Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8uej_M.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ILE 42.A O no hydrogen 2.768 N/A ARG 3.A N ASP 40.A O no hydrogen 3.131 N/A ARG 5.A N CYS 38.A O no hydrogen 2.813 N/A ARG 7.A N GLU 36.A O no hydrogen 2.931 N/A SER 9.A N ASN 34.A O no hydrogen 2.744 N/A ALA 11.A N VAL 32.A O no hydrogen 3.022 N/A SER 13.A OG GLU 29.A OE2 no hydrogen 2.249 N/A SER 13.A OG ILE 30.A O no hydrogen 2.709 N/A GLY 14.A N ILE 30.A O no hydrogen 3.434 N/A THR 17.A N ARG 74.A O no hydrogen 2.790 N/A THR 17.A OG1 ASN 27.A OD1 no hydrogen 2.187 N/A PHE 18.A N VAL 26.A O no hydrogen 3.148 N/A TYR 19.A N THR 72.A O no hydrogen 2.394 N/A LEU 20.A N THR 23.A O no hydrogen 3.091 N/A GLY 22.A N SER 70.A O no hydrogen 2.722 N/A THR 23.A N LEU 20.A O no hydrogen 2.969 N/A THR 23.A OG1 PHE 21.A O no hydrogen 3.418 N/A GLU 28.A N GLU 28.A OE1 no hydrogen 2.505 N/A VAL 32.A N SER 12.A O no hydrogen 2.830 N/A THR 35.A OG1 ARG 33.A O no hydrogen 2.783 N/A GLU 36.A N ARG 7.A O no hydrogen 2.986 N/A TRP 37.A N HIS 53.A O no hydrogen 3.048 N/A CYS 38.A N ARG 5.A O no hydrogen 2.755 N/A SER 39.A N ASP 51.A O no hydrogen 3.337 N/A SER 39.A OG ARG 3.A O no hydrogen 3.488 N/A ASP 40.A N ARG 3.A O no hydrogen 3.336 N/A VAL 41.A N ASP 40.A OD1 no hydrogen 2.530 N/A ILE 42.A N MET 1.A O no hydrogen 3.275 N/A GLY 46.A N ASN 44.A OD1 no hydrogen 2.966 N/A ASN 48.A ND2 VAL 41.A O no hydrogen 3.555 N/A LEU 50.A N ARG 335.A O no hydrogen 3.396 N/A ILE 52.A N LYS 333.A O no hydrogen 2.887 N/A HIS 53.A N TRP 37.A O no hydrogen 3.226 N/A LYS 54.A N THR 331.A O no hydrogen 2.979 N/A GLN 55.A N THR 35.A O no hydrogen 3.172 N/A GLN 55.A NE2 ALA 86.A O no hydrogen 2.823 N/A GLU 56.A N THR 329.A O no hydrogen 2.976 N/A THR 58.A N SER 327.A O no hydrogen 2.703 N/A THR 58.A OG1 TRP 57.A O no hydrogen 2.880 N/A LYS 60.A N ASP 325.A O no hydrogen 2.816 N/A LYS 60.A NZ PRO 61.A O no hydrogen 3.269 N/A LEU 62.A N CYS 78.A O no hydrogen 3.459 N/A SER 63.A N LYS 322.A O no hydrogen 3.310 N/A SER 63.A OG LEU 62.A O no hydrogen 2.713 N/A PHE 68.A N GLY 71.A O no hydrogen 2.672 N/A SER 70.A OG GLY 69.A O no hydrogen 2.540 N/A GLY 71.A N PHE 68.A O no hydrogen 3.344 N/A THR 72.A N TYR 19.A O no hydrogen 2.688 N/A TYR 73.A OH ASP 318.A OD2 no hydrogen 2.660 N/A ARG 74.A N THR 17.A O no hydrogen 2.594 N/A ARG 74.A NE GLN 65.A OE1 no hydrogen 2.530 N/A GLN 77.A N LEU 62.A O no hydrogen 2.904 N/A CYS 78.A N SER 75.A O no hydrogen 3.082 N/A CYS 78.A SG SER 16.A OG no hydrogen 2.335 N/A CYS 78.A SG PRO 79.A O no hydrogen 3.805 N/A CYS 83.A N PRO 80.A O no hydrogen 3.471 N/A CYS 83.A SG PRO 80.A O no hydrogen 3.885 N/A ARG 84.A N GLU 81.A O no hydrogen 3.096 N/A ARG 84.A NH1 GLU 29.A O no hydrogen 3.439 N/A GLY 85.A N TYR 82.A O no hydrogen 3.469 N/A GLN 96.A N GLN 96.A OE1 no hydrogen 2.827 N/A THR 101.A OG1 GLY 98.A O no hydrogen 2.842 N/A THR 102.A N GLY 98.A O no hydrogen 3.344 N/A THR 102.A OG1 GLY 98.A O no hydrogen 3.344 N/A ALA 103.A N LEU 99.A O no hydrogen 2.913 N/A LEU 104.A N GLY 100.A O no hydrogen 2.903 N/A ALA 105.A N THR 101.A O no hydrogen 2.885 N/A ARG 106.A N THR 102.A O no hydrogen 2.911 N/A THR 107.A N ALA 103.A O no hydrogen 2.986 N/A SER 110.A N ASN 108.A OD1 no hydrogen 2.932 N/A SER 110.A OG ASN 108.A OD1 no hydrogen 3.261 N/A GLY 121.A N ALA 118.A O no hydrogen 3.208 N/A LEU 123.A N ILE 120.A O no hydrogen 3.192 N/A ASP 125.A N GLU 122.A O no hydrogen 2.792 N/A ARG 128.A NH1 ASP 125.A OD1 no hydrogen 2.519 N/A PHE 130.A N LEU 126.A O no hydrogen 3.269 N/A LYS 131.A N PRO 127.A O no hydrogen 2.957 N/A LYS 131.A NZ ASP 135.A OD2 no hydrogen 2.968 N/A ILE 132.A N ARG 128.A O no hydrogen 2.874 N/A ALA 133.A N MET 129.A O no hydrogen 2.951 N/A GLY 134.A N PHE 130.A O no hydrogen 2.923 N/A ASP 135.A N LYS 131.A O no hydrogen 2.911 N/A THR 136.A N ILE 132.A O no hydrogen 2.909 N/A THR 136.A OG1 ILE 132.A O no hydrogen 2.845 N/A THR 136.A OG1 ALA 133.A O no hydrogen 2.805 N/A MET 137.A N ALA 133.A O no hydrogen 2.950 N/A LEU 138.A N GLY 134.A O no hydrogen 2.900 N/A ARG 139.A N ASP 135.A O no hydrogen 2.907 N/A LYS 140.A N THR 136.A O no hydrogen 2.923 N/A LYS 140.A NZ THR 136.A O no hydrogen 3.148 N/A LEU 146.A N ASN 143.A O no hydrogen 3.354 N/A TYR 148.A N PHE 145.A O no hydrogen 3.035 N/A GLN 149.A N LEU 146.A O no hydrogen 3.220 N/A PHE 150.A N PHE 145.A O no hydrogen 3.060 N/A LEU 155.A N GLY 151.A O no hydrogen 3.442 N/A ILE 156.A N TRP 152.A O no hydrogen 3.003 N/A SER 157.A N LYS 153.A O no hydrogen 2.965 N/A SER 157.A OG LYS 153.A O no hydrogen 3.470 N/A SER 157.A OG PRO 154.A O no hydrogen 2.528 N/A ASP 158.A N PRO 154.A O no hydrogen 2.931 N/A ILE 159.A N LEU 155.A O no hydrogen 2.984 N/A SER 160.A N ILE 156.A O no hydrogen 2.956 N/A SER 160.A OG ILE 156.A O no hydrogen 3.011 N/A LYS 161.A N SER 157.A O no hydrogen 2.981 N/A ALA 162.A N ASP 158.A O no hydrogen 2.969 N/A LEU 163.A N ILE 159.A O no hydrogen 2.944 N/A ASP 164.A N SER 160.A O no hydrogen 2.957 N/A PHE 165.A N LYS 161.A O no hydrogen 2.960 N/A SER 166.A N ALA 162.A O no hydrogen 2.885 N/A SER 166.A OG LEU 163.A O no hydrogen 2.797 N/A ALA 167.A N LEU 163.A O no hydrogen 2.908 N/A THR 168.A N ASP 164.A O no hydrogen 2.975 N/A THR 168.A OG1 ASP 164.A O no hydrogen 3.458 N/A THR 168.A OG1 PHE 165.A O no hydrogen 2.583 N/A THR 168.A OG1 GLN 354.A OE1 no hydrogen 3.484 N/A VAL 169.A N PHE 165.A O no hydrogen 2.936 N/A ARG 170.A N SER 166.A O no hydrogen 2.879 N/A ARG 170.A NH2 GLU 246.A OE2 no hydrogen 2.714 N/A THR 171.A N ALA 167.A O no hydrogen 2.885 N/A THR 171.A OG1 ALA 167.A O no hydrogen 3.202 N/A THR 171.A OG1 THR 168.A O no hydrogen 2.565 N/A ARG 172.A N THR 168.A O no hydrogen 2.975 N/A ARG 172.A NE ASN 349.A O no hydrogen 2.539 N/A ARG 172.A NH2 ASN 349.A O no hydrogen 2.989 N/A SER 173.A N VAL 169.A O no hydrogen 2.918 N/A SER 173.A OG VAL 169.A O no hydrogen 3.371 N/A SER 173.A OG ARG 170.A O no hydrogen 2.425 N/A ASP 174.A N ARG 170.A O no hydrogen 2.903 N/A GLU 175.A N THR 171.A O no hydrogen 2.942 N/A TRP 176.A N ARG 172.A O no hydrogen 2.950 N/A HIS 177.A N SER 173.A O no hydrogen 2.948 N/A HIS 177.A NE2 PRO 238.A O no hydrogen 3.291 N/A ARG 178.A N ASP 174.A O no hydrogen 2.929 N/A LEU 179.A N GLU 175.A O no hydrogen 2.907 N/A TYR 180.A N TRP 176.A O no hydrogen 2.970 N/A SER 181.A N ARG 178.A O no hydrogen 3.072 N/A GLY 184.A N SER 181.A O no hydrogen 2.980 N/A LEU 185.A N TRP 230.A O no hydrogen 2.507 N/A ARG 187.A N VAL 228.A O no hydrogen 2.951 N/A ILE 189.A N ALA 226.A O no hydrogen 3.231 N/A LEU 191.A N THR 224.A O no hydrogen 2.913 N/A GLY 192.A N ASN 190.A OD1 no hydrogen 2.750 N/A ASP 194.A N ARG 222.A O no hydrogen 2.973 N/A GLU 196.A N THR 220.A O no hydrogen 3.117 N/A LYS 198.A N VAL 218.A O no hydrogen 3.332 N/A LYS 199.A NZ THR 217.A OG1 no hydrogen 2.411 N/A GLU 200.A N HIS 216.A O no hydrogen 2.759 N/A VAL 203.A N ALA 214.A O no hydrogen 2.914 N/A LEU 205.A N VAL 212.A O no hydrogen 2.526 N/A HIS 206.A N VAL 212.A O no hydrogen 3.387 N/A SER 207.A OG GLU 81.A OE2 no hydrogen 2.516 N/A SER 208.A N HIS 206.A ND1 no hydrogen 3.141 N/A VAL 212.A N HIS 206.A O no hydrogen 3.289 N/A ALA 214.A N VAL 203.A O no hydrogen 2.675 N/A SER 215.A N SER 311.A O no hydrogen 2.701 N/A SER 215.A OG SER 311.A O no hydrogen 3.372 N/A HIS 216.A N GLU 200.A O no hydrogen 3.128 N/A HIS 216.A NE2 HIS 308.A ND1 no hydrogen 3.085 N/A THR 217.A N GLN 309.A O no hydrogen 3.095 N/A VAL 218.A N LYS 198.A O no hydrogen 3.511 N/A ILE 219.A N ASN 307.A O no hydrogen 3.057 N/A THR 220.A N GLU 196.A O no hydrogen 2.967 N/A VAL 221.A N THR 305.A O no hydrogen 3.008 N/A ARG 222.A N ASP 194.A O no hydrogen 2.909 N/A ARG 222.A NH1 PRO 94.A O no hydrogen 2.541 N/A ARG 222.A NH1 ASP 194.A OD2 no hydrogen 3.251 N/A ARG 222.A NH2 PRO 94.A O no hydrogen 3.415 N/A LYS 223.A N THR 303.A O no hydrogen 3.227 N/A THR 224.A OG1 LYS 223.A O no hydrogen 2.651 N/A TRP 225.A N MET 301.A O no hydrogen 3.273 N/A ALA 226.A N ILE 189.A O no hydrogen 3.499 N/A THR 227.A N ASN 299.A O no hydrogen 3.416 N/A THR 227.A OG1 ASN 299.A OD1 no hydrogen 2.811 N/A VAL 228.A N ARG 187.A O no hydrogen 3.289 N/A TRP 230.A N LEU 185.A O no hydrogen 2.353 N/A ARG 231.A N SER 294.A O no hydrogen 3.453 N/A ARG 231.A NE TYR 180.A O no hydrogen 2.356 N/A ARG 231.A NH2 TYR 180.A O no hydrogen 2.710 N/A SER 236.A N ASP 233.A O no hydrogen 3.234 N/A THR 241.A OG1 LYS 242.A O no hydrogen 3.038 N/A SER 243.A OG GLU 246.A OE2 no hydrogen 2.131 N/A ALA 249.A N SER 245.A O no hydrogen 2.892 N/A ARG 250.A N GLU 246.A O no hydrogen 2.884 N/A ARG 250.A NH1 ASP 164.A OD1 no hydrogen 3.075 N/A ARG 250.A NH2 ASP 164.A OD1 no hydrogen 2.474 N/A ALA 251.A N LYS 247.A O no hydrogen 2.918 N/A LEU 252.A N HIS 248.A O no hydrogen 2.932 N/A LEU 253.A N ALA 249.A O no hydrogen 2.925 N/A GLY 254.A N ARG 250.A O no hydrogen 3.119 N/A GLY 254.A N ALA 251.A O no hydrogen 3.249 N/A LEU 255.A N LEU 252.A O no hydrogen 2.934 N/A GLY 256.A N LEU 253.A O no hydrogen 3.207 N/A LEU 260.A N GLY 256.A O no hydrogen 3.277 N/A ILE 261.A N VAL 257.A O no hydrogen 2.918 N/A GLU 262.A N GLY 258.A O no hydrogen 3.245 N/A LEU 267.A N ALA 264.A O no hydrogen 2.925 N/A MET 268.A N TRP 265.A O no hydrogen 3.056 N/A TRP 270.A N MET 268.A O no hydrogen 3.008 N/A MET 273.A N PRO 269.A O no hydrogen 3.325 N/A VAL 274.A N TRP 270.A O no hydrogen 2.897 N/A ASP 275.A N SER 271.A O no hydrogen 2.943 N/A TRP 276.A N TRP 272.A O no hydrogen 2.947 N/A PHE 277.A N MET 273.A O no hydrogen 2.876 N/A GLY 278.A N VAL 274.A O no hydrogen 2.945 N/A ASN 279.A N ASP 275.A O no hydrogen 2.941 N/A ASN 279.A ND2 ASP 275.A OD1 no hydrogen 2.661 N/A VAL 280.A N TRP 276.A O no hydrogen 2.891 N/A GLY 281.A N PHE 277.A O no hydrogen 2.905 N/A THR 282.A N GLY 278.A O no hydrogen 2.948 N/A PHE 283.A N ASN 279.A O no hydrogen 2.938 N/A LEU 284.A N VAL 280.A O no hydrogen 2.852 N/A GLN 285.A N GLY 281.A O no hydrogen 3.006 N/A ALA 286.A N THR 282.A O no hydrogen 2.902 N/A SER 287.A N PHE 283.A O no hydrogen 3.060 N/A SER 287.A OG PHE 283.A O no hydrogen 3.308 N/A ASN 289.A ND2 PHE 114.A O no hydrogen 3.243 N/A ASN 289.A ND2 LEU 350.A O no hydrogen 2.843 N/A THR 290.A OG1 ASN 288.A O no hydrogen 2.721 N/A ILE 291.A N ILE 347.A O no hydrogen 3.166 N/A SER 294.A N ARG 231.A O no hydrogen 3.201 N/A GLY 296.A N ARG 229.A O no hydrogen 3.318 N/A VAL 298.A N SER 338.A O no hydrogen 2.977 N/A ASN 299.A N THR 227.A O no hydrogen 3.513 N/A ILE 300.A N SER 336.A O no hydrogen 3.179 N/A MET 301.A N TRP 225.A O no hydrogen 3.121 N/A THR 303.A OG1 SER 332.A O no hydrogen 3.517 N/A THR 304.A N SER 332.A O no hydrogen 2.867 N/A THR 304.A OG1 SER 332.A O no hydrogen 3.505 N/A THR 305.A N VAL 221.A O no hydrogen 3.121 N/A THR 305.A OG1 VAL 330.A O no hydrogen 3.439 N/A THR 305.A OG1 THR 331.A OG1 no hydrogen 3.279 N/A THR 306.A N VAL 330.A O no hydrogen 2.917 N/A THR 306.A OG1 ILE 219.A O no hydrogen 2.412 N/A ASN 307.A N ILE 219.A O no hydrogen 2.983 N/A HIS 308.A N ALA 328.A O no hydrogen 2.761 N/A HIS 308.A ND1 HIS 216.A NE2 no hydrogen 3.085 N/A GLN 309.A N THR 217.A O no hydrogen 3.178 N/A PHE 310.A N CYS 326.A O no hydrogen 3.131 N/A SER 311.A N SER 215.A O no hydrogen 3.240 N/A VAL 312.A N ASP 325.A OD1 no hydrogen 2.992 N/A LYS 313.A N VAL 213.A O no hydrogen 2.647 N/A SER 317.A OG PHE 211.A O no hydrogen 3.165 N/A SER 317.A OG LYS 313.A O no hydrogen 3.558 N/A TRP 320.A NE1 TYR 73.A OH no hydrogen 3.272 N/A ILE 321.A N ASP 318.A O no hydrogen 3.015 N/A LYS 322.A N SER 63.A O no hydrogen 3.265 N/A CYS 326.A SG GLY 324.A O no hydrogen 3.950 N/A SER 327.A N THR 58.A O no hydrogen 2.625 N/A ALA 328.A N HIS 308.A O no hydrogen 2.674 N/A THR 329.A N GLU 56.A O no hydrogen 3.148 N/A VAL 330.A N THR 306.A O no hydrogen 3.092 N/A THR 331.A N LYS 54.A O no hydrogen 2.897 N/A THR 331.A OG1 THR 305.A OG1 no hydrogen 3.279 N/A SER 332.A N THR 304.A O no hydrogen 2.752 N/A LYS 333.A N ILE 52.A O no hydrogen 3.070 N/A SER 336.A N ILE 300.A O no hydrogen 3.269 N/A GLN 337.A NE2 ASP 47.A O no hydrogen 3.272 N/A GLN 337.A NE2 ASP 47.A OD2 no hydrogen 2.492 N/A SER 338.A N VAL 298.A O no hydrogen 2.829 N/A ALA 345.A N ALA 293.A O no hydrogen 3.242 N/A ILE 347.A N ILE 291.A O no hydrogen 3.241 N/A ASN 349.A N ASN 289.A O no hydrogen 3.125 N/A ASN 349.A N ASN 289.A OD1 no hydrogen 3.056 N/A LEU 350.A N ASN 289.A OD1 no hydrogen 3.090 N/A GLN 354.A N SER 351.A O no hydrogen 3.175 N/A LEU 355.A N GLY 352.A O no hydrogen 2.887 N/A SER 356.A N GLY 352.A O no hydrogen 2.908 N/A GLY 362.A N ASP 158.A OD1 no hydrogen 3.193 N/A ARG 365.A N GLY 362.A O no hydrogen 3.404 N/A ARG 365.A NE TYR 148.A O no hydrogen 2.679 N/A ARG 365.A NH2 GLN 149.A O no hydrogen 2.401 N/A VAL 366.A N ILE 363.A O no hydrogen 3.273 N/A ARG 368.A NH1 GLN 364.A O no hydrogen 2.887 N/A ARG 368.A NH2 GLN 364.A O no hydrogen 3.035 N/A ARG 372.A N ARG 368.A O no hydrogen 2.302 N/A