Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1k6j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N GLN 1.A OE1 no hydrogen 2.707 N/A LYS 3.A NZ GLN 103.A OE1 no hydrogen 2.927 N/A ILE 5.A N HIS 28.A O no hydrogen 2.896 N/A ALA 6.A N LEU 73.A O no hydrogen 2.899 N/A VAL 7.A N ARG 30.A O no hydrogen 2.861 N/A ASN 9.A N GLN 32.A OE1 no hydrogen 2.768 N/A ASN 9.A ND2 ASN 77.A O no hydrogen 2.901 N/A ALA 10.A N GLN 32.A O no hydrogen 2.921 N/A GLY 12.A N ASN 9.A O no hydrogen 2.880 N/A GLN 14.A NE2 TYR 150.A OH no hydrogen 2.810 N/A ALA 16.A N GLY 12.A O no hydrogen 2.957 N/A SER 17.A N ARG 13.A O no hydrogen 3.201 N/A SER 17.A OG ALA 189.A O no hydrogen 3.209 N/A SER 17.A OG GLU 190.A O no hydrogen 2.866 N/A LEU 18.A N GLN 14.A O no hydrogen 3.225 N/A ILE 19.A N ALA 15.A O no hydrogen 2.894 N/A ARG 20.A N ALA 16.A O no hydrogen 3.066 N/A ARG 20.A NE GLU 43.A OE2 no hydrogen 2.787 N/A VAL 21.A N SER 17.A O no hydrogen 3.435 N/A ALA 22.A N LEU 18.A O no hydrogen 2.876 N/A ALA 23.A N ILE 19.A O no hydrogen 2.935 N/A ALA 24.A N ARG 20.A O no hydrogen 3.245 N/A VAL 25.A N ALA 22.A O no hydrogen 3.300 N/A GLY 26.A N ALA 23.A O no hydrogen 3.083 N/A HIS 27.A N ALA 22.A O no hydrogen 2.986 N/A HIS 27.A ND1 LYS 3.A O no hydrogen 2.893 N/A VAL 29.A N ASN 49.A O no hydrogen 2.799 N/A ARG 30.A N ILE 5.A O no hydrogen 2.886 N/A ARG 30.A NE THR 66.A O no hydrogen 3.288 N/A ARG 30.A NE LEU 67.A O no hydrogen 2.882 N/A ARG 30.A NH2 THR 66.A O no hydrogen 2.731 N/A ALA 31.A N THR 51.A O no hydrogen 2.871 N/A GLN 32.A N VAL 7.A O no hydrogen 2.908 N/A GLN 32.A NE2 GLY 55.A O no hydrogen 2.936 N/A VAL 33.A N PHE 53.A O no hydrogen 3.248 N/A HIS 34.A NE2 ASN 9.A OD1 no hydrogen 2.702 N/A LYS 37.A N SER 35.A OG no hydrogen 2.987 N/A GLY 38.A N GLU 42.A OE1 no hydrogen 3.371 N/A GLU 42.A N GLY 38.A O no hydrogen 2.944 N/A GLU 43.A N LEU 39.A O no hydrogen 2.986 N/A LEU 44.A N ILE 40.A O no hydrogen 2.787 N/A GLN 45.A N ALA 41.A O no hydrogen 2.917 N/A ALA 46.A N GLU 42.A O no hydrogen 3.214 N/A ALA 46.A N GLU 43.A O no hydrogen 3.212 N/A ILE 47.A N LEU 44.A O no hydrogen 3.223 N/A VAL 50.A N ILE 47.A O no hydrogen 3.170 N/A THR 51.A N VAL 29.A O no hydrogen 2.746 N/A PHE 53.A N ALA 31.A O no hydrogen 2.809 N/A GLN 54.A NE2 HIS 34.A O no hydrogen 2.743 N/A GLY 55.A N VAL 33.A O no hydrogen 3.105 N/A ASN 60.A ND2 PRO 56.A O no hydrogen 2.813 N/A LEU 63.A N ASN 60.A O no hydrogen 3.061 N/A MET 64.A N ASN 60.A O no hydrogen 3.391 N/A ASP 65.A N VAL 61.A O no hydrogen 2.833 N/A THR 66.A N PRO 62.A O no hydrogen 3.106 N/A THR 66.A OG1 PRO 62.A O no hydrogen 2.986 N/A LEU 67.A N LEU 63.A O no hydrogen 2.726 N/A PHE 68.A N MET 64.A O no hydrogen 3.064 N/A GLU 69.A N THR 66.A O no hydrogen 3.211 N/A ALA 71.A N PHE 68.A O no hydrogen 2.920 N/A HIS 72.A N THR 4.A O no hydrogen 2.693 N/A LEU 73.A N THR 4.A O no hydrogen 3.062 N/A ALA 74.A N HIS 104.A O no hydrogen 3.048 N/A PHE 75.A N ALA 6.A O no hydrogen 3.016 N/A ILE 76.A N ILE 106.A O no hydrogen 2.790 N/A THR 78.A OG1 GLU 85.A OE2 no hydrogen 2.607 N/A THR 78.A OG1 TYR 107.A OH no hydrogen 3.216 N/A GLY 83.A N SER 80.A O no hydrogen 2.992 N/A ILE 88.A N ASP 84.A O no hydrogen 2.947 N/A GLY 89.A N GLU 85.A O no hydrogen 2.822 N/A LYS 90.A N ILE 86.A O no hydrogen 2.819 N/A ASP 91.A N ALA 87.A O no hydrogen 2.912 N/A LEU 92.A N ILE 88.A O no hydrogen 2.859 N/A ALA 93.A N GLY 89.A O no hydrogen 3.121 N/A ASP 94.A N LYS 90.A O no hydrogen 2.848 N/A ALA 95.A N ASP 91.A O no hydrogen 2.861 N/A ALA 96.A N LEU 92.A O no hydrogen 2.902 N/A LYS 97.A N ALA 93.A O no hydrogen 2.978 N/A LYS 97.A NZ LEU 138.A O no hydrogen 2.889 N/A ARG 98.A N ASP 94.A O no hydrogen 2.899 N/A ARG 98.A NH2 ASP 65.A OD1 no hydrogen 2.854 N/A ARG 98.A NH2 ASP 65.A OD2 no hydrogen 3.358 N/A ALA 99.A N ALA 95.A O no hydrogen 2.982 N/A GLY 100.A N LYS 97.A O no hydrogen 3.170 N/A THR 101.A OG1 ALA 71.A O no hydrogen 2.667 N/A GLN 103.A N HIS 72.A O no hydrogen 2.717 N/A TYR 105.A N PRO 141.A O no hydrogen 2.786 N/A ILE 106.A N ALA 74.A O no hydrogen 2.868 N/A TYR 107.A N THR 143.A O no hydrogen 2.968 N/A TYR 107.A OH THR 78.A OG1 no hydrogen 3.216 N/A SER 108.A N ILE 76.A O no hydrogen 2.926 N/A SER 108.A OG GLN 14.A OE1 no hydrogen 2.686 N/A SER 109.A N VAL 145.A O no hydrogen 2.825 N/A SER 109.A OG LYS 128.A O no hydrogen 3.523 N/A SER 109.A OG GLU 132.A OE1 no hydrogen 2.752 N/A SER 114.A N ASP 112.A OD1 no hydrogen 3.145 N/A SER 114.A OG ASP 112.A OD1 no hydrogen 2.670 N/A LEU 115.A N ASP 112.A O no hydrogen 3.111 N/A TYR 116.A N HIS 113.A O no hydrogen 3.152 N/A MET 124.A N GLN 258.A OE1 no hydrogen 2.910 N/A TRP 125.A N VAL 122.A O no hydrogen 2.909 N/A ALA 126.A N VAL 122.A O no hydrogen 2.983 N/A LYS 128.A N TRP 125.A O no hydrogen 2.931 N/A LYS 128.A NZ GLU 85.A OE2 no hydrogen 2.799 N/A THR 130.A N ALA 126.A O no hydrogen 3.241 N/A VAL 131.A N PRO 127.A O no hydrogen 3.090 N/A GLU 132.A N LYS 128.A O no hydrogen 2.821 N/A ASN 133.A N PHE 129.A O no hydrogen 2.935 N/A TYR 134.A N THR 130.A O no hydrogen 3.109 N/A TYR 134.A OH ASP 94.A OD1 no hydrogen 2.629 N/A TYR 134.A OH ASP 94.A OD2 no hydrogen 3.128 N/A VAL 135.A N VAL 131.A O no hydrogen 2.813 N/A ARG 136.A N GLU 132.A O no hydrogen 2.876 N/A ARG 136.A NE GLU 132.A OE2 no hydrogen 2.998 N/A ARG 136.A NH1 GLY 210.A O no hydrogen 2.989 N/A ARG 136.A NH2 GLU 132.A OE2 no hydrogen 3.035 N/A ARG 136.A NH2 GLY 210.A O no hydrogen 3.344 N/A GLN 137.A N ASN 133.A O no hydrogen 3.173 N/A LEU 138.A N TYR 134.A O no hydrogen 3.098 N/A LEU 138.A N VAL 135.A O no hydrogen 3.143 N/A GLY 139.A N ARG 136.A O no hydrogen 3.414 N/A SER 142.A N ASN 209.A OD1 no hydrogen 3.130 N/A SER 142.A OG LEU 140.A O no hydrogen 3.056 N/A THR 143.A N TYR 105.A O no hydrogen 3.074 N/A THR 143.A OG1 TRP 208.A O no hydrogen 2.770 N/A PHE 144.A N HIS 211.A O no hydrogen 2.878 N/A VAL 145.A N TYR 107.A O no hydrogen 3.076 N/A TYR 146.A N ILE 213.A O no hydrogen 2.816 N/A TYR 146.A OH GLU 132.A OE1 no hydrogen 2.513 N/A GLY 148.A N LEU 215.A O no hydrogen 2.994 N/A ILE 149.A N PRO 185.A O no hydrogen 2.781 N/A ASN 151.A N LEU 187.A O no hydrogen 2.881 N/A ASN 152.A ND2 ASN 152.A O no hydrogen 2.943 N/A ASN 153.A N TYR 150.A O no hydrogen 2.956 N/A PHE 154.A N ASN 151.A O no hydrogen 3.282 N/A THR 155.A N PHE 162.A O no hydrogen 3.369 N/A THR 155.A OG1 GLU 313.A OE2 no hydrogen 3.337 N/A SER 156.A N GLU 313.A OE2 no hydrogen 2.896 N/A SER 156.A OG GLU 313.A OE1 no hydrogen 2.676 N/A SER 156.A OG GLU 313.A OE2 no hydrogen 3.487 N/A LEU 157.A N THR 155.A OG1 no hydrogen 3.109 N/A TYR 159.A N LEU 157.A O no hydrogen 2.766 N/A PHE 162.A N PRO 160.A O no hydrogen 2.770 N/A MET 164.A N THR 155.A O no hydrogen 2.791 N/A GLU 165.A N GLU 173.A O no hydrogen 2.874 N/A MET 167.A N THR 171.A O no hydrogen 2.715 N/A GLY 170.A N MET 167.A O no hydrogen 2.918 N/A THR 171.A N ASP 169.A OD1 no hydrogen 3.001 N/A THR 171.A OG1 ASP 169.A OD1 no hydrogen 2.678 N/A PHE 172.A N ARG 236.A O no hydrogen 3.006 N/A GLU 173.A N GLU 165.A O no hydrogen 2.926 N/A TRP 174.A N THR 238.A O no hydrogen 2.885 N/A TRP 174.A NE1 LEU 161.A O no hydrogen 2.748 N/A ALA 176.A N VAL 240.A O no hydrogen 3.196 N/A ASP 181.A N ASP 179.A OD1 no hydrogen 2.767 N/A LEU 184.A N LEU 220.A O no hydrogen 2.888 N/A TRP 186.A N GLU 218.A O no hydrogen 2.916 N/A TRP 186.A NE1 LEU 220.A O no hydrogen 3.041 N/A LEU 187.A N ILE 149.A O no hydrogen 2.791 N/A HIS 191.A N ASP 188.A OD1 no hydrogen 3.150 N/A HIS 191.A ND1 ASP 192.A OD1 no hydrogen 2.471 N/A ASP 192.A N ASP 188.A O no hydrogen 2.775 N/A VAL 193.A N ALA 189.A O no hydrogen 3.167 N/A GLY 194.A N SER 17.A OG no hydrogen 2.833 N/A ALA 196.A N ASP 192.A O no hydrogen 3.253 N/A LEU 197.A N VAL 193.A O no hydrogen 2.871 N/A LEU 198.A N GLY 194.A O no hydrogen 2.897 N/A GLN 199.A N PRO 195.A O no hydrogen 3.108 N/A ILE 200.A N ALA 196.A O no hydrogen 3.030 N/A PHE 201.A N LEU 197.A O no hydrogen 3.040 N/A LYS 202.A N LEU 198.A O no hydrogen 2.894 N/A ASP 203.A N GLN 199.A O no hydrogen 2.849 N/A GLY 204.A N ILE 200.A O no hydrogen 2.904 N/A LYS 207.A N GLY 204.A O no hydrogen 3.089 N/A TRP 208.A N GLY 204.A O no hydrogen 3.146 N/A TRP 208.A NE1 ASP 203.A OD1 no hydrogen 2.895 N/A ASN 209.A N PRO 205.A O no hydrogen 2.914 N/A GLY 210.A N SER 142.A O no hydrogen 2.649 N/A HIS 211.A N TRP 208.A O no hydrogen 3.041 N/A ARG 212.A NE GLU 132.A OE2 no hydrogen 2.858 N/A ARG 212.A NH1 GLU 278.A OE2 no hydrogen 2.680 N/A ARG 212.A NH2 GLU 132.A OE2 no hydrogen 3.277 N/A ILE 213.A N PHE 144.A O no hydrogen 2.768 N/A LEU 215.A N TYR 146.A O no hydrogen 2.629 N/A THR 216.A OG1 TRP 186.A O no hydrogen 2.814 N/A PHE 217.A N TRP 186.A O no hydrogen 3.352 N/A LEU 220.A N LEU 184.A O no hydrogen 2.866 N/A SER 221.A N GLN 224.A OE1 no hydrogen 2.877 N/A VAL 223.A N PRO 180.A O no hydrogen 3.174 N/A GLN 224.A N SER 221.A OG no hydrogen 3.289 N/A VAL 225.A N SER 221.A O no hydrogen 2.940 N/A CYS 226.A N PRO 222.A O no hydrogen 3.051 N/A CYS 226.A SG PRO 222.A O no hydrogen 3.462 N/A ALA 227.A N VAL 223.A O no hydrogen 2.950 N/A ALA 228.A N GLN 224.A O no hydrogen 3.000 N/A PHE 229.A N VAL 225.A O no hydrogen 2.980 N/A SER 230.A N CYS 226.A O no hydrogen 2.781 N/A SER 230.A OG ARG 235.A O no hydrogen 2.697 N/A ARG 231.A N ALA 227.A O no hydrogen 2.904 N/A ARG 231.A NE GLU 302.A OE1 no hydrogen 2.829 N/A ARG 231.A NH2 GLU 302.A OE1 no hydrogen 3.149 N/A ALA 232.A N ALA 228.A O no hydrogen 2.978 N/A LEU 233.A N PHE 229.A O no hydrogen 2.844 N/A ASN 234.A N SER 230.A O no hydrogen 2.767 N/A ARG 235.A NH1 GLY 170.A O no hydrogen 2.702 N/A THR 238.A N PHE 172.A O no hydrogen 2.933 N/A TYR 239.A OH PHE 178.A O no hydrogen 2.673 N/A VAL 240.A N TRP 174.A O no hydrogen 2.865 N/A VAL 242.A N ALA 176.A O no hydrogen 2.916 N/A VAL 245.A N GLU 263.A OE2 no hydrogen 2.575 N/A ARG 256.A N PRO 252.A O no hydrogen 3.090 N/A GLU 257.A N VAL 253.A O no hydrogen 2.907 N/A GLN 258.A N GLY 254.A O no hydrogen 3.019 N/A LEU 259.A N TYR 255.A O no hydrogen 2.857 N/A GLU 260.A N ARG 256.A O no hydrogen 3.189 N/A ALA 261.A N GLU 257.A O no hydrogen 3.171 N/A ILE 262.A N GLN 258.A O no hydrogen 3.020 N/A GLU 263.A N LEU 259.A O no hydrogen 3.090 N/A VAL 264.A N GLU 260.A O no hydrogen 3.340 N/A VAL 265.A N ALA 261.A O no hydrogen 2.828 N/A PHE 266.A N ILE 262.A O no hydrogen 2.858 N/A GLY 267.A N ILE 262.A O no hydrogen 3.357 N/A GLU 268.A N GLU 263.A O no hydrogen 2.898 N/A HIS 269.A N VAL 264.A O no hydrogen 3.001 N/A HIS 269.A ND1 VAL 264.A O no hydrogen 3.163 N/A LYS 270.A N PHE 266.A O no hydrogen 3.224 N/A LYS 270.A NZ GLY 267.A O no hydrogen 3.564 N/A ALA 271.A N VAL 265.A O no hydrogen 3.002 N/A PHE 279.A N LEU 276.A O no hydrogen 2.772 N/A SER 280.A N LEU 276.A O no hydrogen 2.803 N/A SER 280.A OG PHE 274.A O no hydrogen 2.714 N/A SER 280.A OG LEU 276.A O no hydrogen 3.168 N/A ARG 286.A N ASP 289.A OD2 no hydrogen 3.041 N/A ASP 289.A N ARG 286.A O no hydrogen 2.985 N/A ARG 292.A N THR 288.A O no hydrogen 3.031 N/A ARG 292.A NE PHE 217.A O no hydrogen 2.858 N/A ARG 292.A NH2 PHE 217.A O no hydrogen 2.884 N/A LYS 293.A N ASP 289.A O no hydrogen 2.992 N/A LEU 294.A N GLU 290.A O no hydrogen 3.020 N/A TRP 295.A N ALA 291.A O no hydrogen 3.028 N/A TRP 295.A NE1 ASP 192.A OD1 no hydrogen 2.758 N/A ARG 299.A N ASP 192.A OD2 no hydrogen 3.103 N/A ARG 299.A NE ASP 188.A OD2 no hydrogen 2.800 N/A ARG 299.A NH2 ASP 188.A OD1 no hydrogen 3.169 N/A ARG 299.A NH2 ASP 188.A OD2 no hydrogen 3.071 N/A MET 301.A N GLU 218.A OE2 no hydrogen 2.865 N/A GLU 303.A N ASP 300.A OD1 no hydrogen 2.756 N/A TYR 304.A N ASP 300.A O no hydrogen 2.932 N/A TYR 304.A OH GLU 312.A OE1 no hydrogen 2.557 N/A ALA 305.A N MET 301.A O no hydrogen 2.761 N/A ARG 306.A N GLU 302.A O no hydrogen 2.909 N/A GLU 307.A N GLU 303.A O no hydrogen 2.738 N/A VAL 308.A N TYR 304.A O no hydrogen 2.873 N/A PHE 309.A N TYR 304.A O no hydrogen 2.933 N/A GLU 312.A N VAL 308.A O no hydrogen 2.939 N/A GLU 313.A N PHE 309.A O no hydrogen 2.789 N/A GLU 314.A N PRO 310.A O no hydrogen 2.983 N/A ALA 315.A N ILE 311.A O no hydrogen 3.014 N/A ASN 316.A N GLU 313.A O no hydrogen 3.079 N/A GLY 317.A N GLU 314.A O no hydrogen 2.732 N/A LEU 318.A N GLU 313.A O no hydrogen 2.936 N/A TRP 320.A NE1 GLU 313.A OE1 no hydrogen 2.701 N/A LEU 322.A N ASP 319.A O no hydrogen 2.848 N/A