Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7nqh_Ae.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A N ASP 122.A OD2 no hydrogen 3.119 N/A SER 4.A N ASP 122.A OD1 no hydrogen 3.114 N/A SER 4.A OG ASP 122.A OD1 no hydrogen 2.321 N/A ALA 6.A N LEU 2.A O no hydrogen 2.908 N/A TYR 7.A N LEU 3.A O no hydrogen 2.907 N/A LYS 12.A NZ TYR 7.A OH no hydrogen 3.193 N/A LYS 12.A NZ GLU 350.A OE2 no hydrogen 3.334 N/A TRP 13.A N ASP 9.A O no hydrogen 2.944 N/A GLU 14.A N SER 10.A O no hydrogen 2.895 N/A ALA 15.A N HIS 11.A O no hydrogen 2.940 N/A ARG 16.A N TRP 13.A O no hydrogen 3.165 N/A LYS 18.A NZ ALA 15.A O no hydrogen 3.517 N/A CYS 21.A N ASN 51.A OD1 no hydrogen 3.086 N/A LEU 26.A N HIS 22.A O no hydrogen 2.988 N/A ALA 27.A N LEU 23.A O no hydrogen 2.907 N/A SER 28.A N ALA 24.A O no hydrogen 2.892 N/A SER 28.A OG ALA 24.A O no hydrogen 2.936 N/A SER 28.A OG ASP 25.A O no hydrogen 3.023 N/A LEU 29.A N ASP 25.A O no hydrogen 2.949 N/A MET 30.A N LEU 26.A O no hydrogen 2.992 N/A ASP 31.A N ALA 27.A O no hydrogen 2.955 N/A LYS 32.A N SER 28.A O no hydrogen 2.937 N/A THR 33.A N LEU 29.A O no hydrogen 2.943 N/A THR 33.A OG1 LEU 29.A O no hydrogen 2.628 N/A TYR 34.A N MET 30.A O no hydrogen 2.875 N/A GLU 35.A N ASP 31.A O no hydrogen 2.883 N/A ARG 36.A N LYS 32.A O no hydrogen 2.961 N/A LYS 37.A N TYR 34.A O no hydrogen 3.139 N/A LEU 38.A N THR 33.A O no hydrogen 3.094 N/A THR 44.A OG1 SER 41.A O no hydrogen 3.194 N/A SER 46.A N SER 42.A O no hydrogen 2.917 N/A SER 46.A OG SER 42.A O no hydrogen 3.339 N/A SER 46.A OG LEU 43.A O no hydrogen 2.613 N/A ARG 47.A N LEU 43.A O no hydrogen 2.881 N/A PHE 48.A N THR 44.A O no hydrogen 2.964 N/A VAL 49.A N ILE 45.A O no hydrogen 2.867 N/A ASP 50.A N SER 46.A O no hydrogen 2.849 N/A ASN 51.A N ARG 47.A O no hydrogen 2.948 N/A ILE 52.A N VAL 49.A O no hydrogen 3.279 N/A ALA 53.A N ASP 57.A OD2 no hydrogen 3.448 N/A ARG 55.A NH2 ASP 96.A OD2 no hydrogen 3.086 N/A ASP 57.A N SER 54.A OG no hydrogen 3.239 N/A ILE 58.A N SER 54.A O no hydrogen 2.948 N/A ASP 59.A N ARG 55.A O no hydrogen 2.942 N/A HIS 60.A N GLU 56.A O no hydrogen 2.920 N/A ALA 61.A N ASP 57.A O no hydrogen 2.864 N/A GLU 62.A N ILE 58.A O no hydrogen 2.844 N/A TYR 63.A N ASP 59.A O no hydrogen 3.064 N/A TYR 64.A N HIS 60.A O no hydrogen 2.879 N/A LEU 65.A N ALA 61.A O no hydrogen 2.793 N/A TYR 66.A N GLU 62.A O no hydrogen 2.983 N/A LYS 67.A N TYR 63.A O no hydrogen 2.958 N/A LYS 67.A NZ TYR 63.A OH no hydrogen 3.535 N/A PHE 68.A N TYR 64.A O no hydrogen 2.828 N/A ARG 69.A N LEU 65.A O no hydrogen 2.851 N/A ARG 69.A NE VAL 106.A O no hydrogen 2.641 N/A ARG 69.A NH2 VAL 106.A O no hydrogen 3.361 N/A HIS 70.A N TYR 66.A O no hydrogen 3.021 N/A SER 71.A N PHE 68.A O no hydrogen 3.257 N/A SER 71.A OG PHE 68.A O no hydrogen 2.420 N/A ASN 73.A ND2 VAL 40.A O no hydrogen 2.405 N/A TYR 76.A N ASN 73.A O no hydrogen 3.390 N/A ARG 78.A NE TYR 76.A O no hydrogen 3.220 N/A THR 81.A N ARG 78.A O no hydrogen 3.256 N/A HIS 83.A N ASP 79.A O no hydrogen 2.968 N/A THR 84.A N TRP 80.A O no hydrogen 2.849 N/A THR 84.A OG1 TRP 80.A O no hydrogen 2.961 N/A THR 84.A OG1 THR 81.A O no hydrogen 2.527 N/A TRP 85.A N THR 81.A O no hydrogen 2.951 N/A ILE 86.A N ILE 82.A O no hydrogen 2.896 N/A ARG 87.A N HIS 83.A O no hydrogen 2.954 N/A ARG 87.A NH1 ASP 9.A O no hydrogen 3.320 N/A GLN 88.A N THR 84.A O no hydrogen 2.917 N/A GLN 88.A NE2 VAL 49.A O no hydrogen 3.275 N/A GLN 88.A NE2 ILE 52.A O no hydrogen 3.147 N/A CYS 89.A N TRP 85.A O no hydrogen 2.936 N/A LEU 90.A N ILE 86.A O no hydrogen 2.857 N/A LYS 91.A N ARG 87.A O no hydrogen 2.956 N/A LYS 91.A NZ GLN 88.A OE1 no hydrogen 3.340 N/A TYR 92.A N CYS 89.A O no hydrogen 3.190 N/A GLY 93.A N CYS 89.A O no hydrogen 2.908 N/A ALA 94.A N CYS 89.A O no hydrogen 2.842 N/A GLN 95.A NE2 TYR 123.A O no hydrogen 3.614 N/A LYS 97.A NZ ASP 96.A OD1 no hydrogen 3.473 N/A LYS 97.A NZ ASP 96.A OD2 no hydrogen 3.375 N/A TYR 100.A N ASP 96.A O no hydrogen 2.872 N/A THR 101.A N LYS 97.A O no hydrogen 2.945 N/A THR 101.A OG1 LYS 97.A O no hydrogen 3.284 N/A THR 101.A OG1 ALA 98.A O no hydrogen 2.370 N/A LEU 102.A N ALA 98.A O no hydrogen 2.912 N/A LYS 103.A N LEU 99.A O no hydrogen 2.817 N/A ASN 104.A N TYR 100.A O no hydrogen 2.939 N/A LYS 105.A N THR 101.A O no hydrogen 2.937 N/A GLN 107.A N ASN 104.A O no hydrogen 3.433 N/A TYR 108.A N LYS 105.A O no hydrogen 3.156 N/A GLY 109.A N LYS 105.A O no hydrogen 2.575 N/A ASP 113.A N PHE 111.A O no hydrogen 3.143 N/A LEU 119.A N TYR 115.A O no hydrogen 2.934 N/A LEU 120.A N THR 116.A O no hydrogen 2.889 N/A MET 121.A N PHE 117.A O no hydrogen 2.908 N/A ASP 122.A N ASN 118.A O no hydrogen 2.895 N/A TYR 123.A N LEU 119.A O no hydrogen 2.943 N/A PHE 124.A N LEU 120.A O no hydrogen 2.931 N/A ILE 125.A N MET 121.A O no hydrogen 2.942 N/A LYS 126.A N ASP 122.A O no hydrogen 2.909 N/A LYS 127.A N PHE 124.A O no hydrogen 3.187 N/A LYS 127.A NZ TYR 123.A O no hydrogen 2.752 N/A GLU 128.A N ILE 125.A O no hydrogen 3.098 N/A ASN 129.A ND2 GLN 95.A OE1 no hydrogen 2.370 N/A LEU 134.A N TYR 130.A O no hydrogen 2.936 N/A SER 135.A N LYS 131.A O no hydrogen 3.011 N/A SER 135.A OG ASP 132.A O no hydrogen 2.615 N/A VAL 136.A N ASP 132.A O no hydrogen 2.922 N/A VAL 137.A N ALA 133.A O no hydrogen 2.942 N/A PHE 138.A N LEU 134.A O no hydrogen 2.955 N/A GLU 139.A N SER 135.A O no hydrogen 2.986 N/A ILE 140.A N VAL 136.A O no hydrogen 2.879 N/A MET 141.A N VAL 137.A O no hydrogen 2.896 N/A MET 142.A N PHE 138.A O no hydrogen 2.924 N/A GLN 143.A N ILE 140.A O no hydrogen 3.072 N/A GLU 144.A N MET 141.A O no hydrogen 3.415 N/A GLU 147.A N ALA 145.A O no hydrogen 2.974 N/A SER 150.A N VAL 148.A O no hydrogen 2.587 N/A SER 150.A OG ASN 118.A OD1 no hydrogen 2.383 N/A GLN 152.A N GLN 152.A OE1 no hydrogen 2.644 N/A GLN 152.A NE2 PRO 149.A O no hydrogen 3.581 N/A LEU 154.A N SER 150.A O no hydrogen 2.955 N/A SER 155.A N THR 151.A O no hydrogen 2.941 N/A SER 155.A OG THR 151.A O no hydrogen 3.228 N/A SER 155.A OG GLN 152.A O no hydrogen 3.050 N/A LEU 156.A N GLN 152.A O no hydrogen 2.920 N/A VAL 158.A N LEU 154.A O no hydrogen 2.994 N/A LEU 159.A N SER 155.A O no hydrogen 2.878 N/A TYR 160.A N LEU 156.A O no hydrogen 2.896 N/A TYR 160.A OH THR 331.A OG1 no hydrogen 2.467 N/A HIS 161.A N TYR 157.A O no hydrogen 2.955 N/A CYS 162.A N VAL 158.A O no hydrogen 2.846 N/A CYS 162.A SG TYR 199.A OH no hydrogen 3.371 N/A LEU 163.A N LEU 159.A O no hydrogen 2.924 N/A ALA 164.A N TYR 160.A O no hydrogen 2.914 N/A GLU 174.A N SER 170.A O no hydrogen 2.887 N/A ARG 175.A N TRP 171.A O no hydrogen 3.004 N/A ARG 175.A NH2 ASN 176.A OD1 no hydrogen 3.355 N/A ASN 176.A N GLU 172.A O no hydrogen 2.959 N/A PHE 177.A N GLU 173.A O no hydrogen 2.894 N/A GLY 178.A N GLU 174.A O no hydrogen 2.908 N/A ALA 179.A N ARG 175.A O no hydrogen 3.023 N/A SER 180.A N ASN 176.A O no hydrogen 2.959 N/A SER 180.A OG ASN 176.A O no hydrogen 3.316 N/A SER 180.A OG PHE 177.A O no hydrogen 2.642 N/A LEU 181.A N PHE 177.A O no hydrogen 2.914 N/A LEU 181.A N GLY 178.A O no hydrogen 3.217 N/A LEU 182.A N GLY 178.A O no hydrogen 3.021 N/A LEU 183.A N ALA 179.A O no hydrogen 2.915 N/A SER 195.A N SER 191.A O no hydrogen 2.907 N/A SER 195.A OG VAL 192.A O no hydrogen 2.561 N/A SER 196.A N VAL 192.A O no hydrogen 2.902 N/A SER 196.A OG VAL 192.A O no hydrogen 3.555 N/A SER 196.A OG GLY 193.A O no hydrogen 2.707 N/A GLN 197.A N GLY 193.A O no hydrogen 2.906 N/A GLN 197.A NE2 GLY 185.A O no hydrogen 2.727 N/A LEU 198.A N LEU 194.A O no hydrogen 2.896 N/A TYR 199.A N SER 195.A O no hydrogen 2.881 N/A GLY 200.A N SER 196.A O no hydrogen 2.901 N/A TYR 201.A N GLN 197.A O no hydrogen 2.897 N/A ALA 202.A N LEU 198.A O no hydrogen 2.925 N/A LEU 203.A N TYR 199.A O no hydrogen 2.969 N/A LEU 204.A N GLY 200.A O no hydrogen 2.889 N/A GLY 205.A N TYR 201.A O no hydrogen 2.835 N/A LYS 206.A N ALA 202.A O no hydrogen 2.975 N/A VAL 207.A N LEU 203.A O no hydrogen 2.982 N/A GLU 208.A N LEU 204.A O no hydrogen 2.887 N/A LEU 209.A N GLY 205.A O no hydrogen 2.895 N/A GLN 210.A N LYS 206.A O no hydrogen 2.964 N/A GLY 212.A N VAL 207.A O no hydrogen 3.245 N/A TYR 217.A N ARG 214.A O no hydrogen 3.113 N/A CYS 218.A SG ARG 214.A O no hydrogen 3.233 N/A LEU 222.A N MET 220.A O no hydrogen 2.818 N/A TYR 228.A OH LEU 223.A O no hydrogen 2.282 N/A ALA 232.A N TYR 228.A O no hydrogen 2.899 N/A LEU 233.A N LEU 229.A O no hydrogen 2.896 N/A GLN 234.A N HIS 230.A O no hydrogen 2.923 N/A VAL 235.A N ARG 231.A O no hydrogen 2.891 N/A MET 236.A N ALA 232.A O no hydrogen 2.924 N/A GLU 237.A N LEU 233.A O no hydrogen 2.864 N/A GLU 237.A N GLN 234.A O no hydrogen 3.240 N/A LYS 238.A N VAL 235.A O no hydrogen 3.055 N/A SER 241.A OG LYS 238.A O no hydrogen 3.520 N/A SER 242.A OG LYS 238.A O no hydrogen 2.509 N/A GLN 247.A NE2 GLU 251.A OE2 no hydrogen 2.543 N/A GLN 247.A NE2 GLU 322.A OE2 no hydrogen 3.039 N/A GLU 251.A N GLN 247.A O no hydrogen 2.891 N/A ALA 252.A N LEU 248.A O no hydrogen 2.945 N/A LEU 253.A N CYS 249.A O no hydrogen 2.846 N/A ASP 254.A N GLY 250.A O no hydrogen 2.928 N/A VAL 255.A N GLU 251.A O no hydrogen 2.886 N/A LEU 256.A N ALA 252.A O no hydrogen 2.901 N/A ASP 257.A N LEU 253.A O no hydrogen 2.823 N/A ARG 258.A N ASP 254.A O no hydrogen 2.882 N/A ARG 258.A NH2 GLU 309.A OE2 no hydrogen 2.766 N/A VAL 259.A N VAL 255.A O no hydrogen 2.814 N/A LEU 260.A N LEU 256.A O no hydrogen 2.948 N/A LYS 261.A N ASP 257.A O no hydrogen 2.902 N/A ALA 262.A N ARG 258.A O no hydrogen 2.860 N/A ALA 262.A N VAL 259.A O no hydrogen 3.262 N/A VAL 263.A N VAL 259.A O no hydrogen 2.919 N/A THR 264.A N LEU 260.A O no hydrogen 2.894 N/A THR 264.A OG1 LEU 260.A O no hydrogen 2.346 N/A ALA 267.A N VAL 263.A O no hydrogen 3.129 N/A SER 271.A N ALA 267.A O no hydrogen 3.512 N/A ARG 283.A N GLU 279.A O no hydrogen 3.308 N/A SER 284.A N GLU 280.A O no hydrogen 2.917 N/A GLU 285.A N SER 281.A O no hydrogen 2.893 N/A GLN 290.A N GLN 290.A OE1 no hydrogen 2.772 N/A LEU 291.A N GLU 294.A OE1 no hydrogen 3.303 N/A SER 299.A N THR 296.A O no hydrogen 3.188 N/A LYS 300.A N GLU 297.A O no hydrogen 3.155 N/A TYR 304.A N LYS 300.A O no hydrogen 3.119 N/A TYR 304.A OH GLU 297.A OE1 no hydrogen 2.846 N/A LEU 305.A N LEU 301.A O no hydrogen 2.929 N/A GLU 306.A N PRO 302.A O no hydrogen 3.353 N/A ARG 307.A N GLN 303.A O no hydrogen 2.915 N/A PHE 308.A N TYR 304.A O no hydrogen 2.911 N/A GLU 309.A N LEU 305.A O no hydrogen 2.905 N/A ALA 310.A N GLU 306.A O no hydrogen 2.937 N/A LEU 311.A N ARG 307.A O no hydrogen 2.912 N/A ARG 312.A N PHE 308.A O no hydrogen 2.895 N/A LYS 314.A N ALA 310.A O no hydrogen 2.941 N/A LEU 315.A N LEU 311.A O no hydrogen 2.903 N/A ALA 317.A N SER 313.A O no hydrogen 2.911 N/A LEU 318.A N LYS 314.A O no hydrogen 2.896 N/A GLY 319.A N LEU 315.A O no hydrogen 2.934 N/A LYS 320.A N LEU 315.A O no hydrogen 3.159 N/A GLU 322.A N GLU 322.A OE1 no hydrogen 2.866 N/A SER 323.A OG GLY 246.A O no hydrogen 3.027 N/A SER 325.A OG GLU 324.A OE1 no hydrogen 3.239 N/A SER 325.A OG THR 328.A OG1 no hydrogen 3.003 N/A THR 328.A N SER 325.A OG no hydrogen 3.386 N/A THR 328.A OG1 GLU 324.A OE1 no hydrogen 2.855 N/A THR 328.A OG1 SER 325.A O no hydrogen 3.440 N/A THR 328.A OG1 SER 325.A OG no hydrogen 3.003 N/A SER 330.A N LEU 326.A O no hydrogen 2.901 N/A SER 330.A OG LEU 326.A O no hydrogen 3.128 N/A SER 330.A OG LEU 327.A O no hydrogen 2.854 N/A THR 331.A N LEU 327.A O no hydrogen 2.881 N/A THR 331.A OG1 TYR 160.A OH no hydrogen 2.467 N/A THR 331.A OG1 LEU 327.A O no hydrogen 2.470 N/A GLN 332.A N THR 328.A O no hydrogen 2.986 N/A LEU 333.A N LEU 329.A O no hydrogen 2.957 N/A ALA 334.A N SER 330.A O no hydrogen 2.900 N/A LYS 335.A N THR 331.A O no hydrogen 2.923 N/A ALA 336.A N GLN 332.A O no hydrogen 2.901 N/A GLN 337.A N LEU 333.A O no hydrogen 2.934 N/A LEU 338.A N ALA 334.A O no hydrogen 2.885 N/A CYS 341.A N GLN 337.A O no hydrogen 3.372 N/A CYS 341.A SG GLN 337.A O no hydrogen 3.337 N/A GLU 342.A N LEU 338.A O no hydrogen 2.904 N/A ALA 343.A N PRO 339.A O no hydrogen 2.897 N/A GLU 344.A N THR 340.A O no hydrogen 2.941 N/A TYR 349.A N ASP 345.A O no hydrogen 2.915 N/A TYR 349.A OH HIS 83.A NE2 no hydrogen 2.564 N/A GLU 350.A N ILE 346.A O no hydrogen 2.931 N/A GLN 351.A N ALA 347.A O no hydrogen 3.365 N/A ARG 352.A N VAL 348.A O no hydrogen 2.954 N/A ARG 352.A NH1 GLN 355.A OE1 no hydrogen 2.754 N/A LEU 353.A N TYR 349.A O no hydrogen 2.914 N/A GLN 354.A N GLU 350.A O no hydrogen 2.925 N/A GLN 355.A N GLN 351.A O no hydrogen 2.909 N/A TRP 356.A N ARG 352.A O no hydrogen 2.921 N/A HIS 357.A N LEU 353.A O no hydrogen 3.190 N/A GLY 358.A N GLN 354.A O no hydrogen 2.946 N/A GLU 359.A N GLN 355.A O no hydrogen 2.891 N/A ARG 360.A N TRP 356.A O no hydrogen 2.900 N/A VAL 361.A N HIS 357.A O no hydrogen 2.949 N/A ARG 362.A N GLY 358.A O no hydrogen 2.936 N/A LEU 363.A N GLU 359.A O no hydrogen 2.931 N/A ILE 364.A N ARG 360.A O no hydrogen 2.978 N/A GLN 365.A N VAL 361.A O no hydrogen 2.960 N/A ARG 366.A N ARG 362.A O no hydrogen 2.964 N/A GLU 367.A N LEU 363.A O no hydrogen 2.967 N/A GLN 368.A N ILE 364.A O no hydrogen 2.915 N/A GLU 369.A N GLN 365.A O no hydrogen 2.879 N/A GLN 370.A N ARG 366.A O no hydrogen 2.980 N/A ARG 371.A N GLU 367.A O no hydrogen 2.968 N/A GLU 372.A N GLN 368.A O no hydrogen 2.939 N/A ARG 373.A N GLU 369.A O no hydrogen 2.958 N/A ALA 374.A N GLN 370.A O no hydrogen 2.882 N/A ARG 375.A N ARG 371.A O no hydrogen 2.950 N/A GLN 376.A N GLU 372.A O no hydrogen 2.923 N/A ASP 377.A N ARG 373.A O no hydrogen 2.947 N/A TYR 378.A N ALA 374.A O no hydrogen 2.905 N/A GLU 379.A N ARG 375.A O no hydrogen 2.908 N/A ALA 380.A N GLN 376.A O no hydrogen 2.902 N/A ARG 381.A N ASP 377.A O no hydrogen 2.951 N/A ARG 382.A N TYR 378.A O no hydrogen 2.885 N/A ALA 383.A N GLU 379.A O no hydrogen 2.917 N/A ALA 384.A N ALA 380.A O no hydrogen 3.311 N/A