Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6hkm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH ASP 56.A OD2 no hydrogen 3.147 N/A ILE 5.A N SER 14.A O no hydrogen 2.950 N/A ILE 8.A N VAL 12.A O no hydrogen 2.862 N/A VAL 11.A N LYS 22.A O no hydrogen 3.297 N/A VAL 12.A N GLY 9.A O no hydrogen 3.238 N/A SER 13.A N ILE 20.A O no hydrogen 2.873 N/A SER 13.A OG GLU 6.A O no hydrogen 2.855 N/A SER 13.A OG SER 14.A O no hydrogen 3.463 N/A SER 14.A N GLU 6.A O no hydrogen 2.792 N/A ALA 15.A N VAL 18.A O no hydrogen 2.982 N/A GLN 16.A NE2 GLN 17.A O no hydrogen 3.327 N/A VAL 18.A N ALA 15.A O no hydrogen 2.799 N/A ALA 19.A N LEU 73.A O no hydrogen 2.672 N/A ILE 20.A N SER 13.A O no hydrogen 2.907 N/A LYS 21.A N VAL 71.A O no hydrogen 2.782 N/A LYS 22.A N VAL 11.A O no hydrogen 2.960 N/A ILE 23.A N VAL 69.A O no hydrogen 2.826 N/A ALA 26.A N LYS 67.A O no hydrogen 2.959 N/A ASP 28.A N ASN 25.A O no hydrogen 3.235 N/A ALA 33.A N VAL 29.A O no hydrogen 2.945 N/A LYS 34.A N VAL 30.A O no hydrogen 2.870 N/A LYS 34.A NZ ASP 300.A O no hydrogen 2.709 N/A LYS 34.A NZ GLU 302.A O no hydrogen 3.462 N/A ARG 35.A N THR 31.A O no hydrogen 3.045 N/A ARG 35.A NH2 ASN 32.A OD1 no hydrogen 3.305 N/A THR 36.A N ASN 32.A O no hydrogen 3.048 N/A THR 36.A OG1 ASN 32.A O no hydrogen 3.050 N/A LEU 37.A N ALA 33.A O no hydrogen 3.124 N/A ARG 38.A N LYS 34.A O no hydrogen 3.046 N/A ARG 38.A NH1 ASP 300.A OD1 no hydrogen 3.035 N/A ARG 38.A NH2 GLY 138.A O no hydrogen 2.665 N/A GLU 39.A N ARG 35.A O no hydrogen 3.042 N/A LEU 40.A N THR 36.A O no hydrogen 3.134 N/A LYS 41.A N LEU 37.A O no hydrogen 3.238 N/A LYS 41.A NZ GLU 316.A OE2 no hydrogen 3.210 N/A ILE 42.A N ARG 38.A O no hydrogen 3.084 N/A LEU 43.A N GLU 39.A O no hydrogen 2.953 N/A LYS 44.A N LEU 40.A O no hydrogen 3.038 N/A LYS 44.A NZ GLU 316.A O no hydrogen 2.738 N/A LYS 44.A NZ GLU 316.A OE1 no hydrogen 2.887 N/A LYS 44.A NZ ASP 319.A OD2 no hydrogen 2.893 N/A HIS 45.A N LYS 41.A O no hydrogen 3.173 N/A HIS 45.A N ILE 42.A O no hydrogen 3.104 N/A HIS 45.A NE2 PRO 293.A O no hydrogen 2.898 N/A PHE 46.A N ILE 42.A O no hydrogen 3.115 N/A LYS 47.A N TYR 108.A OH no hydrogen 2.956 N/A ASN 50.A N HIS 48.A ND1 no hydrogen 3.307 N/A ASN 50.A ND2 GLN 101.A OE1 no hydrogen 3.030 N/A ASN 50.A ND2 LEU 132.A O no hydrogen 2.980 N/A ILE 51.A N HIS 48.A O no hydrogen 3.173 N/A ILE 52.A N ILE 134.A O no hydrogen 3.107 N/A LYS 55.A N VAL 72.A O no hydrogen 2.867 N/A ASP 56.A N VAL 72.A O no hydrogen 3.344 N/A LEU 58.A N TYR 70.A O no hydrogen 3.251 N/A TYR 63.A OH GLU 307.A OE2 no hydrogen 3.036 N/A GLU 65.A N PRO 62.A O no hydrogen 3.262 N/A PHE 66.A N TYR 63.A O no hydrogen 3.177 N/A VAL 69.A N ILE 23.A O no hydrogen 3.115 N/A VAL 71.A N LYS 21.A O no hydrogen 2.922 N/A VAL 72.A N ASP 56.A O no hydrogen 2.761 N/A LEU 73.A N ALA 19.A O no hydrogen 2.750 N/A SER 78.A N VAL 126.A O no hydrogen 2.990 N/A SER 78.A OG ASP 79.A O no hydrogen 3.118 N/A LEU 80.A N LEU 124.A O no hydrogen 2.775 N/A GLN 82.A N ASP 79.A OD1 no hydrogen 2.852 N/A ILE 83.A N ASP 79.A O no hydrogen 3.106 N/A ILE 84.A N LEU 80.A O no hydrogen 2.849 N/A HIS 85.A N HIS 81.A O no hydrogen 2.947 N/A HIS 85.A NE2 GLU 188.A OE2 no hydrogen 2.750 N/A SER 86.A OG GLN 82.A O no hydrogen 2.781 N/A SER 86.A OG ILE 83.A O no hydrogen 2.785 N/A THR 91.A N HIS 94.A ND1 no hydrogen 3.253 N/A THR 91.A OG1 HIS 94.A ND1 no hydrogen 2.658 N/A HIS 94.A N THR 91.A OG1 no hydrogen 3.392 N/A HIS 94.A ND1 THR 91.A OG1 no hydrogen 2.658 N/A VAL 95.A N THR 91.A O no hydrogen 3.181 N/A ARG 96.A N LEU 92.A O no hydrogen 2.809 N/A ARG 96.A NE GLU 93.A OE1 no hydrogen 2.952 N/A ARG 96.A NH1 PHE 278.A O no hydrogen 2.699 N/A ARG 96.A NH2 GLU 93.A OE2 no hydrogen 3.022 N/A TYR 97.A N GLU 93.A O no hydrogen 3.100 N/A PHE 98.A N HIS 94.A O no hydrogen 2.857 N/A LEU 99.A N VAL 95.A O no hydrogen 2.963 N/A TYR 100.A N ARG 96.A O no hydrogen 3.148 N/A TYR 100.A OH GLU 288.A OE2 no hydrogen 2.725 N/A GLN 101.A N TYR 97.A O no hydrogen 3.282 N/A GLN 101.A NE2 CYS 130.A O no hydrogen 2.909 N/A LEU 102.A N PHE 98.A O no hydrogen 3.247 N/A LEU 103.A N LEU 99.A O no hydrogen 3.041 N/A ARG 104.A N TYR 100.A O no hydrogen 2.784 N/A ARG 104.A NE ASP 287.A O no hydrogen 3.023 N/A ARG 104.A NH1 ASN 50.A OD1 no hydrogen 3.039 N/A ARG 104.A NH2 ASP 287.A O no hydrogen 2.824 N/A GLY 105.A N GLN 101.A O no hydrogen 2.997 N/A LEU 106.A N LEU 102.A O no hydrogen 2.859 N/A LYS 107.A N LEU 103.A O no hydrogen 2.973 N/A LYS 107.A NZ GLU 288.A O no hydrogen 3.024 N/A LYS 107.A NZ ASP 290.A OD1 no hydrogen 2.903 N/A TYR 108.A N ARG 104.A O no hydrogen 3.504 N/A MET 109.A N GLY 105.A O no hydrogen 3.048 N/A HIS 110.A N LEU 106.A O no hydrogen 2.600 N/A HIS 110.A NE2 ASP 178.A OD2 no hydrogen 2.722 N/A SER 111.A N LYS 107.A O no hydrogen 3.045 N/A SER 111.A OG LYS 107.A O no hydrogen 3.190 N/A SER 111.A OG TYR 108.A O no hydrogen 2.567 N/A ALA 112.A N MET 109.A O no hydrogen 3.168 N/A GLN 113.A N HIS 110.A O no hydrogen 3.249 N/A VAL 114.A N MET 109.A O no hydrogen 3.437 N/A ILE 115.A N ARG 141.A O no hydrogen 2.851 N/A HIS 116.A N ASP 178.A OD2 no hydrogen 3.000 N/A HIS 116.A NE2 GLY 135.A O no hydrogen 2.839 N/A ARG 117.A N ASP 178.A OD1 no hydrogen 2.877 N/A ARG 117.A NE MET 139.A O no hydrogen 2.823 N/A ARG 117.A NH2 MET 139.A O no hydrogen 2.905 N/A ASN 123.A N LYS 120.A O no hydrogen 2.904 N/A ASN 123.A ND2 ASP 118.A O no hydrogen 2.743 N/A LEU 124.A N PRO 121.A O no hydrogen 2.976 N/A LEU 125.A N LYS 133.A O no hydrogen 2.950 N/A VAL 126.A N SER 78.A O no hydrogen 2.950 N/A ASN 127.A N GLU 131.A O no hydrogen 3.236 N/A ASN 127.A ND2 GLU 131.A OE1 no hydrogen 2.792 N/A ASN 129.A N ASN 127.A OD1 no hydrogen 2.962 N/A CYS 130.A N ASN 127.A O no hydrogen 3.200 N/A GLU 131.A N ASN 127.A OD1 no hydrogen 3.184 N/A LEU 132.A N GLN 101.A OE1 no hydrogen 2.939 N/A LYS 133.A N LEU 125.A O no hydrogen 2.800 N/A LYS 133.A NZ ASP 49.A O no hydrogen 2.635 N/A ILE 134.A N ASN 50.A O no hydrogen 2.967 N/A GLY 135.A N ASN 123.A O no hydrogen 3.091 N/A ALA 140.A N PHE 137.A O no hydrogen 3.161 N/A ARG 141.A N ILE 115.A O no hydrogen 3.048 N/A ARG 141.A NE GLU 147.A OE1 no hydrogen 3.309 N/A ARG 141.A NH1 GLY 138.A O no hydrogen 3.452 N/A ARG 141.A NH1 ALA 140.A O no hydrogen 2.818 N/A ARG 141.A NH2 GLU 147.A OE1 no hydrogen 2.858 N/A GLN 149.A NE2 GLN 149.A O no hydrogen 2.730 N/A TYR 150.A N GLU 147.A O no hydrogen 3.419 N/A THR 153.A OG1 LEU 166.A O no hydrogen 2.696 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.734 N/A TYR 155.A N MET 152.A O no hydrogen 3.244 N/A VAL 156.A N THR 153.A O no hydrogen 3.074 N/A ARG 159.A NE GLY 198.A O no hydrogen 3.161 N/A ARG 159.A NH2 GLY 198.A O no hydrogen 2.759 N/A TRP 160.A NE1 GLY 198.A O no hydrogen 2.795 N/A TYR 161.A N THR 158.A O no hydrogen 3.213 N/A TYR 161.A OH GLU 188.A OE1 no hydrogen 2.750 N/A ARG 162.A N ARG 159.A O no hydrogen 3.496 N/A ARG 162.A NE VAL 156.A O no hydrogen 2.765 N/A ARG 162.A NH2 ALA 157.A O no hydrogen 3.034 N/A GLU 165.A N GLU 165.A OE1 no hydrogen 2.783 N/A LEU 166.A N ALA 163.A O no hydrogen 3.052 N/A MET 167.A N ALA 163.A O no hydrogen 3.264 N/A LEU 168.A N PRO 164.A O no hydrogen 2.770 N/A SER 169.A OG THR 153.A OG1 no hydrogen 2.974 N/A LEU 170.A N GLU 165.A O no hydrogen 2.978 N/A HIS 171.A N TYR 173.A OH no hydrogen 3.245 N/A GLN 175.A N GLN 175.A OE1 no hydrogen 2.961 N/A GLN 175.A NE2 HIS 110.A O no hydrogen 3.055 N/A ALA 176.A N THR 174.A OG1 no hydrogen 3.264 N/A ILE 177.A N THR 174.A O no hydrogen 2.883 N/A ASP 178.A N GLN 175.A O no hydrogen 3.013 N/A TRP 180.A N ALA 176.A O no hydrogen 3.336 N/A SER 181.A N ILE 177.A O no hydrogen 3.510 N/A SER 181.A OG TYR 161.A O no hydrogen 2.937 N/A VAL 182.A N ASP 178.A O no hydrogen 2.829 N/A GLY 183.A N LEU 179.A O no hydrogen 2.977 N/A CYS 184.A N TRP 180.A O no hydrogen 3.031 N/A CYS 184.A SG TRP 180.A O no hydrogen 3.620 N/A ILE 185.A N SER 181.A O no hydrogen 2.859 N/A PHE 186.A N VAL 182.A O no hydrogen 2.648 N/A GLY 187.A N GLY 183.A O no hydrogen 2.803 N/A GLU 188.A N CYS 184.A O no hydrogen 2.822 N/A MET 189.A N ILE 185.A O no hydrogen 2.955 N/A LEU 190.A N PHE 186.A O no hydrogen 3.199 N/A ALA 191.A N GLY 187.A O no hydrogen 3.245 N/A ARG 192.A NH1 ILE 84.A O no hydrogen 3.158 N/A ARG 192.A NH1 GLN 88.A O no hydrogen 3.079 N/A ARG 192.A NH2 GLN 88.A O no hydrogen 2.562 N/A GLN 194.A N GLN 194.A OE1 no hydrogen 2.720 N/A GLY 198.A N PHE 196.A O no hydrogen 2.931 N/A GLY 198.A N GLN 204.A OE1 no hydrogen 3.086 N/A TYR 201.A OH MET 167.A O no hydrogen 2.692 N/A HIS 203.A N ASN 200.A OD1 no hydrogen 2.867 N/A GLN 204.A N ASN 200.A O no hydrogen 2.974 N/A GLN 204.A NE2 PHE 196.A O no hydrogen 3.459 N/A LEU 205.A N TYR 201.A O no hydrogen 3.288 N/A GLN 206.A N VAL 202.A O no hydrogen 3.102 N/A LEU 207.A N HIS 203.A O no hydrogen 3.020 N/A ILE 208.A N GLN 204.A O no hydrogen 3.322 N/A MET 209.A N LEU 205.A O no hydrogen 3.012 N/A MET 210.A N GLN 206.A O no hydrogen 2.755 N/A VAL 211.A N ILE 208.A O no hydrogen 3.311 N/A LEU 212.A N ILE 208.A O no hydrogen 2.815 N/A GLY 213.A N MET 209.A O no hydrogen 2.701 N/A VAL 219.A N SER 216.A OG no hydrogen 3.407 N/A ILE 220.A N SER 216.A O no hydrogen 3.021 N/A GLN 221.A N PRO 217.A O no hydrogen 2.895 N/A ALA 222.A N VAL 219.A O no hydrogen 3.188 N/A VAL 223.A N ILE 220.A O no hydrogen 3.294 N/A VAL 228.A N ALA 225.A O no hydrogen 3.133 N/A ALA 230.A N GLU 226.A O no hydrogen 3.184 N/A ILE 232.A N VAL 228.A O no hydrogen 3.252 N/A GLN 233.A N ARG 229.A O no hydrogen 3.047 N/A SER 234.A N ALA 230.A O no hydrogen 3.181 N/A SER 234.A N TYR 231.A O no hydrogen 3.313 N/A SER 234.A OG TYR 231.A O no hydrogen 2.613 N/A LEU 235.A N ILE 232.A O no hydrogen 3.380 N/A VAL 239.A N VAL 211.A O no hydrogen 2.739 N/A GLU 242.A N GLU 242.A OE1 no hydrogen 2.912 N/A THR 243.A N PRO 240.A O no hydrogen 3.054 N/A THR 243.A OG1 PRO 240.A O no hydrogen 3.123 N/A VAL 244.A N PRO 240.A O no hydrogen 3.380 N/A TYR 245.A N TRP 241.A O no hydrogen 2.919 N/A ALA 248.A N TYR 245.A O no hydrogen 3.412 N/A SER 254.A N ARG 250.A O no hydrogen 3.281 N/A SER 254.A OG HIS 276.A NE2 no hydrogen 3.142 N/A LEU 255.A N GLN 251.A O no hydrogen 3.280 N/A LEU 256.A N ALA 252.A O no hydrogen 2.838 N/A GLY 257.A N LEU 253.A O no hydrogen 2.781 N/A ARG 258.A N SER 254.A O no hydrogen 3.386 N/A ARG 258.A N LEU 255.A O no hydrogen 3.211 N/A MET 259.A N LEU 256.A O no hydrogen 2.935 N/A LEU 260.A N LEU 256.A O no hydrogen 3.154 N/A ARG 261.A N MET 259.A O no hydrogen 3.056 N/A GLU 263.A N GLU 263.A OE1 no hydrogen 2.767 N/A SER 265.A OG GLU 172.A OE2 no hydrogen 3.125 N/A ALA 266.A N GLU 263.A O no hydrogen 3.123 N/A ARG 267.A N PRO 264.A O no hydrogen 3.269 N/A ARG 267.A NE ARG 261.A O no hydrogen 2.979 N/A ARG 267.A NH1 GLU 165.A OE1 no hydrogen 3.247 N/A ARG 267.A NH1 GLU 165.A OE2 no hydrogen 2.688 N/A ARG 267.A NH1 ALA 176.A O no hydrogen 2.956 N/A ARG 267.A NH2 GLU 165.A OE1 no hydrogen 2.802 N/A ARG 267.A NH2 ARG 261.A O no hydrogen 3.115 N/A ILE 268.A N ARG 258.A O no hydrogen 3.001 N/A ALA 272.A N SER 269.A OG no hydrogen 3.028 N/A ALA 273.A N SER 269.A O no hydrogen 2.904 N/A LEU 274.A N ALA 270.A O no hydrogen 3.130 N/A ARG 275.A N ALA 272.A O no hydrogen 3.047 N/A HIS 276.A N ALA 273.A O no hydrogen 3.040 N/A HIS 276.A NE2 SER 254.A OG no hydrogen 3.142 N/A LEU 279.A N HIS 276.A O no hydrogen 3.040 N/A ALA 280.A N PRO 277.A O no hydrogen 3.292 N/A TYR 282.A N LEU 279.A O no hydrogen 3.291 N/A HIS 283.A N ALA 280.A O no hydrogen 3.429 N/A ASP 284.A N GLU 288.A OE2 no hydrogen 2.601 N/A ASP 287.A N ASP 284.A O no hydrogen 3.019 N/A GLU 288.A N PRO 285.A O no hydrogen 3.331 N/A CYS 291.A N SER 111.A OG no hydrogen 2.704 N/A CYS 291.A SG HIS 45.A NE2 no hydrogen 3.731 N/A CYS 291.A SG PRO 293.A O no hydrogen 3.996 N/A PHE 295.A N ALA 112.A O no hydrogen 2.846 N/A ALA 298.A N ASP 296.A OD1 no hydrogen 3.062 N/A ASP 300.A N PHE 297.A O no hydrogen 3.044 N/A ARG 301.A N ALA 298.A O no hydrogen 3.097 N/A ARG 306.A NH1 ASP 28.A O no hydrogen 2.966 N/A ILE 309.A N THR 305.A O no hydrogen 3.096 N/A LYS 310.A N ARG 306.A O no hydrogen 2.877 N/A LYS 310.A NZ TYR 63.A O no hydrogen 3.089 N/A GLU 311.A N GLU 307.A O no hydrogen 3.073 N/A ALA 312.A N ARG 308.A O no hydrogen 2.947 N/A ILE 313.A N ILE 309.A O no hydrogen 2.812 N/A VAL 314.A N LYS 310.A O no hydrogen 2.986 N/A ALA 315.A N GLU 311.A O no hydrogen 3.048 N/A GLU 316.A N ALA 312.A O no hydrogen 3.110 N/A ILE 317.A N ILE 313.A O no hydrogen 3.033 N/A GLU 318.A N VAL 314.A O no hydrogen 2.946 N/A ASP 319.A N ALA 315.A O no hydrogen 2.888 N/A PHE 320.A N GLU 316.A O no hydrogen 2.991 N/A HIS 321.A N ILE 317.A O no hydrogen 3.220 N/A HIS 321.A ND1 GLU 325.A OE2 no hydrogen 2.728 N/A HIS 321.A NE2 ILE 57.A O no hydrogen 2.751 N/A ALA 322.A N GLU 318.A O no hydrogen 2.949 N/A ARG 323.A N ASP 319.A O no hydrogen 3.088 N/A ARG 323.A NE ASP 319.A OD1 no hydrogen 3.520 N/A ARG 324.A N HIS 321.A O no hydrogen 3.229 N/A GLU 325.A N HIS 321.A O no hydrogen 2.783 N/A GLY 326.A N HIS 321.A O no hydrogen 3.430 N/A ILE 327.A N ALA 322.A O no hydrogen 2.796 N/A