Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3c9w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N GLU 5.A OE1 no hydrogen 3.333 N/A VAL 7.A N GLN 10.A O no hydrogen 3.045 N/A GLN 10.A N VAL 7.A O no hydrogen 3.114 N/A PHE 12.A N GLU 5.A O no hydrogen 3.193 N/A ASP 13.A N TYR 95.A OH no hydrogen 2.877 N/A ARG 17.A NE ASP 37.A OD1 no hydrogen 2.902 N/A ARG 17.A NH2 ASP 37.A OD1 no hydrogen 3.336 N/A ARG 17.A NH2 ASP 37.A OD2 no hydrogen 2.792 N/A TYR 18.A N VAL 14.A O no hydrogen 3.416 N/A TYR 18.A OH ASP 81.A OD2 no hydrogen 2.552 N/A THR 19.A N TYR 36.A O no hydrogen 3.114 N/A SER 22.A N SER 34.A O no hydrogen 3.251 N/A TYR 23.A OH GLU 26.A OE1 no hydrogen 2.943 N/A ILE 24.A N VAL 32.A O no hydrogen 2.746 N/A GLY 25.A N VAL 32.A O no hydrogen 3.022 N/A GLY 27.A N GLY 30.A O no hydrogen 2.849 N/A VAL 32.A N GLY 25.A O no hydrogen 2.848 N/A CYS 33.A N ILE 46.A O no hydrogen 2.865 N/A SER 34.A N SER 22.A O no hydrogen 2.899 N/A SER 34.A OG SER 22.A O no hydrogen 3.404 N/A ALA 35.A N VAL 44.A O no hydrogen 2.907 N/A TYR 36.A N THR 19.A O no hydrogen 2.748 N/A TYR 36.A OH LYS 41.A O no hydrogen 2.892 N/A ASP 37.A N VAL 42.A O no hydrogen 2.751 N/A ASN 38.A N ARG 17.A O no hydrogen 2.726 N/A ASN 38.A ND2 PRO 16.A O no hydrogen 3.212 N/A ASN 38.A ND2 ARG 17.A O no hydrogen 2.695 N/A ASN 38.A ND2 THR 19.A OG1 no hydrogen 3.049 N/A LEU 39.A N ASP 37.A OD1 no hydrogen 2.835 N/A ASN 40.A N ASP 37.A OD1 no hydrogen 3.063 N/A ASN 40.A ND2 ASP 37.A OD2 no hydrogen 3.188 N/A LYS 41.A N ASP 37.A O no hydrogen 2.764 N/A ARG 43.A NH1 ASN 20.A OD1 no hydrogen 2.598 N/A ARG 43.A NH2 ASN 20.A O no hydrogen 2.865 N/A ARG 43.A NH2 ASN 20.A OD1 no hydrogen 3.206 N/A ARG 43.A NH2 SER 34.A OG no hydrogen 3.368 N/A VAL 44.A N ALA 35.A O no hydrogen 2.874 N/A ALA 45.A N GLN 98.A O no hydrogen 2.836 N/A ILE 46.A N CYS 33.A O no hydrogen 2.706 N/A LYS 47.A N ILE 96.A O no hydrogen 2.808 N/A LYS 48.A N MET 31.A O no hydrogen 2.818 N/A LYS 48.A NZ VAL 11.A O no hydrogen 2.801 N/A ILE 49.A N VAL 94.A O no hydrogen 2.713 N/A SER 50.A OG ASP 93.A OD1 no hydrogen 2.493 N/A HIS 54.A N PRO 51.A O no hydrogen 3.018 N/A GLN 55.A NE2 LEU 318.A O no hydrogen 2.901 N/A CYS 58.A N HIS 54.A O no hydrogen 2.801 N/A CYS 58.A SG PRO 51.A O no hydrogen 3.416 N/A CYS 58.A SG HIS 54.A O no hydrogen 3.660 N/A GLN 59.A N GLN 55.A O no hydrogen 2.884 N/A ARG 60.A N THR 56.A O no hydrogen 3.017 N/A THR 61.A N TYR 57.A O no hydrogen 3.169 N/A THR 61.A OG1 TYR 57.A O no hydrogen 2.657 N/A LEU 62.A N CYS 58.A O no hydrogen 2.859 N/A ARG 63.A N GLN 59.A O no hydrogen 3.049 N/A ARG 63.A NH1 ASP 316.A OD1 no hydrogen 3.185 N/A ARG 63.A NH2 ASP 316.A OD1 no hydrogen 3.345 N/A GLU 64.A N ARG 60.A O no hydrogen 2.966 N/A ILE 65.A N THR 61.A O no hydrogen 3.075 N/A LYS 66.A N LEU 62.A O no hydrogen 2.853 N/A LYS 66.A NZ ASP 312.A OD2 no hydrogen 3.259 N/A ILE 67.A N ARG 63.A O no hydrogen 2.861 N/A LEU 68.A N GLU 64.A O no hydrogen 2.965 N/A LEU 69.A N ILE 65.A O no hydrogen 2.923 N/A ARG 70.A N ILE 67.A O no hydrogen 2.967 N/A ARG 70.A NH1 LYS 66.A O no hydrogen 2.839 N/A ARG 70.A NH1 GLU 330.A OE2 no hydrogen 3.009 N/A ARG 70.A NH2 GLU 330.A OE2 no hydrogen 2.843 N/A PHE 71.A N ILE 67.A O no hydrogen 3.019 N/A ARG 72.A N TYR 132.A OH no hydrogen 3.134 N/A HIS 73.A NE2 ASN 75.A OD1 no hydrogen 3.045 N/A ASN 75.A ND2 LEU 156.A O no hydrogen 3.081 N/A ILE 76.A N HIS 73.A O no hydrogen 3.193 N/A ILE 77.A N ILE 158.A O no hydrogen 3.027 N/A ASN 80.A N VAL 97.A O no hydrogen 2.956 N/A ILE 83.A N TYR 95.A O no hydrogen 2.766 N/A ARG 84.A NE THR 331.A OG1 no hydrogen 2.896 N/A ARG 84.A NH1 ALA 85.A O no hydrogen 2.893 N/A ARG 84.A NH2 PHE 328.A O no hydrogen 3.210 N/A MET 91.A N THR 87.A O no hydrogen 2.753 N/A MET 91.A N ILE 88.A O no hydrogen 3.205 N/A VAL 94.A N ILE 49.A O no hydrogen 2.851 N/A TYR 95.A N ILE 83.A O no hydrogen 3.018 N/A ILE 96.A N LYS 47.A O no hydrogen 2.802 N/A VAL 97.A N ASP 81.A O no hydrogen 2.910 N/A GLN 98.A N ALA 45.A O no hydrogen 2.906 N/A GLU 102.A N LEU 150.A O no hydrogen 2.848 N/A THR 103.A N LEU 150.A O no hydrogen 2.904 N/A THR 103.A OG1 ASP 104.A O no hydrogen 3.432 N/A LEU 105.A N LEU 148.A O no hydrogen 2.681 N/A LYS 107.A N ASP 104.A OD1 no hydrogen 3.022 N/A LYS 107.A NZ ASP 104.A OD2 no hydrogen 3.151 N/A LEU 108.A N ASP 104.A O no hydrogen 2.958 N/A LEU 109.A N LEU 105.A O no hydrogen 2.840 N/A LYS 110.A N TYR 106.A O no hydrogen 3.252 N/A LYS 110.A N LYS 107.A O no hydrogen 3.185 N/A THR 111.A N LEU 108.A O no hydrogen 3.416 N/A THR 111.A OG1 LYS 107.A O no hydrogen 3.469 N/A THR 111.A OG1 LEU 108.A O no hydrogen 3.508 N/A GLN 112.A N LEU 108.A O no hydrogen 3.215 N/A SER 115.A OG HIS 118.A ND1 no hydrogen 2.557 N/A HIS 118.A N SER 115.A O no hydrogen 2.966 N/A HIS 118.A N SER 115.A OG no hydrogen 3.309 N/A ILE 119.A N SER 115.A O no hydrogen 2.982 N/A CYS 120.A N ASN 116.A O no hydrogen 2.908 N/A CYS 120.A SG TYR 292.A O no hydrogen 3.239 N/A TYR 121.A N ASP 117.A O no hydrogen 2.804 N/A PHE 122.A N HIS 118.A O no hydrogen 2.652 N/A LEU 123.A N ILE 119.A O no hydrogen 2.884 N/A TYR 124.A N CYS 120.A O no hydrogen 2.868 N/A TYR 124.A OH GLU 302.A OE2 no hydrogen 2.642 N/A GLN 125.A N TYR 121.A O no hydrogen 3.026 N/A GLN 125.A NE2 TYR 121.A O no hydrogen 3.571 N/A GLN 125.A NE2 CYS 154.A O no hydrogen 2.723 N/A ILE 126.A N PHE 122.A O no hydrogen 2.860 N/A LEU 127.A N LEU 123.A O no hydrogen 2.893 N/A ARG 128.A N TYR 124.A O no hydrogen 2.788 N/A ARG 128.A NE ASP 301.A O no hydrogen 2.889 N/A ARG 128.A NH1 ASN 75.A OD1 no hydrogen 2.674 N/A ARG 128.A NH2 GLU 74.A OE2 no hydrogen 3.512 N/A ARG 128.A NH2 ASP 301.A O no hydrogen 2.968 N/A GLY 129.A N GLN 125.A O no hydrogen 3.112 N/A LEU 130.A N ILE 126.A O no hydrogen 2.875 N/A LYS 131.A N LEU 127.A O no hydrogen 2.838 N/A LYS 131.A NZ GLU 302.A O no hydrogen 3.043 N/A TYR 132.A N ARG 128.A O no hydrogen 3.363 N/A ILE 133.A N GLY 129.A O no hydrogen 2.943 N/A HIS 134.A N LEU 130.A O no hydrogen 2.791 N/A HIS 134.A NE2 ASP 190.A OD2 no hydrogen 2.879 N/A SER 135.A N LYS 131.A O no hydrogen 2.921 N/A SER 135.A OG LYS 131.A O no hydrogen 3.455 N/A SER 135.A OG TYR 132.A O no hydrogen 2.751 N/A ALA 136.A N TYR 132.A O no hydrogen 3.124 N/A ASN 137.A N HIS 134.A O no hydrogen 2.940 N/A VAL 138.A N ILE 133.A O no hydrogen 3.082 N/A LEU 139.A N ARG 165.A O no hydrogen 2.740 N/A HIS 140.A N ASP 190.A OD2 no hydrogen 2.790 N/A HIS 140.A NE2 CYS 159.A O no hydrogen 2.956 N/A ARG 141.A N ASP 190.A OD1 no hydrogen 2.770 N/A ARG 141.A NH1 LEU 163.A O no hydrogen 2.782 N/A ASP 142.A N HIS 140.A ND1 no hydrogen 3.003 N/A ASN 147.A N LYS 144.A O no hydrogen 3.010 N/A ASN 147.A ND2 ASP 142.A O no hydrogen 2.733 N/A ASN 147.A ND2 ASP 142.A OD2 no hydrogen 3.506 N/A LEU 148.A N PRO 145.A O no hydrogen 2.988 N/A LEU 149.A N LYS 157.A O no hydrogen 2.940 N/A LEU 150.A N THR 103.A O no hydrogen 2.799 N/A ASN 151.A N ASP 155.A O no hydrogen 3.098 N/A ASN 151.A ND2 ASP 155.A OD2 no hydrogen 2.747 N/A THR 153.A OG1 ASN 151.A OD1 no hydrogen 3.154 N/A CYS 154.A N ASN 151.A O no hydrogen 3.148 N/A ASP 155.A N ASN 151.A OD1 no hydrogen 2.860 N/A LEU 156.A N GLN 125.A OE1 no hydrogen 2.957 N/A LYS 157.A N LEU 149.A O no hydrogen 2.799 N/A LYS 157.A NZ GLU 74.A O no hydrogen 2.829 N/A ILE 158.A N ASN 75.A O no hydrogen 2.709 N/A CYS 159.A N ASN 147.A O no hydrogen 2.783 N/A PHE 161.A N GLU 64.A OE2 no hydrogen 2.864 N/A GLY 162.A N ASP 160.A OD1 no hydrogen 3.115 N/A ALA 164.A N PHE 161.A O no hydrogen 2.948 N/A ARG 165.A N LEU 139.A O no hydrogen 3.039 N/A ALA 167.A N ASN 137.A O no hydrogen 2.985 N/A TRP 172.A NE1 GLY 210.A O no hydrogen 3.030 N/A TYR 173.A N THR 170.A O no hydrogen 3.381 N/A TYR 173.A OH GLU 200.A OE1 no hydrogen 2.575 N/A TYR 173.A OH GLU 200.A OE2 no hydrogen 3.216 N/A ARG 174.A N ARG 171.A O no hydrogen 3.335 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.657 N/A ILE 178.A N ALA 175.A O no hydrogen 3.156 N/A LEU 180.A N PRO 176.A O no hydrogen 2.937 N/A ASN 181.A N GLU 177.A O no hydrogen 2.995 N/A LYS 187.A NZ HIS 134.A O no hydrogen 2.775 N/A ILE 189.A N THR 186.A O no hydrogen 3.259 N/A ASP 190.A N LYS 187.A O no hydrogen 3.131 N/A ILE 191.A N LYS 187.A O no hydrogen 3.378 N/A TRP 192.A N SER 188.A O no hydrogen 2.884 N/A SER 193.A N ILE 189.A O no hydrogen 3.207 N/A SER 193.A OG TYR 173.A O no hydrogen 2.835 N/A SER 193.A OG ILE 189.A O no hydrogen 3.249 N/A VAL 194.A N ASP 190.A O no hydrogen 3.030 N/A GLY 195.A N ILE 191.A O no hydrogen 2.867 N/A CYS 196.A N TRP 192.A O no hydrogen 2.994 N/A CYS 196.A SG TRP 172.A O no hydrogen 3.837 N/A CYS 196.A SG TRP 192.A O no hydrogen 3.541 N/A ILE 197.A N SER 193.A O no hydrogen 2.994 N/A LEU 198.A N VAL 194.A O no hydrogen 2.700 N/A ALA 199.A N GLY 195.A O no hydrogen 2.880 N/A GLU 200.A N CYS 196.A O no hydrogen 2.931 N/A MET 201.A N ILE 197.A O no hydrogen 2.858 N/A LEU 202.A N LEU 198.A O no hydrogen 2.995 N/A SER 203.A N GLU 200.A O no hydrogen 3.360 N/A SER 203.A OG ALA 199.A O no hydrogen 2.941 N/A SER 203.A OG ARG 205.A O no hydrogen 3.475 N/A ASN 204.A N GLU 200.A O no hydrogen 2.687 N/A ASN 204.A ND2 LEU 109.A O no hydrogen 3.112 N/A ASN 204.A ND2 GLN 112.A O no hydrogen 2.620 N/A ARG 205.A NE PRO 206.A O no hydrogen 2.485 N/A ARG 205.A NH2 PRO 206.A O no hydrogen 2.579 N/A GLY 210.A N GLN 216.A OE1 no hydrogen 2.819 N/A LYS 211.A N ASP 215.A OD2 no hydrogen 2.972 N/A GLN 216.A N HIS 212.A O no hydrogen 3.286 N/A GLN 216.A NE2 PHE 208.A O no hydrogen 2.907 N/A ASN 218.A N LEU 214.A O no hydrogen 3.307 N/A HIS 219.A N ASP 215.A O no hydrogen 2.799 N/A HIS 219.A ND1 ASP 215.A O no hydrogen 3.037 N/A ILE 220.A N GLN 216.A O no hydrogen 3.116 N/A LEU 221.A N LEU 217.A O no hydrogen 2.992 N/A GLY 222.A N ASN 218.A O no hydrogen 2.796 N/A ILE 223.A N HIS 219.A O no hydrogen 3.343 N/A LEU 224.A N ILE 220.A O no hydrogen 2.974 N/A GLY 225.A N LEU 221.A O no hydrogen 2.716 N/A SER 226.A N LYS 250.A O no hydrogen 3.038 N/A ASP 231.A N SER 228.A OG no hydrogen 3.363 N/A LEU 232.A N SER 228.A O no hydrogen 2.683 N/A ASN 233.A N GLN 229.A O no hydrogen 3.103 N/A ASN 233.A N GLU 230.A O no hydrogen 3.188 N/A CYS 234.A N ASP 231.A O no hydrogen 3.102 N/A CYS 234.A SG ASP 231.A O no hydrogen 2.672 N/A ILE 235.A N LEU 232.A O no hydrogen 3.043 N/A ALA 240.A N ASN 237.A OD1 no hydrogen 2.984 N/A ARG 241.A N ASN 237.A O no hydrogen 3.014 N/A ARG 241.A NH1 LEU 232.A O no hydrogen 3.313 N/A ARG 241.A NH1 ILE 235.A O no hydrogen 2.841 N/A ASN 242.A N LEU 238.A O no hydrogen 3.119 N/A TYR 243.A N LYS 239.A O no hydrogen 3.065 N/A LEU 244.A N ALA 240.A O no hydrogen 2.819 N/A LEU 245.A N ARG 241.A O no hydrogen 3.168 N/A SER 246.A N ASN 242.A O no hydrogen 2.948 N/A SER 246.A OG TYR 243.A O no hydrogen 2.593 N/A LEU 247.A N LEU 244.A O no hydrogen 3.186 N/A VAL 253.A N ILE 223.A O no hydrogen 2.863 N/A TRP 255.A NE1 ASP 271.A OD1 no hydrogen 2.795 N/A ARG 257.A N PRO 254.A O no hydrogen 3.318 N/A LEU 258.A N TRP 255.A O no hydrogen 3.261 N/A PHE 259.A N TRP 255.A O no hydrogen 2.943 N/A ALA 262.A N PHE 259.A O no hydrogen 3.295 N/A LYS 265.A N ASP 263.A OD1 no hydrogen 3.221 N/A LEU 267.A N ASP 263.A O no hydrogen 3.152 N/A ASP 268.A N SER 264.A O no hydrogen 2.907 N/A LEU 269.A N LYS 265.A O no hydrogen 2.943 N/A LEU 270.A N ALA 266.A O no hydrogen 2.757 N/A ASP 271.A N LEU 267.A O no hydrogen 2.918 N/A LYS 272.A N ASP 268.A O no hydrogen 3.385 N/A LYS 272.A NZ ASP 268.A OD1 no hydrogen 2.763 N/A LYS 272.A NZ ASP 268.A OD2 no hydrogen 3.020 N/A MET 273.A N LEU 269.A O no hydrogen 3.024 N/A LEU 274.A N LEU 270.A O no hydrogen 2.816 N/A THR 275.A OG1 ASP 271.A O no hydrogen 3.031 N/A THR 275.A OG1 LYS 272.A O no hydrogen 3.451 N/A ASN 277.A N ASP 231.A OD2 no hydrogen 3.321 N/A ASN 277.A ND2 ASP 231.A OD1 no hydrogen 3.567 N/A HIS 279.A N ASN 277.A OD1 no hydrogen 2.888 N/A LYS 280.A NZ GLU 230.A OE1 no hydrogen 3.107 N/A LYS 280.A NZ GLU 230.A OE2 no hydrogen 3.525 N/A ARG 281.A N PRO 278.A O no hydrogen 3.428 N/A ARG 281.A NE THR 275.A O no hydrogen 2.678 N/A ARG 281.A NH1 GLU 177.A OE2 no hydrogen 2.590 N/A ARG 281.A NH1 SER 188.A O no hydrogen 2.780 N/A ARG 281.A NH2 GLU 177.A OE1 no hydrogen 2.777 N/A ARG 281.A NH2 GLU 177.A OE2 no hydrogen 3.151 N/A ARG 281.A NH2 THR 275.A O no hydrogen 2.911 N/A ARG 281.A NH2 PHE 276.A O no hydrogen 2.931 N/A ILE 282.A N LYS 272.A O no hydrogen 3.000 N/A ALA 287.A N GLU 283.A O no hydrogen 2.825 N/A LEU 288.A N VAL 284.A O no hydrogen 2.943 N/A ALA 289.A N GLU 285.A O no hydrogen 3.325 N/A HIS 290.A N ALA 287.A O no hydrogen 3.209 N/A HIS 290.A NE2 ASP 268.A OD2 no hydrogen 2.646 N/A TYR 292.A N HIS 290.A ND1 no hydrogen 3.009 N/A LEU 293.A N HIS 290.A O no hydrogen 3.139 N/A GLU 294.A N PRO 291.A O no hydrogen 2.967 N/A TYR 296.A N LEU 293.A O no hydrogen 3.121 N/A TYR 297.A N LEU 293.A O no hydrogen 3.026 N/A ASP 298.A N GLU 302.A OE2 no hydrogen 3.016 N/A SER 300.A OG ASP 298.A OD1 no hydrogen 2.668 N/A ASP 301.A N ASP 298.A O no hydrogen 2.791 N/A ALA 305.A N SER 135.A OG no hydrogen 2.750 N/A GLU 306.A N GLU 306.A OE1 no hydrogen 2.785 N/A PHE 309.A N ALA 136.A O no hydrogen 2.872 N/A LYS 310.A NZ GLU 314.A OE1 no hydrogen 3.257 N/A LYS 322.A N PRO 319.A O no hydrogen 3.091 N/A LEU 323.A N PRO 319.A O no hydrogen 3.060 N/A LYS 324.A N LYS 320.A O no hydrogen 2.703 N/A LYS 324.A NZ MET 91.A O no hydrogen 3.136 N/A LEU 326.A N LYS 322.A O no hydrogen 3.174 N/A ILE 327.A N LEU 323.A O no hydrogen 2.848 N/A PHE 328.A N LYS 324.A O no hydrogen 2.796 N/A GLU 329.A N GLU 325.A O no hydrogen 2.921 N/A GLU 330.A N LEU 326.A O no hydrogen 2.720 N/A THR 331.A N ILE 327.A O no hydrogen 2.986 N/A THR 331.A OG1 ILE 327.A O no hydrogen 2.552 N/A THR 331.A OG1 PHE 328.A O no hydrogen 3.071 N/A ALA 332.A N GLU 329.A O no hydrogen 3.319 N/A PHE 334.A N THR 331.A O no hydrogen 3.289 N/A GLN 335.A N ALA 332.A O no hydrogen 3.003 N/A