Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2gej_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N HIS 33.A ND1 no hydrogen 3.563 N/A ARG 2.A N ASP 77.A OD2 no hydrogen 2.745 N/A ARG 2.A NE GLY 74.A O no hydrogen 2.874 N/A ARG 2.A NH1 GLU 34.A OE1 no hydrogen 3.318 N/A ARG 2.A NH2 GLY 74.A O no hydrogen 2.785 N/A ILE 3.A N GLU 34.A O no hydrogen 2.642 N/A GLY 4.A N VAL 78.A O no hydrogen 2.933 N/A MET 5.A N SER 36.A O no hydrogen 2.623 N/A VAL 6.A N HIS 80.A O no hydrogen 2.816 N/A CYS 7.A N LEU 38.A O no hydrogen 2.740 N/A CYS 7.A SG TYR 9.A O no hydrogen 3.354 N/A SER 10.A OG ALA 41.A O no hydrogen 3.003 N/A SER 10.A OG SER 42.A OG no hydrogen 3.372 N/A PHE 11.A N SER 42.A OG no hydrogen 2.816 N/A ASP 12.A N SER 10.A OG no hydrogen 3.182 N/A GLN 18.A N GLN 18.A OE1 no hydrogen 2.832 N/A GLN 18.A NE2 SER 10.A O no hydrogen 2.968 N/A SER 19.A N GLY 15.A O no hydrogen 3.013 N/A HIS 20.A N GLY 16.A O no hydrogen 3.070 N/A VAL 21.A N VAL 17.A O no hydrogen 2.958 N/A LEU 22.A N GLN 18.A O no hydrogen 3.002 N/A GLN 23.A N SER 19.A O no hydrogen 3.026 N/A GLN 23.A NE2 SER 19.A O no hydrogen 3.213 N/A LEU 24.A N HIS 20.A O no hydrogen 2.716 N/A ALA 25.A N VAL 21.A O no hydrogen 2.853 N/A GLU 26.A N LEU 22.A O no hydrogen 3.238 N/A VAL 27.A N GLN 23.A O no hydrogen 3.163 N/A LEU 28.A N LEU 24.A O no hydrogen 3.026 N/A ARG 29.A N ALA 25.A O no hydrogen 2.933 N/A ASP 30.A N GLU 26.A O no hydrogen 2.762 N/A ALA 31.A N VAL 27.A O no hydrogen 3.093 N/A ALA 31.A N LEU 28.A O no hydrogen 3.120 N/A GLY 32.A N ARG 29.A O no hydrogen 2.850 N/A HIS 33.A N LEU 28.A O no hydrogen 3.116 N/A GLU 34.A N MET 1.A O no hydrogen 2.807 N/A SER 36.A N ILE 3.A O no hydrogen 2.826 N/A VAL 37.A N TYR 50.A O no hydrogen 2.886 N/A LEU 38.A N MET 5.A O no hydrogen 2.696 N/A ALA 39.A N VAL 52.A O no hydrogen 3.270 N/A ALA 41.A N GLY 55.A O no hydrogen 2.976 N/A SER 42.A OG SER 10.A OG no hydrogen 3.372 N/A SER 42.A OG PRO 40.A O no hydrogen 3.173 N/A HIS 44.A N ASP 12.A OD1 no hydrogen 3.108 N/A LYS 46.A NZ LYS 46.A O no hydrogen 3.269 N/A VAL 51.A N PRO 48.A O no hydrogen 3.147 N/A VAL 52.A N VAL 37.A O no hydrogen 2.749 N/A GLY 54.A N ALA 39.A O no hydrogen 2.730 N/A GLY 55.A N SER 53.A OG no hydrogen 2.991 N/A THR 63.A N GLY 60.A O no hydrogen 2.920 N/A THR 63.A OG1 GLY 54.A O no hydrogen 2.695 N/A HIS 64.A N GLY 60.A O no hydrogen 3.462 N/A ARG 65.A N PRO 61.A O no hydrogen 2.978 N/A LYS 66.A N ALA 62.A O no hydrogen 2.801 N/A VAL 67.A N THR 63.A O no hydrogen 2.844 N/A LYS 68.A N HIS 64.A O no hydrogen 3.291 N/A LYS 69.A N ARG 65.A O no hydrogen 2.808 N/A TRP 70.A N LYS 66.A O no hydrogen 2.918 N/A TRP 70.A NE1 SER 36.A OG no hydrogen 2.812 N/A ILE 71.A N VAL 67.A O no hydrogen 3.072 N/A ALA 72.A N LYS 68.A O no hydrogen 3.010 N/A GLU 73.A N LYS 69.A O no hydrogen 3.079 N/A GLY 74.A N ILE 71.A O no hydrogen 3.140 N/A ASP 77.A N ARG 2.A O no hydrogen 2.809 N/A VAL 78.A N ARG 2.A O no hydrogen 3.425 N/A LEU 79.A N PRO 100.A O no hydrogen 2.969 N/A HIS 80.A N GLY 4.A O no hydrogen 2.774 N/A HIS 80.A ND1 TYR 348.A OH no hydrogen 2.601 N/A HIS 80.A NE2 THR 104.A OG1 no hydrogen 2.536 N/A ILE 81.A N VAL 102.A O no hydrogen 2.714 N/A HIS 82.A N VAL 6.A O no hydrogen 3.152 N/A HIS 82.A ND1 HIS 106.A NE2 no hydrogen 2.892 N/A GLU 83.A N THR 104.A O no hydrogen 2.758 N/A ASN 85.A N GLU 83.A O no hydrogen 2.845 N/A SER 88.A OG ASN 85.A O no hydrogen 2.622 N/A SER 90.A OG HIS 82.A O no hydrogen 2.647 N/A MET 91.A N SER 88.A OG no hydrogen 3.167 N/A LEU 92.A N SER 88.A O no hydrogen 2.981 N/A ALA 93.A N LEU 89.A O no hydrogen 2.881 N/A LEU 94.A N SER 90.A O no hydrogen 2.951 N/A GLN 95.A N MET 91.A O no hydrogen 2.870 N/A ALA 96.A N LEU 92.A O no hydrogen 3.024 N/A ALA 96.A N ALA 93.A O no hydrogen 3.009 N/A ALA 97.A N ALA 93.A O no hydrogen 2.976 N/A GLU 98.A N GLN 359.A O no hydrogen 2.760 N/A VAL 102.A N LEU 79.A O no hydrogen 2.731 N/A ALA 103.A N GLY 131.A O no hydrogen 2.869 N/A THR 104.A N ILE 81.A O no hydrogen 2.824 N/A THR 104.A OG1 HIS 80.A NE2 no hydrogen 2.536 N/A PHE 105.A N ILE 133.A O no hydrogen 2.870 N/A HIS 106.A ND1 ASN 156.A OD1 no hydrogen 3.246 N/A HIS 106.A NE2 HIS 82.A ND1 no hydrogen 2.892 N/A THR 107.A N GLU 83.A OE1 no hydrogen 3.200 N/A THR 107.A N GLU 83.A OE2 no hydrogen 3.107 N/A THR 107.A OG1 GLU 83.A OE1 no hydrogen 2.780 N/A SER 108.A N SER 263.A OG no hydrogen 2.966 N/A LEU 113.A N THR 110.A OG1 no hydrogen 3.410 N/A THR 114.A N THR 110.A O no hydrogen 3.196 N/A THR 114.A OG1 THR 110.A O no hydrogen 3.173 N/A LEU 115.A N LYS 111.A O no hydrogen 2.872 N/A SER 116.A N SER 112.A O no hydrogen 3.139 N/A SER 116.A OG SER 112.A O no hydrogen 3.094 N/A SER 116.A OG LEU 113.A O no hydrogen 3.439 N/A VAL 117.A N LEU 113.A O no hydrogen 3.203 N/A PHE 118.A N THR 114.A O no hydrogen 3.029 N/A GLN 119.A N LEU 115.A O no hydrogen 2.613 N/A GLN 119.A NE2 ALA 146.A O no hydrogen 3.113 N/A ARG 123.A N GLY 120.A O no hydrogen 3.322 N/A HIS 126.A N LEU 122.A O no hydrogen 2.983 N/A GLU 127.A N ARG 123.A O no hydrogen 2.721 N/A LYS 128.A N TYR 125.A O no hydrogen 3.251 N/A LYS 128.A NZ LEU 94.A O no hydrogen 2.562 N/A LYS 128.A NZ ALA 97.A O no hydrogen 2.990 N/A ILE 129.A N HIS 126.A O no hydrogen 2.905 N/A ILE 130.A N ILE 101.A O no hydrogen 2.907 N/A GLY 131.A N ILE 101.A O no hydrogen 3.051 N/A ARG 132.A NH2 HIS 126.A O no hydrogen 2.918 N/A ILE 133.A N ALA 103.A O no hydrogen 2.759 N/A ALA 134.A N VAL 152.A O no hydrogen 2.712 N/A ALA 139.A N SER 136.A OG no hydrogen 3.379 N/A ARG 140.A N SER 136.A O no hydrogen 3.267 N/A ARG 140.A NE ALA 151.A O no hydrogen 3.350 N/A ARG 141.A N ASP 137.A O no hydrogen 3.019 N/A ARG 141.A NE ASP 137.A OD2 no hydrogen 2.845 N/A ARG 141.A NH2 ASP 137.A OD2 no hydrogen 3.272 N/A TRP 142.A N LEU 138.A O no hydrogen 2.833 N/A GLN 143.A N ALA 139.A O no hydrogen 3.100 N/A MET 144.A N ARG 140.A O no hydrogen 3.068 N/A GLU 145.A N ARG 141.A O no hydrogen 3.025 N/A ALA 146.A N TRP 142.A O no hydrogen 2.928 N/A LEU 147.A N GLN 143.A O no hydrogen 3.089 N/A GLY 148.A N MET 144.A O no hydrogen 3.009 N/A VAL 152.A N ARG 132.A O no hydrogen 3.035 N/A ILE 154.A N ALA 134.A O no hydrogen 2.819 N/A VAL 158.A N TYR 335.A O no hydrogen 2.853 N/A VAL 160.A N ASP 336.A OD1 no hydrogen 2.995 N/A ALA 161.A N ASP 159.A OD1 no hydrogen 3.199 N/A SER 162.A N ASP 159.A O no hydrogen 3.162 N/A SER 162.A OG ASP 159.A O no hydrogen 3.056 N/A ALA 164.A N VAL 160.A O no hydrogen 3.170 N/A ASP 165.A N ALA 161.A O no hydrogen 3.020 N/A ALA 166.A N PHE 163.A O no hydrogen 2.801 N/A TYR 172.A N LEU 169.A O no hydrogen 3.059 N/A TYR 172.A OH GLU 210.A OE1 no hydrogen 3.268 N/A TYR 172.A OH GLU 210.A OE2 no hydrogen 2.400 N/A ARG 174.A NH1 ASP 208.A O no hydrogen 2.841 N/A ARG 174.A NH2 ASP 208.A O no hydrogen 3.196 N/A ARG 174.A NH2 ASP 208.A OD1 no hydrogen 3.045 N/A ARG 177.A N ARG 174.A O no hydrogen 3.116 N/A THR 178.A N ASP 252.A OD2 no hydrogen 2.734 N/A VAL 179.A N GLU 210.A O no hydrogen 2.785 N/A LEU 180.A N VAL 253.A O no hydrogen 2.857 N/A PHE 181.A N LEU 212.A O no hydrogen 2.930 N/A GLY 183.A N VAL 214.A O no hydrogen 2.864 N/A ARG 184.A NE GLU 187.A OE1 no hydrogen 3.128 N/A ARG 184.A NE GLU 187.A OE2 no hydrogen 2.808 N/A ARG 184.A NH2 GLU 187.A OE1 no hydrogen 3.309 N/A GLU 187.A N ARG 184.A O no hydrogen 3.103 N/A LYS 190.A N GLU 187.A O no hydrogen 3.121 N/A LYS 190.A NZ GLU 262.A OE2 no hydrogen 2.443 N/A GLY 191.A N PRO 188.A O no hydrogen 2.909 N/A VAL 194.A N GLY 191.A O no hydrogen 3.023 N/A LEU 195.A N GLY 191.A O no hydrogen 3.490 N/A LEU 196.A N MET 192.A O no hydrogen 2.821 N/A ALA 197.A N ALA 193.A O no hydrogen 2.929 N/A ALA 198.A N VAL 194.A O no hydrogen 2.928 N/A LEU 199.A N LEU 195.A O no hydrogen 3.097 N/A LEU 199.A N LEU 196.A O no hydrogen 3.248 N/A LEU 202.A N ALA 198.A O no hydrogen 2.960 N/A VAL 203.A N LEU 199.A O no hydrogen 2.733 N/A ALA 204.A N PRO 200.A O no hydrogen 3.094 N/A ARG 205.A N LEU 202.A O no hydrogen 2.804 N/A PHE 206.A N LEU 202.A O no hydrogen 2.963 N/A VAL 209.A N PHE 206.A O no hydrogen 2.675 N/A GLU 210.A N ARG 177.A O no hydrogen 3.242 N/A ILE 211.A N HIS 232.A O no hydrogen 2.682 N/A LEU 212.A N VAL 179.A O no hydrogen 2.731 N/A ILE 213.A N ARG 234.A O no hydrogen 2.872 N/A VAL 214.A N PHE 181.A O no hydrogen 2.832 N/A GLY 215.A N GLY 237.A O no hydrogen 3.033 N/A ASP 218.A N ASP 186.A OD2 no hydrogen 3.349 N/A GLU 221.A N ASP 218.A OD1 no hydrogen 3.418 N/A LEU 222.A N GLU 219.A O no hydrogen 3.230 N/A ARG 223.A N GLU 219.A O no hydrogen 2.885 N/A ARG 223.A NH1 GLU 219.A OE1 no hydrogen 3.037 N/A GLU 224.A N ASP 220.A O no hydrogen 2.978 N/A GLN 225.A NE2 GLU 221.A O no hydrogen 3.281 N/A ALA 226.A N LEU 222.A O no hydrogen 2.784 N/A GLY 227.A N GLU 224.A O no hydrogen 3.246 N/A LEU 229.A N ALA 226.A O no hydrogen 2.749 N/A ALA 230.A N GLY 227.A O no hydrogen 3.213 N/A HIS 232.A N LEU 229.A O no hydrogen 3.027 N/A HIS 232.A ND1 VAL 209.A O no hydrogen 2.585 N/A LEU 233.A N ALA 230.A O no hydrogen 3.356 N/A ARG 234.A N ILE 211.A O no hydrogen 2.906 N/A ARG 234.A NH1 TYR 172.A OH no hydrogen 3.005 N/A THR 243.A N ASP 240.A OD1 no hydrogen 2.701 N/A THR 243.A OG1 ASP 240.A OD1 no hydrogen 2.951 N/A LYS 244.A N ASP 240.A O no hydrogen 3.021 N/A LYS 244.A NZ ASP 241.A OD1 no hydrogen 2.660 N/A LYS 244.A NZ GLU 270.A OE2 no hydrogen 3.504 N/A ALA 245.A N ASP 241.A O no hydrogen 2.987 N/A SER 246.A N ALA 242.A O no hydrogen 2.974 N/A SER 246.A OG PRO 167.A O no hydrogen 2.444 N/A ALA 247.A N THR 243.A O no hydrogen 2.691 N/A MET 248.A N LYS 244.A O no hydrogen 2.871 N/A ARG 249.A N ALA 245.A O no hydrogen 2.999 N/A ARG 249.A NH1 ALA 166.A O no hydrogen 2.696 N/A SER 250.A N SER 246.A O no hydrogen 3.008 N/A SER 250.A OG SER 246.A O no hydrogen 2.739 N/A SER 250.A OG ALA 247.A O no hydrogen 3.287 N/A ALA 251.A N MET 248.A O no hydrogen 3.255 N/A ASP 252.A N THR 178.A O no hydrogen 2.933 N/A VAL 253.A N THR 178.A O no hydrogen 3.400 N/A TYR 254.A N ALA 277.A O no hydrogen 2.917 N/A CYS 255.A N LEU 180.A O no hydrogen 2.823 N/A ALA 256.A N VAL 279.A O no hydrogen 2.937 N/A LEU 259.A N ARG 189.A O no hydrogen 2.598 N/A SER 263.A OG SER 108.A O no hydrogen 3.062 N/A LEU 268.A N GLY 265.A O no hydrogen 2.712 N/A VAL 269.A N GLY 265.A O no hydrogen 3.258 N/A GLU 270.A N ILE 266.A O no hydrogen 2.847 N/A ALA 271.A N VAL 267.A O no hydrogen 2.928 N/A MET 272.A N LEU 268.A O no hydrogen 2.963 N/A ALA 273.A N VAL 269.A O no hydrogen 2.962 N/A ALA 274.A N GLU 270.A O no hydrogen 3.154 N/A GLY 275.A N MET 272.A O no hydrogen 2.917 N/A THR 276.A N ALA 271.A O no hydrogen 3.013 N/A THR 276.A OG1 MET 248.A O no hydrogen 2.624 N/A VAL 279.A N TYR 254.A O no hydrogen 2.907 N/A ALA 280.A N ARG 297.A O no hydrogen 2.833 N/A SER 281.A N ALA 256.A O no hydrogen 2.745 N/A SER 281.A OG HIS 258.A O no hydrogen 2.585 N/A ARG 287.A N LEU 283.A O no hydrogen 3.053 N/A ARG 287.A NE ASP 282.A OD1 no hydrogen 3.066 N/A ARG 287.A NH2 ASP 282.A OD1 no hydrogen 3.206 N/A ARG 287.A NH2 ASP 282.A OD2 no hydrogen 3.048 N/A ARG 288.A N ASP 284.A O no hydrogen 3.284 N/A ARG 288.A NH2 SER 263.A O no hydrogen 3.377 N/A VAL 289.A N ALA 285.A O no hydrogen 3.346 N/A LEU 290.A N PHE 286.A O no hydrogen 2.943 N/A ALA 291.A N ARG 288.A O no hydrogen 3.164 N/A ASP 292.A N ARG 287.A O no hydrogen 3.033 N/A GLY 293.A N LEU 290.A O no hydrogen 3.203 N/A ASP 294.A N ALA 291.A O no hydrogen 3.084 N/A ALA 295.A N LEU 290.A O no hydrogen 2.839 N/A ARG 297.A N VAL 278.A O no hydrogen 3.099 N/A VAL 299.A N ALA 280.A O no hydrogen 3.049 N/A MET 307.A N ASP 303.A O no hydrogen 3.030 N/A ALA 308.A N ALA 304.A O no hydrogen 2.952 N/A ALA 309.A N ASP 305.A O no hydrogen 3.395 N/A ALA 310.A N GLY 306.A O no hydrogen 2.856 N/A LEU 311.A N MET 307.A O no hydrogen 2.916 N/A ILE 312.A N ALA 308.A O no hydrogen 2.725 N/A GLY 313.A N ALA 309.A O no hydrogen 2.766 N/A ILE 314.A N ALA 310.A O no hydrogen 3.101 N/A LEU 315.A N LEU 311.A O no hydrogen 2.893 N/A GLU 316.A N ILE 312.A O no hydrogen 3.133 N/A ASP 317.A N GLY 313.A O no hydrogen 3.227 N/A LEU 320.A N ASP 317.A OD1 no hydrogen 2.957 N/A ARG 321.A N ASP 317.A O no hydrogen 3.453 N/A ARG 321.A NH1 ILE 314.A O no hydrogen 3.555 N/A ALA 322.A N ASP 318.A O no hydrogen 3.005 N/A GLY 323.A N GLN 319.A O no hydrogen 3.020 N/A TYR 324.A N LEU 320.A O no hydrogen 2.893 N/A VAL 325.A N ARG 321.A O no hydrogen 2.756 N/A ALA 326.A N ALA 322.A O no hydrogen 2.720 N/A ARG 327.A N GLY 323.A O no hydrogen 2.818 N/A ARG 327.A NH1 ASP 294.A O no hydrogen 2.332 N/A ALA 328.A N TYR 324.A O no hydrogen 2.743 N/A SER 329.A N VAL 325.A O no hydrogen 2.986 N/A SER 329.A OG VAL 325.A O no hydrogen 2.700 N/A GLU 330.A N ALA 326.A O no hydrogen 3.086 N/A GLU 330.A N ARG 327.A O no hydrogen 3.143 N/A ARG 331.A N ARG 327.A O no hydrogen 3.106 N/A ARG 331.A NE VAL 289.A O no hydrogen 3.279 N/A ARG 331.A NH2 TYR 335.A OH no hydrogen 3.362 N/A VAL 332.A N ALA 328.A O no hydrogen 2.949 N/A ARG 334.A N ARG 331.A O no hydrogen 3.188 N/A TYR 335.A N VAL 332.A O no hydrogen 3.035 N/A ASP 336.A N HIS 333.A O no hydrogen 3.143 N/A TRP 337.A N VAL 158.A O no hydrogen 2.748 N/A TRP 337.A NE1 GLN 23.A OE1 no hydrogen 3.309 N/A SER 338.A N ASP 336.A OD2 no hydrogen 2.832 N/A SER 338.A OG ASP 336.A OD2 no hydrogen 2.707 N/A VAL 339.A N ASP 336.A O no hydrogen 3.135 N/A VAL 340.A N ASP 336.A O no hydrogen 3.313 N/A SER 341.A N TRP 337.A O no hydrogen 2.744 N/A SER 341.A OG TRP 337.A O no hydrogen 2.480 N/A GLN 343.A N VAL 339.A O no hydrogen 3.117 N/A ILE 344.A N VAL 340.A O no hydrogen 3.119 N/A MET 345.A N SER 341.A O no hydrogen 3.065 N/A ARG 346.A N ALA 342.A O no hydrogen 3.036 N/A VAL 347.A N GLN 343.A O no hydrogen 3.334 N/A TYR 348.A N ILE 344.A O no hydrogen 2.759 N/A TYR 348.A OH HIS 80.A ND1 no hydrogen 2.601 N/A GLU 349.A N MET 345.A O no hydrogen 2.789 N/A THR 350.A N ARG 346.A O no hydrogen 2.882 N/A THR 350.A OG1 ARG 346.A O no hydrogen 3.067 N/A VAL 351.A N VAL 347.A O no hydrogen 3.151 N/A SER 352.A OG TYR 348.A O no hydrogen 2.716 N/A ILE 356.A N GLY 353.A O no hydrogen 3.001 N/A LYS 357.A NZ ASP 75.A O no hydrogen 2.774 N/A LYS 357.A NZ ASP 77.A OD1 no hydrogen 2.914 N/A VAL 358.A N PHE 76.A O no hydrogen 2.931 N/A GLN 359.A N GLU 98.A O no hydrogen 2.963 N/A GLN 359.A NE2 LYS 357.A O no hydrogen 3.447 N/A SER 361.A N ALA 96.A O no hydrogen 2.575 N/A