen 2.941 N/A ALA 104.A N PHE 91.A O no hydrogen 2.762 N/A ASP 105.A N VAL 4.A O no hydrogen 3.131 N/A ALA 106.A N ARG 5.A O no hydrogen 2.883 N/A LEU 107.A N GLY 274.A O no hydrogen 3.011 N/A ILE 108.A N GLY 7.A O no hydrogen 2.725 N/A ILE 109.A N PHE 276.A O no hydrogen 2.722 N/A ALA 110.A N ILE 9.A O no hydrogen 2.806 N/A THR 111.A OG1 GLN 243.A O no hydrogen 2.611 N/A THR 114.A N ASP 241.A O no hydrogen 2.908 N/A ALA 115.A N GLN 40.A OE1 no hydrogen 2.846 N/A ARG 116.A N GLY 239.A O no hydrogen 2.972 N/A ARG 116.A NE VAL 238.A O no hydrogen 3.576 N/A ARG 117.A NE GLU 123.A OE2 no hydrogen 3.082 N/A ARG 117.A NH1 GLU 123.A OE1 no hydrogen 3.037 N/A ARG 117.A NH1 GLU 123.A OE2 no hydrogen 3.484 N/A CYS 120.A SG LYS 121.A O no hydrogen 4.029 N/A LYS 121.A NZ GLU 205.A OE2 no hydrogen 3.299 N/A GLU 123.A N CYS 120.A O no hydrogen 3.217 N/A TYR 126.A N GLY 122.A O no hydrogen 3.034 N/A TRP 127.A N LYS 124.A O no hydrogen 3.446 N/A TRP 127.A NE1 THR 43.A O no hydrogen 2.837 N/A GLN 128.A N VAL 131.A O no hydrogen 2.939 N/A GLN 128.A NE2 ASP 138.A OD2 no hydrogen 3.274 N/A LYS 129.A N TYR 126.A O no hydrogen 2.794 N/A VAL 131.A N TYR 126.A O no hydrogen 3.264 N/A SER 132.A N LEU 234.A O no hydrogen 3.070 N/A SER 132.A OG CYS 134.A O no hydrogen 3.378 N/A SER 132.A OG ASP 138.A OD2 no hydrogen 2.884 N/A CYS 134.A N SER 132.A OG no hydrogen 3.147 N/A ALA 135.A N GLU 159.A OE2 no hydrogen 3.151 N/A ASP 138.A N CYS 134.A O no hydrogen 2.982 N/A MET 141.A N ASP 138.A O no hydrogen 3.103 N/A ALA 142.A N SER 139.A O no hydrogen 3.027 N/A THR 143.A OG1 ALA 140.A O no hydrogen 3.068 N/A GLY 144.A N ILE 166.A O no hydrogen 3.230 N/A LYS 145.A N ALA 142.A O no hydrogen 3.104 N/A VAL 147.A N LYS 169.A O no hydrogen 2.897 N/A VAL 148.A N ALA 233.A O no hydrogen 2.795 N/A VAL 149.A N TYR 171.A O no hydrogen 2.663 N/A VAL 150.A N TYR 235.A O no hydrogen 2.797 N/A GLY 151.A N VAL 173.A O no hydrogen 3.180 N/A CYS 157.A N GLY 153.A O no hydrogen 3.297 N/A CYS 157.A SG GLY 153.A O no hydrogen 3.280 N/A GLU 158.A N ASP 154.A O no hydrogen 2.881 N/A GLU 159.A N VAL 155.A O no hydrogen 2.785 N/A ALA 160.A N ALA 156.A O no hydrogen 3.034 N/A THR 161.A N CYS 157.A O no hydrogen 3.097 N/A THR 161.A OG1 CYS 157.A O no hydrogen 2.499 N/A TYR 162.A N GLU 158.A O no hydrogen 2.806 N/A LEU 163.A N GLU 159.A O no hydrogen 3.034 N/A THR 164.A N ALA 160.A O no hydrogen 3.273 N/A THR 164.A OG1 THR 161.A O no hydrogen 2.944 N/A ILE 166.A N LEU 163.A O no hydrogen 2.988 N/A ALA 167.A N LEU 163.A O no hydrogen 2.785 N/A THR 168.A N LYS 145.A O no hydrogen 2.912 N/A LYS 169.A NZ LEU 194.A O no hydrogen 3.463 N/A VAL 170.A N LEU 194.A O no hydrogen 2.995 N/A TYR 171.A N VAL 147.A O no hydrogen 2.765 N/A MET 172.A N GLU 196.A O no hydrogen 3.012 N/A VAL 173.A N VAL 149.A O no hydrogen 2.934 N/A LEU 174.A N ILE 198.A O no hydrogen 2.770 N/A ARG 180.A N GLY 152.A O no hydrogen 2.908 N/A SER 182.A N ASP 154.A OD1 no hydrogen 2.926 N/A SER 182.A OG ASP 154.A OD1 no hydrogen 2.906 N/A VAL 186.A N SER 182.A O no hydrogen 3.140 N/A LYS 187.A N ALA 183.A O no hydrogen 3.108 N/A LYS 188.A N ALA 184.A O no hydrogen 3.140 N/A VAL 189.A N MET 185.A O no hydrogen 2.928 N/A MET 190.A N VAL 186.A O no hydrogen 2.990 N/A ASN 191.A N LYS 187.A O no hydrogen 2.915 N/A GLU 192.A N VAL 189.A O no hydrogen 3.430 N/A LYS 193.A NZ ASN 191.A O no hydrogen 2.783 N/A LEU 194.A N GLU 192.A OE2 no hydrogen 3.232 N/A ILE 195.A N GLU 192.A O no hydrogen 3.245 N/A GLU 196.A N VAL 170.A O no hydrogen 3.057 N/A ILE 198.A N MET 172.A O no hydrogen 2.780 N/A ASP 200.A N ARG 176.A O no hydrogen 2.915 N/A SER 201.A N LEU 174.A O no hydrogen 2.996 N/A SER 201.A OG TYR 199.A O no hydrogen 2.675 N/A ALA 202.A N LYS 219.A O no hydrogen 3.000 N/A ASP 204.A N SER 217.A O no hydrogen 2.828 N/A GLU 205.A N SER 217.A O no hydrogen 3.233 N/A ILE 206.A N LYS 121.A O no hydrogen 2.771 N/A LYS 207.A N SER 215.A O no hydrogen 2.725 N/A ASP 209.A N CYS 212.A O no hydrogen 3.180 N/A GLY 210.A N TYR 126.A OH no hydrogen 3.003 N/A LYS 211.A N ASP 209.A OD1 no hydrogen 3.094 N/A CYS 212.A N ASP 209.A OD1 no hydrogen 3.103 N/A CYS 212.A SG LYS 129.A O no hydrogen 3.717 N/A CYS 212.A SG VAL 213.A O no hydrogen 3.628 N/A VAL 213.A N LYS 129.A O no hydrogen 3.010 N/A THR 214.A N LYS 207.A O no hydrogen 2.809 N/A THR 214.A OG1 LYS 207.A O no hydrogen 3.561 N/A SER 215.A N LYS 207.A O no hydrogen 3.027 N/A VAL 216.A N LEU 229.A O no hydrogen 3.116 N/A SER 217.A N GLU 205.A O no hydrogen 2.751 N/A SER 217.A OG THR 228.A OG1 no hydrogen 3.255 N/A ILE 218.A N ARG 227.A O no hydrogen 2.611 N/A LYS 219.A N ALA 202.A O no hydrogen 2.993 N/A ASN 220.A N LYS 225.A O no hydrogen 2.737 N/A LEU 221.A N ASP 200.A O no hydrogen 2.732 N/A LYS 222.A NZ ASP 200.A OD1 no hydrogen 3.161 N/A ASP 223.A N ASN 220.A OD1 no hydrogen 3.002 N/A LYS 225.A N ASP 223.A OD1 no hydrogen 2.652 N/A THR 226.A OG1 ILE 218.A O no hydrogen 3.367 N/A ARG 227.A N ILE 218.A O no hydrogen 2.627 N/A ARG 227.A NH1 GLU 196.A OE2 no hydrogen 3.113 N/A ARG 227.A NH2 GLU 196.A OE2 no hydrogen 2.990 N/A THR 228.A OG1 SER 217.A OG no hydrogen 3.255 N/A LEU 229.A N VAL 216.A O no hydrogen 2.755 N/A GLY 232.A N GLU 146.A O no hydrogen 2.639 N/A LEU 234.A N GLY 130.A O no hydrogen 2.768 N/A TYR 235.A N VAL 148.A O no hydrogen 2.722 N/A TYR 235.A OH ASP 138.A O no hydrogen 2.914 N/A TRP 236.A N SER 132.A O no hydrogen 2.810 N/A TRP 236.A NE1 GLU 123.A OE2 no hydrogen 3.221 N/A ALA 237.A N VAL 150.A O no hydrogen 2.779 N/A ASP 241.A N THR 114.A O no hydrogen 2.676 N/A GLN 243.A N GLY 112.A O no hydrogen 3.007 N/A GLN 243.A NE2 ASP 241.A O no hydrogen 3.034 N/A THR 244.A OG1 GLY 258.A O no hydrogen 3.069 N/A LEU 247.A N THR 244.A O no hydrogen 3.335 N/A LYS 248.A N GLN 251.A OE1 no hydrogen 2.702 N/A GLN 251.A N LYS 248.A O no hydrogen 3.012 N/A GLN 251.A NE2 ILE 84.A O no hydrogen 2.725 N/A GLU 253.A N SER 271.A OG no hydrogen 3.019 N/A GLN 254.A NE2 LEU 252.A O no hydrogen 3.586 N/A ASP 255.A N TYR 259.A O no hydrogen 2.940 N/A GLU 256.A N GLU 256.A OE2 no hydrogen 2.866 N/A GLY 258.A N ASP 255.A O no hydrogen 3.141 N/A ILE 260.A N CYS 281.A O no hydrogen 2.913 N/A LEU 261.A N GLU 253.A O no hydrogen 3.095 N/A LYS 263.A N ARG 269.A O no hydrogen 2.859 N/A LYS 263.A NZ GLU 253.A OE1 no hydrogen 3.225 N/A THR 267.A N ASP 264.A O no hydrogen 2.719 N/A THR 267.A OG1 ASP 264.A O no hydrogen 2.272 N/A GLN 268.A N ASP 302.A OD2 no hydrogen 2.802 N/A ARG 269.A N THR 267.A OG1 no hydrogen 3.384 N/A THR 270.A N VAL 275.A O no hydrogen 3.344 N/A THR 270.A OG1 VAL 272.A O no hydrogen 3.145 N/A THR 270.A OG1 VAL 275.A O no hydrogen 2.491 N/A VAL 275.A N VAL 272.A O no hydrogen 3.189 N/A PHE 276.A N LEU 107.A O no hydrogen 2.783 N/A ALA 277.A N GLN 268.A O no hydrogen 3.160 N/A ALA 278.A N ILE 109.A O no hydrogen 2.830 N/A GLY 279.A N SER 295.A OG no hydrogen 2.714 N/A CYS 281.A SG ILE 109.A O no hydrogen 3.376 N/A CYS 281.A SG ALA 278.A O no hydrogen 3.453 N/A CYS 282.A N GLY 279.A O no hydrogen 3.090 N/A CYS 282.A SG GLY 279.A O no hydrogen 3.267 N/A LEU 285.A N ASP 283.A OD1 no hydrogen 2.966 N/A TYR 286.A N ASP 283.A OD1 no hydrogen 3.332 N/A TYR 286.A N ASP 283.A OD2 no hydrogen 3.126 N/A ARG 287.A N ASP 283.A OD2 no hydrogen 3.031 N/A ARG 287.A NH1 HIS 284.A O no hydrogen 3.360 N/A GLN 288.A NE2 ARG 287.A O no hydrogen 3.028 N/A ALA 292.A N GLN 288.A O no hydrogen 2.918 N/A ALA 293.A N ALA 289.A O no hydrogen 2.815 N/A GLY 294.A N VAL 290.A O no hydrogen 2.978 N/A SER 295.A N VAL 291.A O no hydrogen 2.965 N/A SER 295.A OG ALA 292.A O no hydrogen 2.747 N/A GLY 296.A N ALA 292.A O no hydrogen 2.983 N/A SER 297.A N ALA 293.A O no hydrogen 3.157 N/A LYS 298.A N GLY 294.A O no hydrogen 3.161 N/A LYS 298.A NZ PRO 266.A O no hydrogen 3.067 N/A ALA 299.A N SER 295.A O no hydrogen 2.886 N/A ALA 300.A N GLY 296.A O no hydrogen 2.968 N/A LEU 301.A N SER 297.A O no hydrogen 2.991 N/A ASP 302.A N LYS 298.A O no hydrogen 2.886 N/A ALA 303.A N ALA 299.A O no hydrogen 2.919 N/A GLU 304.A N ALA 300.A O no hydrogen 3.089 N/A ARG 305.A N LEU 301.A O no hydrogen 3.069 N/A TRP 306.A N ASP 302.A O no hydrogen 2.965 N/A LEU 307.A N ALA 303.A O no hydrogen 2.827 N/A ALA 308.A N GLU 304.A O no hydrogen 3.206 N/A