Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xaj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N VAL 16.A O no hydrogen 3.375 N/A MET 1.A N GLU 17.A OE1 no hydrogen 3.565 N/A LYS 2.A NZ TYR 15.A OH no hydrogen 3.186 N/A LEU 3.A N ILE 14.A O no hydrogen 3.184 N/A THR 5.A N TYR 12.A O no hydrogen 3.373 N/A THR 5.A OG1 ASN 11.A OD1 no hydrogen 3.255 N/A THR 5.A OG1 TYR 12.A O no hydrogen 3.119 N/A TYR 7.A N ASN 11.A OD1 no hydrogen 2.639 N/A TYR 7.A OH VAL 221.A O no hydrogen 3.000 N/A ASN 11.A ND2 TYR 7.A O no hydrogen 2.614 N/A TYR 12.A N THR 5.A OG1 no hydrogen 2.765 N/A ILE 14.A N LEU 3.A O no hydrogen 2.961 N/A TYR 15.A N VAL 153.A O no hydrogen 2.887 N/A VAL 16.A N MET 1.A O no hydrogen 3.312 N/A GLU 17.A N TYR 155.A O no hydrogen 2.980 N/A HIS 18.A ND1 ASP 158.A OD1 no hydrogen 2.914 N/A HIS 18.A NE2 ASP 207.A OD1 no hydrogen 2.330 N/A GLY 19.A N ASP 156.A OD2 no hydrogen 2.492 N/A ALA 20.A N GLU 17.A O no hydrogen 3.217 N/A ILE 21.A N ASP 156.A OD1 no hydrogen 3.388 N/A LYS 22.A N GLY 19.A O no hydrogen 3.266 N/A TYR 23.A N ALA 20.A O no hydrogen 3.225 N/A TYR 23.A OH GLU 17.A OE1 no hydrogen 3.213 N/A THR 26.A OG1 TYR 23.A O no hydrogen 2.762 N/A TYR 27.A N ILE 24.A O no hydrogen 3.272 N/A LEU 28.A N ILE 24.A O no hydrogen 3.273 N/A GLN 30.A NE2 TYR 27.A O no hydrogen 2.782 N/A PHE 31.A N LEU 28.A O no hydrogen 2.975 N/A ASP 32.A N ASN 87.A O no hydrogen 2.696 N/A GLN 33.A NE2 HIS 82.A O no hydrogen 3.225 N/A SER 34.A OG GLN 33.A O no hydrogen 2.845 N/A PHE 35.A N ALA 89.A O no hydrogen 2.891 N/A LEU 36.A N HIS 56.A O no hydrogen 3.063 N/A LEU 37.A N ILE 91.A O no hydrogen 2.942 N/A ILE 38.A N VAL 58.A O no hydrogen 2.882 N/A ASP 39.A N VAL 93.A O no hydrogen 3.314 N/A TYR 41.A N ASP 39.A OD1 no hydrogen 3.015 N/A ASN 43.A N ASP 39.A O no hydrogen 2.836 N/A GLN 44.A N GLU 40.A O no hydrogen 3.330 N/A TYR 45.A N TYR 41.A O no hydrogen 3.021 N/A PHE 46.A N VAL 42.A O no hydrogen 2.747 N/A LYS 49.A NZ ASP 156.A OD1 no hydrogen 3.345 N/A ASP 51.A N ASN 48.A O no hydrogen 2.986 N/A ILE 53.A N PHE 50.A O no hydrogen 3.076 N/A ASN 54.A ND2 LEU 28.A O no hydrogen 3.611 N/A HIS 56.A N SER 34.A O no hydrogen 2.738 N/A LYS 57.A NZ ASN 43.A OD1 no hydrogen 2.947 N/A VAL 58.A N LEU 36.A O no hydrogen 2.674 N/A ILE 60.A N ILE 38.A O no hydrogen 2.864 N/A GLY 63.A N ASP 39.A OD2 no hydrogen 2.882 N/A LYS 65.A N ALA 62.A O no hydrogen 3.335 N/A THR 66.A N GLY 63.A O no hydrogen 3.194 N/A LYS 67.A NZ ASP 100.A OD1 no hydrogen 3.043 N/A LYS 67.A NZ ASN 142.A OD1 no hydrogen 3.177 N/A THR 68.A N THR 66.A O no hydrogen 3.042 N/A THR 68.A OG1 GLU 70.A OE2 no hydrogen 3.412 N/A GLN 71.A N THR 68.A OG1 no hydrogen 3.057 N/A GLN 71.A NE2 THR 75.A OG1 no hydrogen 2.766 N/A TYR 72.A N THR 68.A O no hydrogen 2.780 N/A TYR 72.A OH THR 108.A OG1 no hydrogen 2.581 N/A GLN 73.A N PHE 69.A O no hydrogen 2.510 N/A GLU 74.A N GLU 70.A O no hydrogen 2.897 N/A THR 75.A N GLN 71.A O no hydrogen 2.958 N/A THR 75.A OG1 GLN 71.A O no hydrogen 2.745 N/A LEU 76.A N TYR 72.A O no hydrogen 3.024 N/A GLU 77.A N GLN 73.A O no hydrogen 2.923 N/A TYR 78.A N GLU 74.A O no hydrogen 2.960 N/A ILE 79.A N THR 75.A O no hydrogen 3.194 N/A LEU 80.A N LEU 76.A O no hydrogen 2.954 N/A SER 81.A N GLU 77.A O no hydrogen 3.199 N/A SER 81.A OG TYR 78.A O no hydrogen 2.898 N/A SER 81.A OG HIS 82.A ND1 no hydrogen 3.135 N/A HIS 82.A N ILE 79.A O no hydrogen 3.102 N/A HIS 82.A ND1 SER 81.A OG no hydrogen 3.135 N/A HIS 83.A N LEU 80.A O no hydrogen 3.295 N/A THR 85.A N THR 88.A OG1 no hydrogen 3.112 N/A THR 85.A OG1 ASP 32.A OD2 no hydrogen 2.328 N/A ASN 87.A ND2 GLN 30.A O no hydrogen 3.016 N/A THR 88.A OG1 THR 85.A O no hydrogen 2.636 N/A ILE 90.A N HIS 114.A O no hydrogen 2.584 N/A ILE 91.A N PHE 35.A O no hydrogen 3.233 N/A ALA 92.A N ILE 116.A O no hydrogen 2.742 N/A VAL 93.A N LEU 37.A O no hydrogen 2.856 N/A GLY 94.A N VAL 118.A O no hydrogen 3.254 N/A GLY 99.A N GLY 95.A O no hydrogen 2.895 N/A ASP 100.A N GLY 96.A O no hydrogen 2.789 N/A PHE 101.A N ALA 97.A O no hydrogen 3.021 N/A ALA 102.A N THR 98.A O no hydrogen 2.970 N/A GLY 103.A N GLY 99.A O no hydrogen 2.750 N/A PHE 104.A N ASP 100.A O no hydrogen 3.022 N/A PHE 104.A N PHE 101.A O no hydrogen 2.850 N/A VAL 105.A N PHE 101.A O no hydrogen 2.975 N/A ALA 106.A N ALA 102.A O no hydrogen 2.883 N/A THR 108.A N PHE 104.A O no hydrogen 3.089 N/A THR 108.A N VAL 105.A O no hydrogen 3.247 N/A THR 108.A OG1 TYR 72.A OH no hydrogen 2.581 N/A THR 108.A OG1 PHE 104.A O no hydrogen 2.722 N/A THR 108.A OG1 VAL 105.A O no hydrogen 3.275 N/A LEU 109.A N VAL 105.A O no hydrogen 2.711 N/A ARG 111.A N THR 108.A O no hydrogen 2.927 N/A GLY 112.A N LEU 109.A O no hydrogen 2.796 N/A VAL 113.A N ALA 106.A O no hydrogen 2.784 N/A HIS 114.A N THR 88.A O no hydrogen 2.913 N/A HIS 114.A NE2 ASN 87.A OD1 no hydrogen 3.016 N/A ILE 116.A N ILE 90.A O no hydrogen 2.678 N/A GLN 117.A N ALA 152.A O no hydrogen 2.926 N/A VAL 118.A N ALA 92.A O no hydrogen 2.725 N/A THR 120.A N GLY 94.A O no hydrogen 2.948 N/A ALA 124.A N THR 121.A OG1 no hydrogen 2.921 N/A HIS 125.A N ILE 122.A O no hydrogen 2.968 N/A HIS 125.A ND1 ILE 122.A O no hydrogen 2.945 N/A HIS 125.A NE2 HIS 178.A ND1 no hydrogen 3.012 N/A ASP 126.A N LEU 123.A O no hydrogen 3.146 N/A SER 127.A N LEU 123.A O no hydrogen 3.454 N/A SER 128.A N ALA 124.A O no hydrogen 3.145 N/A SER 128.A OG ALA 124.A O no hydrogen 2.472 N/A VAL 129.A N ASP 126.A O no hydrogen 2.942 N/A GLY 130.A N TYR 12.A OH no hydrogen 3.197 N/A LYS 132.A NZ GLU 227.A OE2 no hydrogen 3.467 N/A VAL 133.A N ALA 146.A O no hydrogen 3.099 N/A GLY 134.A N ASP 100.A O no hydrogen 3.189 N/A ILE 135.A N ILE 144.A O no hydrogen 2.719 N/A ASN 136.A N LYS 67.A O no hydrogen 2.923 N/A ASN 136.A ND2 GLU 64.A OE1 no hydrogen 3.081 N/A ASN 136.A ND2 LYS 67.A O no hydrogen 3.619 N/A SER 137.A N GLY 140.A O no hydrogen 3.361 N/A GLN 139.A N SER 137.A OG no hydrogen 2.958 N/A GLY 140.A N SER 137.A O no hydrogen 2.938 N/A LYS 141.A NZ GLU 245.A OE1 no hydrogen 2.645 N/A LYS 141.A NZ GLU 245.A OE2 no hydrogen 3.475 N/A ASN 142.A N ASN 136.A OD1 no hydrogen 2.946 N/A ALA 146.A N VAL 133.A O no hydrogen 2.935 N/A TYR 148.A N GLY 131.A O no hydrogen 2.767 N/A TYR 148.A OH VAL 113.A O no hydrogen 2.385 N/A ARG 149.A NE GLU 225.A OE1 no hydrogen 2.819 N/A ARG 149.A NH1 SER 9.A O no hydrogen 2.987 N/A ARG 149.A NH1 ASN 10.A O no hydrogen 3.018 N/A ARG 149.A NH2 GLU 225.A OE1 no hydrogen 3.437 N/A ARG 149.A NH2 GLU 225.A OE2 no hydrogen 3.383 N/A THR 151.A N PHE 115.A O no hydrogen 2.535 N/A ALA 152.A N PHE 115.A O no hydrogen 3.424 N/A VAL 153.A N PRO 13.A O no hydrogen 2.914 N/A ILE 154.A N GLN 117.A O no hydrogen 2.664 N/A TYR 155.A N TYR 15.A O no hydrogen 2.670 N/A TYR 155.A OH THR 121.A O no hydrogen 2.582 N/A LEU 157.A N GLU 17.A O no hydrogen 2.893 N/A ASP 158.A N ASP 156.A OD2 no hydrogen 2.702 N/A PHE 159.A N ASP 156.A O no hydrogen 3.039 N/A LEU 160.A N LEU 157.A O no hydrogen 3.384 N/A THR 162.A OG1 PHE 159.A O no hydrogen 3.172 N/A LEU 163.A N LEU 160.A O no hydrogen 2.965 N/A GLN 167.A N PRO 164.A O no hydrogen 3.211 N/A ILE 168.A N PRO 164.A O no hydrogen 3.195 N/A LEU 169.A N PHE 165.A O no hydrogen 2.710 N/A SER 170.A N LYS 166.A O no hydrogen 2.952 N/A GLY 171.A N GLN 167.A O no hydrogen 2.825 N/A TYR 172.A N ILE 168.A O no hydrogen 2.810 N/A TYR 172.A OH TYR 283.A OH no hydrogen 2.772 N/A GLU 174.A N GLY 171.A O no hydrogen 3.080 N/A VAL 175.A N GLY 171.A O no hydrogen 3.442 N/A TYR 176.A N TYR 172.A O no hydrogen 2.767 N/A TYR 176.A OH GLU 191.A OE1 no hydrogen 2.942 N/A LYS 177.A N ALA 173.A O no hydrogen 2.959 N/A LYS 177.A NZ GLU 174.A OE2 no hydrogen 3.302 N/A LYS 177.A NZ LEU 234.A O no hydrogen 2.931 N/A HIS 178.A N GLU 174.A O no hydrogen 3.219 N/A HIS 178.A ND1 HIS 125.A NE2 no hydrogen 3.012 N/A LEU 180.A N TYR 176.A O no hydrogen 2.892 N/A LEU 181.A N LYS 177.A O no hydrogen 3.058 N/A ASN 182.A N ALA 179.A O no hydrogen 2.841 N/A ASN 182.A ND2 THR 216.A OG1 no hydrogen 3.051 N/A GLY 183.A N LEU 180.A O no hydrogen 3.062 N/A THR 187.A OG1 ALA 179.A O no hydrogen 2.971 N/A THR 187.A OG1 GLY 183.A O no hydrogen 3.211 N/A ILE 190.A N ALA 186.A O no hydrogen 3.319 N/A GLU 191.A N THR 187.A O no hydrogen 2.891 N/A GLN 192.A N GLN 188.A O no hydrogen 2.955 N/A GLN 192.A N ASP 189.A O no hydrogen 3.180 N/A GLN 192.A NE2 GLN 188.A O no hydrogen 2.995 N/A HIS 193.A N ILE 190.A O no hydrogen 3.146 N/A HIS 193.A NE2 ASN 204.A O no hydrogen 2.722 N/A PHE 194.A N ILE 190.A O no hydrogen 2.921 N/A ARG 197.A NH2 GLN 201.A OE1 no hydrogen 3.412 N/A ILE 199.A N ASP 196.A OD1 no hydrogen 2.819 N/A LEU 200.A N ASP 196.A O no hydrogen 3.210 N/A GLN 201.A N ARG 197.A O no hydrogen 2.758 N/A SER 202.A N GLU 198.A O no hydrogen 2.957 N/A SER 202.A OG ILE 199.A O no hydrogen 2.951 N/A LEU 203.A N LEU 200.A O no hydrogen 2.636 N/A ASN 204.A N SER 202.A OG no hydrogen 3.326 N/A MET 206.A N LEU 203.A O no hydrogen 3.233 N/A ILE 210.A N MET 206.A O no hydrogen 2.853 N/A ILE 210.A N ASP 207.A O no hydrogen 3.139 N/A ALA 211.A N ASP 207.A O no hydrogen 3.141 N/A LYS 212.A N LYS 208.A O no hydrogen 3.239 N/A GLY 213.A N TYR 209.A O no hydrogen 3.125 N/A ILE 214.A N ILE 210.A O no hydrogen 3.011 N/A GLU 215.A N ALA 211.A O no hydrogen 2.991 N/A THR 216.A N LYS 212.A O no hydrogen 3.165 N/A THR 216.A OG1 LYS 212.A O no hydrogen 2.549 N/A LYS 217.A N GLY 213.A O no hydrogen 3.119 N/A LYS 217.A NZ ASP 126.A O no hydrogen 2.749 N/A LYS 217.A NZ ASP 126.A OD1 no hydrogen 2.714 N/A LYS 217.A NZ VAL 129.A O no hydrogen 2.660 N/A LEU 218.A N ILE 214.A O no hydrogen 2.760 N/A ASP 219.A N THR 216.A O no hydrogen 3.339 N/A VAL 221.A N LYS 217.A O no hydrogen 2.889 N/A VAL 222.A N LEU 218.A O no hydrogen 3.247 N/A ALA 223.A N ASP 219.A O no hydrogen 3.051 N/A ASP 224.A N ILE 220.A O no hydrogen 2.742 N/A GLU 227.A N ASP 224.A O no hydrogen 3.433 N/A GLN 228.A N ASP 224.A OD1 no hydrogen 3.042 N/A GLY 229.A N ASP 224.A OD2 no hydrogen 2.598 N/A ARG 231.A N ASP 224.A OD2 no hydrogen 3.140 N/A ARG 231.A NH1 GLY 130.A O no hydrogen 2.904 N/A ARG 231.A NH2 GLY 130.A O no hydrogen 3.097 N/A LYS 232.A N GLY 229.A O no hydrogen 3.157 N/A PHE 233.A N VAL 230.A O no hydrogen 2.885 N/A LEU 234.A N ARG 231.A O no hydrogen 3.352 N/A ASN 235.A N LYS 232.A O no hydrogen 3.074 N/A LEU 236.A N PHE 233.A O no hydrogen 3.044 N/A HIS 238.A N ASN 235.A O no hydrogen 2.918 N/A HIS 238.A NE2 GLU 174.A OE1 no hydrogen 3.296 N/A PHE 240.A N THR 239.A OG1 no hydrogen 2.686 N/A HIS 242.A N HIS 238.A O no hydrogen 2.985 N/A VAL 244.A N PHE 240.A O no hydrogen 2.956 N/A GLU 245.A N GLY 241.A O no hydrogen 3.124 N/A TYR 246.A OH SER 137.A O no hydrogen 3.341 N/A TYR 247.A N GLU 245.A O no hydrogen 2.696 N/A HIS 248.A N VAL 244.A O no hydrogen 3.229 N/A HIS 248.A N GLU 245.A O no hydrogen 3.348 N/A LYS 249.A N GLU 245.A O no hydrogen 2.988 N/A HIS 252.A ND1 GLU 245.A OE1 no hydrogen 2.924 N/A GLY 253.A N SER 170.A OG no hydrogen 2.947 N/A ALA 255.A N PRO 251.A O no hydrogen 3.119 N/A VAL 256.A N HIS 252.A O no hydrogen 3.015 N/A VAL 256.A N GLY 253.A O no hydrogen 2.956 N/A MET 257.A N GLY 253.A O no hydrogen 3.075 N/A MET 257.A N HIS 254.A O no hydrogen 3.244 N/A VAL 258.A N HIS 254.A O no hydrogen 3.282 N/A GLY 259.A N ALA 255.A O no hydrogen 3.065 N/A ILE 260.A N VAL 256.A O no hydrogen 2.982 N/A ILE 260.A N MET 257.A O no hydrogen 3.073 N/A ILE 261.A N MET 257.A O no hydrogen 3.017 N/A TYR 262.A N VAL 258.A O no hydrogen 2.912 N/A GLN 263.A N GLY 259.A O no hydrogen 2.841 N/A GLN 263.A NE2 ILE 260.A O no hydrogen 2.705 N/A PHE 264.A N ILE 260.A O no hydrogen 3.201 N/A ILE 265.A N ILE 261.A O no hydrogen 3.135 N/A VAL 266.A N TYR 262.A O no hydrogen 3.054 N/A ALA 267.A N GLN 263.A O no hydrogen 2.962 N/A ASN 268.A N PHE 264.A O no hydrogen 3.058 N/A ASN 268.A N ILE 265.A O no hydrogen 3.033 N/A ASN 268.A ND2 HIS 275.A O no hydrogen 3.584 N/A ALA 269.A N ILE 265.A O no hydrogen 2.920 N/A PHE 271.A N ALA 267.A O no hydrogen 2.579 N/A ASP 272.A N ASN 268.A O no hydrogen 2.916 N/A SER 273.A OG ALA 267.A O no hydrogen 3.268 N/A SER 273.A OG ARG 312.A O no hydrogen 3.032 N/A LYS 274.A NZ ASP 272.A OD1 no hydrogen 3.265 N/A HIS 275.A N ASN 268.A OD1 no hydrogen 2.798 N/A HIS 275.A NE2 MET 311.A O no hydrogen 3.049 N/A ILE 277.A N HIS 275.A O no hydrogen 3.008 N/A HIS 279.A N ASP 276.A O no hydrogen 2.864 N/A HIS 279.A N ASP 276.A OD1 no hydrogen 3.188 N/A HIS 279.A NE2 GLU 191.A OE1 no hydrogen 3.338 N/A TYR 280.A N ASP 276.A O no hydrogen 3.397 N/A ILE 281.A N ILE 277.A O no hydrogen 3.053 N/A GLN 282.A N SER 278.A O no hydrogen 3.303 N/A TYR 283.A N HIS 279.A O no hydrogen 3.196 N/A TYR 283.A OH TYR 172.A OH no hydrogen 2.772 N/A TYR 283.A OH PHE 194.A O no hydrogen 2.707 N/A LEU 284.A N TYR 280.A O no hydrogen 3.168 N/A ILE 285.A N ILE 281.A O no hydrogen 3.228 N/A GLN 286.A N GLN 282.A O no hydrogen 2.781 N/A GLN 286.A NE2 LYS 195.A O no hydrogen 3.053 N/A LEU 287.A N TYR 283.A O no hydrogen 3.000 N/A GLY 288.A N LEU 284.A O no hydrogen 3.254 N/A GLY 288.A N ILE 285.A O no hydrogen 3.294 N/A TYR 289.A N LEU 284.A O no hydrogen 2.926 N/A TYR 289.A OH LEU 169.A O no hydrogen 2.378 N/A LEU 291.A N TYR 289.A O no hydrogen 2.847 N/A ASP 292.A N PRO 290.A O no hydrogen 1.997 N/A SER 297.A OG TYR 294.A O no hydrogen 2.683 N/A ASP 298.A N MET 295.A O no hydrogen 3.487 N/A LYS 299.A NZ ASN 142.A O no hydrogen 2.880 N/A LYS 300.A NZ ASN 235.A OD1 no hydrogen 3.048 N/A LYS 300.A NZ ASP 298.A OD2 no hydrogen 2.525 N/A ASN 301.A ND2 MET 295.A O no hydrogen 3.263 N/A GLN 304.A N ASP 302.A O no hydrogen 2.551 N/A GLY 305.A N ASP 302.A O no hydrogen 3.205 N/A GLN 307.A NE2 VAL 306.A O no hydrogen 3.695 N/A MET 308.A N GLN 320.A O no hydrogen 3.275 N/A MET 311.A N GLN 263.A OE1 no hydrogen 2.891 N/A ARG 312.A N ASP 316.A O no hydrogen 3.045 N/A ARG 312.A NH1 ASP 316.A OD2 no hydrogen 2.810 N/A VAL 318.A N LEU 310.A O no hydrogen 2.828 N/A GLN 320.A N MET 308.A O no hydrogen 2.999 N/A THR 326.A N ASP 323.A OD2 no hydrogen 2.985 N/A THR 326.A OG1 ASP 323.A OD2 no hydrogen 2.485 N/A LEU 327.A N ASP 323.A O no hydrogen 3.303 N/A GLN 328.A N GLN 324.A O no hydrogen 2.562 N/A HIS 329.A N LEU 325.A O no hydrogen 2.773 N/A ALA 330.A N THR 326.A O no hydrogen 3.147 N/A CYS 331.A N LEU 327.A O no hydrogen 2.943 N/A CYS 331.A SG CYS 331.A O no hydrogen 2.786 N/A GLU 332.A N HIS 329.A O no hydrogen 3.271 N/A GLN 333.A N HIS 329.A O no hydrogen 2.765 N/A LEU 334.A N ALA 330.A O no hydrogen 2.975 N/A THR 336.A N GLN 333.A O no hydrogen 3.309 N/A THR 336.A OG1 GLN 333.A O no hydrogen 2.930 N/A TYR 337.A N LEU 334.A O no hydrogen 3.478 N/A