Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3iu2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A N ASP 7.A OD1 no hydrogen 3.367 N/A TYR 3.A N ASP 7.A OD2 no hydrogen 2.966 N/A TYR 3.A OH VAL 172.A O no hydrogen 3.010 N/A ASP 7.A N TYR 3.A O no hydrogen 2.918 N/A THR 8.A N PHE 5.A O no hydrogen 2.919 N/A THR 8.A OG1 PHE 5.A O no hydrogen 2.676 N/A GLN 9.A N TRP 6.A O no hydrogen 3.189 N/A GLN 9.A NE2 THR 8.A OG1 no hydrogen 3.057 N/A VAL 11.A N GLN 9.A O no hydrogen 2.754 N/A LYS 13.A N GLU 16.A OE1 no hydrogen 2.954 N/A GLU 16.A N LYS 13.A O no hydrogen 3.335 N/A GLY 22.A N LYS 368.A O no hydrogen 2.895 N/A GLU 25.A N ASN 366.A OD1 no hydrogen 2.849 N/A LYS 28.A NZ GLU 25.A OE1 no hydrogen 3.433 N/A ASP 29.A N ASP 29.A OD1.A no hydrogen 2.570 N/A ARG 32.A NH1 GLU 34.A O no hydrogen 2.878 N/A TYR 36.A N GLU 152.A OE1 no hydrogen 3.096 N/A GLN 40.A N GLN 40.A OE1 no hydrogen 2.754 N/A PHE 42.A N PRO 39.A O no hydrogen 3.332 N/A THR 43.A N ARG 101.A O no hydrogen 2.853 N/A THR 43.A OG1 TRP 44.A O no hydrogen 3.330 N/A TRP 44.A NE1 TYR 36.A O no hydrogen 2.803 N/A ASP 45.A N GLY 99.A O no hydrogen 2.965 N/A LEU 47.A N HIS 97.A O no hydrogen 2.955 N/A GLY 50.A N ASP 48.A OD1 no hydrogen 3.083 N/A ASP 51.A N ASP 48.A O no hydrogen 3.018 N/A VAL 54.A N ASP 51.A OD2 no hydrogen 2.970 N/A LEU 55.A N ASP 51.A O no hydrogen 3.001 N/A LYS 56.A N ARG 52.A O no hydrogen 3.143 N/A GLU 57.A N GLY 53.A O no hydrogen 3.097 N/A LEU 58.A N VAL 54.A O no hydrogen 3.049 N/A TYR 59.A N LEU 55.A O no hydrogen 2.858 N/A TYR 59.A OH ASP 77.A OD1 no hydrogen 2.769 N/A THR 60.A N LYS 56.A O no hydrogen 2.927 N/A THR 60.A OG1 LYS 56.A O no hydrogen 3.265 N/A LEU 61.A N GLU 57.A O no hydrogen 2.975 N/A LEU 62.A N LEU 58.A O no hydrogen 3.030 N/A ASN 63.A N TYR 59.A O no hydrogen 2.777 N/A ASN 63.A ND2 ASP 77.A OD1 no hydrogen 2.959 N/A GLU 64.A N THR 60.A O no hydrogen 2.953 N/A ASN 65.A N LEU 62.A O no hydrogen 3.354 N/A ASN 65.A ND2 LEU 61.A O no hydrogen 3.030 N/A TYR 66.A N LEU 62.A O no hydrogen 2.881 N/A ASP 69.A N PHE 74.A O no hydrogen 3.064 N/A ASP 71.A N ASP 69.A OD2 no hydrogen 3.058 N/A ASN 72.A N ASP 69.A O no hydrogen 3.062 N/A ASN 72.A ND2 GLU 68.A OE2 no hydrogen 2.954 N/A MET 73.A N ASP 69.A OD1 no hydrogen 2.660 N/A PHE 74.A N ASP 69.A OD1 no hydrogen 2.801 N/A ARG 75.A N THR 292.A O no hydrogen 3.041 N/A ARG 75.A NE GLU 68.A OE1 no hydrogen 2.971 N/A ARG 75.A NH1 ASN 63.A O no hydrogen 3.258 N/A ARG 75.A NH2 GLU 68.A OE1 no hydrogen 2.891 N/A PHE 76.A N VAL 67.A O no hydrogen 3.131 N/A ASP 77.A N PRO 290.A O no hydrogen 2.900 N/A TYR 78.A OH GLN 382.A O no hydrogen 2.538 N/A PHE 82.A N SER 79.A OG no hydrogen 2.963 N/A LEU 83.A N SER 79.A O no hydrogen 2.914 N/A LEU 84.A N PRO 80.A O no hydrogen 3.022 N/A TRP 85.A N GLU 81.A O no hydrogen 3.175 N/A TRP 85.A NE1 HIS 259.A O no hydrogen 2.852 N/A ALA 86.A N PHE 82.A O no hydrogen 2.833 N/A LEU 87.A N LEU 83.A O no hydrogen 2.950 N/A ARG 88.A N LEU 84.A O no hydrogen 3.015 N/A TRP 92.A N PRO 89.A O no hydrogen 3.043 N/A GLN 95.A N GLN 95.A OE1 no hydrogen 2.957 N/A TRP 96.A N LEU 93.A O no hydrogen 3.126 N/A TRP 96.A NE1 ARG 156.A O no hydrogen 3.216 N/A HIS 97.A N PRO 94.A O no hydrogen 3.218 N/A HIS 97.A NE2 LEU 87.A O no hydrogen 2.874 N/A CYS 98.A N ILE 112.A O no hydrogen 3.023 N/A GLY 99.A N ASP 45.A O no hydrogen 2.913 N/A VAL 100.A N GLY 110.A O no hydrogen 2.830 N/A ARG 101.A N THR 43.A O no hydrogen 2.900 N/A ARG 101.A NE ASP 45.A OD2 no hydrogen 2.757 N/A ARG 101.A NH1 GLU 57.A OE1 no hydrogen 3.447 N/A ARG 101.A NH1 GLU 57.A OE2 no hydrogen 2.776 N/A ARG 101.A NH1 ARG 106.A O no hydrogen 2.787 N/A ARG 101.A NH2 GLU 57.A OE1 no hydrogen 2.927 N/A VAL 102.A N LYS 107.A O no hydrogen 2.941 N/A VAL 103.A N GLY 41.A O no hydrogen 2.806 N/A ARG 106.A N VAL 102.A O no hydrogen 2.784 N/A ARG 106.A NH1 VAL 103.A O no hydrogen 3.247 N/A LYS 107.A N SER 105.A OG no hydrogen 3.239 N/A VAL 109.A N VAL 100.A O no hydrogen 2.850 N/A GLY 110.A N VAL 100.A O no hydrogen 3.227 N/A PHE 111.A N CYS 135.A O no hydrogen 2.992 N/A ILE 112.A N CYS 98.A O no hydrogen 3.013 N/A SER 113.A N ASN 132.A O no hydrogen 3.070 N/A SER 113.A OG ASN 132.A O no hydrogen 2.741 N/A ALA 114.A N TRP 96.A O no hydrogen 3.078 N/A ILE 115.A N GLU 130.A O no hydrogen 3.085 N/A ALA 117.A N MET 128.A O no hydrogen 3.035 N/A ILE 119.A N LYS 126.A O no hydrogen 2.888 N/A HIS 120.A N THR 249.A O no hydrogen 2.878 N/A ILE 121.A N THR 124.A O no hydrogen 2.821 N/A TYR 122.A N HIS 247.A O no hydrogen 2.843 N/A TYR 122.A OH PRO 370.A O no hydrogen 2.825 N/A THR 124.A N ILE 121.A O no hydrogen 3.062 N/A LYS 126.A N ILE 119.A O no hydrogen 2.891 N/A MET 128.A N ALA 117.A O no hydrogen 2.779 N/A VAL 129.A N GLN 164.A O no hydrogen 3.289 N/A GLU 130.A N ILE 115.A O no hydrogen 2.866 N/A ILE 131.A N VAL 166.A O no hydrogen 3.145 N/A ASN 132.A N SER 113.A O no hydrogen 3.205 N/A ASN 132.A ND2 GLN 382.A OXT no hydrogen 2.931 N/A PHE 133.A N ASN 132.A OD1 no hydrogen 2.891 N/A CYS 135.A N PHE 111.A O no hydrogen 2.924 N/A CYS 135.A SG ASN 65.A O no hydrogen 3.378 N/A HIS 137.A N VAL 109.A O no hydrogen 2.933 N/A LYS 138.A N ASN 65.A OD1 no hydrogen 2.981 N/A LYS 138.A NZ GLU 68.A OE1 no hydrogen 2.792 N/A LYS 139.A N HIS 137.A ND1 no hydrogen 3.132 N/A LEU 140.A N HIS 137.A O no hydrogen 2.820 N/A ARG 141.A N LYS 138.A O no hydrogen 3.434 N/A ARG 141.A NE VAL 136.A O no hydrogen 2.782 N/A ARG 141.A NH2 VAL 136.A O no hydrogen 3.344 N/A LEU 149.A N VAL 145.A O no hydrogen 3.127 N/A ILE 150.A N ALA 146.A O no hydrogen 2.919 N/A ARG 151.A N PRO 147.A O no hydrogen 2.915 N/A ARG 151.A NH2 THR 8.A OG1 no hydrogen 3.265 N/A GLU 152.A N VAL 148.A O no hydrogen 2.927 N/A ILE 153.A N LEU 149.A O no hydrogen 3.059 N/A THR 154.A N ILE 150.A O no hydrogen 3.021 N/A THR 154.A OG1 ILE 150.A O no hydrogen 2.813 N/A ARG 155.A N ARG 151.A O no hydrogen 2.958 N/A ARG 155.A NE GLU 152.A OE1 no hydrogen 2.974 N/A ARG 155.A NH1 ARG 32.A O no hydrogen 3.134 N/A ARG 155.A NH2 GLU 152.A OE2 no hydrogen 2.851 N/A ARG 156.A N GLU 152.A O no hydrogen 3.029 N/A ARG 156.A NE GLU 152.A OE2 no hydrogen 2.848 N/A ARG 156.A NH1 GLN 95.A O no hydrogen 2.956 N/A ARG 156.A NH2 GLU 152.A OE2 no hydrogen 3.198 N/A VAL 157.A N ILE 153.A O no hydrogen 2.936 N/A HIS 158.A N THR 154.A O no hydrogen 2.808 N/A LEU 159.A N ARG 155.A O no hydrogen 3.045 N/A GLU 160.A N VAL 157.A O no hydrogen 3.045 N/A GLY 161.A N HIS 158.A O no hydrogen 2.955 N/A ILE 162.A N VAL 157.A O no hydrogen 3.417 N/A GLN 164.A NE2 ASN 366.A O no hydrogen 2.970 N/A ALA 165.A N TYR 365.A O no hydrogen 3.417 N/A VAL 166.A N VAL 129.A O no hydrogen 2.909 N/A TYR 167.A N TYR 363.A O no hydrogen 3.222 N/A ALA 169.A N GLN 361.A O no hydrogen 3.072 N/A LEU 173.A N TYR 363.A OH no hydrogen 2.799 N/A LYS 175.A NZ GLU 16.A O no hydrogen 3.400 N/A VAL 177.A N TYR 362.A O no hydrogen 2.835 N/A CYS 180.A N LEU 360.A O no hydrogen 2.790 N/A ARG 181.A N ASP 340.A OD1 no hydrogen 2.768 N/A ARG 181.A NH2 GLY 356.A O no hydrogen 3.121 N/A TYR 182.A OH.B TYR 306.A OH no hydrogen 3.057 N/A TRP 183.A N ALA 338.A O no hydrogen 2.879 N/A HIS 184.A N GLY 354.A O no hydrogen 2.856 N/A HIS 184.A ND1 ASN 337.A OD1 no hydrogen 2.712 N/A ARG 185.A N PHE 336.A O no hydrogen 2.782 N/A ARG 185.A NE LEU 351.A O no hydrogen 2.989 N/A ARG 185.A NH1 SER 186.A O no hydrogen 2.780 N/A ARG 185.A NH1 TYR 213.A O no hydrogen 2.925 N/A LEU 187.A N ASP 334.A O no hydrogen 2.979 N/A ASN 188.A N ASP 334.A O no hydrogen 2.990 N/A ASN 188.A ND2 ASP 334.A OD2 no hydrogen 3.163 N/A LYS 191.A NZ SER 301.A O no hydrogen 2.702 N/A LYS 191.A NZ ASP 334.A OD1 no hydrogen 2.871 N/A LEU 192.A N ASN 188.A O no hydrogen 3.124 N/A ILE 193.A N PRO 189.A O no hydrogen 2.953 N/A GLU 194.A N ARG 190.A O no hydrogen 3.136 N/A VAL 195.A N LYS 191.A O no hydrogen 2.990 N/A LYS 196.A N ILE 193.A O no hydrogen 3.030 N/A SER 198.A N LEU 192.A O no hydrogen 3.070 N/A ASN 203.A N SER 201.A OG no hydrogen 3.144 N/A MET 204.A N SER 201.A O no hydrogen 3.422 N/A ARG 208.A N THR 205.A OG1 no hydrogen 3.007 N/A ARG 208.A NH1 ARG 208.A O no hydrogen 3.264 N/A THR 209.A N THR 205.A O no hydrogen 2.883 N/A THR 209.A OG1 THR 205.A O no hydrogen 2.866 N/A MET 210.A N MET 206.A O no hydrogen 2.909 N/A LYS 211.A N GLN 207.A O no hydrogen 3.190 N/A LEU 212.A N ARG 208.A O no hydrogen 2.837 N/A TYR 213.A N THR 209.A O no hydrogen 3.206 N/A ARG 214.A N LYS 211.A O no hydrogen 3.340 N/A LYS 220.A N ASP 323.A OD1 no hydrogen 2.853 N/A THR 221.A N ASP 323.A OD2 no hydrogen 2.880 N/A THR 221.A OG1 ASP 323.A OD2 no hydrogen 2.840 N/A LEU 224.A N THR 221.A O no hydrogen 3.468 N/A ARG 225.A N VAL 272.A O no hydrogen 3.005 N/A ARG 225.A NE GLU 274.A OE2 no hydrogen 2.843 N/A ARG 225.A NH1 PRO 226.A O no hydrogen 3.232 N/A ARG 225.A NH1 ASP 231.A OD2 no hydrogen 2.667 N/A ARG 225.A NH2 ASP 231.A OD1 no hydrogen 2.973 N/A ARG 225.A NH2 ASP 231.A OD2 no hydrogen 3.545 N/A ARG 225.A NH2 GLU 274.A OE2 no hydrogen 3.215 N/A MET 227.A N THR 270.A O no hydrogen 2.909 N/A GLU 228.A N ASP 231.A OD2 no hydrogen 2.735 N/A ASP 231.A N GLU 228.A O no hydrogen 2.881 N/A ILE 232.A N THR 229.A O no hydrogen 3.133 N/A VAL 235.A N ASP 231.A O no hydrogen 2.971 N/A HIS 236.A N ILE 232.A O no hydrogen 3.044 N/A HIS 236.A NE2 MET 252.A O no hydrogen 2.874 N/A GLN 237.A N PRO 233.A O no hydrogen 2.894 N/A LEU 238.A N VAL 234.A O no hydrogen 2.793 N/A LEU 239.A N VAL 235.A O no hydrogen 2.984 N/A THR 240.A N HIS 236.A O no hydrogen 2.975 N/A THR 240.A OG1 HIS 236.A O no hydrogen 2.695 N/A ARG 241.A N GLN 237.A O no hydrogen 3.215 N/A TYR 242.A N LEU 238.A O no hydrogen 2.980 N/A TYR 242.A OH GLU 343.A OE1 no hydrogen 2.665 N/A LEU 243.A N LEU 239.A O no hydrogen 2.969 N/A GLN 245.A NE2 TYR 242.A O no hydrogen 3.001 N/A PHE 246.A N LEU 243.A O no hydrogen 3.141 N/A HIS 247.A N LYS 376.A O no hydrogen 2.816 N/A THR 249.A N HIS 120.A O no hydrogen 2.993 N/A VAL 251.A N ASN 118.A O no hydrogen 2.827 N/A SER 253.A N GLU 256.A OE1 no hydrogen 2.848 N/A SER 253.A OG GLU 256.A OE1 no hydrogen 3.456 N/A GLU 256.A N SER 253.A OG no hydrogen 3.003 N/A VAL 257.A N SER 253.A O no hydrogen 2.998 N/A GLU 258.A N GLN 254.A O no hydrogen 3.021 N/A HIS 259.A N GLU 255.A O no hydrogen 3.169 N/A HIS 259.A NE2 TRP 85.A O no hydrogen 2.678 N/A TRP 260.A N GLU 256.A O no hydrogen 2.883 N/A PHE 261.A N VAL 257.A O no hydrogen 2.950 N/A TYR 262.A N GLU 258.A O no hydrogen 3.039 N/A GLN 264.A N ILE 268.A O no hydrogen 2.931 N/A ILE 267.A N GLN 264.A O no hydrogen 2.971 N/A ILE 268.A N GLN 264.A O no hydrogen 2.995 N/A ASP 269.A N PHE 286.A O no hydrogen 3.029 N/A THR 270.A OG1 PHE 261.A O no hydrogen 2.657 N/A PHE 271.A N LEU 284.A O no hydrogen 2.884 N/A VAL 272.A N ARG 225.A O no hydrogen 2.792 N/A VAL 273.A N ASP 282.A O no hydrogen 2.853 N/A GLU 274.A N GLY 223.A O no hydrogen 3.007 N/A ASN 275.A N GLU 279.A O no hydrogen 2.884 N/A ASN 277.A N ASN 275.A OD1 no hydrogen 2.815 N/A GLY 278.A N ASN 275.A O no hydrogen 3.045 N/A GLU 279.A N ASN 275.A OD1 no hydrogen 2.982 N/A THR 281.A N VAL 273.A O no hydrogen 2.978 N/A THR 281.A OG1 ASP 282.A OD1 no hydrogen 2.651 N/A PHE 283.A N VAL 311.A O no hydrogen 2.972 N/A LEU 284.A N PHE 271.A O no hydrogen 2.878 N/A SER 285.A N ASN 310.A OD1 no hydrogen 3.231 N/A SER 285.A OG TYR 309.A O no hydrogen 2.797 N/A PHE 286.A N ASP 269.A O no hydrogen 3.018 N/A TYR 287.A N TYR 306.A O no hydrogen 2.875 N/A TYR 287.A OH LEU 381.A O no hydrogen 2.983 N/A THR 288.A N ILE 267.A O no hydrogen 2.881 N/A LEU 289.A N ALA 304.A O no hydrogen 3.100 N/A SER 291.A N LEU 302.A O no hydrogen 2.916 N/A THR 292.A N ARG 75.A O no hydrogen 2.753 N/A ILE 293.A N LYS 300.A O no hydrogen 2.997 N/A MET 294.A N MET 73.A O no hydrogen 2.901 N/A THR 298.A N HIS 296.A ND1 no hydrogen 3.323 N/A HIS 299.A N HIS 296.A ND1 no hydrogen 3.091 N/A LYS 300.A NZ HIS 296.A O no hydrogen 2.795 N/A LYS 300.A NZ PRO 297.A O no hydrogen 3.312 N/A LEU 302.A N SER 291.A O no hydrogen 2.913 N/A LYS 303.A N ASP 334.A OD1 no hydrogen 3.016 N/A LYS 303.A NZ LYS 331.A O no hydrogen 2.830 N/A ALA 305.A N VAL 335.A O no hydrogen 3.049 N/A TYR 306.A N TYR 287.A O no hydrogen 2.861 N/A TYR 306.A OH TYR 182.A OH.B no hydrogen 3.057 N/A SER 307.A N ASN 337.A O no hydrogen 2.875 N/A PHE 308.A N SER 285.A O no hydrogen 3.032 N/A TYR 309.A N SER 285.A OG no hydrogen 3.054 N/A ASN 310.A ND2 SER 307.A OG no hydrogen 2.925 N/A VAL 311.A N PHE 283.A O no hydrogen 2.920 N/A HIS 312.A NE2 GLU 343.A OE1 no hydrogen 2.909 N/A THR 313.A N ASP 282.A OD2 no hydrogen 2.810 N/A THR 313.A OG1 THR 281.A O no hydrogen 2.531 N/A GLN 314.A N ASP 282.A OD2 no hydrogen 3.108 N/A THR 315.A N ASP 282.A OD2 no hydrogen 3.072 N/A THR 315.A OG1 ASP 282.A OD1 no hydrogen 2.629 N/A LEU 320.A N PRO 316.A O no hydrogen 3.038 N/A MET 321.A N LEU 317.A O no hydrogen 2.965 N/A SER 322.A N LEU 318.A O no hydrogen 3.056 N/A ASP 323.A N ASP 319.A O no hydrogen 3.082 N/A ALA 324.A N LEU 320.A O no hydrogen 2.977 N/A LEU 325.A N MET 321.A O no hydrogen 2.948 N/A VAL 326.A N SER 322.A O no hydrogen 3.138 N/A LEU 327.A N ASP 323.A O no hydrogen 2.912 N/A ALA 328.A N ALA 324.A O no hydrogen 2.944 N/A LYS 329.A N LEU 325.A O no hydrogen 2.987 N/A MET 330.A N VAL 326.A O no hydrogen 2.935 N/A LYS 331.A N LEU 327.A O no hydrogen 3.053 N/A LYS 331.A NZ ASP 269.A OD1 no hydrogen 3.139 N/A GLY 332.A N LYS 329.A O no hydrogen 3.058 N/A PHE 333.A N ALA 328.A O no hydrogen 3.083 N/A ASP 334.A N LYS 303.A O no hydrogen 2.848 N/A PHE 336.A N ARG 185.A O no hydrogen 2.980 N/A ASN 337.A N ALA 305.A O no hydrogen 2.738 N/A ALA 338.A N TRP 183.A O no hydrogen 3.025 N/A ASP 340.A N ARG 181.A O no hydrogen 3.222 N/A MET 342.A N VAL 377.A O no hydrogen 3.058 N/A ASN 344.A N LEU 341.A O no hydrogen 2.948 N/A ASN 344.A ND2 LEU 339.A O no hydrogen 2.941 N/A LYS 345.A NZ GLU 375.A OE2.A no hydrogen 2.763 N/A THR 346.A N GLU 343.A O no hydrogen 3.069 N/A THR 346.A OG1 GLU 343.A O no hydrogen 2.721 N/A PHE 347.A N ASN 344.A O no hydrogen 3.001 N/A LEU 348.A N ASN 344.A O no hydrogen 3.129 N/A LEU 351.A N PHE 347.A O no hydrogen 3.009 N/A LYS 352.A N GLU 349.A O no hydrogen 3.242 N/A LYS 352.A NZ LEU 212.A O no hydrogen 2.859 N/A PHE 353.A N LEU 348.A O no hydrogen 2.993 N/A GLY 354.A N HIS 184.A O no hydrogen 2.832 N/A GLY 356.A N TYR 182.A O no hydrogen 2.758 N/A LEU 360.A N CYS 180.A O no hydrogen 2.841 N/A GLN 361.A N ALA 169.A O no hydrogen 2.890 N/A GLN 361.A NE2 THR 179.A OG1 no hydrogen 2.576 N/A TYR 362.A N GLY 178.A O no hydrogen 2.848 N/A TYR 362.A OH LEU 379.A O no hydrogen 2.683 N/A TYR 363.A N TYR 167.A O no hydrogen 2.865 N/A TYR 363.A OH VAL 171.A O no hydrogen 2.612 N/A TYR 365.A N ALA 165.A O no hydrogen 2.794 N/A TYR 365.A OH GLN 9.A OE1 no hydrogen 2.767 N/A ASN 366.A N PRO 10.A O no hydrogen 3.055 N/A ASN 366.A ND2 GLU 25.A O no hydrogen 3.506 N/A ASN 366.A ND2 PHE 163.A O no hydrogen 3.032 N/A LYS 368.A N GLY 22.A O no hydrogen 2.673 N/A CYS 369.A SG PRO 370.A O no hydrogen 3.786 N/A MET 372.A N VAL 177.A O no hydrogen 2.791 N/A GLU 375.A N GLU 375.A OE1.A no hydrogen 2.725 N/A GLU 375.A N GLU 375.A OE1.B no hydrogen 2.738 N/A LYS 376.A N GLY 373.A O no hydrogen 2.915 N/A VAL 377.A N ALA 374.A O no hydrogen 3.105 N/A GLY 378.A N LEU 248.A O no hydrogen 2.725 N/A VAL 380.A N TYR 309.A OH no hydrogen 3.025 N/A