Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xkj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N LEU 295.A O no hydrogen 2.815 N/A LEU 5.A N THR 38.A O no hydrogen 2.739 N/A PHE 6.A N MET 297.A O no hydrogen 2.994 N/A PHE 7.A N ALA 40.A O no hydrogen 2.716 N/A LEU 8.A N GLU 300.A OE1 no hydrogen 2.705 N/A ASN 9.A N GLU 300.A OE2 no hydrogen 3.050 N/A MET 11.A N ASN 48.A O no hydrogen 2.951 N/A ASN 12.A N ARG 15.A O no hydrogen 3.187 N/A LYS 14.A N ASN 12.A OD1 no hydrogen 2.976 N/A ARG 15.A N ASN 12.A O no hydrogen 3.116 N/A ARG 15.A N ASN 12.A OD1 no hydrogen 3.249 N/A ARG 15.A NH1 GLU 23.A OE1 no hydrogen 3.462 N/A ARG 15.A NH1 GLU 300.A O no hydrogen 2.860 N/A ARG 15.A NH2 GLU 300.A O no hydrogen 3.079 N/A SER 16.A OG ASP 18.A OD1 no hydrogen 3.216 N/A SER 16.A OG ASP 18.A OD2 no hydrogen 2.863 N/A GLN 19.A NE2 SER 16.A OG no hydrogen 2.689 N/A VAL 20.A N SER 16.A O no hydrogen 2.945 N/A ILE 21.A N SER 17.A O no hydrogen 3.222 N/A GLU 22.A N ASP 18.A O no hydrogen 3.135 N/A GLU 23.A N GLN 19.A O no hydrogen 2.809 N/A MET 24.A N VAL 20.A O no hydrogen 3.027 N/A LEU 25.A N ILE 21.A O no hydrogen 3.262 N/A ASP 26.A N GLU 22.A O no hydrogen 3.224 N/A THR 27.A N GLU 23.A O no hydrogen 3.222 N/A THR 27.A OG1 GLU 23.A O no hydrogen 3.109 N/A ALA 28.A N MET 24.A O no hydrogen 3.004 N/A HIS 29.A N LEU 25.A O no hydrogen 3.212 N/A TYR 30.A N ASP 26.A O no hydrogen 2.971 N/A TYR 30.A OH ASP 313.A OD1 no hydrogen 2.627 N/A TYR 30.A OH ASP 313.A OD2 no hydrogen 3.112 N/A VAL 31.A N THR 27.A O no hydrogen 2.853 N/A ASP 32.A N ALA 28.A O no hydrogen 3.078 N/A GLN 33.A N TYR 30.A O no hydrogen 3.334 N/A GLN 33.A NE2 HIS 29.A O no hydrogen 2.875 N/A LEU 34.A N VAL 31.A O no hydrogen 3.088 N/A LYS 35.A N ASN 316.A OD1 no hydrogen 2.935 N/A ASP 37.A N PHE 3.A O no hydrogen 2.741 N/A THR 38.A OG1 ASP 37.A OD2 no hydrogen 3.048 N/A LEU 39.A N LYS 70.A O no hydrogen 2.843 N/A ALA 40.A N LEU 5.A O no hydrogen 2.807 N/A VAL 41.A N ALA 72.A O no hydrogen 2.894 N/A TYR 42.A N PHE 7.A O no hydrogen 2.994 N/A GLU 43.A N ASN 75.A OD1 no hydrogen 2.915 N/A ASN 44.A N VAL 52.A O no hydrogen 2.978 N/A ASN 44.A ND2 SER 47.A OG no hydrogen 2.834 N/A ASN 44.A ND2 GLY 50.A O no hydrogen 3.056 N/A HIS 45.A NE2 GLU 43.A OE2 no hydrogen 2.884 N/A SER 47.A OG GLU 253.A OE1 no hydrogen 2.913 N/A SER 47.A OG GLU 253.A OE2 no hydrogen 3.486 N/A ASN 49.A N SER 47.A OG no hydrogen 3.399 N/A ASN 49.A ND2 GLU 253.A OE1 no hydrogen 2.660 N/A GLY 50.A N ASN 48.A O no hydrogen 3.016 N/A VAL 51.A N ASN 9.A O no hydrogen 2.867 N/A THR 57.A N ALA 54.A O no hydrogen 3.212 N/A VAL 58.A N ALA 54.A O no hydrogen 3.306 N/A ALA 59.A N PRO 55.A O no hydrogen 2.810 N/A GLY 60.A N LEU 56.A O no hydrogen 2.948 N/A PHE 61.A N THR 57.A O no hydrogen 3.367 N/A LEU 62.A N VAL 58.A O no hydrogen 3.168 N/A LEU 63.A N ALA 59.A O no hydrogen 2.967 N/A GLY 64.A N GLY 60.A O no hydrogen 3.015 N/A MET 65.A N LEU 62.A O no hydrogen 3.118 N/A THR 66.A N LEU 62.A O no hydrogen 2.951 N/A THR 66.A N LEU 63.A O no hydrogen 3.403 N/A THR 66.A OG1 LEU 62.A O no hydrogen 2.782 N/A LYS 67.A N ASP 32.A OD2 no hydrogen 2.981 N/A ASN 68.A N ASP 32.A OD1 no hydrogen 3.047 N/A ASN 68.A ND2 ASP 32.A O no hydrogen 2.750 N/A ALA 69.A N ASP 32.A OD1 no hydrogen 3.104 N/A LYS 70.A N ASP 37.A O no hydrogen 3.081 N/A LYS 70.A NZ ASP 37.A OD1 no hydrogen 3.505 N/A VAL 71.A N ARG 100.A O no hydrogen 2.884 N/A ALA 72.A N LEU 39.A O no hydrogen 2.827 N/A SER 73.A N ALA 102.A O no hydrogen 3.374 N/A SER 73.A OG GLY 104.A O no hydrogen 2.874 N/A LEU 74.A N VAL 41.A O no hydrogen 2.901 N/A HIS 76.A N GLY 104.A O no hydrogen 3.139 N/A HIS 76.A ND1 GLU 43.A OE1 no hydrogen 2.893 N/A VAL 77.A N GLU 43.A OE1 no hydrogen 3.068 N/A ILE 78.A N SER 106.A O no hydrogen 3.422 N/A THR 79.A OG1 ASP 107.A OD1 no hydrogen 3.442 N/A THR 80.A OG1 VAL 77.A O no hydrogen 3.219 N/A HIS 81.A N ILE 78.A O no hydrogen 3.284 N/A VAL 84.A N HIS 82.A ND1 no hydrogen 3.263 N/A ARG 85.A N HIS 82.A O no hydrogen 2.809 N/A VAL 86.A N HIS 82.A O no hydrogen 3.274 N/A ALA 87.A N PRO 83.A O no hydrogen 3.132 N/A GLU 88.A N VAL 84.A O no hydrogen 2.962 N/A GLU 89.A N ARG 85.A O no hydrogen 2.834 N/A ALA 90.A N VAL 86.A O no hydrogen 2.943 N/A CYS 91.A N ALA 87.A O no hydrogen 2.954 N/A CYS 91.A SG ALA 87.A O no hydrogen 3.215 N/A LEU 92.A N GLU 88.A O no hydrogen 3.175 N/A LEU 92.A N GLU 89.A O no hydrogen 3.111 N/A LEU 93.A N GLU 89.A O no hydrogen 3.030 N/A ASP 94.A N ALA 90.A O no hydrogen 3.165 N/A GLN 95.A N CYS 91.A O no hydrogen 3.045 N/A GLN 95.A NE2 HIS 161.A O no hydrogen 2.604 N/A MET 96.A N LEU 92.A O no hydrogen 2.924 N/A SER 97.A N LEU 93.A O no hydrogen 3.005 N/A SER 97.A OG LEU 93.A O no hydrogen 2.820 N/A GLU 98.A N GLN 95.A O no hydrogen 3.043 N/A GLY 99.A N ASP 94.A O no hydrogen 3.148 N/A ARG 100.A N SER 97.A OG no hydrogen 3.183 N/A ARG 100.A NE ALA 69.A O no hydrogen 3.096 N/A ARG 100.A NH1 LEU 63.A O no hydrogen 3.325 N/A ARG 100.A NH1 THR 66.A O no hydrogen 3.379 N/A ARG 100.A NH2 THR 66.A OG1 no hydrogen 2.805 N/A ARG 100.A NH2 ALA 69.A O no hydrogen 2.816 N/A ALA 102.A N VAL 71.A O no hydrogen 3.085 N/A PHE 103.A N ALA 169.A O no hydrogen 2.907 N/A PHE 105.A N PHE 171.A O no hydrogen 3.070 N/A SER 106.A N HIS 76.A O no hydrogen 2.669 N/A SER 106.A OG ASP 107.A O no hydrogen 2.594 N/A CYS 108.A SG LYS 110.A O no hydrogen 3.031 N/A LYS 110.A NZ ASN 44.A OD1 no hydrogen 3.169 N/A LYS 110.A NZ HIS 45.A O no hydrogen 3.270 N/A LYS 110.A NZ GLU 253.A OE2 no hydrogen 3.108 N/A MET 114.A N SER 111.A O no hydrogen 3.038 N/A ARG 115.A N SER 111.A O no hydrogen 3.021 N/A PHE 117.A N ASP 113.A O no hydrogen 3.019 N/A ARG 119.A N MET 114.A O no hydrogen 3.290 N/A ARG 119.A NE PHE 117.A O no hydrogen 3.476 N/A SER 123.A OG ASP 122.A OD1 no hydrogen 3.139 N/A GLN 124.A NE2 ASP 107.A OD1 no hydrogen 3.472 N/A GLN 124.A NE2 ASP 107.A OD2 no hydrogen 3.373 N/A GLN 124.A NE2 CYS 108.A O no hydrogen 3.460 N/A LEU 127.A N SER 123.A O no hydrogen 3.012 N/A PHE 128.A N GLN 124.A O no hydrogen 2.909 N/A SER 129.A N PHE 125.A O no hydrogen 3.122 N/A SER 129.A OG PHE 125.A O no hydrogen 2.989 N/A SER 129.A OG GLN 126.A O no hydrogen 2.953 N/A GLU 130.A N GLN 126.A O no hydrogen 2.921 N/A CYS 131.A N LEU 127.A O no hydrogen 2.827 N/A CYS 131.A SG LEU 127.A O no hydrogen 3.332 N/A HIS 132.A N PHE 128.A O no hydrogen 3.015 N/A HIS 132.A NE2 GLN 170.A OE1 no hydrogen 2.857 N/A LYS 133.A N SER 129.A O no hydrogen 3.097 N/A ILE 134.A N GLU 130.A O no hydrogen 3.122 N/A ILE 135.A N CYS 131.A O no hydrogen 3.075 N/A ASN 136.A N HIS 132.A O no hydrogen 2.795 N/A ASP 137.A N LYS 133.A O no hydrogen 3.018 N/A ALA 138.A N ILE 134.A O no hydrogen 3.288 N/A PHE 139.A N ILE 135.A O no hydrogen 2.880 N/A THR 140.A N ASN 136.A O no hydrogen 3.054 N/A THR 140.A OG1 ASN 136.A O no hydrogen 3.048 N/A THR 140.A OG1 ASP 137.A O no hydrogen 3.220 N/A THR 141.A N ASP 137.A O no hydrogen 2.710 N/A THR 141.A OG1 ASP 137.A O no hydrogen 2.956 N/A GLY 142.A N ALA 138.A O no hydrogen 2.843 N/A TYR 143.A N THR 141.A OG1 no hydrogen 3.020 N/A CYS 144.A N ILE 156.A O no hydrogen 3.434 N/A PHE 150.A N ASN 148.A OD1 no hydrogen 3.188 N/A TYR 151.A N ASN 148.A OD1 no hydrogen 3.219 N/A VAL 158.A N GLY 142.A O no hydrogen 2.915 N/A PHE 163.A N ASP 94.A OD2 no hydrogen 2.730 N/A THR 164.A N ASP 94.A OD2 no hydrogen 2.906 N/A THR 164.A OG1 ASP 94.A OD1 no hydrogen 3.179 N/A GLY 167.A N THR 164.A O no hydrogen 2.859 N/A GLN 170.A NE2 ASN 136.A OD1 no hydrogen 3.500 N/A PHE 171.A N PHE 103.A O no hydrogen 3.324 N/A VAL 172.A N PRO 189.A O no hydrogen 2.940 N/A ASN 173.A N PHE 105.A O no hydrogen 3.124 N/A ASN 173.A ND2 LEU 74.A O no hydrogen 2.872 N/A ALA 174.A N VAL 191.A O no hydrogen 3.212 N/A THR 175.A N ASN 173.A O no hydrogen 2.987 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.813 N/A VAL 179.A N SER 176.A OG no hydrogen 3.244 N/A VAL 180.A N SER 176.A O no hydrogen 2.881 N/A GLU 181.A N LYS 177.A O no hydrogen 2.921 N/A TRP 182.A N GLU 178.A O no hydrogen 3.074 N/A ALA 183.A N VAL 179.A O no hydrogen 2.658 N/A ALA 184.A N VAL 180.A O no hydrogen 2.726 N/A LYS 185.A N GLU 181.A O no hydrogen 3.077 N/A LEU 186.A N ALA 183.A O no hydrogen 3.255 N/A GLY 187.A N ALA 183.A O no hydrogen 3.017 N/A GLY 187.A N ALA 184.A O no hydrogen 3.129 N/A LEU 188.A N ALA 183.A O no hydrogen 3.146 N/A LEU 190.A N HIS 224.A ND1 no hydrogen 3.165 N/A VAL 191.A N VAL 172.A O no hydrogen 2.986 N/A PHE 192.A N LYS 225.A O no hydrogen 2.700 N/A ASP 196.A N ARG 193.A O no hydrogen 3.315 N/A ASN 198.A N GLU 270.A OE1 no hydrogen 2.801 N/A GLN 200.A N SER 197.A OG no hydrogen 2.821 N/A GLN 200.A NE2 GLN 200.A O no hydrogen 3.136 N/A GLN 200.A NE2 GLU 203.A OE1 no hydrogen 2.926 N/A ARG 201.A N SER 197.A O no hydrogen 3.088 N/A ARG 201.A NE ARG 193.A O no hydrogen 2.961 N/A ARG 201.A NH2 ASP 196.A O no hydrogen 3.059 N/A LYS 202.A N ASN 198.A O no hydrogen 3.075 N/A GLU 203.A N ALA 199.A O no hydrogen 3.271 N/A TYR 204.A N GLN 200.A O no hydrogen 3.173 N/A ALA 205.A N ARG 201.A O no hydrogen 2.877 N/A GLY 206.A N LYS 202.A O no hydrogen 2.941 N/A LEU 207.A N GLU 203.A O no hydrogen 2.962 N/A TYR 208.A N TYR 204.A O no hydrogen 2.963 N/A TYR 208.A OH LEU 188.A O no hydrogen 3.056 N/A HIS 209.A N ALA 205.A O no hydrogen 3.400 N/A GLU 210.A N GLY 206.A O no hydrogen 3.003 N/A VAL 211.A N LEU 207.A O no hydrogen 3.139 N/A ALA 212.A N TYR 208.A O no hydrogen 2.860 N/A GLN 213.A N HIS 209.A O no hydrogen 2.639 N/A ALA 214.A N GLU 210.A O no hydrogen 2.825 N/A HIS 215.A N VAL 211.A O no hydrogen 3.078 N/A HIS 215.A ND1 VAL 211.A O no hydrogen 3.128 N/A VAL 217.A N ALA 212.A O no hydrogen 3.096 N/A SER 220.A OG ASP 218.A OD1 no hydrogen 3.074 N/A ARG 223.A NE ASP 294.A OD1 no hydrogen 3.187 N/A ARG 223.A NH2 ASP 294.A OD1 no hydrogen 2.844 N/A LYS 225.A N LEU 190.A O no hydrogen 2.966 N/A LYS 225.A NZ ARG 223.A O no hydrogen 2.979 N/A LYS 225.A NZ ASP 294.A OD2 no hydrogen 2.976 N/A LEU 226.A N ASP 294.A O no hydrogen 3.081 N/A THR 227.A N PHE 192.A O no hydrogen 3.183 N/A THR 227.A OG1 PHE 192.A O no hydrogen 2.895 N/A LEU 228.A N LEU 296.A O no hydrogen 2.986 N/A LEU 229.A N ASN 271.A OD1 no hydrogen 3.047 N/A VAL 230.A N SER 298.A O no hydrogen 2.900 N/A ASN 231.A N ALA 272.A O no hydrogen 3.037 N/A ASN 233.A N GLY 274.A O no hydrogen 2.952 N/A ASP 235.A N ASN 233.A OD1 no hydrogen 2.886 N/A GLU 237.A N ASP 235.A OD1 no hydrogen 3.118 N/A ALA 238.A N ASP 235.A O no hydrogen 2.645 N/A ALA 239.A N ASP 235.A O no hydrogen 3.207 N/A ARG 240.A N GLY 236.A O no hydrogen 3.322 N/A ARG 240.A NH2 GLU 278.A OE1 no hydrogen 3.064 N/A ARG 240.A NH2 GLU 278.A OE2 no hydrogen 2.943 N/A ALA 241.A N GLU 237.A O no hydrogen 3.237 N/A GLU 242.A N ALA 238.A O no hydrogen 2.856 N/A ALA 243.A N ALA 239.A O no hydrogen 2.987 N/A ARG 244.A N ARG 240.A O no hydrogen 3.011 N/A ARG 244.A NH2 GLU 261.A OE1 no hydrogen 2.967 N/A VAL 245.A N ALA 241.A O no hydrogen 3.332 N/A TYR 246.A N GLU 242.A O no hydrogen 3.371 N/A LEU 247.A N ALA 243.A O no hydrogen 3.036 N/A VAL 251.A N LEU 247.A O no hydrogen 3.075 N/A ARG 252.A N GLU 249.A O no hydrogen 3.141 N/A GLU 253.A N GLU 249.A O no hydrogen 2.917 N/A SER 254.A N PHE 250.A O no hydrogen 2.985 N/A TYR 255.A N VAL 251.A O no hydrogen 3.036 N/A TYR 255.A OH ASP 195.A OD2 no hydrogen 2.814 N/A GLN 262.A N ASP 259.A OD2 no hydrogen 3.066 N/A LYS 263.A N ASP 259.A O no hydrogen 3.365 N/A LYS 263.A NZ ASP 195.A O no hydrogen 2.945 N/A MET 264.A N PHE 260.A O no hydrogen 3.032 N/A GLY 265.A N GLU 261.A O no hydrogen 3.073 N/A GLU 266.A N GLN 262.A O no hydrogen 2.936 N/A GLU 266.A N LYS 263.A O no hydrogen 3.074 N/A LEU 267.A N LYS 263.A O no hydrogen 2.844 N/A LEU 268.A N MET 264.A O no hydrogen 3.116 N/A SER 269.A N GLU 266.A O no hydrogen 3.139 N/A SER 269.A OG GLY 265.A O no hydrogen 3.270 N/A SER 269.A OG GLU 266.A O no hydrogen 3.512 N/A GLU 270.A N GLU 266.A O no hydrogen 2.969 N/A ASN 271.A N LEU 267.A O no hydrogen 3.161 N/A ASN 271.A ND2 TRP 194.A O no hydrogen 3.389 N/A ASN 271.A ND2 LEU 267.A O no hydrogen 2.810 N/A ILE 273.A N ASN 271.A O no hydrogen 2.477 N/A GLY 274.A N ASN 231.A O no hydrogen 3.000 N/A THR 275.A N GLU 278.A OE1 no hydrogen 2.790 N/A THR 275.A OG1 GLU 277.A OE1 no hydrogen 3.567 N/A GLU 278.A N THR 275.A OG1 no hydrogen 3.425 N/A SER 279.A N THR 275.A O no hydrogen 2.917 N/A SER 279.A OG GLN 232.A OE1 no hydrogen 3.318 N/A SER 279.A OG ALA 272.A O no hydrogen 3.052 N/A THR 280.A N TYR 276.A O no hydrogen 3.004 N/A THR 280.A OG1 TYR 276.A O no hydrogen 2.796 N/A GLN 281.A N GLU 277.A O no hydrogen 2.905 N/A ALA 282.A N GLU 278.A O no hydrogen 3.042 N/A ALA 283.A N SER 279.A O no hydrogen 3.369 N/A ALA 283.A N THR 280.A O no hydrogen 3.095 N/A ARG 284.A N THR 280.A O no hydrogen 3.278 N/A ARG 284.A NH1 GLN 281.A OE1 no hydrogen 3.539 N/A VAL 285.A N GLN 281.A O no hydrogen 3.184 N/A ALA 286.A N ALA 282.A O no hydrogen 3.098 N/A ILE 287.A N ALA 283.A O no hydrogen 2.986 N/A GLU 288.A N ARG 284.A O no hydrogen 2.938 N/A CYS 289.A N VAL 285.A O no hydrogen 3.073 N/A CYS 289.A SG VAL 285.A O no hydrogen 3.615 N/A CYS 290.A SG ALA 286.A O no hydrogen 3.179 N/A GLY 291.A N ILE 287.A O no hydrogen 2.948 N/A ALA 293.A N HIS 224.A O no hydrogen 2.859 N/A ASP 294.A N HIS 224.A O no hydrogen 3.229 N/A LEU 295.A N LYS 2.A O no hydrogen 2.859 N/A LEU 296.A N LEU 226.A O no hydrogen 2.900 N/A MET 297.A N GLY 4.A O no hydrogen 2.921 N/A SER 298.A N LEU 228.A O no hydrogen 3.133 N/A SER 298.A OG GLU 300.A OE1 no hydrogen 3.076 N/A SER 301.A OG ASN 231.A OD1 no hydrogen 2.875 N/A MET 302.A N PHE 299.A O no hydrogen 3.457 N/A GLU 303.A N GLU 242.A OE2 no hydrogen 3.165 N/A GLN 307.A NE2 GLN 232.A O no hydrogen 3.035 N/A GLN 308.A N ASP 304.A O no hydrogen 2.920 N/A GLN 308.A NE2 MET 302.A O no hydrogen 3.092 N/A ARG 309.A N LYS 305.A O no hydrogen 3.092 N/A ALA 310.A N ALA 306.A O no hydrogen 3.041 N/A VAL 311.A N GLN 307.A O no hydrogen 2.973 N/A ILE 312.A N GLN 308.A O no hydrogen 3.028 N/A ASP 313.A N ARG 309.A O no hydrogen 2.945 N/A VAL 314.A N ALA 310.A O no hydrogen 3.138 N/A VAL 315.A N VAL 311.A O no hydrogen 3.198 N/A ASN 316.A N ILE 312.A O no hydrogen 3.022 N/A ALA 317.A N ASP 313.A O no hydrogen 3.017 N/A ASN 318.A N VAL 314.A O no hydrogen 2.882 N/A ASN 318.A ND2 TYR 276.A OH no hydrogen 2.994 N/A ILE 319.A N VAL 315.A O no hydrogen 3.032 N/A VAL 320.A N ASN 316.A O no hydrogen 3.232 N/A VAL 320.A N ALA 317.A O no hydrogen 2.965 N/A LYS 321.A N ALA 317.A O no hydrogen 3.016 N/A TYR 322.A N ASN 318.A O no hydrogen 3.066 N/A HIS 323.A N ILE 319.A O no hydrogen 2.975 N/A SER 324.A OG VAL 320.A O no hydrogen 3.038 N/A