Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jly_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 7.A N PHE 45.A O no hydrogen 2.687 N/A CYS 8.A N ILE 152.A O no hydrogen 2.940 N/A CYS 8.A SG ALA 43.A O no hydrogen 3.606 N/A LYS 10.A N HIS 150.A O no hydrogen 2.889 N/A SER 11.A N LYS 16.A O no hydrogen 2.902 N/A SER 11.A OG ASN 123.A OD1 no hydrogen 3.019 N/A ASN 12.A ND2 SER 145.A O no hydrogen 3.457 N/A HIS 14.A N SER 11.A O no hydrogen 3.107 N/A HIS 14.A NE2 PHE 33.A O no hydrogen 2.611 N/A GLN 15.A N SER 11.A O no hydrogen 2.636 N/A GLN 15.A NE2 ASN 12.A O no hydrogen 2.777 N/A LYS 16.A NZ ASP 36.A OD1 no hydrogen 2.970 N/A TYR 17.A N ALA 35.A O no hydrogen 2.990 N/A LEU 18.A N LEU 9.A O no hydrogen 2.904 N/A ARG 19.A N GLN 32.A O no hydrogen 2.924 N/A ARG 19.A NH1 SER 34.A OG no hydrogen 3.109 N/A TYR 20.A N LEU 42.A O no hydrogen 3.042 N/A TYR 20.A OH TYR 28.A OH no hydrogen 2.826 N/A GLN 21.A N LEU 30.A O no hydrogen 2.857 N/A GLN 21.A NE2 TYR 133.A OH no hydrogen 2.778 N/A ASP 23.A N GLN 21.A OE1 no hydrogen 3.152 N/A GLN 27.A NE2 GLN 26.A OE1 no hydrogen 3.122 N/A TYR 28.A N ILE 25.A O no hydrogen 2.814 N/A GLY 29.A N GLN 21.A O no hydrogen 2.853 N/A LEU 30.A N GLN 27.A O no hydrogen 2.894 N/A GLN 32.A N ARG 19.A O no hydrogen 2.974 N/A GLN 32.A NE2 VAL 131.A O no hydrogen 3.066 N/A PHE 33.A N SER 132.A O no hydrogen 2.952 N/A SER 34.A N GLN 32.A O no hydrogen 2.848 N/A SER 34.A OG GLN 32.A OE1 no hydrogen 2.786 N/A ALA 35.A N TYR 17.A O no hydrogen 2.904 N/A ASP 40.A N LYS 37.A O no hydrogen 3.191 N/A LEU 42.A N ASP 40.A OD1 no hydrogen 2.884 N/A ALA 43.A N ASP 40.A O no hydrogen 3.086 N/A GLN 44.A NE2 ASP 40.A O no hydrogen 2.887 N/A PHE 45.A N MET 7.A O no hydrogen 2.914 N/A GLU 46.A N LYS 60.A O no hydrogen 2.842 N/A VAL 47.A N VAL 5.A O no hydrogen 2.706 N/A GLU 48.A N HIS 58.A O no hydrogen 2.690 N/A SER 50.A N LEU 56.A O no hydrogen 3.006 N/A SER 50.A OG GLU 87.A OE2 no hydrogen 2.760 N/A LYS 51.A N GLU 87.A OE2 no hydrogen 2.978 N/A LYS 51.A NZ HIS 58.A NE2 no hydrogen 3.258 N/A LYS 51.A NZ GLU 87.A OE2 no hydrogen 3.181 N/A THR 52.A N GLU 87.A OE1 no hydrogen 3.371 N/A THR 52.A OG1 GLU 87.A OE1 no hydrogen 2.716 N/A TYR 53.A N SER 50.A OG no hydrogen 3.079 N/A LEU 56.A N TYR 53.A O no hydrogen 3.255 N/A VAL 57.A N PHE 97.A O no hydrogen 3.028 N/A HIS 58.A N GLU 48.A O no hydrogen 2.604 N/A HIS 58.A NE2 GLU 87.A OE2 no hydrogen 2.943 N/A LYS 60.A N GLU 46.A O no hydrogen 2.899 N/A SER 61.A N LYS 66.A O no hydrogen 3.013 N/A ARG 62.A N GLN 44.A O no hydrogen 3.010 N/A ARG 62.A NH1 GLU 46.A OE1 no hydrogen 3.086 N/A THR 64.A OG1 ALA 80.A O no hydrogen 3.446 N/A ASN 65.A N SER 61.A O no hydrogen 2.789 N/A LYS 66.A NZ ASN 83.A OD1 no hydrogen 2.739 N/A TYR 67.A N ALA 82.A O no hydrogen 2.881 N/A TYR 67.A OH GLU 48.A OE1 no hydrogen 2.982 N/A TYR 67.A OH GLU 48.A OE2 no hydrogen 3.103 N/A LEU 68.A N ILE 59.A O no hydrogen 2.868 N/A VAL 69.A N THR 79.A O no hydrogen 2.694 N/A ARG 70.A NE HIS 75.A O no hydrogen 2.689 N/A ARG 70.A NH1 GLN 116.A OE1 no hydrogen 2.971 N/A ARG 70.A NH2 HIS 75.A O no hydrogen 3.235 N/A TRP 71.A N TRP 77.A O no hydrogen 2.921 N/A SER 72.A OG HIS 75.A ND1 no hydrogen 2.706 N/A ASN 74.A N SER 72.A OG no hydrogen 3.162 N/A HIS 75.A N SER 72.A O no hydrogen 3.213 N/A HIS 75.A ND1 SER 72.A OG no hydrogen 2.706 N/A ILE 78.A N LEU 134.A O no hydrogen 3.260 N/A THR 79.A N VAL 69.A O no hydrogen 2.768 N/A THR 79.A OG1 GLY 29.A O no hydrogen 3.205 N/A THR 79.A OG1 SER 81.A OG no hydrogen 2.815 N/A ALA 80.A N GLY 29.A O no hydrogen 3.358 N/A SER 81.A OG THR 79.A OG1 no hydrogen 2.815 N/A ALA 82.A N TYR 67.A O no hydrogen 2.890 N/A ASP 86.A N THR 95.A OG1 no hydrogen 2.909 N/A ASN 88.A N ASP 86.A OD1 no hydrogen 3.029 N/A SER 90.A N ASN 88.A OD1 no hydrogen 2.839 N/A ASN 91.A N ASN 88.A O no hydrogen 3.078 N/A ALA 93.A N ASN 91.A OD1 no hydrogen 3.412 N/A CYS 94.A N ASN 91.A O no hydrogen 2.825 N/A CYS 94.A SG ASP 86.A O no hydrogen 3.429 N/A THR 95.A N ASP 86.A O no hydrogen 2.931 N/A THR 95.A OG1 HIS 58.A ND1 no hydrogen 2.722 N/A THR 95.A OG1 ASP 86.A O no hydrogen 3.327 N/A PHE 97.A N VAL 57.A O no hydrogen 2.979 N/A LYS 98.A N LEU 113.A O no hydrogen 2.860 N/A LEU 100.A N ARG 111.A O no hydrogen 2.745 N/A TYR 101.A OH ALA 1.A O no hydrogen 2.770 N/A VAL 102.A N LYS 109.A O no hydrogen 3.126 N/A ASN 106.A N GLU 103.A O no hydrogen 3.014 N/A ASN 106.A ND2 GLU 103.A OE2 no hydrogen 3.356 N/A LYS 108.A N ASN 106.A OD1 no hydrogen 3.074 N/A LYS 109.A NZ GLU 103.A OE1 no hydrogen 3.320 N/A VAL 110.A N PHE 149.A O no hydrogen 2.942 N/A ARG 111.A N LEU 100.A O no hydrogen 2.752 N/A ARG 111.A NE ASP 147.A OD2 no hydrogen 3.187 N/A LEU 113.A N LYS 98.A O no hydrogen 2.899 N/A HIS 114.A N HIS 119.A O no hydrogen 2.801 N/A VAL 115.A N LEU 96.A O no hydrogen 3.027 N/A LEU 117.A N HIS 114.A ND1 no hydrogen 3.254 N/A GLY 118.A N HIS 114.A O no hydrogen 2.798 N/A HIS 119.A ND1 ALA 136.A O no hydrogen 2.825 N/A TYR 120.A N SER 138.A O no hydrogen 2.791 N/A THR 121.A N LEU 112.A O no hydrogen 3.039 N/A THR 121.A OG1 LEU 112.A O no hydrogen 2.819 N/A GLN 122.A N PHE 135.A O no hydrogen 2.977 N/A ASN 123.A N LYS 146.A O no hydrogen 2.873 N/A TYR 124.A N TYR 133.A O no hydrogen 2.813 N/A VAL 126.A N PHE 130.A O no hydrogen 2.751 N/A PHE 130.A N GLY 127.A O no hydrogen 3.337 N/A VAL 131.A N SER 129.A O no hydrogen 2.863 N/A SER 132.A N THR 125.A OG1 no hydrogen 2.806 N/A TYR 133.A N TYR 124.A O no hydrogen 2.809 N/A LEU 134.A N LEU 31.A O no hydrogen 2.941 N/A PHE 135.A N GLN 122.A O no hydrogen 3.138 N/A ALA 136.A N TYR 76.A O no hydrogen 2.896 N/A SER 138.A OG GLU 137.A OE1 no hydrogen 2.520 N/A GLN 140.A N SER 138.A OG no hydrogen 3.146 N/A GLN 140.A NE2 SER 138.A OG no hydrogen 2.896 N/A ASP 142.A N ASP 147.A OD2 no hydrogen 2.980 N/A SER 145.A N ASP 142.A O no hydrogen 3.157 N/A LYS 146.A N ASP 142.A OD2 no hydrogen 2.780 N/A LYS 146.A NZ ASP 142.A OD1 no hydrogen 3.163 N/A LYS 146.A NZ ASP 142.A OD2 no hydrogen 2.682 N/A VAL 148.A N SER 145.A O no hydrogen 3.324 N/A PHE 149.A N VAL 110.A O no hydrogen 2.721 N/A HIS 150.A N LYS 10.A O no hydrogen 2.917 N/A VAL 151.A N LYS 108.A O no hydrogen 2.981 N/A ILE 152.A N CYS 8.A O no hydrogen 2.937 N/A TRP 154.A N ILE 6.A O no hydrogen 3.147 N/A LYS 155.A N ASP 153.A OD1 no hydrogen 2.956 N/A SER 156.A N ASP 153.A O no hydrogen 3.205 N/A SER 156.A OG ASP 153.A O no hydrogen 2.787 N/A PHE 158.A N LYS 155.A O no hydrogen 3.329 N/A GLN 159.A N SER 156.A O no hydrogen 3.004 N/A VAL 165.A N HIS 200.A O no hydrogen 3.081 N/A THR 166.A N ILE 297.A O no hydrogen 2.928 N/A THR 166.A OG1 VAL 198.A O no hydrogen 2.651 N/A LYS 168.A N GLU 295.A O no hydrogen 2.842 N/A LYS 168.A NZ GLY 172.A O no hydrogen 2.786 N/A GLY 169.A N LYS 173.A O no hydrogen 2.977 N/A ASN 171.A ND2 PHE 188.A O no hydrogen 3.361 N/A GLY 172.A N GLY 169.A O no hydrogen 3.020 N/A LYS 173.A N ASN 171.A OD1 no hydrogen 3.258 N/A LYS 173.A NZ ASP 191.A OD1 no hydrogen 2.679 N/A TYR 174.A N TYR 190.A O no hydrogen 2.846 N/A LEU 175.A N PHE 167.A O no hydrogen 2.912 N/A GLY 176.A N GLN 187.A O no hydrogen 2.930 N/A VAL 177.A N LYS 197.A O no hydrogen 2.921 N/A ILE 178.A N CYS 185.A O no hydrogen 2.731 N/A ILE 180.A N LEU 183.A O no hydrogen 2.899 N/A LEU 183.A N ILE 180.A O no hydrogen 2.953 N/A CYS 185.A N ILE 178.A O no hydrogen 2.716 N/A CYS 185.A SG LEU 183.A O no hydrogen 3.716 N/A GLN 187.A N GLY 176.A O no hydrogen 2.860 N/A GLN 187.A NE2 ILE 278.A O no hydrogen 2.917 N/A PHE 188.A N ASN 279.A O no hydrogen 2.956 N/A TYR 190.A N TYR 174.A O no hydrogen 3.392 N/A TYR 190.A OH VAL 177.A O no hydrogen 2.595 N/A ASP 195.A N ASN 192.A O no hydrogen 3.269 N/A LYS 197.A N ASP 195.A OD1 no hydrogen 3.425 N/A LYS 197.A NZ ASP 195.A OD1 no hydrogen 3.242 N/A VAL 198.A N ASP 195.A O no hydrogen 2.851 N/A HIS 200.A N VAL 165.A O no hydrogen 2.826 N/A HIS 200.A NE2 LEU 175.A O no hydrogen 2.768 N/A GLN 201.A N LYS 213.A O no hydrogen 2.957 N/A GLN 201.A NE2 ASN 215.A OD1 no hydrogen 2.524 N/A PHE 203.A N CYS 211.A O no hydrogen 2.818 N/A THR 205.A N THR 209.A O no hydrogen 2.930 N/A THR 205.A OG1 ASN 207.A OD1 no hydrogen 2.962 N/A THR 205.A OG1 THR 209.A O no hydrogen 2.705 N/A THR 205.A OG1 THR 209.A OG1 no hydrogen 2.771 N/A GLY 208.A N THR 205.A O no hydrogen 3.116 N/A THR 209.A N ASN 207.A OD1 no hydrogen 3.123 N/A THR 209.A OG1 THR 205.A OG1 no hydrogen 2.771 N/A THR 209.A OG1 ASN 207.A OD1 no hydrogen 2.590 N/A ILE 210.A N PHE 246.A O no hydrogen 2.731 N/A CYS 211.A N PHE 203.A O no hydrogen 2.855 N/A LYS 213.A N GLN 201.A O no hydrogen 2.917 N/A LYS 213.A NZ ASN 218.A OD1 no hydrogen 3.029 N/A SER 214.A N LYS 219.A O no hydrogen 2.775 N/A ASN 215.A N ALA 199.A O no hydrogen 3.070 N/A MET 217.A N SER 214.A OG no hydrogen 3.075 N/A ASN 218.A N SER 214.A O no hydrogen 2.530 N/A PHE 220.A N GLY 233.A O no hydrogen 3.012 N/A TRP 221.A N ILE 212.A O no hydrogen 2.869 N/A ARG 222.A N LEU 230.A O no hydrogen 2.852 N/A ARG 222.A NE ASP 232.A OD1 no hydrogen 2.789 N/A ARG 222.A NH1 GLU 241.A OE2 no hydrogen 3.112 N/A ARG 222.A NH2 ASP 232.A OD1 no hydrogen 3.390 N/A ARG 222.A NH2 ASP 232.A OD2 no hydrogen 2.884 N/A LEU 223.A N ALA 243.A O no hydrogen 2.957 N/A SER 224.A N TRP 228.A O no hydrogen 3.065 N/A ASP 227.A N SER 224.A O no hydrogen 2.916 N/A TRP 228.A N THR 225.A O no hydrogen 2.990 N/A ILE 229.A N MET 281.A O no hydrogen 2.956 N/A LEU 230.A N ARG 222.A O no hydrogen 2.899 N/A VAL 231.A N PRO 184.A O no hydrogen 2.753 N/A GLY 233.A N PHE 220.A O no hydrogen 2.918 N/A ARG 237.A N ASP 235.A OD1 no hydrogen 2.913 N/A ARG 237.A NE ASP 235.A OD1 no hydrogen 2.988 N/A ARG 237.A NE ASP 235.A OD2 no hydrogen 3.316 N/A ARG 237.A NH2 ASP 235.A OD2 no hydrogen 2.766 N/A GLU 238.A N ASP 235.A O no hydrogen 2.922 N/A THR 239.A N ASP 235.A O no hydrogen 3.196 N/A ASN 240.A N PRO 236.A O no hydrogen 2.699 N/A GLU 241.A N THR 239.A OG1 no hydrogen 3.278 N/A ALA 244.A N GLU 241.A O no hydrogen 2.898 N/A LEU 245.A N ALA 242.A O no hydrogen 3.104 N/A PHE 246.A N ILE 210.A O no hydrogen 2.900 N/A ARG 247.A N LEU 259.A O no hydrogen 3.067 N/A ARG 247.A NH1 ASN 207.A O no hydrogen 2.872 N/A ARG 247.A NH2 ASN 207.A O no hydrogen 3.067 N/A ASP 249.A N SER 257.A O no hydrogen 2.903 N/A HIS 251.A N VAL 255.A O no hydrogen 2.732 N/A HIS 251.A NE2 SER 257.A OG no hydrogen 2.904 N/A ASP 252.A N VAL 255.A O no hydrogen 3.294 N/A PHE 253.A N ASP 252.A OD1 no hydrogen 2.937 N/A VAL 255.A N ASP 252.A O no hydrogen 2.886 N/A ILE 256.A N LEU 294.A O no hydrogen 2.927 N/A SER 257.A N ASP 249.A O no hydrogen 3.079 N/A SER 257.A OG HIS 251.A NE2 no hydrogen 2.904 N/A SER 257.A OG ALA 292.A O no hydrogen 2.846 N/A LEU 259.A N ARG 247.A O no hydrogen 2.835 N/A ASN 260.A N TRP 265.A O no hydrogen 2.913 N/A ASN 260.A ND2 ALA 243.A O no hydrogen 2.771 N/A MET 261.A N LEU 245.A O no hydrogen 2.956 N/A GLN 262.A N ASN 260.A OD1 no hydrogen 2.964 N/A LYS 263.A N ASN 260.A OD1 no hydrogen 3.216 N/A LYS 263.A NZ ASP 227.A OD2 no hydrogen 2.862 N/A LYS 263.A NZ ALA 283.A O no hydrogen 2.882 N/A THR 264.A OG1 LYS 263.A O no hydrogen 2.715 N/A PHE 266.A N THR 285.A O no hydrogen 2.842 N/A ILE 267.A N LEU 258.A O no hydrogen 3.060 N/A LYS 268.A N ASN 282.A O no hydrogen 2.898 N/A LYS 268.A NZ ASP 289.A OD2 no hydrogen 2.660 N/A LYS 268.A NZ THR 291.A OG1 no hydrogen 3.066 N/A ARG 269.A N THR 291.A O no hydrogen 3.164 N/A ARG 269.A NE ASN 170.A OD1 no hydrogen 3.050 N/A ARG 269.A NH1 ASN 279.A OD1 no hydrogen 2.660 N/A ARG 269.A NH2 ASN 170.A OD1 no hydrogen 2.809 N/A PHE 270.A N CYS 280.A O no hydrogen 2.915 N/A SER 272.A N PHE 277.A O no hydrogen 3.217 N/A PHE 277.A N LYS 274.A O no hydrogen 3.310 N/A ILE 278.A N GLY 276.A O no hydrogen 3.125 N/A ASN 279.A N THR 271.A OG1 no hydrogen 3.015 N/A CYS 280.A N PHE 270.A O no hydrogen 2.800 N/A CYS 280.A SG ILE 278.A O no hydrogen 3.636 N/A MET 281.A N LEU 186.A O no hydrogen 2.829 N/A ASN 282.A N LYS 268.A O no hydrogen 2.953 N/A ASN 282.A ND2 ASP 226.A O no hydrogen 3.055 N/A ALA 283.A N ASP 227.A O no hydrogen 2.982 N/A ALA 284.A N ASN 282.A O no hydrogen 2.877 N/A THR 285.A N PHE 266.A O no hydrogen 3.466 N/A THR 285.A OG1 ASN 287.A O no hydrogen 2.736 N/A GLU 290.A N GLU 290.A OE1 no hydrogen 3.110 N/A THR 291.A OG1 ASP 289.A OD1 no hydrogen 2.792 N/A ALA 292.A N ASP 289.A O no hydrogen 2.837 N/A LEU 294.A N ILE 256.A O no hydrogen 2.697 N/A GLU 295.A N LYS 168.A O no hydrogen 3.107 N/A ILE 296.A N ASN 254.A O no hydrogen 2.897 N/A ILE 297.A N THR 166.A O no hydrogen 3.110 N/A LEU 299.A N TYR 164.A O no hydrogen 2.707 N/A