Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ump_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 HIS 5.A ND1 no hydrogen 2.329 N/A HIS 5.A N THR 2.A O no hydrogen 3.026 N/A HIS 7.A N GLY 3.A O no hydrogen 3.245 N/A HIS 7.A ND1 TYR 244.A OH no hydrogen 2.816 N/A GLU 8.A N LEU 4.A O no hydrogen 3.221 N/A LYS 9.A N HIS 5.A O no hydrogen 3.094 N/A ILE 10.A N VAL 6.A O no hydrogen 2.977 N/A LYS 11.A N HIS 7.A O no hydrogen 3.109 N/A LYS 11.A NZ ASP 260.A OD1 no hydrogen 3.021 N/A LYS 11.A NZ ASP 262.A OD1 no hydrogen 3.504 N/A HIS 12.A N GLU 8.A O no hydrogen 3.179 N/A MET 13.A N LYS 9.A O no hydrogen 2.959 N/A VAL 14.A N ILE 10.A O no hydrogen 2.898 N/A LYS 15.A N LYS 11.A O no hydrogen 3.215 N/A ASN 16.A N MET 13.A O no hydrogen 3.389 N/A TYR 17.A OH GLN 354.A OE1 no hydrogen 2.872 N/A THR 19.A OG1 THR 61.A O no hydrogen 2.831 N/A MET 20.A N TYR 17.A O no hydrogen 3.323 N/A ILE 21.A N GLY 18.A O no hydrogen 3.071 N/A THR 22.A N THR 19.A O no hydrogen 3.017 N/A THR 22.A OG1 THR 19.A O no hydrogen 2.702 N/A GLY 23.A N MET 20.A O no hydrogen 3.365 N/A ALA 26.A N TYR 346.A OH no hydrogen 3.285 N/A LEU 29.A N PRO 25.A O no hydrogen 3.370 N/A GLY 30.A N ALA 26.A O no hydrogen 3.027 N/A GLN 31.A N GLU 27.A O no hydrogen 2.879 N/A GLN 31.A NE2 GLU 27.A O no hydrogen 3.575 N/A ASN 32.A N ILE 28.A O no hydrogen 3.008 N/A GLU 33.A N LEU 29.A O no hydrogen 2.836 N/A ALA 34.A N GLY 30.A O no hydrogen 3.074 N/A GLU 35.A N ASN 32.A O no hydrogen 3.144 N/A ILE 36.A N GLU 33.A O no hydrogen 3.079 N/A SER 37.A N GLU 33.A O no hydrogen 3.176 N/A SER 37.A OG GLU 33.A O no hydrogen 2.560 N/A TYR 40.A N SER 37.A O no hydrogen 3.357 N/A LYS 42.A NZ GLU 53.A OE2 no hydrogen 3.224 N/A LYS 43.A NZ GLU 377.A O no hydrogen 3.230 N/A LYS 48.A N ASN 46.A OD1 no hydrogen 3.031 N/A ASN 50.A N ASN 46.A O no hydrogen 3.261 N/A ASN 50.A ND2 LYS 42.A O no hydrogen 3.277 N/A ASN 50.A ND2 MET 44.A O no hydrogen 2.870 N/A ILE 51.A N MET 47.A O no hydrogen 2.896 N/A ALA 52.A N LYS 48.A O no hydrogen 3.118 N/A GLU 53.A N GLU 49.A O no hydrogen 3.212 N/A VAL 55.A N ILE 51.A O no hydrogen 2.913 N/A ARG 56.A N ALA 52.A O no hydrogen 2.883 N/A LYS 57.A N GLU 53.A O no hydrogen 3.283 N/A LYS 57.A N VAL 54.A O no hydrogen 3.290 N/A LYS 57.A NZ GLU 53.A OE1 no hydrogen 2.778 N/A SER 58.A N VAL 55.A O no hydrogen 3.510 N/A SER 58.A OG VAL 55.A O no hydrogen 2.908 N/A GLN 62.A N GLU 59.A O no hydrogen 3.283 N/A SER 66.A N THR 64.A OG1 no hydrogen 3.099 N/A LYS 69.A N SER 66.A O no hydrogen 3.043 N/A LYS 69.A NZ GLU 73.A OE2 no hydrogen 2.826 N/A ALA 70.A N SER 66.A O no hydrogen 3.041 N/A SER 71.A N ALA 67.A O no hydrogen 3.177 N/A SER 71.A OG ALA 67.A O no hydrogen 3.055 N/A SER 71.A OG SER 225.A OG no hydrogen 3.122 N/A ASN 72.A N GLY 68.A O no hydrogen 3.121 N/A GLU 73.A N LYS 69.A O no hydrogen 2.944 N/A VAL 74.A N ALA 70.A O no hydrogen 3.091 N/A CYS 75.A N SER 71.A O no hydrogen 3.239 N/A CYS 75.A SG SER 71.A O no hydrogen 3.201 N/A ASP 76.A N ASN 72.A O no hydrogen 3.055 N/A LEU 78.A N VAL 74.A O no hydrogen 3.225 N/A LEU 79.A N CYS 75.A O no hydrogen 3.021 N/A GLY 80.A N ASP 76.A O no hydrogen 3.009 N/A THR 81.A OG1 ASP 76.A OD2 no hydrogen 3.497 N/A ALA 84.A N GLY 80.A O no hydrogen 2.980 N/A SER 85.A N THR 81.A O no hydrogen 3.170 N/A GLU 86.A N GLU 82.A O no hydrogen 2.932 N/A PHE 87.A N GLY 83.A O no hydrogen 2.884 N/A GLU 88.A N ALA 84.A O no hydrogen 2.983 N/A LYS 89.A N GLU 86.A O no hydrogen 3.267 N/A LYS 89.A NZ GLU 86.A OE1 no hydrogen 2.343 N/A SER 90.A N PHE 87.A O no hydrogen 3.238 N/A SER 90.A OG PHE 87.A O no hydrogen 3.386 N/A SER 91.A OG TYR 92.A O no hydrogen 3.413 N/A GLN 93.A N PHE 321.A O no hydrogen 2.831 N/A GLN 93.A NE2 SER 91.A O no hydrogen 3.213 N/A LEU 95.A N VAL 319.A O no hydrogen 2.916 N/A SER 96.A OG ASP 98.A OD1 no hydrogen 3.560 N/A SER 100.A N ASP 98.A OD1 no hydrogen 3.106 N/A SER 100.A OG ASP 98.A OD1 no hydrogen 2.798 N/A LYS 103.A N GLY 99.A O no hydrogen 3.086 N/A GLY 104.A N SER 100.A O no hydrogen 3.078 N/A SER 105.A N LEU 102.A O no hydrogen 2.923 N/A SER 105.A OG ASN 101.A O no hydrogen 2.346 N/A LEU 111.A N VAL 230.A O no hydrogen 2.857 N/A LEU 112.A N THR 324.A O no hydrogen 2.855 N/A VAL 113.A N ILE 228.A O no hydrogen 3.057 N/A ARG 114.A N LYS 322.A O no hydrogen 3.122 N/A ARG 114.A NH1 ASN 72.A OD1 no hydrogen 2.615 N/A ARG 114.A NH2 ASN 72.A OD1 no hydrogen 3.086 N/A VAL 115.A N PHE 226.A O no hydrogen 2.938 N/A GLU 116.A N LYS 320.A O no hydrogen 3.077 N/A MET 117.A N HIS 224.A O no hydrogen 2.958 N/A ASP 118.A N ARG 318.A O no hydrogen 2.930 N/A ARG 119.A N THR 221.A O no hydrogen 2.584 N/A PHE 120.A N PRO 316.A O no hydrogen 2.912 N/A ASN 121.A N CYS 219.A O no hydrogen 2.709 N/A LYS 125.A NZ ASN 184.A OD1 no hydrogen 2.347 N/A LYS 125.A NZ TYR 185.A O no hydrogen 3.114 N/A TYR 126.A N TYR 185.A O no hydrogen 2.974 N/A TYR 126.A OH TYR 182.A O no hydrogen 2.449 N/A LYS 128.A N GLN 183.A O no hydrogen 2.846 N/A LYS 128.A NZ PHE 174.A O no hydrogen 2.771 N/A LYS 128.A NZ ILE 177.A O no hydrogen 2.978 N/A LYS 130.A N GLU 133.A OE1 no hydrogen 3.011 N/A ARG 131.A NH2 GLN 150.A OE1 no hydrogen 2.550 N/A GLU 133.A N LYS 130.A O no hydrogen 2.886 N/A PHE 134.A N ARG 131.A O no hydrogen 3.485 N/A GLU 137.A N ASN 135.A OD1 no hydrogen 3.093 N/A THR 138.A N ASN 135.A O no hydrogen 3.158 N/A ALA 139.A N ASN 135.A O no hydrogen 3.005 N/A LYS 141.A NZ ASP 155.A O no hydrogen 2.481 N/A ASN 142.A N ASP 155.A O no hydrogen 3.177 N/A ASN 142.A ND2 ASN 121.A O no hydrogen 3.660 N/A LYS 143.A N LEU 154.A O no hydrogen 3.424 N/A LYS 143.A NZ GLN 127.A OE1 no hydrogen 2.816 N/A LYS 143.A NZ GLU 140.A OE2 no hydrogen 3.218 N/A LYS 143.A NZ ASN 184.A OD1 no hydrogen 3.024 N/A ILE 144.A N LYS 125.A O no hydrogen 3.432 N/A TYR 145.A N VAL 152.A O no hydrogen 2.913 N/A TYR 145.A OH GLU 140.A O no hydrogen 2.303 N/A LEU 146.A N GLN 127.A O no hydrogen 3.092 N/A LEU 147.A N GLN 150.A O no hydrogen 2.808 N/A GLN 150.A NE2 ASP 162.A OD1 no hydrogen 2.777 N/A VAL 152.A N TYR 145.A O no hydrogen 3.055 N/A TYR 153.A N ILE 161.A O no hydrogen 2.807 N/A TYR 153.A OH ASN 142.A OD1 no hydrogen 3.246 N/A LEU 154.A N LYS 143.A O no hydrogen 3.256 N/A ASP 155.A N LYS 159.A O no hydrogen 3.099 N/A PHE 157.A N ASP 155.A OD2 no hydrogen 2.612 N/A GLY 158.A N ASP 155.A OD2 no hydrogen 2.850 N/A LYS 159.A N ASP 155.A OD2 no hydrogen 3.081 N/A ILE 161.A N TYR 153.A O no hydrogen 2.796 N/A LEU 163.A N LEU 151.A O no hydrogen 3.221 N/A GLY 164.A N ASP 162.A OD2 no hydrogen 2.698 N/A GLN 165.A NE2 LEU 163.A O no hydrogen 2.945 N/A SER 167.A OG ASP 149.A O no hydrogen 2.998 N/A CYS 170.A N THR 166.A O no hydrogen 2.986 N/A CYS 170.A SG THR 166.A O no hydrogen 3.483 N/A HIS 171.A N SER 167.A O no hydrogen 2.975 N/A ARG 172.A N ASP 168.A O no hydrogen 3.084 N/A ARG 172.A NH1 GLU 205.A OE1 no hydrogen 3.425 N/A ARG 172.A NH2 GLU 205.A OE1 no hydrogen 3.276 N/A ARG 172.A NH2 GLU 205.A OE2 no hydrogen 3.037 N/A LEU 173.A N THR 169.A O no hydrogen 3.158 N/A PHE 174.A N CYS 170.A O no hydrogen 2.858 N/A ASN 175.A N HIS 171.A O no hydrogen 3.219 N/A ASN 175.A ND2 GLU 148.A OE1 no hydrogen 3.439 N/A ASN 175.A ND2 HIS 171.A O no hydrogen 2.450 N/A ILE 177.A N LEU 173.A O no hydrogen 3.430 N/A THR 178.A N GLU 199.A OE2 no hydrogen 3.247 N/A THR 179.A N GLU 199.A OE2 no hydrogen 2.918 N/A THR 179.A OG1 GLU 199.A OE1 no hydrogen 3.427 N/A THR 179.A OG1 GLU 199.A OE2 no hydrogen 2.499 N/A TYR 182.A N THR 179.A O no hydrogen 3.082 N/A GLN 183.A N PRO 180.A O no hydrogen 3.429 N/A TYR 185.A OH ASP 189.A OD2 no hydrogen 2.702 N/A LEU 187.A N GLN 124.A O no hydrogen 3.089 N/A ILE 192.A N ASP 189.A O no hydrogen 3.219 N/A ASP 193.A N GLU 200.A OE2 no hydrogen 3.191 N/A GLU 196.A N ASP 193.A O no hydrogen 3.145 N/A SER 197.A OG GLU 200.A OE1 no hydrogen 3.553 N/A GLU 200.A N SER 197.A OG no hydrogen 3.350 N/A ALA 201.A N SER 197.A O no hydrogen 3.252 N/A ALA 202.A N ALA 198.A O no hydrogen 3.295 N/A MET 203.A N GLU 199.A O no hydrogen 3.201 N/A PHE 204.A N GLU 200.A O no hydrogen 2.880 N/A GLU 205.A N ALA 201.A O no hydrogen 2.884 N/A MET 206.A N ALA 202.A O no hydrogen 2.976 N/A GLY 207.A N MET 203.A O no hydrogen 3.047 N/A GLU 208.A N PHE 204.A O no hydrogen 3.092 N/A ILE 209.A N GLU 205.A O no hydrogen 2.988 N/A VAL 210.A N MET 206.A O no hydrogen 2.940 N/A LYS 211.A N GLY 207.A O no hydrogen 2.814 N/A ALA 212.A N GLU 208.A O no hydrogen 3.281 N/A ALA 212.A N ILE 209.A O no hydrogen 3.255 N/A LYS 213.A N ILE 209.A O no hydrogen 3.157 N/A MET 214.A N VAL 210.A O no hydrogen 2.909 N/A LYS 215.A N ALA 212.A O no hydrogen 3.423 N/A ASN 216.A N LYS 213.A O no hydrogen 3.236 N/A ILE 217.A N MET 214.A O no hydrogen 3.179 N/A CYS 219.A SG ASN 121.A O no hydrogen 3.961 N/A CYS 219.A SG TYR 153.A OH no hydrogen 3.277 N/A THR 221.A N ARG 119.A O no hydrogen 2.934 N/A THR 221.A OG1 ARG 119.A O no hydrogen 3.308 N/A THR 223.A N MET 117.A O no hydrogen 2.808 N/A HIS 224.A N MET 117.A O no hydrogen 3.329 N/A HIS 224.A NE2 GLN 245.A OE1 no hydrogen 3.289 N/A SER 225.A N HIS 224.A ND1 no hydrogen 2.969 N/A SER 225.A OG SER 71.A OG no hydrogen 3.122 N/A PHE 226.A N VAL 115.A O no hydrogen 3.100 N/A THR 227.A N TYR 244.A O no hydrogen 2.785 N/A ILE 228.A N VAL 113.A O no hydrogen 2.866 N/A PHE 229.A N TYR 242.A O no hydrogen 2.803 N/A VAL 230.A N LEU 111.A O no hydrogen 3.032 N/A GLU 232.A N ASN 110.A OD1 no hydrogen 2.475 N/A SER 233.A OG THR 238.A O no hydrogen 3.390 N/A THR 238.A N SER 235.A O no hydrogen 3.032 N/A ARG 239.A NE PRO 231.A O no hydrogen 3.196 N/A ARG 239.A NH1 PRO 107.A O no hydrogen 3.238 N/A ARG 239.A NH2 PRO 107.A O no hydrogen 3.282 N/A ARG 239.A NH2 PRO 231.A O no hydrogen 2.946 N/A TYR 242.A N PHE 229.A O no hydrogen 3.076 N/A TYR 244.A N THR 227.A O no hydrogen 2.353 N/A TYR 244.A OH HIS 7.A ND1 no hydrogen 2.816 N/A GLN 245.A NE2 HIS 251.A NE2 no hydrogen 2.969 N/A GLN 245.A NE2 PHE 297.A O no hydrogen 2.649 N/A TYR 247.A N HIS 251.A O no hydrogen 3.174 N/A TYR 247.A OH TYR 293.A OH no hydrogen 2.589 N/A THR 249.A OG1 TRP 248.A O no hydrogen 2.590 N/A HIS 251.A ND1 THR 252.A O no hydrogen 3.033 N/A THR 252.A OG1 GLN 255.A OE1 no hydrogen 3.059 N/A GLN 254.A NE2 LYS 15.A O no hydrogen 2.929 N/A GLN 255.A N THR 252.A OG1 no hydrogen 3.248 N/A TRP 256.A N THR 252.A O no hydrogen 2.953 N/A TRP 256.A NE1 PRO 243.A O no hydrogen 2.815 N/A PHE 257.A N LEU 253.A O no hydrogen 3.021 N/A SER 258.A N GLN 254.A O no hydrogen 2.919 N/A GLY 259.A N GLN 255.A O no hydrogen 2.963 N/A ASP 260.A N PHE 257.A O no hydrogen 3.004 N/A LYS 261.A NZ SER 298.A O no hydrogen 2.550 N/A GLU 263.A N ASP 260.A O no hydrogen 3.069 N/A LYS 264.A N ASP 260.A O no hydrogen 3.206 N/A LEU 265.A N LYS 261.A O no hydrogen 2.904 N/A SER 266.A N GLU 263.A O no hydrogen 2.972 N/A GLY 269.A N SER 266.A O no hydrogen 3.172 N/A TYR 273.A N GLY 269.A O no hydrogen 3.195 N/A ILE 274.A N ILE 270.A O no hydrogen 3.428 N/A GLU 275.A N ASP 271.A O no hydrogen 2.966 N/A LYS 276.A N GLY 272.A O no hydrogen 3.296 N/A LEU 277.A N TYR 273.A O no hydrogen 3.225 N/A ALA 278.A N ILE 274.A O no hydrogen 2.914 N/A LEU 279.A N GLU 275.A O no hydrogen 3.006 N/A LEU 280.A N LEU 277.A O no hydrogen 3.258 N/A GLY 281.A N ALA 278.A O no hydrogen 3.105 N/A THR 282.A N LEU 279.A O no hydrogen 3.026 N/A THR 283.A N LEU 279.A O no hydrogen 3.358 N/A SER 290.A OG SER 286.A O no hydrogen 3.459 N/A SER 290.A OG LYS 313.A O no hydrogen 3.567 N/A TYR 293.A N ARG 289.A O no hydrogen 3.077 N/A TYR 293.A OH TYR 247.A OH no hydrogen 2.589 N/A GLY 294.A N SER 290.A O no hydrogen 3.059 N/A GLU 295.A N SER 291.A O no hydrogen 2.893 N/A LEU 296.A N ILE 292.A O no hydrogen 3.060 N/A SER 298.A N GLY 294.A O no hydrogen 3.183 N/A SER 298.A OG GLY 294.A O no hydrogen 2.229 N/A SER 298.A OG LYS 302.A O no hydrogen 3.311 N/A LYS 302.A N PRO 299.A O no hydrogen 3.201 N/A LYS 302.A NZ GLY 301.A O no hydrogen 3.474 N/A THR 308.A OG1 VAL 305.A O no hydrogen 3.454 N/A ARG 318.A N ASP 118.A O no hydrogen 2.967 N/A LYS 320.A N GLU 116.A O no hydrogen 3.073 N/A LYS 320.A NZ GLU 116.A O no hydrogen 3.260 N/A LYS 320.A NZ GLU 116.A OE2 no hydrogen 2.304 N/A LYS 320.A NZ ASP 118.A OD1 no hydrogen 3.275 N/A LYS 320.A NZ ASP 118.A OD2 no hydrogen 2.352 N/A PHE 321.A N GLN 93.A O no hydrogen 3.108 N/A LYS 322.A N ARG 114.A O no hydrogen 3.236 N/A LYS 322.A NZ PHE 87.A O no hydrogen 3.153 N/A LYS 322.A NZ SER 90.A O no hydrogen 3.426 N/A THR 324.A N LEU 112.A O no hydrogen 3.079 N/A THR 324.A OG1 VAL 323.A O no hydrogen 2.678 N/A VAL 326.A N ASN 110.A O no hydrogen 3.095 N/A ILE 330.A N ASN 327.A O no hydrogen 3.000 N/A ILE 330.A N ASN 327.A OD1 no hydrogen 2.987 N/A ALA 331.A N ASN 327.A O no hydrogen 3.105 N/A LEU 332.A N PRO 328.A O no hydrogen 2.953 N/A ASN 334.A N ILE 330.A O no hydrogen 2.937 N/A ASN 334.A ND2 LEU 77.A O no hydrogen 3.269 N/A LEU 335.A N ALA 331.A O no hydrogen 2.980 N/A GLU 336.A N LEU 332.A O no hydrogen 2.989 N/A VAL 338.A N ASN 334.A O no hydrogen 3.343 N/A GLN 339.A N LEU 335.A O no hydrogen 3.029 N/A GLU 340.A N GLU 336.A O no hydrogen 2.981 N/A PHE 341.A N GLU 337.A O no hydrogen 2.923 N/A ILE 342.A N VAL 338.A O no hydrogen 2.745 N/A ASP 343.A N GLN 339.A O no hydrogen 2.838 N/A THR 344.A OG1 GLU 340.A O no hydrogen 2.649 N/A ASN 345.A N PHE 341.A O no hydrogen 3.196 N/A TYR 346.A N ILE 342.A O no hydrogen 2.952 N/A ASP 353.A N ASN 350.A O no hydrogen 3.062 N/A GLN 354.A N ASN 350.A O no hydrogen 3.113 N/A GLN 354.A NE2 ASP 343.A OD1 no hydrogen 2.733 N/A GLN 354.A NE2 TYR 346.A O no hydrogen 2.836 N/A CYS 355.A N ALA 351.A O no hydrogen 3.250 N/A CYS 355.A SG ASN 16.A O no hydrogen 3.139 N/A CYS 355.A SG ALA 351.A O no hydrogen 3.353 N/A GLU 356.A N LYS 352.A O no hydrogen 3.334 N/A LEU 357.A N ASP 353.A O no hydrogen 3.092 N/A TYR 358.A N GLN 354.A O no hydrogen 3.237 N/A TYR 358.A OH ILE 24.A O no hydrogen 2.675 N/A LYS 359.A N CYS 355.A O no hydrogen 2.914 N/A ILE 360.A N GLU 356.A O no hydrogen 2.989 N/A LYS 361.A N LEU 357.A O no hydrogen 3.183 N/A ALA 362.A N TYR 358.A O no hydrogen 3.173 N/A GLN 363.A N LYS 359.A O no hydrogen 2.894 N/A GLU 364.A N ILE 360.A O no hydrogen 2.808 N/A ALA 365.A N LYS 361.A O no hydrogen 2.997 N/A MET 366.A N ALA 362.A O no hydrogen 3.006 N/A THR 367.A N GLN 363.A O no hydrogen 2.982 N/A THR 367.A OG1 GLN 363.A O no hydrogen 2.868 N/A LYS 368.A N GLU 364.A O no hydrogen 3.066 N/A GLN 369.A N ALA 365.A O no hydrogen 3.102 N/A LEU 370.A N MET 366.A O no hydrogen 2.911 N/A GLU 371.A N THR 367.A O no hydrogen 2.988 N/A MET 372.A N LYS 368.A O no hydrogen 3.273 N/A ARG 373.A N GLN 369.A O no hydrogen 3.113 N/A LEU 374.A N LEU 370.A O no hydrogen 2.872 N/A ILE 376.A N ARG 373.A O no hydrogen 3.395 N/A