Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1u4s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ ASP 29.A OD1 no hydrogen 2.900 N/A LYS 3.A NZ ASN 57.A O no hydrogen 2.958 N/A LYS 5.A N ASP 73.A OD1 no hydrogen 2.774 N/A LYS 5.A NZ ASP 68.A O no hydrogen 2.732 N/A LYS 5.A NZ ALA 70.A O no hydrogen 2.551 N/A ILE 6.A N ASP 29.A O no hydrogen 2.857 N/A VAL 7.A N VAL 74.A O no hydrogen 2.826 N/A LEU 8.A N VAL 31.A O no hydrogen 2.782 N/A VAL 9.A N ILE 76.A O no hydrogen 2.799 N/A GLY 10.A N PHE 33.A O no hydrogen 2.844 N/A SER 11.A N ASP 34.A OD2 no hydrogen 2.828 N/A SER 11.A OG PHE 33.A O no hydrogen 2.744 N/A GLY 16.A N GLY 12.A O no hydrogen 2.848 N/A VAL 17.A N MET 13.A O no hydrogen 3.144 N/A MET 18.A N ILE 14.A O no hydrogen 2.974 N/A ALA 19.A N GLY 15.A O no hydrogen 2.991 N/A THR 20.A N GLY 16.A O no hydrogen 3.170 N/A THR 20.A OG1 GLY 16.A O no hydrogen 3.062 N/A LEU 21.A N VAL 17.A O no hydrogen 2.948 N/A ILE 22.A N MET 18.A O no hydrogen 2.978 N/A VAL 23.A N ALA 19.A O no hydrogen 3.180 N/A GLN 24.A N THR 20.A O no hydrogen 3.013 N/A LYS 25.A N LEU 21.A O no hydrogen 2.916 N/A ASN 26.A N VAL 23.A O no hydrogen 3.001 N/A LEU 27.A N ILE 22.A O no hydrogen 2.949 N/A ASP 29.A N ALA 4.A O no hydrogen 2.910 N/A VAL 30.A N LYS 59.A O no hydrogen 2.711 N/A VAL 31.A N ILE 6.A O no hydrogen 2.957 N/A LEU 32.A N SER 61.A O no hydrogen 2.809 N/A PHE 33.A N LEU 8.A O no hydrogen 2.911 N/A ASP 34.A N SER 63.A O no hydrogen 3.028 N/A VAL 36.A N ASP 34.A OD1 no hydrogen 2.962 N/A ASN 38.A N ASN 64.A OD1 no hydrogen 3.206 N/A MET 39.A N LYS 37.A O no hydrogen 2.850 N/A GLY 42.A N ASN 38.A O no hydrogen 2.980 N/A LYS 43.A N MET 39.A O no hydrogen 2.949 N/A LYS 43.A NZ SER 11.A O no hydrogen 2.863 N/A LYS 43.A NZ GLY 12.A O no hydrogen 3.201 N/A ALA 44.A N PRO 40.A O no hydrogen 2.890 N/A LEU 45.A N HIS 41.A O no hydrogen 3.023 N/A ASP 46.A N GLY 42.A O no hydrogen 3.142 N/A THR 47.A N LYS 43.A O no hydrogen 2.968 N/A THR 47.A OG1 LYS 43.A O no hydrogen 2.810 N/A SER 48.A N ALA 44.A O no hydrogen 2.836 N/A SER 48.A OG LEU 45.A O no hydrogen 2.653 N/A THR 50.A N THR 47.A O no hydrogen 3.042 N/A THR 50.A OG1 THR 47.A O no hydrogen 2.693 N/A ASN 51.A N SER 48.A O no hydrogen 3.163 N/A ASN 51.A ND2 SER 48.A O no hydrogen 2.886 N/A ASN 51.A ND2 CYS 58.A O no hydrogen 2.790 N/A VAL 52.A N HIS 49.A O no hydrogen 3.136 N/A SER 56.A N ASN 51.A O no hydrogen 2.990 N/A SER 56.A OG VAL 23.A O no hydrogen 2.611 N/A ASN 57.A N ASN 26.A OD1 no hydrogen 2.981 N/A CYS 58.A N ASN 51.A OD1 no hydrogen 2.772 N/A CYS 58.A SG ASN 26.A OD1 no hydrogen 3.190 N/A CYS 58.A SG GLY 28.A O no hydrogen 3.123 N/A LYS 59.A N ASP 29.A OD1 no hydrogen 2.900 N/A SER 61.A N VAL 30.A O no hydrogen 2.907 N/A SER 61.A OG VAL 30.A O no hydrogen 3.565 N/A SER 63.A N LEU 32.A O no hydrogen 2.941 N/A SER 63.A OG THR 65.A O no hydrogen 3.051 N/A SER 63.A OG ASP 68.A OD2 no hydrogen 2.654 N/A ASN 64.A ND2 ASP 34.A O no hydrogen 2.705 N/A ASN 64.A ND2 VAL 36.A O no hydrogen 2.747 N/A THR 65.A N SER 63.A OG no hydrogen 2.969 N/A TYR 66.A OH GLU 98.A OE1 no hydrogen 2.649 N/A ASP 68.A N THR 65.A O no hydrogen 2.973 N/A LEU 69.A N TYR 66.A O no hydrogen 2.946 N/A ALA 70.A N ASP 67.A O no hydrogen 3.081 N/A ALA 72.A N LEU 69.A O no hydrogen 3.021 N/A ASP 73.A N LYS 5.A O no hydrogen 2.850 N/A VAL 74.A N LYS 5.A O no hydrogen 3.218 N/A VAL 75.A N PHE 111.A O no hydrogen 2.881 N/A ILE 76.A N VAL 7.A O no hydrogen 2.860 N/A VAL 77.A N ILE 113.A O no hydrogen 2.922 N/A THR 78.A N VAL 9.A O no hydrogen 2.914 N/A THR 78.A OG1 VAL 9.A O no hydrogen 3.564 N/A ALA 79.A N VAL 9.A O no hydrogen 3.173 N/A PHE 81.A N ASN 92.A OD1 no hydrogen 2.703 N/A ARG 85.A NE ASP 86.A OD2 no hydrogen 2.593 N/A ARG 85.A NH1 GLU 298.A OE2 no hydrogen 2.978 N/A ASP 87.A N ASN 84.A O no hydrogen 2.990 N/A ASP 87.A N ASN 84.A OD1 no hydrogen 2.941 N/A LEU 88.A N ARG 85.A O no hydrogen 3.214 N/A LEU 89.A N ASP 86.A O no hydrogen 3.095 N/A ASN 92.A N LEU 88.A O no hydrogen 2.894 N/A ASN 92.A ND2 PHE 81.A O no hydrogen 2.863 N/A ASN 93.A N LEU 89.A O no hydrogen 2.990 N/A ASN 93.A ND2 ALA 306.A O no hydrogen 3.253 N/A LYS 94.A N PRO 90.A O no hydrogen 3.123 N/A ILE 95.A N LEU 91.A O no hydrogen 3.259 N/A MET 96.A N ASN 92.A O no hydrogen 2.927 N/A ILE 97.A N ASN 93.A O no hydrogen 2.904 N/A GLU 98.A N LYS 94.A O no hydrogen 2.994 N/A ILE 99.A N ILE 95.A O no hydrogen 2.920 N/A GLY 100.A N MET 96.A O no hydrogen 2.765 N/A GLY 101.A N ILE 97.A O no hydrogen 3.003 N/A HIS 102.A N GLU 98.A O no hydrogen 3.357 N/A ILE 103.A N ILE 99.A O no hydrogen 2.920 N/A LYS 104.A N GLY 100.A O no hydrogen 2.907 N/A LYS 105.A N GLY 101.A O no hydrogen 3.078 N/A ASN 106.A N HIS 102.A O no hydrogen 2.756 N/A ASN 106.A ND2 HIS 102.A O no hydrogen 2.905 N/A CYS 107.A N ILE 103.A O no hydrogen 2.918 N/A CYS 107.A SG LEU 69.A O no hydrogen 3.511 N/A ALA 110.A N CYS 107.A O no hydrogen 3.064 N/A PHE 111.A N ASP 73.A O no hydrogen 3.003 N/A ILE 112.A N LYS 136.A O no hydrogen 2.826 N/A ILE 113.A N VAL 75.A O no hydrogen 2.939 N/A VAL 114.A N ILE 138.A O no hydrogen 2.853 N/A VAL 115.A N VAL 77.A O no hydrogen 2.839 N/A THR 116.A N VAL 77.A O no hydrogen 3.447 N/A THR 116.A OG1 ALA 79.A O no hydrogen 2.634 N/A VAL 119.A N ASN 117.A OD1 no hydrogen 3.211 N/A MET 122.A N PRO 118.A O no hydrogen 2.981 N/A VAL 123.A N VAL 119.A O no hydrogen 2.884 N/A GLN 124.A NE2 ASP 262.A O no hydrogen 3.057 N/A LEU 125.A N VAL 121.A O no hydrogen 3.225 N/A LEU 126.A N MET 122.A O no hydrogen 2.911 N/A HIS 127.A N VAL 123.A O no hydrogen 2.890 N/A GLN 128.A N GLN 124.A O no hydrogen 2.925 N/A HIS 129.A N LEU 125.A O no hydrogen 2.990 N/A SER 130.A N LEU 126.A O no hydrogen 2.808 N/A SER 130.A OG LEU 126.A O no hydrogen 2.824 N/A SER 130.A OG HIS 127.A O no hydrogen 3.354 N/A GLY 131.A N HIS 127.A O no hydrogen 3.183 N/A VAL 132.A N SER 130.A OG no hydrogen 3.348 N/A LYS 134.A NZ GLU 255.A OE2 no hydrogen 2.979 N/A ASN 135.A ND2 ASN 274.A O no hydrogen 2.931 N/A LYS 136.A N PRO 133.A O no hydrogen 2.963 N/A LYS 136.A NZ ASN 109B.A O no hydrogen 2.678 N/A ILE 138.A N ILE 112.A O no hydrogen 2.879 N/A GLY 139.A N SER 251.A O no hydrogen 2.952 N/A LEU 140.A N VAL 114.A O no hydrogen 2.882 N/A VAL 143.A N ILE 249.A O no hydrogen 3.077 N/A ASP 145.A N GLY 141.A O no hydrogen 2.965 N/A THR 146.A N GLY 142.A O no hydrogen 2.825 N/A THR 146.A OG1 GLY 142.A O no hydrogen 2.723 N/A THR 146.A OG1 VAL 143.A O no hydrogen 3.428 N/A SER 147.A N VAL 143.A O no hydrogen 3.094 N/A SER 147.A OG LEU 144.A O no hydrogen 2.631 N/A ARG 148.A N ASP 145.A O no hydrogen 3.237 N/A LEU 149.A N ASP 145.A O no hydrogen 3.442 N/A LYS 150.A N THR 146.A O no hydrogen 2.759 N/A LYS 150.A NZ THR 146.A OG1 no hydrogen 3.001 N/A TYR 151.A N SER 147.A O no hydrogen 2.897 N/A TYR 152.A N ARG 148.A O no hydrogen 2.864 N/A TYR 152.A OH THR 214.A OG1 no hydrogen 3.199 N/A ILE 153.A N LEU 149.A O no hydrogen 3.068 N/A SER 154.A N LYS 150.A O no hydrogen 3.002 N/A SER 154.A OG TYR 151.A O no hydrogen 2.792 N/A GLN 155.A N TYR 151.A O no hydrogen 3.072 N/A GLN 155.A N TYR 152.A O no hydrogen 3.264 N/A GLN 155.A NE2 SER 154.A OG no hydrogen 3.023 N/A LYS 156.A N TYR 152.A O no hydrogen 3.273 N/A LYS 156.A NZ GLU 203.A OE2 no hydrogen 2.773 N/A LEU 157.A N ILE 153.A O no hydrogen 2.894 N/A VAL 159.A N SER 154.A O no hydrogen 3.086 N/A ARG 162.A NH1 GLU 235.A OE2 no hydrogen 2.862 N/A ARG 162.A NH2 GLU 235.A OE2 no hydrogen 2.880 N/A ASP 163.A N CYS 160.A O no hydrogen 2.846 N/A VAL 164.A N PRO 161.A O no hydrogen 3.158 N/A ASN 165.A N THR 184.A O no hydrogen 2.958 N/A ALA 166.A N ASN 165.A OD1 no hydrogen 2.926 N/A VAL 169.A N VAL 177.A O no hydrogen 2.939 N/A GLY 170.A N GLY 266.A O no hydrogen 2.898 N/A HIS 172.A N ASP 120.A OD2 no hydrogen 2.853 N/A HIS 172.A ND1 ASP 145.A OD1 no hydrogen 2.704 N/A MET 176.A N GLY 173.A O no hydrogen 3.007 N/A VAL 177.A N VAL 169.A O no hydrogen 2.933 N/A LEU 179.A N HIS 167.A O no hydrogen 3.135 N/A LYS 180.A NZ ASP 201.A OD1 no hydrogen 2.570 N/A ARG 181.A NE GLU 288.A OE1 no hydrogen 2.902 N/A ARG 181.A NH2 GLN 283.A O no hydrogen 3.103 N/A ARG 181.A NH2 GLU 288.A OE2 no hydrogen 2.812 N/A TYR 182.A N LEU 179.A O no hydrogen 3.011 N/A ILE 183.A N LYS 180.A O no hydrogen 3.296 N/A THR 184.A N ASN 165.A O no hydrogen 2.889 N/A VAL 185.A N ILE 188C.A O no hydrogen 2.829 N/A GLU 192.A N PRO 189D.A O no hydrogen 3.112 N/A PHE 193.A N LEU 190A.A O no hydrogen 2.853 N/A ILE 194.A N LEU 190A.A O no hydrogen 3.146 N/A ASN 195.A N GLN 191B.A O no hydrogen 2.770 N/A ASN 196.A N GLU 192.A O no hydrogen 3.031 N/A LYS 197.A N ILE 194.A O no hydrogen 3.025 N/A LEU 198.A N PHE 193.A O no hydrogen 2.775 N/A ILE 199.A N PHE 193.A O no hydrogen 3.416 N/A SER 200.A N GLU 203.A OE1 no hydrogen 2.827 N/A SER 200.A OG GLU 203.A OE1 no hydrogen 3.387 N/A GLU 203.A N SER 200.A OG no hydrogen 2.956 N/A LEU 204.A N SER 200.A O no hydrogen 2.897 N/A GLU 205.A N ASP 201.A O no hydrogen 2.921 N/A ALA 206.A N ALA 202.A O no hydrogen 3.097 N/A ILE 207.A N GLU 203.A O no hydrogen 2.961 N/A PHE 208.A N LEU 204.A O no hydrogen 2.882 N/A ASP 209.A N GLU 205.A O no hydrogen 3.074 N/A ARG 210.A N ALA 206.A O no hydrogen 2.910 N/A ARG 210.A NE GLU 217.A OE1 no hydrogen 2.966 N/A ARG 210.A NE GLU 217.A OE2 no hydrogen 3.465 N/A ARG 210.A NH2 GLU 217.A OE2 no hydrogen 2.991 N/A THR 211.A N ILE 207.A O no hydrogen 2.882 N/A THR 211.A OG1 ILE 207.A O no hydrogen 2.820 N/A VAL 212.A N PHE 208.A O no hydrogen 3.001 N/A ASN 213.A N ASP 209.A O no hydrogen 3.001 N/A ASN 213.A ND2 ASP 209.A O no hydrogen 3.021 N/A THR 214.A N THR 211.A O no hydrogen 3.371 N/A THR 214.A OG1 TYR 152.A OH no hydrogen 3.199 N/A THR 214.A OG1 ARG 210.A O no hydrogen 2.632 N/A THR 214.A OG1 THR 211.A O no hydrogen 3.459 N/A GLU 217.A N ASN 213.A O no hydrogen 2.847 N/A ILE 218.A N THR 214.A O no hydrogen 2.921 N/A VAL 219.A N ALA 215.A O no hydrogen 3.003 N/A ASN 220.A N LEU 216.A O no hydrogen 2.862 N/A LEU 221.A N GLU 217.A O no hydrogen 3.044 N/A HIS 222.A N VAL 219.A O no hydrogen 2.952 N/A ALA 223.A N ILE 218.A O no hydrogen 3.109 N/A ALA 230.A N TYR 226.A O no hydrogen 3.044 N/A ALA 231.A N VAL 227.A O no hydrogen 2.951 N/A ALA 232.A N ALA 228.A O no hydrogen 2.945 N/A ILE 233.A N PRO 229.A O no hydrogen 3.061 N/A ILE 234.A N ALA 230.A O no hydrogen 3.001 N/A GLU 235.A N ALA 231.A O no hydrogen 2.849 N/A MET 236.A N ALA 232.A O no hydrogen 3.117 N/A ALA 237.A N ILE 233.A O no hydrogen 2.873 N/A GLU 238.A N ILE 234.A O no hydrogen 2.712 N/A SER 239.A N GLU 235.A O no hydrogen 3.099 N/A SER 239.A OG LEU 271.A O no hydrogen 2.680 N/A TYR 240.A N MET 236.A O no hydrogen 3.280 N/A LEU 241.A N ALA 237.A O no hydrogen 2.887 N/A LYS 242.A N GLU 238.A O no hydrogen 2.877 N/A LYS 242.A NZ GLU 238.A OE2 no hydrogen 2.709 N/A ASP 243.A N TYR 240.A O no hydrogen 3.264 N/A LEU 244.A N SER 239.A O no hydrogen 2.935 N/A LYS 245.A NZ ASP 243.A OD1 no hydrogen 2.814 N/A LYS 245.A NZ GLU 277.A OE2 no hydrogen 2.606 N/A LYS 246.A N SER 239.A OG no hydrogen 3.219 N/A LYS 246.A NZ GLU 235.A OE2 no hydrogen 2.729 N/A LEU 248.A N VAL 269.A O no hydrogen 2.900 N/A CYS 250.A N THR 267.A O no hydrogen 3.046 N/A CYS 250.A SG LEU 248.A O no hydrogen 3.703 N/A SER 251.A N GLY 139.A O no hydrogen 3.025 N/A SER 251.A OG ASP 120.A OD1 no hydrogen 2.668 N/A THR 252.A N GLY 265.A O no hydrogen 3.155 N/A LEU 254.A N ILE 263.A O no hydrogen 2.873 N/A GLU 255.A N GLN 257.A OE1 no hydrogen 2.762 N/A GLY 256.A N HIS 260.A O no hydrogen 2.731 N/A GLN 257.A N GLN 257.A OE1 no hydrogen 2.968 N/A TYR 258.A N GLU 281.A OE2 no hydrogen 3.004 N/A TYR 258.A OH THR 267.A OG1 no hydrogen 2.738 N/A GLY 259.A N GLY 256.A O no hydrogen 2.904 N/A HIS 260.A N GLN 257.A O no hydrogen 3.120 N/A HIS 260.A NE2 ASP 293.A OD1 no hydrogen 2.792 N/A GLY 265.A N THR 252.A O no hydrogen 3.102 N/A GLY 266.A N GLY 170.A O no hydrogen 3.000 N/A THR 267.A N CYS 250.A O no hydrogen 3.055 N/A THR 267.A OG1 TYR 258.A OH no hydrogen 2.738 N/A THR 267.A OG1 ILE 280.A O no hydrogen 2.721 N/A VAL 269.A N LEU 248.A O no hydrogen 2.921 N/A VAL 270.A N GLN 278.A O no hydrogen 2.982 N/A LEU 271.A N LYS 246.A O no hydrogen 3.107 N/A GLY 272.A N GLY 275.A O no hydrogen 2.959 N/A ALA 273.A N ASP 243.A OD1 no hydrogen 2.794 N/A ASN 274.A N GLU 277.A OE1 no hydrogen 2.908 N/A ASN 274.A ND2 GLU 277.A OE1 no hydrogen 3.526 N/A GLY 275.A N GLY 272.A O no hydrogen 2.836 N/A VAL 276.A N ASN 135.A O no hydrogen 2.818 N/A GLU 277.A N VAL 270.A O no hydrogen 2.824 N/A ILE 280.A N PRO 268.A O no hydrogen 2.785 N/A LEU 282.A N TYR 258.A OH no hydrogen 2.911 N/A ASN 285.A N GLU 288.A OE2 no hydrogen 2.988 N/A SER 286.A OG GLU 287.A OE2 no hydrogen 2.793 N/A GLU 288.A N ASN 285.A OD1 no hydrogen 2.907 N/A LYS 289.A N ASN 285.A O no hydrogen 2.941 N/A LYS 289.A NZ TYR 258.A O no hydrogen 2.801 N/A LYS 289.A NZ ASP 293.A OD1 no hydrogen 2.673 N/A LYS 289.A NZ ASP 293.A OD2 no hydrogen 3.239 N/A ALA 290.A N SER 286.A O no hydrogen 3.007 N/A LYS 291.A NZ GLU 294.A OE2 no hydrogen 3.152 N/A PHE 292.A N GLU 288.A O no hydrogen 3.040 N/A ASP 293.A N LYS 289.A O no hydrogen 2.839 N/A GLU 294.A N ALA 290.A O no hydrogen 3.197 N/A ALA 295.A N LYS 291.A O no hydrogen 3.185 N/A ILE 296.A N PHE 292.A O no hydrogen 3.016 N/A ALA 297.A N ASP 293.A O no hydrogen 2.893 N/A GLU 298.A N GLU 294.A O no hydrogen 3.124 N/A THR 299.A N ALA 295.A O no hydrogen 3.154 N/A THR 299.A OG1 ALA 295.A O no hydrogen 3.471 N/A LYS 300.A N ILE 296.A O no hydrogen 2.899 N/A ARG 301.A N ALA 297.A O no hydrogen 2.892 N/A ARG 301.A NE GLU 298.A OE1 no hydrogen 2.876 N/A ARG 301.A NH1 ASP 86.A OD1 no hydrogen 3.022 N/A ARG 301.A NH2 ASP 86.A OD1 no hydrogen 3.448 N/A ARG 301.A NH2 ASP 86.A OD2 no hydrogen 3.306 N/A ARG 301.A NH2 GLU 298.A OE2 no hydrogen 2.960 N/A MET 302.A N GLU 298.A O no hydrogen 3.006 N/A LYS 303.A N THR 299.A O no hydrogen 2.875 N/A LYS 303.A NZ GLN 124.A OE1 no hydrogen 2.787 N/A ALA 304.A N LYS 300.A O no hydrogen 3.071 N/A LEU 305.A N ARG 301.A O no hydrogen 3.291 N/A ALA 306.A N MET 302.A O no hydrogen 3.062 N/A ALA 306.A N LYS 303.A O no hydrogen 3.020 N/A ALA 54A.A N THR 50.A O no hydrogen 2.877 N/A GLY 186A.A N ASP 163.A O no hydrogen 2.811 N/A LEU 190A.A N ILE 183.A O no hydrogen 3.004 N/A TYR 55B.A N VAL 52.A O no hydrogen 3.361 N/A GLN 191B.A NE2 ASN 195.A OD1 no hydrogen 2.835 N/A ILE 188C.A N VAL 185.A O no hydrogen 2.984 N/A