Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wl6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLN 135.A O no hydrogen 3.092 N/A CYS 4.A SG TYR 8.A O no hydrogen 3.609 N/A CYS 4.A SG CYS 136.A O no hydrogen 3.413 N/A CYS 4.A SG THR 139.A OG1 no hydrogen 3.400 N/A TYR 8.A N PRO 5.A O no hydrogen 2.917 N/A TYR 8.A OH VAL 16.A O no hydrogen 2.691 N/A LYS 11.A N ASN 15.A OD1 no hydrogen 2.915 N/A LYS 11.A NZ GLU 12.A O no hydrogen 2.887 N/A LYS 11.A NZ LEU 14.A O no hydrogen 2.887 N/A GLY 13.A N VAL 29.A O no hydrogen 2.815 N/A ASN 15.A N PHE 27.A O no hydrogen 2.751 N/A ASN 15.A ND2 LYS 11.A O no hydrogen 2.884 N/A ASN 15.A ND2 GLY 13.A O no hydrogen 2.994 N/A ASN 15.A ND2 PHE 27.A O no hydrogen 3.682 N/A PHE 18.A N ARG 25.A O no hydrogen 2.844 N/A HIS 20.A N MET 23.A O no hydrogen 3.074 N/A HIS 20.A NE2 SER 128.A OG no hydrogen 2.700 N/A LYS 21.A NZ SER 128.A OG no hydrogen 2.808 N/A MET 23.A N HIS 20.A O no hydrogen 2.835 N/A ARG 25.A N PHE 18.A O no hydrogen 2.838 N/A ARG 25.A NH1 ASP 126.A OD1 no hydrogen 2.791 N/A ARG 25.A NH2 VAL 78.A O no hydrogen 3.031 N/A ARG 25.A NH2 ASP 126.A OD1 no hydrogen 2.821 N/A PHE 27.A N ASN 15.A O no hydrogen 3.012 N/A ILE 28.A N ALA 76.A O no hydrogen 2.849 N/A VAL 29.A N GLY 13.A O no hydrogen 2.875 N/A TYR 30.A N VAL 74.A O no hydrogen 2.840 N/A ALA 32.A N THR 73.A OG1 no hydrogen 2.940 N/A LYS 33.A N ALA 68.A O no hydrogen 2.840 N/A ALA 39.A N LYS 142.A O no hydrogen 2.898 N/A VAL 41.A N ARG 147.A O no hydrogen 2.898 N/A TRP 42.A N THR 73.A O no hydrogen 2.988 N/A VAL 43.A N PHE 149.A O no hydrogen 2.875 N/A MET 45.A N GLY 151.A O no hydrogen 2.761 N/A THR 46.A OG1 GLU 50.A O no hydrogen 2.708 N/A THR 46.A OG1 SER 51.A O no hydrogen 3.423 N/A SER 51.A N ASP 54.A OD2 no hydrogen 2.899 N/A THR 52.A OG1 PRO 77.A O no hydrogen 3.412 N/A ASN 53.A N PRO 86.A O no hydrogen 2.878 N/A ASP 54.A N SER 51.A OG no hydrogen 2.832 N/A ASN 55.A N SER 51.A O no hydrogen 2.959 N/A LEU 56.A N THR 52.A O no hydrogen 2.944 N/A LEU 56.A N ASN 53.A O no hydrogen 3.130 N/A THR 57.A N ASN 53.A O no hydrogen 2.846 N/A THR 57.A N ASP 54.A O no hydrogen 3.191 N/A THR 57.A OG1 ASN 53.A O no hydrogen 2.743 N/A VAL 58.A N ASP 54.A O no hydrogen 2.908 N/A SER 61.A N VAL 58.A O no hydrogen 2.903 N/A SER 61.A OG GLU 50.A OE2 no hydrogen 2.680 N/A GLY 62.A N ALA 59.A O no hydrogen 3.101 N/A ALA 63.A N VAL 58.A O no hydrogen 3.025 N/A ASN 64.A N ASN 55.A O no hydrogen 2.901 N/A SER 65.A N LEU 56.A O no hydrogen 2.890 N/A SER 65.A OG LEU 56.A O no hydrogen 2.699 N/A ILE 66.A N ALA 63.A O no hydrogen 3.069 N/A LEU 67.A N ASN 64.A O no hydrogen 3.169 N/A ALA 68.A N SER 65.A O no hydrogen 3.022 N/A ASP 69.A N ILE 66.A O no hydrogen 3.039 N/A HIS 70.A N LEU 67.A O no hydrogen 2.931 N/A HIS 70.A NE2 ASP 296.A OD2 no hydrogen 2.697 N/A GLY 71.A N ALA 68.A O no hydrogen 3.179 N/A TYR 72.A N LEU 67.A O no hydrogen 3.176 N/A TYR 72.A OH ASP 296.A OD1 no hydrogen 2.659 N/A THR 73.A N PRO 40.A O no hydrogen 2.909 N/A VAL 74.A N TYR 30.A O no hydrogen 2.960 N/A ILE 75.A N TRP 42.A O no hydrogen 2.914 N/A ALA 76.A N ILE 28.A O no hydrogen 2.859 N/A VAL 78.A N ALA 26.A O no hydrogen 2.991 N/A ARG 79.A NH1 SER 48.A O no hydrogen 3.088 N/A ARG 79.A NH1 ARG 89.A O no hydrogen 3.215 N/A ARG 79.A NH2 ARG 89.A O no hydrogen 2.835 N/A CYS 81.A SG ASN 104.A O no hydrogen 3.836 N/A CYS 81.A SG PRO 105.A O no hydrogen 3.991 N/A ALA 82.A N ARG 79.A O no hydrogen 3.045 N/A ASN 83.A N ALA 80.A O no hydrogen 3.079 N/A ASP 85.A N ALA 82.A O no hydrogen 3.039 N/A ASN 87.A N ASP 85.A OD1 no hydrogen 2.824 N/A ILE 88.A N ASP 85.A O no hydrogen 3.232 N/A ARG 89.A N GLU 91.A OE1 no hydrogen 2.809 N/A ARG 89.A NE ASP 54.A OD2 no hydrogen 2.938 N/A ARG 89.A NH2 ASP 54.A OD1 no hydrogen 2.941 N/A GLU 91.A N GLU 91.A OE1 no hydrogen 2.851 N/A CYS 93.A N GLY 90.A O no hydrogen 3.040 N/A CYS 93.A SG GLU 91.A O no hydrogen 3.882 N/A ASN 94.A N GLY 90.A O no hydrogen 2.953 N/A GLY 95.A N CYS 93.A O no hydrogen 3.053 N/A GLY 97.A N ASN 102.A O no hydrogen 2.987 N/A TRP 101.A N SER 98.A O no hydrogen 3.040 N/A ASN 102.A N GLY 109.A O no hydrogen 2.849 N/A TRP 103.A NE1 SER 48.A OG no hydrogen 2.794 N/A ASN 104.A N GLY 95.A O no hydrogen 2.837 N/A ASN 104.A ND2 ARG 92.A O no hydrogen 2.950 N/A TRP 106.A NE1 THR 46.A O no hydrogen 2.793 N/A PHE 107.A N ASP 126.A OD2 no hydrogen 2.860 N/A ARG 110.A N ARG 211.A O no hydrogen 3.035 N/A ARG 110.A NH2 GLY 188.A O no hydrogen 2.896 N/A ALA 111.A N GLY 100.A O no hydrogen 2.775 N/A SER 115.A N ASP 113.A OD1 no hydrogen 2.954 N/A SER 115.A OG ASP 113.A OD1 no hydrogen 2.525 N/A GLY 116.A N ASP 113.A O no hydrogen 2.998 N/A GLU 117.A N PRO 114.A O no hydrogen 3.057 N/A TRP 119.A N GLY 116.A O no hydrogen 2.943 N/A TRP 119.A NE1 ASN 99.A O no hydrogen 2.935 N/A LYS 120.A N GLU 117.A O no hydrogen 2.971 N/A LYS 120.A NZ GLU 117.A OE1 no hydrogen 3.465 N/A LYS 120.A NZ GLU 117.A OE2 no hydrogen 2.745 N/A ASN 121.A ND2 TYR 215.A O no hydrogen 2.890 N/A GLY 124.A N ASP 122.A OD1 no hydrogen 3.022 N/A SER 127.A OG GLU 123.A OE1 no hydrogen 2.701 N/A SER 128.A N GLY 124.A O no hydrogen 3.385 N/A SER 128.A OG HIS 20.A NE2 no hydrogen 2.700 N/A SER 128.A OG GLY 124.A O no hydrogen 3.297 N/A SER 128.A OG PRO 125.A O no hydrogen 3.496 N/A PHE 129.A N PRO 125.A O no hydrogen 3.196 N/A PHE 130.A N ASP 126.A O no hydrogen 2.919 N/A VAL 131.A N SER 127.A O no hydrogen 3.487 N/A ALA 132.A N SER 128.A O no hydrogen 3.110 N/A MET 133.A N PHE 129.A O no hydrogen 2.756 N/A VAL 134.A N PHE 130.A O no hydrogen 2.971 N/A GLN 135.A N VAL 131.A O no hydrogen 2.936 N/A CYS 136.A N ALA 132.A O no hydrogen 2.977 N/A VAL 137.A N MET 133.A O no hydrogen 2.955 N/A GLY 138.A N VAL 134.A O no hydrogen 3.035 N/A THR 139.A N CYS 136.A O no hydrogen 2.955 N/A THR 139.A OG1 CYS 136.A O no hydrogen 2.736 N/A LYS 140.A N VAL 137.A O no hydrogen 2.954 N/A TYR 141.A N VAL 137.A O no hydrogen 3.007 N/A ASP 144.A N ALA 39.A O no hydrogen 2.842 N/A ARG 146.A N ASP 144.A OD1 no hydrogen 2.902 N/A ARG 146.A NE LYS 303.A O no hydrogen 2.904 N/A ARG 146.A NH2 LYS 303.A O no hydrogen 3.026 N/A ARG 147.A N ASP 144.A O no hydrogen 2.914 N/A ARG 147.A NE ALA 299.A O no hydrogen 2.842 N/A ARG 147.A NH1 ASP 144.A OD2 no hydrogen 2.783 N/A ARG 147.A NH2 ALA 299.A O no hydrogen 3.487 N/A PHE 149.A N VAL 41.A O no hydrogen 3.033 N/A LEU 150.A N GLY 173.A O no hydrogen 3.305 N/A GLY 151.A N VAL 43.A O no hydrogen 2.961 N/A GLY 152.A N LEU 175.A O no hydrogen 3.102 N/A ILE 153.A N MET 45.A O no hydrogen 3.301 N/A SER 154.A N ILE 177.A O no hydrogen 2.980 N/A SER 154.A OG HIS 280.A NE2 no hydrogen 2.740 N/A SER 155.A OG GLU 108.A OE2 no hydrogen 2.805 N/A GLY 156.A N ILE 153.A O no hydrogen 2.832 N/A THR 158.A N SER 154.A O no hydrogen 2.914 N/A THR 158.A OG1 SER 154.A O no hydrogen 3.198 N/A MET 159.A N SER 155.A O no hydrogen 2.862 N/A THR 160.A N GLY 156.A O no hydrogen 3.075 N/A THR 160.A OG1 GLY 156.A O no hydrogen 2.860 N/A ASN 161.A N GLY 157.A O no hydrogen 3.057 N/A ASN 161.A ND2 GLU 180.A O no hydrogen 3.155 N/A ARG 162.A N THR 158.A O no hydrogen 2.991 N/A ARG 162.A NE GLU 123.A O no hydrogen 2.869 N/A ARG 162.A NH1 VAL 212.A O no hydrogen 2.982 N/A ARG 162.A NH2 TRP 119.A O no hydrogen 3.016 N/A ARG 162.A NH2 ASP 122.A O no hydrogen 2.830 N/A ALA 163.A N MET 159.A O no hydrogen 2.861 N/A LEU 164.A N THR 160.A O no hydrogen 2.925 N/A LEU 165.A N ASN 161.A O no hydrogen 3.079 N/A PHE 166.A N ARG 162.A O no hydrogen 2.971 N/A ARG 167.A N ALA 163.A O no hydrogen 2.757 N/A ARG 167.A NE GLU 123.A OE1 no hydrogen 2.839 N/A ARG 167.A NE GLU 123.A OE2 no hydrogen 3.370 N/A ARG 167.A NH2 GLU 123.A OE2 no hydrogen 2.898 N/A PHE 170.A N ARG 167.A O no hydrogen 3.022 N/A TRP 171.A N ARG 167.A O no hydrogen 3.291 N/A ALA 172.A N LEU 148.A O no hydrogen 2.792 N/A GLY 174.A N ILE 225.A O no hydrogen 3.028 N/A LEU 175.A N LEU 150.A O no hydrogen 2.878 N/A ILE 177.A N GLY 152.A O no hydrogen 2.926 N/A SER 178.A N VAL 229.A O no hydrogen 2.965 N/A SER 178.A OG ASP 235.A OD1 no hydrogen 3.402 N/A SER 178.A OG ASP 235.A OD2 no hydrogen 2.594 N/A GLU 180.A N THR 158.A OG1 no hydrogen 2.817 N/A TRP 181.A N GLU 180.A OE2 no hydrogen 2.804 N/A TRP 181.A NE1 HIS 208.A O no hydrogen 2.908 N/A TYR 182.A N GLU 180.A OE2 no hydrogen 2.891 N/A TYR 182.A OH GLU 108.A OE1 no hydrogen 2.803 N/A TYR 182.A OH GLU 108.A OE2 no hydrogen 3.270 N/A THR 184.A N GLN 209.A O no hydrogen 2.986 N/A THR 184.A OG1 SER 185.A O no hydrogen 2.949 N/A SER 185.A N THR 189.A O no hydrogen 3.086 N/A GLY 188.A N SER 185.A O no hydrogen 2.894 N/A THR 189.A N ASP 187.A OD1 no hydrogen 3.015 N/A THR 189.A OG1 ASP 187.A OD1 no hydrogen 2.652 N/A THR 189.A OG1 ASP 187.A OD2 no hydrogen 3.426 N/A ASP 195.A N SER 192.A OG no hydrogen 2.993 N/A ALA 196.A N SER 192.A O no hydrogen 2.778 N/A ARG 197.A N PHE 193.A O no hydrogen 2.965 N/A ALA 198.A N ASP 194.A O no hydrogen 2.973 N/A ALA 199.A N ASP 195.A O no hydrogen 2.840 N/A VAL 200.A N ALA 196.A O no hydrogen 3.308 N/A ALA 201.A N ARG 197.A O no hydrogen 3.264 N/A ALA 202.A N ALA 198.A O no hydrogen 2.940 N/A ALA 203.A N VAL 200.A O no hydrogen 3.019 N/A LYS 206.A N ALA 203.A O no hydrogen 3.358 N/A LYS 206.A NZ ASP 186.A OD1 no hydrogen 2.656 N/A LYS 206.A NZ ASP 186.A OD2 no hydrogen 3.544 N/A LYS 206.A NZ ILE 207.A O no hydrogen 2.952 N/A HIS 208.A NE2 ALA 203.A O no hydrogen 2.820 N/A ARG 211.A N TYR 182.A O no hydrogen 2.876 N/A ARG 211.A NH1 ARG 110.A O no hydrogen 2.897 N/A VAL 212.A N TRP 181.A O no hydrogen 3.205 N/A GLY 213.A N GLY 210.A O no hydrogen 3.252 N/A TYR 215.A N LYS 120.A O no hydrogen 2.938 N/A TYR 215.A OH ASP 186.A O no hydrogen 2.976 N/A LEU 217.A N GLN 209.A OE1 no hydrogen 2.801 N/A GLY 222.A N SER 168.A OG no hydrogen 2.824 N/A LEU 224.A N ASP 268.A O no hydrogen 3.141 N/A ILE 225.A N ALA 172.A O no hydrogen 3.044 N/A VAL 226.A N VAL 270.A O no hydrogen 2.842 N/A MET 227.A N GLY 174.A O no hydrogen 2.957 N/A THR 228.A N VAL 272.A O no hydrogen 2.980 N/A VAL 229.A N PRO 176.A O no hydrogen 3.141 N/A TRP 230.A N CYS 274.A O no hydrogen 2.940 N/A GLY 231.A N ASP 235.A OD2 no hydrogen 2.772 N/A ASP 235.A N GLY 232.A O no hydrogen 2.869 N/A LEU 236.A N LYS 234.A O no hydrogen 2.742 N/A TRP 237.A N ALA 250.A O no hydrogen 2.887 N/A CYS 239.A N PHE 247.A O no hydrogen 2.781 N/A ARG 241.A N SER 245.A O no hydrogen 2.839 N/A ARG 241.A NH1 SER 245.A OG no hydrogen 2.869 N/A GLY 244.A N ARG 241.A O no hydrogen 2.743 N/A SER 245.A N ASP 243.A OD1 no hydrogen 2.810 N/A SER 245.A OG ASP 243.A OD1 no hydrogen 2.640 N/A ARG 246.A NE ASN 238.A O no hydrogen 3.474 N/A ARG 246.A NE CYS 239.A O no hydrogen 3.256 N/A ARG 246.A NH2 ASN 238.A O no hydrogen 2.993 N/A PHE 247.A N CYS 239.A O no hydrogen 3.159 N/A CYS 249.A N TRP 237.A O no hydrogen 2.970 N/A CYS 249.A SG TRP 237.A O no hydrogen 3.612 N/A ALA 250.A N TRP 237.A O no hydrogen 3.271 N/A TYR 252.A N ASP 235.A O no hydrogen 3.077 N/A ARG 253.A N ASP 251.A OD1 no hydrogen 2.942 N/A ARG 253.A NH1 LEU 329.A O no hydrogen 2.992 N/A SER 255.A OG GLY 179.A O no hydrogen 2.717 N/A SER 255.A OG TYR 252.A O no hydrogen 3.375 N/A THR 256.A N TYR 252.A O no hydrogen 3.062 N/A THR 256.A OG1 TYR 252.A O no hydrogen 2.812 N/A THR 256.A OG1 ARG 253.A O no hydrogen 3.259 N/A GLN 257.A N ARG 253.A O no hydrogen 3.050 N/A GLN 257.A NE2 GLN 257.A O no hydrogen 3.699 N/A GLN 257.A NE2 ASN 261.A OD1 no hydrogen 2.983 N/A GLN 257.A NE2 PHE 326.A O no hydrogen 3.000 N/A ALA 258.A N PRO 254.A O no hydrogen 2.885 N/A GLY 259.A N SER 255.A O no hydrogen 2.999 N/A SER 260.A N THR 256.A O no hydrogen 2.941 N/A SER 260.A OG THR 256.A O no hydrogen 3.509 N/A SER 260.A OG GLN 257.A O no hydrogen 2.799 N/A ASN 261.A N GLN 257.A O no hydrogen 2.916 N/A ASN 261.A ND2 PRO 204.A O no hydrogen 2.803 N/A ASN 261.A ND2 LYS 206.A O no hydrogen 2.859 N/A PHE 262.A N ALA 258.A O no hydrogen 3.136 N/A PHE 263.A N GLY 259.A O no hydrogen 3.039 N/A SER 264.A N SER 260.A O no hydrogen 2.940 N/A SER 264.A OG SER 260.A O no hydrogen 2.710 N/A ALA 265.A N ASN 261.A O no hydrogen 3.216 N/A GLN 266.A N PHE 263.A O no hydrogen 3.264 N/A VAL 269.A N GLN 266.A O no hydrogen 3.295 N/A VAL 270.A N LEU 224.A O no hydrogen 2.976 N/A VAL 272.A N VAL 226.A O no hydrogen 2.771 N/A ALA 273.A N HIS 322.A O no hydrogen 2.869 N/A CYS 274.A N THR 228.A O no hydrogen 2.960 N/A SER 275.A N THR 320.A O no hydrogen 2.810 N/A SER 276.A N TRP 230.A O no hydrogen 2.908 N/A SER 276.A OG GLY 318.A O no hydrogen 2.810 N/A THR 277.A N SER 276.A OG no hydrogen 2.730 N/A GLY 279.A N GLY 231.A O no hydrogen 2.826 N/A HIS 280.A ND1 ASP 235.A OD1 no hydrogen 2.697 N/A HIS 280.A NE2 SER 154.A OG no hydrogen 2.740 N/A TRP 282.A NE1 ASN 291.A OD1 no hydrogen 2.953 N/A ASN 286.A ND2 GLU 317.A O no hydrogen 2.949 N/A THR 287.A OG1 PRO 283.A O no hydrogen 2.688 N/A GLN 288.A NE2 GLY 62.A O no hydrogen 3.014 N/A PHE 290.A N ASN 286.A O no hydrogen 2.889 N/A ASN 291.A N THR 287.A O no hydrogen 2.869 N/A ASN 291.A ND2 GLY 62.A O no hydrogen 2.906 N/A ARG 292.A N GLN 288.A O no hydrogen 2.956 N/A TRP 293.A N GLU 289.A O no hydrogen 2.942 N/A TRP 293.A NE1 THR 313.A OG1 no hydrogen 3.010 N/A ALA 294.A N PHE 290.A O no hydrogen 2.779 N/A LEU 295.A N ASN 291.A O no hydrogen 3.021 N/A ASP 296.A N ARG 292.A O no hydrogen 2.901 N/A THR 297.A N TRP 293.A O no hydrogen 2.865 N/A THR 297.A OG1 TRP 293.A O no hydrogen 2.624 N/A LEU 298.A N ALA 294.A O no hydrogen 2.959 N/A ALA 299.A N LEU 295.A O no hydrogen 2.880 N/A SER 300.A N THR 297.A O no hydrogen 3.112 N/A SER 300.A OG THR 297.A O no hydrogen 2.695 N/A HIS 301.A N LEU 298.A O no hydrogen 2.980 N/A LYS 303.A N ARG 146.A O no hydrogen 2.851 N/A LYS 303.A NZ SER 168.A O no hydrogen 2.731 N/A LYS 303.A NZ TRP 171.A O no hydrogen 2.749 N/A LYS 303.A NZ PRO 223.A O no hydrogen 2.682 N/A SER 305.A N PRO 302.A O no hydrogen 3.019 N/A SER 305.A OG PRO 302.A O no hydrogen 2.577 N/A ARG 308.A N ASP 306.A OD1 no hydrogen 2.969 N/A SER 309.A N ASP 306.A O no hydrogen 2.898 N/A SER 309.A OG ASP 306.A O no hydrogen 3.039 N/A PHE 310.A N PRO 307.A O no hydrogen 3.312 N/A TYR 319.A N PRO 316.A O no hydrogen 3.308 N/A TYR 319.A OH LEU 285.A O no hydrogen 2.582 N/A THR 320.A N SER 275.A O no hydrogen 3.032 N/A HIS 322.A N ALA 273.A O no hydrogen 3.107 N/A HIS 322.A ND1 VAL 323.A O no hydrogen 3.230 N/A GLY 324.A N HIS 271.A O no hydrogen 2.729 N/A PHE 326.A N SER 260.A OG no hydrogen 2.948 N/A