Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5kcj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A ND2 LYS 70.A O no hydrogen 3.179 N/A HIS 3.A ND1 THR 72.A OG1 no hydrogen 2.788 N/A LEU 4.A N THR 72.A O no hydrogen 2.802 N/A SER 5.A OG ARG 102.A O no hydrogen 2.722 N/A ILE 6.A N ASP 74.A O no hydrogen 3.075 N/A VAL 7.A N MET 105.A O no hydrogen 3.064 N/A THR 8.A N TYR 76.A O no hydrogen 2.855 N/A THR 8.A OG1 VAL 107.A O no hydrogen 2.628 N/A LEU 9.A N THR 8.A OG1 no hydrogen 2.844 N/A GLU 11.A N VAL 15.A O no hydrogen 2.816 N/A PHE 14.A N GLU 11.A O no hydrogen 3.036 N/A VAL 15.A N GLU 11.A O no hydrogen 3.063 N/A ILE 16.A N LYS 55.A O no hydrogen 2.713 N/A VAL 17.A N GLU 10.A OE2 no hydrogen 2.984 N/A GLU 18.A N CYS 53.A O no hydrogen 2.767 N/A GLU 25.A N ASP 21.A O no hydrogen 3.144 N/A CYS 27.A SG LYS 52.A O no hydrogen 3.416 N/A THR 31.A N VAL 28.A O no hydrogen 3.110 N/A THR 31.A OG1 VAL 28.A O no hydrogen 2.699 N/A VAL 32.A N CYS 54.A O no hydrogen 2.801 N/A CYS 34.A N LYS 52.A O no hydrogen 2.968 N/A ARG 35.A N LEU 75.A O no hydrogen 3.011 N/A ARG 35.A NE ASP 74.A OD1 no hydrogen 2.983 N/A ARG 35.A NE ASP 74.A OD2 no hydrogen 3.037 N/A ARG 35.A NH2 ASP 74.A OD2 no hydrogen 3.095 N/A LYS 36.A N VAL 50.A O no hydrogen 3.007 N/A VAL 38.A N MET 48.A O no hydrogen 2.787 N/A LYS 39.A NZ ASN 42.A OD1 no hydrogen 2.799 N/A ILE 40.A N GLU 46.A O no hydrogen 3.028 N/A SER 43.A N ASN 41.A OD1 no hydrogen 2.826 N/A GLU 46.A N THR 44.A OG1 no hydrogen 3.191 N/A MET 48.A N VAL 38.A O no hydrogen 2.786 N/A VAL 50.A N LYS 36.A O no hydrogen 2.787 N/A LYS 52.A N CYS 34.A O no hydrogen 2.852 N/A LYS 52.A NZ ASP 19.A OD1 no hydrogen 2.795 N/A CYS 53.A N GLU 18.A O no hydrogen 2.825 N/A CYS 54.A N VAL 32.A O no hydrogen 2.827 N/A LYS 55.A N ILE 16.A O no hydrogen 2.960 N/A LYS 55.A NZ GLU 18.A OE2 no hydrogen 2.771 N/A PHE 57.A N PRO 13.A O no hydrogen 2.896 N/A CYS 58.A N PHE 14.A O no hydrogen 2.805 N/A ASP 60.A N GLY 56.A O no hydrogen 3.017 N/A ILE 61.A N PHE 57.A O no hydrogen 3.112 N/A LEU 62.A N CYS 58.A O no hydrogen 2.934 N/A LYS 63.A N ILE 59.A O no hydrogen 2.926 N/A LYS 63.A NZ ASN 30.A O no hydrogen 3.355 N/A LYS 63.A NZ ASP 60.A OD1 no hydrogen 3.085 N/A LYS 64.A N ASP 60.A O no hydrogen 3.135 N/A LYS 64.A NZ GLU 266.A OE1 no hydrogen 3.098 N/A LEU 65.A N ILE 61.A O no hydrogen 2.962 N/A SER 66.A N LEU 62.A O no hydrogen 2.803 N/A SER 66.A OG PHE 71.A O no hydrogen 2.679 N/A ARG 67.A N LYS 63.A O no hydrogen 3.247 N/A THR 68.A N LYS 64.A O no hydrogen 2.936 N/A THR 68.A OG1 LYS 64.A O no hydrogen 3.033 N/A VAL 69.A N LEU 65.A O no hydrogen 2.791 N/A PHE 71.A N SER 66.A O no hydrogen 3.008 N/A THR 72.A N ASN 2.A O no hydrogen 2.836 N/A THR 72.A OG1 HIS 3.A ND1 no hydrogen 2.788 N/A ASP 74.A N LEU 4.A O no hydrogen 2.864 N/A TYR 76.A N ILE 6.A O no hydrogen 2.834 N/A TYR 76.A OH GLU 97.A OE1 no hydrogen 2.672 N/A LEU 77.A N ARG 35.A O no hydrogen 2.796 N/A VAL 78.A N THR 8.A O no hydrogen 2.970 N/A HIS 83.A NE2 GLU 11.A OE1 no hydrogen 2.818 N/A LYS 85.A N ASN 92.A OD1 no hydrogen 3.125 N/A LYS 85.A NZ ASN 166.A OD1 no hydrogen 2.796 N/A LYS 86.A NZ ASN 89.A OD1 no hydrogen 3.361 N/A VAL 87.A N VAL 90.A O no hydrogen 2.805 N/A VAL 90.A N VAL 87.A O no hydrogen 2.930 N/A ASN 92.A N LYS 85.A O no hydrogen 3.038 N/A GLY 93.A N ASN 80.A O no hydrogen 2.741 N/A MET 94.A N LYS 82.A O no hydrogen 2.813 N/A ILE 95.A N HIS 83.A O no hydrogen 3.230 N/A GLY 96.A N ASN 92.A O no hydrogen 3.035 N/A GLU 97.A N GLY 93.A O no hydrogen 3.101 N/A VAL 98.A N MET 94.A O no hydrogen 3.331 N/A VAL 98.A N ILE 95.A O no hydrogen 3.121 N/A VAL 99.A N ILE 95.A O no hydrogen 2.864 N/A TYR 100.A N GLY 96.A O no hydrogen 2.908 N/A GLN 101.A N VAL 98.A O no hydrogen 2.937 N/A ARG 102.A N GLU 97.A O no hydrogen 2.800 N/A ARG 102.A NE GLU 97.A OE1 no hydrogen 3.116 N/A ARG 102.A NE GLU 97.A OE2 no hydrogen 3.142 N/A ARG 102.A NH2 GLU 97.A OE2 no hydrogen 3.119 N/A ALA 103.A N GLU 97.A O no hydrogen 3.109 N/A VAL 104.A N SER 5.A O no hydrogen 2.839 N/A ALA 106.A N ALA 243.A O no hydrogen 2.944 N/A VAL 107.A N VAL 7.A O no hydrogen 2.878 N/A SER 109.A OG GLU 11.A OE1 no hydrogen 2.643 N/A ILE 112.A N GLY 239.A O no hydrogen 3.043 N/A ARG 116.A N ASN 113.A OD1 no hydrogen 2.922 N/A ARG 116.A NH1 THR 111.A O no hydrogen 2.993 N/A ARG 116.A NH2 GLY 84.A O no hydrogen 2.773 N/A SER 117.A N ASN 113.A O no hydrogen 3.058 N/A SER 117.A OG ASN 113.A O no hydrogen 2.700 N/A GLU 118.A N GLU 115.A O no hydrogen 3.334 N/A VAL 119.A N ARG 116.A O no hydrogen 3.081 N/A VAL 120.A N ARG 116.A O no hydrogen 2.951 N/A ASP 121.A N LEU 244.A O no hydrogen 2.947 N/A SER 123.A N ILE 242.A O no hydrogen 2.868 N/A SER 123.A OG VAL 124.A O no hydrogen 2.793 N/A VAL 124.A N ASP 255.A OD1 no hydrogen 2.792 N/A PHE 126.A N TYR 240.A O no hydrogen 2.924 N/A THR 129.A N THR 238.A O no hydrogen 2.862 N/A THR 129.A OG1 ASP 210.A OD1 no hydrogen 2.665 N/A ILE 131.A N PHE 235.A O no hydrogen 2.779 N/A SER 132.A N TYR 209.A O no hydrogen 2.925 N/A SER 132.A OG TYR 233.A O no hydrogen 2.690 N/A MET 134.A N PHE 207.A O no hydrogen 2.716 N/A VAL 135.A N VAL 227.A O no hydrogen 2.753 N/A ARG 137.A N LYS 225.A O no hydrogen 2.759 N/A ARG 137.A NE CYS 224.A O no hydrogen 3.218 N/A ARG 137.A NH2 CYS 224.A O no hydrogen 2.781 N/A THR 139.A N SER 136.A O no hydrogen 3.172 N/A THR 139.A OG1 SER 136.A O no hydrogen 2.684 N/A THR 142.A N ASP 146.A OD2 no hydrogen 2.748 N/A THR 142.A OG1 ASP 146.A OD2 no hydrogen 3.106 N/A ASP 146.A N GLY 143.A O no hydrogen 2.984 N/A LYS 148.A N ASP 146.A OD1 no hydrogen 3.020 N/A PHE 149.A N ASP 146.A O no hydrogen 2.972 N/A GLN 150.A N ASP 146.A O no hydrogen 3.008 N/A ARG 151.A N LYS 147.A O no hydrogen 2.888 N/A ARG 151.A NE ASP 154.A OD2 no hydrogen 2.704 N/A ARG 151.A NH2 ASP 154.A OD1 no hydrogen 3.398 N/A ARG 151.A NH2 ASP 154.A OD2 no hydrogen 3.452 N/A HIS 153.A ND1 TYR 179.A OH no hydrogen 3.142 N/A ASP 154.A N ARG 151.A O no hydrogen 3.076 N/A TYR 155.A N PRO 152.A O no hydrogen 3.359 N/A ARG 160.A N ASP 205.A OD2 no hydrogen 2.729 N/A ARG 160.A NE ASP 205.A OD2 no hydrogen 3.128 N/A ARG 160.A NH1 GLY 202.A O no hydrogen 2.890 N/A ARG 160.A NH2 GLY 202.A O no hydrogen 2.803 N/A ARG 160.A NH2 ASP 205.A OD1 no hydrogen 2.794 N/A GLY 162.A N ALA 206.A O no hydrogen 3.324 N/A THR 163.A OG1 VAL 164.A O no hydrogen 3.492 N/A THR 163.A OG1 ILE 208.A O no hydrogen 2.680 N/A ASN 166.A N GLU 170.A OE1 no hydrogen 2.817 N/A ARG 171.A N GLY 167.A O no hydrogen 3.197 N/A ARG 171.A NE.A GLU 115.A OE2 no hydrogen 3.414 N/A ARG 171.A NH1.B GLU 115.A OE1 no hydrogen 3.083 N/A ASN 172.A N SER 168.A O no hydrogen 3.122 N/A ILE 173.A N THR 169.A O no hydrogen 3.090 N/A ARG 174.A N GLU 170.A O no hydrogen 2.864 N/A ASN 175.A N ARG 171.A O no hydrogen 2.974 N/A ASN 176.A N ASN 172.A O no hydrogen 2.828 N/A ASN 176.A ND2 ASN 172.A OD1 no hydrogen 2.787 N/A TYR 177.A N ILE 173.A O no hydrogen 2.760 N/A TYR 179.A OH HIS 153.A ND1 no hydrogen 3.142 N/A HIS 181.A N TYR 177.A O no hydrogen 3.024 N/A GLN 182.A N PRO 178.A O no hydrogen 3.206 N/A GLN 182.A NE2 TYR 179.A O no hydrogen 3.084 N/A TYR 183.A N TYR 179.A O no hydrogen 3.150 N/A TYR 183.A OH PHE 159.A O no hydrogen 2.627 N/A MET 184.A N MET 180.A O no hydrogen 2.984 N/A THR 185.A OG1 GLN 182.A O no hydrogen 3.136 N/A PHE 187.A N MET 184.A O no hydrogen 2.771 N/A ASN 188.A N THR 185.A O no hydrogen 2.960 N/A GLN 189.A N THR 163.A O no hydrogen 2.915 N/A GLN 189.A NE2 PHE 187.A O no hydrogen 2.856 N/A ALA 195.A N GLY 191.A O no hydrogen 3.127 N/A LEU 196.A N VAL 192.A O no hydrogen 2.909 N/A VAL 197.A N GLU 193.A O no hydrogen 3.153 N/A SER 198.A N ASP 194.A O no hydrogen 2.945 N/A SER 198.A OG.A GLN 189.A OE1 no hydrogen 3.224 N/A SER 198.A OG.A ASP 194.A O no hydrogen 3.192 N/A LEU 199.A N ALA 195.A O no hydrogen 2.876 N/A LYS 200.A N LEU 196.A O no hydrogen 2.895 N/A LYS 200.A NZ ASP 221.A OD1 no hydrogen 2.883 N/A LYS 200.A NZ GLU 222.A O no hydrogen 3.315 N/A THR 201.A N VAL 197.A O no hydrogen 2.989 N/A THR 201.A OG1 VAL 197.A O no hydrogen 2.778 N/A GLY 202.A N LEU 199.A O no hydrogen 3.167 N/A LYS 203.A N SER 198.A O no hydrogen 2.772 N/A LEU 204.A N SER 198.A O no hydrogen 3.243 N/A ASP 205.A N ARG 160.A O no hydrogen 2.676 N/A ALA 206.A N ARG 160.A O no hydrogen 3.094 N/A PHE 207.A N MET 134.A O no hydrogen 2.865 N/A ILE 208.A N GLY 162.A O no hydrogen 2.891 N/A TYR 209.A N SER 132.A O no hydrogen 3.077 N/A TYR 209.A OH GLU 11.A OE2 no hydrogen 2.572 N/A ALA 211.A N GLY 130.A O no hydrogen 2.886 N/A ALA 212.A N THR 129.A OG1 no hydrogen 2.999 N/A VAL 213.A N ASP 210.A OD2 no hydrogen 2.828 N/A LEU 214.A N ASP 210.A O no hydrogen 3.084 N/A ASN 215.A N ALA 211.A O no hydrogen 2.923 N/A TYR 216.A N ALA 212.A O no hydrogen 3.236 N/A LYS 217.A N VAL 213.A O no hydrogen 2.852 N/A LYS 217.A NZ GLU 193.A OE2 no hydrogen 2.821 N/A ALA 218.A N LEU 214.A O no hydrogen 2.918 N/A GLY 219.A N ASN 215.A O no hydrogen 3.130 N/A ARG 220.A N TYR 216.A O no hydrogen 3.288 N/A ARG 220.A N LYS 217.A O no hydrogen 3.292 N/A ARG 220.A NE THR 276.A O no hydrogen 2.996 N/A ARG 220.A NH2 THR 276.A O no hydrogen 2.844 N/A ASP 221.A N ALA 218.A O no hydrogen 3.358 N/A CYS 224.A N ASP 221.A O no hydrogen 3.001 N/A CYS 224.A SG ASP 221.A O no hydrogen 4.005 N/A LEU 226.A N ASP 221.A OD2 no hydrogen 2.740 N/A VAL 227.A N VAL 135.A O no hydrogen 2.802 N/A ILE 229.A N VAL 133.A O no hydrogen 2.971 N/A TYR 233.A N ILE 229.A O no hydrogen 3.006 N/A PHE 235.A N ILE 131.A O no hydrogen 2.794 N/A THR 237.A OG1.A GLU 128.A OE2 no hydrogen 3.487 N/A THR 238.A N THR 129.A O no hydrogen 2.856 N/A THR 238.A OG1 ILE 112.A O no hydrogen 2.645 N/A GLY 239.A N THR 238.A OG1 no hydrogen 2.759 N/A TYR 240.A N VAL 127.A O no hydrogen 2.794 N/A TYR 240.A OH ASP 210.A OD2 no hydrogen 2.714 N/A GLY 241.A N LEU 110.A O no hydrogen 3.018 N/A ILE 242.A N SER 123.A OG no hydrogen 2.955 N/A ALA 243.A N ALA 106.A O no hydrogen 3.308 N/A LEU 244.A N ASP 121.A O no hydrogen 2.787 N/A GLN 245.A NE2 ALA 103.A O no hydrogen 2.974 N/A LYS 246.A NZ SER 117.A O no hydrogen 2.814 N/A LYS 246.A NZ VAL 120.A O no hydrogen 2.955 N/A LYS 246.A NZ ASP 121.A OD1 no hydrogen 2.811 N/A TRP 250.A N SER 248.A OG no hydrogen 3.281 N/A LYS 251.A NZ ASP 255.A OD2 no hydrogen 2.786 N/A ILE 254.A N TRP 250.A O no hydrogen 3.153 N/A ASP 255.A N LYS 251.A O no hydrogen 2.954 N/A LEU 256.A N ARG 252.A O no hydrogen 3.154 N/A ALA 257.A N GLN 253.A O no hydrogen 2.945 N/A LEU 258.A N ILE 254.A O no hydrogen 2.824 N/A LEU 259.A N ASP 255.A O no hydrogen 3.019 N/A GLN 260.A N LEU 256.A O no hydrogen 2.887 N/A PHE 261.A N ALA 257.A O no hydrogen 2.854 N/A VAL 262.A N LEU 258.A O no hydrogen 2.901 N/A GLY 263.A N LEU 259.A O no hydrogen 2.972 N/A ASP 264.A N GLN 260.A O no hydrogen 2.973 N/A GLY 265.A N VAL 262.A O no hydrogen 3.358 N/A MET 267.A N PHE 261.A O no hydrogen 3.116 N/A GLU 269.A N GLY 265.A O no hydrogen 2.989 N/A LEU 270.A N GLU 266.A O no hydrogen 3.280 N/A GLU 271.A N MET 267.A O no hydrogen 3.234 N/A THR 272.A N GLU 268.A O no hydrogen 3.094 N/A THR 272.A OG1 GLU 268.A O no hydrogen 2.961 N/A LEU 273.A N GLU 269.A O no hydrogen 2.909 N/A TRP 274.A N LEU 270.A O no hydrogen 2.789 N/A TRP 274.A NE1 ASP 60.A OD2 no hydrogen 2.701 N/A LEU 275.A N GLU 271.A O no hydrogen 2.715 N/A THR 276.A OG1 THR 272.A O no hydrogen 2.995 N/A CYS 279.A N GLY 219.A O no hydrogen 2.891 N/A CYS 279.A SG ALA 218.A O no hydrogen 3.408 N/A CYS 279.A SG GLY 219.A O no hydrogen 3.577 N/A CYS 279.A SG ASP 221.A O no hydrogen 3.549 N/A