Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q60_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 6.A N GLY 2.A O no hydrogen 3.300 N/A ARG 7.A N ASP 3.A O no hydrogen 2.838 N/A ARG 7.A NE ASP 8.A OD1 no hydrogen 3.158 N/A ARG 7.A NH2 ASP 8.A OD1 no hydrogen 3.327 N/A ASP 8.A N SER 4.A O no hydrogen 2.974 N/A LEU 9.A N PHE 5.A O no hydrogen 2.841 N/A LEU 10.A N MET 6.A O no hydrogen 2.953 N/A LYS 11.A N ARG 7.A O no hydrogen 3.020 N/A LYS 11.A NZ GLU 14.A OE1 no hydrogen 3.311 N/A ARG 12.A N ASP 8.A O no hydrogen 2.899 N/A GLU 13.A N LEU 9.A O no hydrogen 2.991 N/A GLU 14.A N LYS 11.A O no hydrogen 3.153 N/A ILE 17.A N GLU 13.A O no hydrogen 2.936 N/A GLY 18.A N GLU 14.A O no hydrogen 2.925 N/A TYR 19.A N GLU 15.A O no hydrogen 3.014 N/A CYS 20.A N LEU 16.A O no hydrogen 3.034 N/A CYS 20.A SG LEU 16.A O no hydrogen 3.443 N/A ARG 21.A N ILE 17.A O no hydrogen 2.758 N/A ARG 21.A NH2.B SER 153.A O no hydrogen 2.579 N/A GLU 22.A N GLY 18.A O no hydrogen 2.906 N/A GLU 23.A N TYR 19.A O no hydrogen 2.914 N/A ALA 24.A N CYS 20.A O no hydrogen 3.035 N/A ALA 24.A N ARG 21.A O no hydrogen 3.245 N/A LEU 25.A N GLU 22.A O no hydrogen 3.128 N/A LYS 26.A N GLU 23.A O no hydrogen 3.266 N/A LYS 26.A NZ GLU 23.A OE1 no hydrogen 2.954 N/A ALA 29.A N LYS 26.A O no hydrogen 3.158 N/A VAL 32.A N PRO 28.A O no hydrogen 3.122 N/A GLU 33.A N ALA 29.A O no hydrogen 2.990 N/A ALA 34.A N ALA 30.A O no hydrogen 3.133 N/A VAL 35.A N MET 31.A O no hydrogen 3.041 N/A THR 36.A N VAL 32.A O no hydrogen 3.073 N/A THR 36.A OG1 VAL 32.A O no hydrogen 2.711 N/A ALA 37.A N GLU 33.A O no hydrogen 3.211 N/A THR 38.A N ALA 34.A O no hydrogen 3.140 N/A THR 38.A N VAL 35.A O no hydrogen 3.056 N/A THR 38.A OG1 ALA 34.A O no hydrogen 2.787 N/A THR 38.A OG1 PRO 138.A O no hydrogen 3.486 N/A VAL 39.A N VAL 35.A O no hydrogen 3.110 N/A TRP 40.A N THR 36.A O no hydrogen 2.830 N/A THR 46.A N LEU 59.A O no hydrogen 3.016 N/A THR 46.A OG1 VAL 39.A O no hydrogen 2.926 N/A VAL 48.A N ARG 57.A O no hydrogen 2.966 N/A ASP 49.A N ALA 126.A O no hydrogen 2.894 N/A SER 50.A N GLY 55.A O no hydrogen 3.003 N/A SER 50.A OG SER 53.A OG no hydrogen 3.422 N/A SER 50.A OG ASP 123.A OD1 no hydrogen 2.598 N/A SER 50.A OG ASP 123.A OD2 no hydrogen 3.220 N/A LEU 51.A N ALA 124.A O no hydrogen 2.762 N/A LEU 52.A N SER 50.A OG no hydrogen 3.120 N/A SER 53.A N SER 50.A OG no hydrogen 3.178 N/A GLY 55.A N SER 53.A OG no hydrogen 2.803 N/A ARG 57.A N VAL 48.A O no hydrogen 2.896 N/A ARG 57.A NE ASP 78.A OD2 no hydrogen 2.926 N/A ARG 57.A NH1 ASP 123.A OD2 no hydrogen 3.063 N/A ARG 57.A NH2 ASP 78.A OD2 no hydrogen 2.693 N/A LEU 59.A N THR 46.A O no hydrogen 3.014 N/A LYS 60.A N ARG 77.A O no hydrogen 2.892 N/A LEU 61.A N ALA 44.A O no hydrogen 2.828 N/A VAL 62.A N LEU 75.A O no hydrogen 2.899 N/A GLU 63.A N LEU 75.A O no hydrogen 3.266 N/A LEU 65.A N VAL 73.A O no hydrogen 2.903 N/A ARG 66.A N VAL 73.A O no hydrogen 3.159 N/A ARG 66.A NE ASP 155.A OD1 no hydrogen 2.835 N/A ARG 66.A NH2 ASP 155.A OD2 no hydrogen 2.854 N/A GLY 68.A N SER 71.A O no hydrogen 2.931 N/A VAL 72.A N VAL 89.A O no hydrogen 2.930 N/A VAL 73.A N ARG 66.A O no hydrogen 2.860 N/A PHE 74.A N LEU 87.A O no hydrogen 2.866 N/A LEU 75.A N GLU 63.A O no hydrogen 2.847 N/A VAL 76.A N PHE 85.A O no hydrogen 2.913 N/A ARG 77.A N LYS 60.A O no hydrogen 2.877 N/A ARG 77.A NH1 ASP 84.A OD1 no hydrogen 3.147 N/A ASP 78.A N GLU 83.A O no hydrogen 2.859 N/A VAL 79.A N LYS 58.A O no hydrogen 3.023 N/A GLU 80.A N ASP 78.A OD1 no hydrogen 3.079 N/A ARG 81.A N ASP 78.A OD1 no hydrogen 3.043 N/A PHE 85.A N VAL 76.A O no hydrogen 2.856 N/A ALA 86.A N MET 149.A O no hydrogen 2.789 N/A LEU 87.A N PHE 74.A O no hydrogen 2.783 N/A LYS 88.A N LEU 147.A O no hydrogen 2.850 N/A VAL 89.A N VAL 72.A O no hydrogen 2.987 N/A THR 91.A N ARG 70.A O no hydrogen 3.030 N/A MET 92.A N ALA 141.A O no hydrogen 2.867 N/A SER 97.A N ALA 94.A O no hydrogen 2.980 N/A SER 97.A OG ALA 94.A O no hydrogen 2.594 N/A ARG 98.A NE GLU 102.A OE2 no hydrogen 3.041 N/A GLU 100.A N ASN 96.A O no hydrogen 2.957 N/A LEU 101.A N SER 97.A O no hydrogen 2.847 N/A GLU 102.A N ARG 98.A O no hydrogen 3.026 N/A ARG 103.A N SER 99.A O no hydrogen 3.108 N/A LEU 104.A N GLU 100.A O no hydrogen 2.960 N/A HIS 105.A N LEU 101.A O no hydrogen 2.873 N/A HIS 105.A ND1 TYR 145.A OH no hydrogen 2.848 N/A GLU 106.A N GLU 102.A O no hydrogen 2.992 N/A ALA 107.A N ARG 103.A O no hydrogen 2.825 N/A THR 108.A N LEU 104.A O no hydrogen 2.787 N/A THR 108.A OG1 LEU 104.A O no hydrogen 2.790 N/A PHE 109.A N HIS 105.A O no hydrogen 3.062 N/A ALA 110.A N GLU 106.A O no hydrogen 3.059 N/A ALA 111.A N ALA 107.A O no hydrogen 3.147 N/A ALA 112.A N THR 108.A O no hydrogen 2.902 N/A ARG 113.A N PHE 109.A O no hydrogen 3.011 N/A LEU 114.A N ALA 110.A O no hydrogen 3.162 N/A LEU 115.A N ALA 111.A O no hydrogen 3.029 N/A GLY 116.A N ALA 112.A O no hydrogen 3.112 N/A LEU 119.A N LEU 217.A O no hydrogen 2.757 N/A SER 122.A N LEU 148.A O no hydrogen 2.964 N/A ASP 123.A N LEU 148.A O no hydrogen 3.453 N/A ALA 124.A N ASP 123.A OD1 no hydrogen 2.782 N/A VAL 125.A N LEU 146.A O no hydrogen 2.874 N/A ALA 126.A N ASP 49.A O no hydrogen 2.862 N/A VAL 127.A N ASN 144.A OD1 no hydrogen 2.717 N/A GLN 128.A NE2 ASP 49.A OD1 no hydrogen 2.811 N/A GLN 128.A NE2 GLU 56.A OE2 no hydrogen 2.951 N/A GLN 130.A NE2 SER 137.A O no hydrogen 2.929 N/A PHE 133.A N ASN 144.A O no hydrogen 2.865 N/A LEU 136.A N VAL 142.A O no hydrogen 2.733 N/A SER 137.A N GLN 130.A OE1 no hydrogen 2.853 N/A ALA 143.A N PHE 90.A O no hydrogen 2.959 N/A ASN 144.A N ALA 134.A O no hydrogen 2.883 N/A ASN 144.A ND2 VAL 127.A O no hydrogen 3.327 N/A ASN 144.A ND2 PRO 131.A O no hydrogen 3.024 N/A TYR 145.A OH HIS 105.A ND1 no hydrogen 2.848 N/A LEU 146.A N VAL 125.A O no hydrogen 2.868 N/A LEU 147.A N LYS 88.A O no hydrogen 2.860 N/A LEU 148.A N ASP 123.A O no hydrogen 2.855 N/A MET 149.A N ALA 86.A O no hydrogen 2.924 N/A SER 153.A N ILE 209.A O no hydrogen 2.834 N/A VAL 154.A N ILE 209.A O no hydrogen 3.366 N/A LEU 156.A N LEU 207.A O no hydrogen 2.881 N/A GLU 157.A N PRO 204.A O no hydrogen 3.050 N/A LEU 158.A N ASP 155.A OD2 no hydrogen 3.178 N/A LEU 159.A N ASP 155.A O no hydrogen 3.066 N/A PHE 160.A N LEU 156.A O no hydrogen 2.887 N/A SER 161.A N GLU 157.A O no hydrogen 3.005 N/A SER 161.A OG GLU 157.A O no hydrogen 3.543 N/A SER 161.A OG LEU 158.A O no hydrogen 3.257 N/A THR 162.A N LEU 158.A O no hydrogen 2.834 N/A THR 162.A OG1 LEU 158.A O no hydrogen 2.806 N/A LEU 163.A N LEU 159.A O no hydrogen 2.855 N/A ASP 164.A N PHE 160.A O no hydrogen 2.977 N/A PHE 165.A N THR 162.A O no hydrogen 3.313 N/A ARG 170.A NE GLU 13.A OE1 no hydrogen 3.412 N/A ARG 170.A NE GLU 13.A OE2 no hydrogen 2.869 N/A ARG 170.A NH2 GLU 13.A OE1 no hydrogen 3.096 N/A GLY 174.A N ARG 170.A O no hydrogen 3.235 N/A LEU 176.A N ASP 172.A O no hydrogen 2.936 N/A ALA 177.A N GLU 173.A O no hydrogen 2.949 N/A LEU 178.A N GLY 174.A O no hydrogen 3.081 N/A HIS 179.A N ILE 175.A O no hydrogen 3.154 N/A HIS 179.A ND1 ILE 175.A O no hydrogen 2.780 N/A ILE 180.A N LEU 176.A O no hydrogen 2.938 N/A LEU 181.A N ALA 177.A O no hydrogen 2.939 N/A THR 182.A N LEU 178.A O no hydrogen 3.081 N/A THR 182.A OG1 LEU 178.A O no hydrogen 2.823 N/A ALA 183.A N HIS 179.A O no hydrogen 2.938 N/A GLN 184.A N ILE 180.A O no hydrogen 2.881 N/A GLN 184.A NE2 ASP 3.A OD1 no hydrogen 3.088 N/A GLN 184.A NE2 GLY 213.A O no hydrogen 3.141 N/A LEU 185.A N LEU 181.A O no hydrogen 2.954 N/A ILE 186.A N THR 182.A O no hydrogen 3.175 N/A ARG 187.A N ALA 183.A O no hydrogen 2.939 N/A LEU 188.A N GLN 184.A O no hydrogen 2.882 N/A ALA 189.A N LEU 185.A O no hydrogen 2.986 N/A ALA 190.A N ILE 186.A O no hydrogen 2.859 N/A ASN 191.A N ARG 187.A O no hydrogen 2.953 N/A LEU 192.A N LEU 188.A O no hydrogen 3.176 N/A GLN 193.A N ALA 189.A O no hydrogen 3.044 N/A SER 194.A N ALA 190.A O no hydrogen 2.919 N/A SER 194.A OG ASN 191.A O no hydrogen 2.935 N/A LYS 195.A N LEU 192.A O no hydrogen 3.026 N/A LYS 195.A NZ ASN 191.A OD1 no hydrogen 2.910 N/A GLY 196.A N GLN 193.A O no hydrogen 2.931 N/A LEU 197.A N LEU 192.A O no hydrogen 2.949 N/A VAL 198.A N TRP 224.A O no hydrogen 2.883 N/A HIS 199.A N ASN 257.A OD1 no hydrogen 2.826 N/A HIS 199.A NE2 GLY 218.A O no hydrogen 2.938 N/A HIS 199.A NE2 ASP 219.A O no hydrogen 2.887 N/A GLY 200.A N ALA 222.A O no hydrogen 2.917 N/A HIS 201.A N HIS 199.A ND1 no hydrogen 2.900 N/A HIS 201.A NE2 ASP 219.A OD1 no hydrogen 2.792 N/A PHE 202.A N GLN 260.A OE1 no hydrogen 3.024 N/A THR 203.A OG1 HIS 201.A O no hydrogen 3.339 N/A THR 203.A OG1 ASP 205.A OD1 no hydrogen 2.722 N/A ASN 206.A N THR 203.A O no hydrogen 2.783 N/A ASN 206.A ND2 HIS 201.A O no hydrogen 3.148 N/A ASN 206.A ND2 GLY 218.A O no hydrogen 2.977 N/A LEU 207.A N PRO 204.A O no hydrogen 3.520 N/A PHE 208.A N MET 216.A O no hydrogen 2.832 N/A ILE 209.A N VAL 154.A O no hydrogen 2.920 N/A MET 210.A N ARG 214.A O no hydrogen 2.961 N/A GLY 213.A N MET 210.A O no hydrogen 2.833 N/A ARG 214.A N ASP 212.A OD1 no hydrogen 3.029 N/A MET 216.A N PHE 208.A O no hydrogen 2.786 N/A LEU 217.A N ARG 117.A O no hydrogen 2.934 N/A GLY 218.A N ASN 206.A O no hydrogen 3.102 N/A ALA 222.A N ASP 219.A O no hydrogen 2.949 N/A LEU 223.A N VAL 220.A O no hydrogen 2.969 N/A TRP 224.A N VAL 198.A O no hydrogen 2.817 N/A LYS 225.A NZ LYS 195.A O no hydrogen 3.223 N/A LYS 225.A NZ GLY 196.A O no hydrogen 3.439 N/A VAL 226.A N GLY 196.A O no hydrogen 2.893 N/A GLY 227.A N PHE 252.A O no hydrogen 2.767 N/A THR 228.A N LYS 225.A O no hydrogen 3.169 N/A THR 228.A OG1 LYS 225.A O no hydrogen 2.712 N/A ARG 229.A NH1 THR 251.A OG1 no hydrogen 2.920 N/A GLY 230.A N ALA 250.A O no hydrogen 2.894 N/A ALA 232.A N SER 248.A O no hydrogen 2.984 N/A SER 234.A N PRO 231.A O no hydrogen 3.072 N/A SER 234.A OG PRO 231.A O no hydrogen 2.734 N/A VAL 235.A N ALA 232.A O no hydrogen 3.071 N/A TYR 239.A N PRO 236.A O no hydrogen 2.896 N/A ALA 240.A N VAL 237.A O no hydrogen 3.379 N/A ARG 242.A NE LEU 291.A O no hydrogen 2.784 N/A ARG 242.A NH2 LEU 291.A O no hydrogen 3.244 N/A ARG 242.A NH2 ASP 297.A OD1 no hydrogen 3.286 N/A ARG 242.A NH2 ASP 297.A OD2 no hydrogen 3.183 N/A GLU 243.A N GLU 243.A OE1 no hydrogen 2.962 N/A PHE 244.A N PRO 241.A O no hydrogen 2.928 N/A LEU 245.A N PRO 241.A O no hydrogen 3.334 N/A ALA 250.A N GLY 230.A O no hydrogen 2.858 N/A PHE 252.A N THR 228.A O no hydrogen 2.780 N/A LEU 256.A N THR 253.A O no hydrogen 3.154 N/A LEU 256.A N THR 253.A OG1 no hydrogen 3.180 N/A ASN 257.A ND2 HIS 199.A O no hydrogen 2.719 N/A ASN 257.A ND2 GLN 260.A OE1 no hydrogen 3.077 N/A ALA 258.A N HIS 254.A O no hydrogen 2.988 N/A TRP 259.A N ALA 255.A O no hydrogen 3.053 N/A GLN 260.A N LEU 256.A O no hydrogen 2.922 N/A GLN 260.A NE2 GLY 200.A O no hydrogen 3.167 N/A GLN 260.A NE2 TYR 239.A O no hydrogen 3.146 N/A LEU 261.A N ASN 257.A O no hydrogen 2.842 N/A GLY 262.A N ALA 258.A O no hydrogen 2.912 N/A LEU 263.A N TRP 259.A O no hydrogen 2.968 N/A SER 264.A N GLN 260.A O no hydrogen 3.050 N/A ILE 265.A N LEU 261.A O no hydrogen 2.934 N/A TYR 266.A N GLY 262.A O no hydrogen 2.946 N/A TYR 266.A OH ALA 300.A O no hydrogen 2.573 N/A ARG 267.A N LEU 263.A O no hydrogen 2.891 N/A ARG 267.A NE LEU 271.A O no hydrogen 2.824 N/A ARG 267.A NH1 GLU 157.A OE1 no hydrogen 2.701 N/A ARG 267.A NH1 GLU 157.A OE2 no hydrogen 3.529 N/A ARG 267.A NH1 TYR 239.A OH no hydrogen 2.924 N/A ARG 267.A NH2 GLU 157.A OE2 no hydrogen 3.269 N/A ARG 267.A NH2 LEU 271.A O no hydrogen 3.176 N/A VAL 268.A N SER 264.A O no hydrogen 2.903 N/A TRP 269.A N ILE 265.A O no hydrogen 3.327 N/A TRP 269.A N TYR 266.A O no hydrogen 3.204 N/A TRP 269.A NE1 THR 182.A OG1 no hydrogen 2.931 N/A CYS 270.A N TYR 266.A O no hydrogen 2.793 N/A LEU 271.A N ARG 267.A O no hydrogen 2.808 N/A PHE 272.A N CYS 270.A O no hydrogen 2.803 N/A LEU 273.A N THR 279.A OG1 no hydrogen 2.908 N/A LEU 277.A N PRO 274.A O no hydrogen 3.062 N/A VAL 278.A N ARG 288.A O no hydrogen 2.847 N/A THR 279.A N SER 285.A OG no hydrogen 2.720 N/A THR 279.A OG1 LEU 277.A O no hydrogen 3.030 N/A ILE 282.A N THR 279.A O no hydrogen 3.224 N/A LYS 283.A N ASP 164.A OD2 no hydrogen 2.845 N/A LYS 283.A NZ ASP 164.A O no hydrogen 2.936 N/A SER 285.A N ILE 282.A O no hydrogen 3.470 N/A SER 285.A OG TRP 286.A O no hydrogen 2.569 N/A ARG 288.A N GLY 276.A O no hydrogen 3.016 N/A ARG 288.A NE SER 290.A O no hydrogen 3.226 N/A ARG 288.A NE VAL 293.A O no hydrogen 3.008 N/A ARG 288.A NH1 PHE 275.A O no hydrogen 2.984 N/A ARG 288.A NH1 ASP 297.A OD1 no hydrogen 2.861 N/A ARG 288.A NH2 VAL 293.A O no hydrogen 2.871 N/A ARG 288.A NH2 ASP 297.A OD1 no hydrogen 2.792 N/A ARG 292.A N SER 290.A OG no hydrogen 3.085 N/A ARG 292.A NE LEU 245.A O no hydrogen 3.034 N/A ARG 292.A NH2 LEU 245.A O no hydrogen 3.033 N/A VAL 293.A N SER 290.A O no hydrogen 3.381 N/A CYS 304.A N PHE 301.A O no hydrogen 3.016 N/A CYS 304.A SG ALA 300.A O no hydrogen 3.934 N/A THR 305.A N TRP 269.A O no hydrogen 2.864 N/A THR 305.A OG1 TRP 269.A O no hydrogen 3.302 N/A LYS 312.A N PRO 308.A O no hydrogen 3.112 N/A THR 313.A N ASP 309.A O no hydrogen 2.931 N/A THR 313.A OG1 ASP 309.A O no hydrogen 3.311 N/A LEU 314.A N PHE 310.A O no hydrogen 3.171 N/A ILE 315.A N VAL 311.A O no hydrogen 2.948 N/A GLY 316.A N LYS 312.A O no hydrogen 2.972 N/A ARG 317.A N THR 313.A O no hydrogen 2.981 N/A PHE 318.A N LEU 314.A O no hydrogen 2.950 N/A LEU 319.A N ILE 315.A O no hydrogen 2.875 N/A ASP 322.A N ASN 320.A OD1 no hydrogen 2.903 N/A ARG 324.A N ASP 322.A OD1 no hydrogen 3.010 N/A ARG 325.A N ASP 322.A O no hydrogen 2.906 N/A ARG 326.A NE ASN 320.A O no hydrogen 2.878 N/A ARG 326.A NH1 GLU 243.A OE2 no hydrogen 2.914 N/A ARG 326.A NH1 ALA 255.A O no hydrogen 3.075 N/A ARG 326.A NH2 ASN 320.A O no hydrogen 3.132 N/A ARG 326.A NH2 PHE 321.A O no hydrogen 3.335 N/A LEU 327.A N ARG 317.A O no hydrogen 3.098 N/A LEU 328.A N GLU 331.A OE2 no hydrogen 2.994 N/A LEU 330.A N GLN 193.A OE1 no hydrogen 2.865 N/A ALA 332.A N LEU 328.A O no hydrogen 2.759 N/A MET 333.A N PRO 329.A O no hydrogen 3.101 N/A MET 333.A N LEU 330.A O no hydrogen 3.281 N/A GLU 334.A N GLU 331.A O no hydrogen 2.865 N/A THR 335.A N ALA 332.A O no hydrogen 3.114 N/A THR 335.A OG1 ALA 332.A O no hydrogen 2.735 N/A GLU 337.A N GLU 337.A OE1 no hydrogen 2.739 N/A PHE 338.A N THR 335.A OG1 no hydrogen 3.135 N/A LEU 339.A N THR 335.A O no hydrogen 3.224 N/A GLN 340.A N PRO 336.A O no hydrogen 3.024 N/A LEU 341.A N GLU 337.A O no hydrogen 3.026 N/A GLN 342.A N PHE 338.A O no hydrogen 2.915 N/A ASN 343.A N LEU 339.A O no hydrogen 2.943 N/A GLU 344.A N GLN 340.A O no hydrogen 2.835 N/A ILE 345.A N LEU 341.A O no hydrogen 3.142 N/A SER 346.A N GLN 342.A O no hydrogen 2.870 N/A SER 346.A OG GLN 342.A O no hydrogen 3.251 N/A SER 347.A N ASN 343.A O no hydrogen 2.868 N/A SER 347.A OG ASN 343.A O no hydrogen 3.117 N/A SER 347.A OG GLU 344.A O no hydrogen 3.386 N/A SER 348.A N GLU 344.A O no hydrogen 3.054 N/A SER 348.A OG GLU 344.A O no hydrogen 3.014 N/A LEU 349.A N ILE 345.A O no hydrogen 2.971 N/A SER 350.A N SER 346.A O no hydrogen 3.183 N/A SER 350.A OG SER 347.A O no hydrogen 2.882 N/A SER 350.A OG SER 350.A O no hydrogen 2.591 N/A