Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kcf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 3.A OE1 no hydrogen 2.789 N/A THR 5.A N SER 2.A O no hydrogen 3.191 N/A THR 5.A OG1 SER 2.A O no hydrogen 2.670 N/A THR 6.A N ASP 9.A OD2 no hydrogen 3.225 N/A THR 6.A OG1 ASP 9.A OD2 no hydrogen 2.602 N/A LEU 7.A N GLU 57.A OE1 no hydrogen 2.813 N/A LYS 8.A N GLU 57.A OE2 no hydrogen 2.845 N/A ASP 9.A N THR 6.A OG1 no hydrogen 2.998 N/A LEU 10.A N THR 6.A O no hydrogen 2.942 N/A ILE 11.A N LEU 7.A O no hydrogen 2.740 N/A TYR 12.A N LYS 8.A O no hydrogen 3.093 N/A ASP 13.A N ASP 9.A O no hydrogen 2.984 N/A MET 14.A N LEU 10.A O no hydrogen 3.235 N/A THR 15.A N ILE 11.A O no hydrogen 3.018 N/A THR 16.A N MET 14.A O no hydrogen 2.517 N/A THR 16.A OG1 TYR 12.A O no hydrogen 2.518 N/A SER 17.A N MET 14.A O no hydrogen 2.844 N/A SER 19.A OG SER 21.A OG no hydrogen 2.731 N/A SER 21.A OG SER 19.A O no hydrogen 3.548 N/A SER 21.A OG SER 19.A OG no hydrogen 2.731 N/A GLN 28.A N PRO 24.A O no hydrogen 2.921 N/A GLN 28.A NE2 LEU 23.A O no hydrogen 2.777 N/A ARG 29.A N LEU 25.A O no hydrogen 2.633 N/A ARG 29.A NH1 ASP 96.A OD2 no hydrogen 3.385 N/A THR 30.A N LEU 26.A O no hydrogen 3.083 N/A THR 30.A OG1 LEU 26.A O no hydrogen 2.988 N/A ILE 31.A N VAL 27.A O no hydrogen 2.927 N/A ALA 32.A N GLN 28.A O no hydrogen 2.958 N/A ARG 33.A N ARG 29.A O no hydrogen 2.981 N/A ARG 33.A NE ASP 96.A OD1 no hydrogen 2.814 N/A THR 34.A N ILE 31.A O no hydrogen 2.928 N/A THR 34.A OG1 THR 30.A O no hydrogen 2.428 N/A THR 34.A OG1 ILE 31.A O no hydrogen 3.016 N/A ILE 35.A N ALA 32.A O no hydrogen 3.254 N/A VAL 36.A N LYS 53.A O no hydrogen 2.795 N/A GLN 38.A N ARG 51.A O no hydrogen 2.818 N/A GLN 38.A NE2 VAL 36.A O no hydrogen 2.910 N/A SER 40.A OG GLU 48.A OE2 no hydrogen 3.184 N/A ILE 41.A N VAL 49.A O no hydrogen 2.667 N/A LYS 43.A NZ GLU 48.A OE2 no hydrogen 3.455 N/A VAL 49.A N GLY 42.A O no hydrogen 2.699 N/A TRP 50.A N VAL 61.A O no hydrogen 2.697 N/A ARG 51.A N GLU 39.A O no hydrogen 3.142 N/A ARG 51.A NE GLU 58.A OE2 no hydrogen 2.597 N/A ARG 51.A NH1 GLU 39.A OE2 no hydrogen 2.438 N/A ARG 51.A NH2 GLU 58.A OE2 no hydrogen 3.325 N/A GLY 52.A N VAL 59.A O no hydrogen 2.865 N/A LYS 53.A N VAL 36.A O no hydrogen 3.039 N/A TRP 54.A N GLU 57.A O no hydrogen 2.728 N/A TRP 54.A NE1 THR 34.A OG1 no hydrogen 2.998 N/A ARG 55.A NH1 SER 2.A O no hydrogen 3.033 N/A ARG 55.A NH1 THR 5.A O no hydrogen 3.371 N/A ARG 55.A NH2 ILE 1.A O no hydrogen 3.393 N/A GLU 57.A N TRP 54.A O no hydrogen 2.752 N/A ALA 60.A N SER 110.A O no hydrogen 2.860 N/A VAL 61.A N TRP 50.A O no hydrogen 2.891 N/A LYS 62.A N LEU 108.A O no hydrogen 2.777 N/A LYS 62.A NZ GLU 75.A OE1 no hydrogen 2.837 N/A ILE 63.A N GLU 48.A O no hydrogen 2.953 N/A PHE 64.A N LEU 106.A O no hydrogen 2.894 N/A SER 65.A N GLU 68.A OE2 no hydrogen 3.019 N/A SER 66.A OG THR 102.A O no hydrogen 3.056 N/A GLU 68.A N SER 65.A O no hydrogen 2.784 N/A TRP 72.A NE1 TRP 107.A O no hydrogen 3.082 N/A PHE 73.A N GLU 69.A O no hydrogen 2.973 N/A ARG 74.A N ARG 70.A O no hydrogen 2.985 N/A ARG 74.A NH1 ASP 196.A OD1 no hydrogen 3.352 N/A ARG 74.A NH2 ALA 185.A O no hydrogen 3.162 N/A ARG 74.A NH2 ASP 196.A OD1 no hydrogen 3.504 N/A ARG 74.A NH2 ASP 196.A OD2 no hydrogen 3.258 N/A GLU 75.A N SER 71.A O no hydrogen 3.231 N/A ALA 76.A N TRP 72.A O no hydrogen 3.152 N/A GLU 77.A N PHE 73.A O no hydrogen 2.601 N/A ILE 78.A N ARG 74.A O no hydrogen 2.759 N/A TYR 79.A N GLU 75.A O no hydrogen 2.922 N/A TYR 79.A OH LEU 90.A O no hydrogen 3.311 N/A GLN 80.A N ALA 76.A O no hydrogen 3.153 N/A GLN 80.A N GLU 77.A O no hydrogen 3.059 N/A THR 81.A OG1 ILE 78.A O no hydrogen 2.685 N/A THR 81.A OG1 THR 81.A O no hydrogen 2.297 N/A ARG 85.A NH1 GLY 20.A O no hydrogen 3.292 N/A ASN 88.A ND2 CYS 177.A O no hydrogen 2.622 N/A ILE 89.A N HIS 86.A O no hydrogen 3.121 N/A LEU 90.A N ILE 179.A O no hydrogen 2.794 N/A ILE 93.A N VAL 109.A O no hydrogen 2.796 N/A ALA 94.A N VAL 109.A O no hydrogen 3.261 N/A ALA 95.A N GLN 28.A OE1 no hydrogen 2.883 N/A ASP 96.A N TRP 107.A O no hydrogen 2.926 N/A ASN 97.A ND2 ASP 96.A OD2 no hydrogen 3.244 N/A LYS 98.A N GLN 105.A O no hydrogen 2.962 N/A TRP 103.A N ASN 100.A O no hydrogen 3.136 N/A THR 104.A N GLY 101.A O no hydrogen 3.191 N/A THR 104.A OG1 GLY 101.A O no hydrogen 2.927 N/A GLN 105.A N LYS 98.A O no hydrogen 2.902 N/A TRP 107.A N ASP 96.A O no hydrogen 2.882 N/A LEU 108.A N LYS 62.A O no hydrogen 3.284 N/A VAL 109.A N ALA 94.A O no hydrogen 2.724 N/A SER 110.A N ALA 60.A O no hydrogen 2.715 N/A SER 110.A OG ASP 111.A O no hydrogen 3.062 N/A ASP 111.A N GLY 91.A O no hydrogen 3.202 N/A GLY 116.A N HIS 113.A O no hydrogen 2.724 N/A SER 117.A OG ASP 120.A OD2 no hydrogen 2.592 N/A LEU 118.A N ILE 169.A O no hydrogen 2.631 N/A PHE 119.A N SER 166.A O no hydrogen 2.989 N/A ASP 120.A N SER 117.A OG no hydrogen 2.868 N/A TYR 121.A N SER 117.A O no hydrogen 2.788 N/A LEU 122.A N LEU 118.A O no hydrogen 2.819 N/A ASN 123.A N PHE 119.A O no hydrogen 3.173 N/A ASN 123.A ND2 PHE 119.A O no hydrogen 3.079 N/A ARG 124.A N ASP 120.A O no hydrogen 3.431 N/A ARG 124.A NH1 ARG 124.A O no hydrogen 3.030 N/A MET 132.A N THR 128.A O no hydrogen 2.859 N/A ILE 133.A N GLU 130.A O no hydrogen 2.883 N/A LYS 134.A N GLU 130.A O no hydrogen 3.331 N/A LEU 135.A N GLY 131.A O no hydrogen 2.870 N/A ALA 136.A N MET 132.A O no hydrogen 3.449 N/A LEU 137.A N ILE 133.A O no hydrogen 2.567 N/A SER 138.A N LYS 134.A O no hydrogen 2.975 N/A SER 138.A OG LYS 134.A O no hydrogen 2.646 N/A SER 138.A OG LEU 135.A O no hydrogen 2.841 N/A THR 139.A N LEU 135.A O no hydrogen 3.074 N/A THR 139.A OG1 LEU 135.A O no hydrogen 2.710 N/A ALA 140.A N ALA 136.A O no hydrogen 2.808 N/A SER 141.A N LEU 137.A O no hydrogen 2.739 N/A SER 141.A OG LEU 137.A O no hydrogen 2.614 N/A GLY 142.A N SER 138.A O no hydrogen 2.835 N/A LEU 143.A N THR 139.A O no hydrogen 2.938 N/A ALA 144.A N ALA 140.A O no hydrogen 2.803 N/A HIS 145.A N SER 141.A O no hydrogen 2.895 N/A HIS 145.A ND1 HIS 145.A O no hydrogen 2.521 N/A LEU 146.A N GLY 142.A O no hydrogen 2.876 N/A HIS 147.A N LEU 143.A O no hydrogen 3.014 N/A MET 148.A N ALA 144.A O no hydrogen 2.879 N/A GLN 154.A N THR 153.A OG1 no hydrogen 2.508 N/A LYS 156.A NZ HIS 145.A O no hydrogen 3.080 N/A LYS 156.A NZ LEU 146.A O no hydrogen 2.961 N/A LYS 156.A NZ MET 148.A O no hydrogen 2.927 N/A LYS 156.A NZ PRO 157.A O no hydrogen 2.897 N/A ALA 158.A N HIS 188.A O no hydrogen 3.263 N/A ILE 159.A N LEU 146.A O no hydrogen 2.807 N/A ALA 160.A N VAL 186.A O no hydrogen 3.055 N/A ARG 162.A N ASP 228.A OD1 no hydrogen 2.951 N/A ARG 162.A NE LEU 184.A O no hydrogen 3.495 N/A LYS 165.A NZ THR 203.A OG1 no hydrogen 2.659 N/A SER 166.A OG TYR 206.A OH no hydrogen 3.044 N/A SER 166.A OG GLU 238.A OE2 no hydrogen 3.048 N/A ASN 168.A N LYS 165.A O no hydrogen 3.179 N/A ASN 168.A ND2 ASP 163.A O no hydrogen 2.693 N/A ASN 168.A ND2 ASP 163.A OD2 no hydrogen 2.956 N/A LEU 170.A N CYS 178.A O no hydrogen 3.149 N/A VAL 171.A N GLY 116.A O no hydrogen 3.210 N/A LYS 172.A N THR 176.A O no hydrogen 3.079 N/A LYS 172.A NZ GLU 87.A O no hydrogen 2.590 N/A GLY 175.A N LYS 172.A O no hydrogen 3.296 N/A THR 176.A N ASN 174.A OD1 no hydrogen 3.179 N/A THR 176.A OG1 ASN 174.A OD1 no hydrogen 2.281 N/A CYS 177.A SG LEU 135.A O no hydrogen 3.774 N/A CYS 178.A N LEU 170.A O no hydrogen 3.095 N/A CYS 178.A SG HIS 113.A NE2 no hydrogen 3.978 N/A CYS 178.A SG LEU 170.A O no hydrogen 3.889 N/A ILE 179.A N ASN 88.A O no hydrogen 3.004 N/A ALA 180.A N ASN 168.A O no hydrogen 2.914 N/A LEU 182.A N GLU 75.A OE2 no hydrogen 2.596 N/A GLY 183.A N ASP 181.A OD1 no hydrogen 3.268 N/A ALA 185.A N LEU 182.A O no hydrogen 2.791 N/A VAL 186.A N ALA 160.A O no hydrogen 2.940 N/A ARG 187.A N ASP 196.A OD2 no hydrogen 3.248 N/A ARG 187.A NE ASP 196.A OD1 no hydrogen 2.572 N/A ARG 187.A NH2 GLU 77.A OE1 no hydrogen 3.333 N/A ARG 187.A NH2 ASP 196.A OD1 no hydrogen 2.689 N/A HIS 188.A N ALA 158.A O no hydrogen 3.008 N/A HIS 188.A ND1 THR 194.A O no hydrogen 2.756 N/A THR 192.A OG1 ASP 189.A OD2 no hydrogen 2.648 N/A THR 192.A OG1 THR 194.A OG1 no hydrogen 2.982 N/A THR 194.A N ASP 189.A O no hydrogen 3.283 N/A THR 194.A OG1 THR 192.A OG1 no hydrogen 2.982 N/A THR 203.A N ASP 163.A OD1 no hydrogen 2.858 N/A THR 203.A OG1 ASP 163.A OD1 no hydrogen 3.270 N/A TYR 206.A OH GLU 238.A OE1 no hydrogen 2.480 N/A MET 207.A N LYS 204.A O no hydrogen 2.677 N/A VAL 211.A N ALA 208.A O no hydrogen 3.132 N/A LEU 212.A N ALA 208.A O no hydrogen 2.915 N/A ASP 213.A N PRO 209.A O no hydrogen 3.073 N/A ASP 214.A N VAL 211.A O no hydrogen 2.984 N/A SER 215.A N GLU 210.A O no hydrogen 3.111 N/A SER 215.A OG GLU 210.A O no hydrogen 3.444 N/A SER 215.A OG ASP 213.A OD1 no hydrogen 2.656 N/A ILE 216.A N GLU 210.A O no hydrogen 2.856 N/A LYS 219.A N ASN 217.A OD1 no hydrogen 2.731 N/A HIS 220.A N ASN 217.A OD1 no hydrogen 2.827 N/A SER 223.A OG ASN 217.A O no hydrogen 3.254 N/A PHE 224.A N PHE 221.A O no hydrogen 2.529 N/A LYS 225.A NZ HIS 147.A O no hydrogen 3.083 N/A LYS 225.A NZ GLU 222.A OE2 no hydrogen 3.212 N/A ARG 226.A N GLU 222.A O no hydrogen 2.779 N/A ALA 227.A N SER 223.A O no hydrogen 3.171 N/A ASP 228.A N PHE 224.A O no hydrogen 3.024 N/A ILE 229.A N LYS 225.A O no hydrogen 3.069 N/A TYR 230.A N ARG 226.A O no hydrogen 3.124 N/A TYR 230.A OH MET 207.A O no hydrogen 2.993 N/A TYR 230.A OH TYR 256.A OH no hydrogen 2.991 N/A ALA 231.A N ALA 227.A O no hydrogen 3.210 N/A MET 232.A N ASP 228.A O no hydrogen 2.829 N/A GLY 233.A N ILE 229.A O no hydrogen 2.942 N/A GLY 233.A N TYR 230.A O no hydrogen 3.079 N/A LEU 234.A N TYR 230.A O no hydrogen 3.238 N/A VAL 235.A N ALA 231.A O no hydrogen 2.931 N/A PHE 236.A N MET 232.A O no hydrogen 2.885 N/A TRP 237.A N GLY 233.A O no hydrogen 2.958 N/A GLU 238.A N LEU 234.A O no hydrogen 3.160 N/A ILE 239.A N VAL 235.A O no hydrogen 3.066 N/A ALA 240.A N PHE 236.A O no hydrogen 3.200 N/A ARG 241.A N TRP 237.A O no hydrogen 2.981 N/A ARG 242.A N ILE 239.A O no hydrogen 2.931 N/A CYS 243.A N ALA 240.A O no hydrogen 2.741 N/A CYS 243.A SG VAL 127.A O no hydrogen 3.753 N/A SER 244.A N VAL 127.A O no hydrogen 2.921 N/A HIS 249.A ND1 GLY 247.A O no hydrogen 3.125 N/A TYR 252.A OH GLU 238.A OE2 no hydrogen 2.569 N/A TYR 256.A OH TYR 230.A OH no hydrogen 2.991 N/A VAL 260.A N TYR 256.A O no hydrogen 3.353 N/A GLU 267.A N SER 265.A OG no hydrogen 3.312 N/A ARG 270.A N VAL 266.A O no hydrogen 3.299 N/A LYS 271.A N GLU 267.A O no hydrogen 3.293 N/A VAL 273.A N MET 269.A O no hydrogen 2.817 N/A CYS 274.A SG PRO 209.A O no hydrogen 4.031 N/A CYS 274.A SG ASP 213.A OD2 no hydrogen 3.217 N/A GLU 275.A N ARG 270.A O no hydrogen 3.293 N/A GLN 276.A N LYS 271.A O no hydrogen 3.156 N/A LYS 277.A N CYS 274.A O no hydrogen 3.330 N/A LEU 278.A N VAL 272.A O no hydrogen 2.976 N/A ARG 279.A NE TRP 303.A O no hydrogen 2.992 N/A ARG 279.A NH1 VAL 273.A O no hydrogen 3.154 N/A ARG 279.A NH1 LEU 278.A O no hydrogen 3.388 N/A ARG 279.A NH2 TRP 303.A O no hydrogen 2.728 N/A TRP 286.A N PRO 283.A O no hydrogen 3.179 N/A SER 288.A OG ARG 285.A O no hydrogen 2.966 N/A CYS 289.A SG GLU 327.A OE1 no hydrogen 3.166 N/A ARG 293.A N CYS 289.A O no hydrogen 3.152 N/A ARG 293.A N GLU 290.A O no hydrogen 3.199 N/A VAL 294.A N GLU 290.A O no hydrogen 3.038 N/A MET 295.A N ALA 291.A O no hydrogen 3.152 N/A LYS 297.A N ARG 293.A O no hydrogen 2.898 N/A ILE 298.A N VAL 294.A O no hydrogen 3.072 N/A MET 299.A N MET 295.A O no hydrogen 2.638 N/A ARG 300.A N ALA 296.A O no hydrogen 2.894 N/A GLU 301.A N LYS 297.A O no hydrogen 3.031 N/A CYS 302.A N MET 299.A O no hydrogen 3.434 N/A CYS 302.A SG ILE 229.A O no hydrogen 3.993 N/A CYS 302.A SG ILE 298.A O no hydrogen 3.310 N/A TRP 303.A N MET 299.A O no hydrogen 3.223 N/A ALA 309.A N ASN 306.A O no hydrogen 3.072 N/A ALA 309.A N ASN 306.A OD1 no hydrogen 2.977 N/A ARG 310.A N GLY 307.A O no hydrogen 3.212 N/A ARG 310.A NE TYR 304.A O no hydrogen 2.850 N/A ARG 310.A NH1 GLU 210.A OE1 no hydrogen 3.030 N/A ARG 310.A NH1 GLU 210.A OE2 no hydrogen 3.093 N/A ARG 310.A NH1 ARG 226.A O no hydrogen 3.391 N/A ARG 310.A NH2 GLU 210.A OE2 no hydrogen 2.516 N/A ARG 310.A NH2 TYR 304.A O no hydrogen 3.019 N/A LEU 311.A N GLU 301.A O no hydrogen 2.931 N/A ARG 315.A N THR 312.A OG1 no hydrogen 3.017 N/A ARG 315.A NE ARG 315.A O no hydrogen 2.953 N/A ILE 316.A N THR 312.A O no hydrogen 2.784 N/A LYS 317.A N ALA 313.A O no hydrogen 2.635 N/A LYS 318.A N LEU 314.A O no hydrogen 2.814 N/A THR 319.A N ARG 315.A O no hydrogen 2.973 N/A LEU 320.A N ILE 316.A O no hydrogen 3.083 N/A SER 321.A N LYS 317.A O no hydrogen 2.565 N/A GLN 322.A N LYS 318.A O no hydrogen 2.740 N/A LEU 323.A N THR 319.A O no hydrogen 3.016 N/A SER 324.A N LEU 320.A O no hydrogen 3.003 N/A GLN 325.A N GLN 322.A O no hydrogen 2.499 N/A GLN 326.A N GLN 322.A O no hydrogen 3.244 N/A