Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3t6s_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N THR 185.A O no hydrogen 2.738 N/A MET 1.A N ASP 250.A OD2 no hydrogen 2.500 N/A TRP 3.A N LEU 183.A O no hydrogen 3.024 N/A TRP 3.A NE1 THR 185.A OG1 no hydrogen 2.917 N/A PHE 7.A N SER 174.A O no hydrogen 2.665 N/A VAL 8.A N ALA 180.A O no hydrogen 2.773 N/A SER 9.A N VAL 172.A O no hydrogen 2.752 N/A ALA 12.A N ALA 170.A O no hydrogen 2.932 N/A TRP 14.A N ALA 168.A O no hydrogen 2.781 N/A SER 19.A N VAL 43.A O no hydrogen 2.783 N/A ALA 21.A N GLU 41.A O no hydrogen 3.062 N/A ASP 23.A N THR 20.A OG1 no hydrogen 2.984 N/A ALA 24.A N THR 20.A O no hydrogen 3.086 N/A VAL 25.A N ALA 21.A O no hydrogen 2.799 N/A MET 26.A N GLN 22.A O no hydrogen 3.085 N/A ALA 27.A N ASP 23.A O no hydrogen 2.981 N/A GLY 28.A N VAL 25.A O no hydrogen 2.920 N/A LEU 29.A N ALA 24.A O no hydrogen 2.971 N/A ARG 34.A N ASP 31.A OD1 no hydrogen 3.129 N/A ARG 34.A NE TRP 156.A O no hydrogen 2.902 N/A ARG 34.A NH1 ASP 160.A O no hydrogen 2.879 N/A ARG 34.A NH2 TRP 156.A O no hydrogen 2.949 N/A ARG 34.A NH2 VAL 159.A O no hydrogen 2.749 N/A ARG 34.A NH2 ASP 160.A O no hydrogen 3.521 N/A SER 35.A N ASP 31.A O no hydrogen 3.136 N/A LYS 36.A N PRO 32.A O no hydrogen 3.174 N/A LEU 37.A N ALA 33.A O no hydrogen 3.012 N/A ARG 38.A N ARG 34.A O no hydrogen 2.904 N/A ARG 38.A NH2 ARG 267.A O no hydrogen 2.927 N/A GLY 39.A N SER 35.A O no hydrogen 3.288 N/A GLU 41.A N ARG 291.A O no hydrogen 2.827 N/A SER 42.A N ARG 291.A O no hydrogen 3.078 N/A SER 42.A OG THR 292.A O no hydrogen 2.706 N/A VAL 43.A N SER 19.A O no hydrogen 2.957 N/A THR 44.A N THR 293.A O no hydrogen 2.926 N/A THR 44.A OG1 ASP 166.A O no hydrogen 2.656 N/A THR 44.A OG1 THR 293.A O no hydrogen 3.244 N/A VAL 45.A N PRO 17.A O no hydrogen 2.953 N/A ALA 46.A N ASP 166.A OD2 no hydrogen 2.812 N/A SER 47.A OG ASP 52.A OD2 no hydrogen 2.674 N/A ALA 49.A N SER 47.A OG no hydrogen 3.027 N/A ASP 52.A N ALA 49.A O no hydrogen 2.954 N/A ALA 53.A N GLU 50.A O no hydrogen 3.078 N/A ARG 56.A N ALA 53.A O no hydrogen 3.004 N/A ARG 56.A NE.A TYR 97.A OH no hydrogen 3.032 N/A ARG 56.A NH2.A GLU 50.A O no hydrogen 3.179 N/A MET 57.A N ALA 53.A O no hydrogen 3.024 N/A ALA 58.A N PRO 54.A O no hydrogen 2.876 N/A ALA 59.A N PRO 55.A O no hydrogen 2.884 N/A ARG 60.A N ARG 56.A O no hydrogen 3.181 N/A ARG 60.A NH1 GLU 51.A O no hydrogen 2.805 N/A ARG 60.A NH2 GLU 51.A O no hydrogen 3.092 N/A ALA 61.A N MET 57.A O no hydrogen 2.959 N/A ALA 62.A N ALA 58.A O no hydrogen 2.841 N/A ARG 63.A N ALA 59.A O no hydrogen 2.926 N/A ALA 64.A N ARG 60.A O no hydrogen 3.052 N/A ALA 65.A N ALA 61.A O no hydrogen 2.956 N/A LEU 66.A N ALA 62.A O no hydrogen 2.850 N/A GLY 67.A N ARG 63.A O no hydrogen 3.068 N/A ARG 68.A N ALA 64.A O no hydrogen 3.210 N/A ARG 68.A NH2 VAL 11.A O no hydrogen 3.000 N/A GLY 69.A N ALA 65.A O no hydrogen 3.353 N/A ASP 70.A N GLY 67.A O no hydrogen 3.179 N/A VAL 71.A N LEU 66.A O no hydrogen 3.201 N/A ALA 74.A N ASP 72.A OD2 no hydrogen 3.303 N/A ASP 75.A N ASP 72.A O no hydrogen 2.871 N/A VAL 76.A N PRO 73.A O no hydrogen 3.230 N/A SER 77.A N ALA 139.A O no hydrogen 2.906 N/A SER 77.A OG ALA 139.A O no hydrogen 3.340 N/A VAL 79.A N PRO 108.A O no hydrogen 2.994 N/A LEU 80.A N LEU 141.A O no hydrogen 2.995 N/A HIS 81.A N PHE 110.A O no hydrogen 2.968 N/A HIS 81.A ND1 THR 143.A OG1 no hydrogen 2.783 N/A HIS 81.A NE2 GLN 87.A OE1 no hydrogen 2.832 N/A SER 82.A N THR 143.A O no hydrogen 2.885 N/A SER 82.A OG GLY 118.A O no hydrogen 3.212 N/A SER 83.A N LEU 112.A O no hydrogen 3.330 N/A LEU 84.A N ASP 146.A OD1 no hydrogen 2.818 N/A LEU 84.A N ASP 146.A OD2 no hydrogen 3.360 N/A TRP 85.A N ASP 146.A OD2 no hydrogen 2.867 N/A GLN 87.A NE2 TRP 85.A O no hydrogen 3.044 N/A GLN 87.A NE2 PHE 86.A O no hydrogen 3.682 N/A GLN 87.A NE2 GLY 145.A O no hydrogen 3.020 N/A ALA 94.A N TRP 92.A O no hydrogen 3.028 N/A TYR 97.A N PRO 93.A O no hydrogen 3.396 N/A VAL 98.A N ALA 94.A O no hydrogen 3.061 N/A ALA 99.A N ALA 95.A O no hydrogen 2.922 N/A HIS 100.A N SER 96.A O no hydrogen 2.784 N/A GLU 101.A N TYR 97.A O no hydrogen 2.943 N/A ALA 102.A N VAL 98.A O no hydrogen 2.972 N/A VAL 103.A N ALA 99.A O no hydrogen 2.807 N/A GLY 104.A N ALA 99.A O no hydrogen 2.736 N/A PHE 110.A N VAL 79.A O no hydrogen 2.937 N/A LEU 112.A N HIS 81.A O no hydrogen 2.901 N/A ARG 115.A NH1 LEU 84.A O no hydrogen 2.952 N/A CYS 116.A SG HIS 295.A NE2 no hydrogen 2.984 N/A ASN 117.A N GLN 114.A O no hydrogen 2.962 N/A ASN 117.A ND2 THR 332.A OG1 no hydrogen 3.104 N/A GLY 118.A N ARG 115.A O no hydrogen 3.120 N/A GLY 121.A N ASN 117.A O no hydrogen 2.885 N/A ALA 122.A N GLY 118.A O no hydrogen 2.943 N/A ILE 123.A N MET 120.A O no hydrogen 2.988 N/A LEU 125.A N GLY 121.A O no hydrogen 3.308 N/A ALA 126.A N ALA 122.A O no hydrogen 2.835 N/A GLY 127.A N ILE 123.A O no hydrogen 2.790 N/A ALA 128.A N GLU 124.A O no hydrogen 3.001 N/A TYR 129.A N LEU 125.A O no hydrogen 3.080 N/A LEU 130.A N ALA 126.A O no hydrogen 2.934 N/A GLY 131.A N GLY 127.A O no hydrogen 3.129 N/A SER 132.A N TYR 129.A O no hydrogen 3.148 N/A SER 132.A OG TYR 129.A O no hydrogen 2.682 N/A ILE 134.A N SER 132.A OG no hydrogen 3.373 N/A HIS 138.A ND1 SER 174.A OG no hydrogen 2.954 N/A ALA 139.A N ASP 75.A O no hydrogen 3.103 N/A ALA 140.A N LEU 173.A O no hydrogen 2.989 N/A LEU 141.A N LEU 78.A O no hydrogen 2.865 N/A LEU 142.A N LEU 171.A O no hydrogen 2.847 N/A THR 143.A N LEU 80.A O no hydrogen 2.830 N/A THR 143.A OG1 HIS 81.A ND1 no hydrogen 2.783 N/A THR 144.A N ALA 169.A O no hydrogen 2.890 N/A ASP 146.A N GLY 167.A O no hydrogen 3.137 N/A ARG 147.A NH1 SER 47.A O no hydrogen 2.922 N/A ARG 147.A NH1 ALA 49.A O no hydrogen 2.830 N/A PHE 148.A N ASP 166.A OD1 no hydrogen 2.911 N/A ARG 152.A NH1 PRO 212.A O no hydrogen 2.915 N/A ILE 153.A N ALA 149.A O no hydrogen 3.057 N/A ASP 154.A N SER 158.A OG no hydrogen 2.881 N/A ARG 155.A NH1 ASP 166.A OD1 no hydrogen 3.231 N/A ARG 155.A NH1 ASP 166.A OD2 no hydrogen 3.161 N/A ARG 155.A NH2 TYR 164.A O no hydrogen 3.101 N/A ARG 155.A NH2 ASP 166.A OD1 no hydrogen 2.850 N/A TRP 156.A N ASP 154.A OD2 no hydrogen 3.105 N/A ASN 157.A N ASP 154.A O no hydrogen 3.130 N/A ASN 157.A ND2 LEU 29.A O no hydrogen 2.928 N/A ASN 157.A ND2 ASP 154.A OD1 no hydrogen 2.964 N/A ASN 157.A ND2 ASP 154.A OD2 no hydrogen 3.553 N/A SER 158.A N ASP 154.A O no hydrogen 2.745 N/A SER 158.A OG ASP 154.A O no hydrogen 3.170 N/A SER 158.A OG ALA 214.A O no hydrogen 2.748 N/A THR 162.A OG1 VAL 265.A O no hydrogen 2.694 N/A MET 163.A N THR 162.A OG1 no hydrogen 2.799 N/A TYR 164.A N ARG 155.A O no hydrogen 2.924 N/A GLY 165.A N HIS 295.A O no hydrogen 2.973 N/A ASP 166.A N THR 44.A O no hydrogen 2.818 N/A GLY 167.A N ASP 146.A O no hydrogen 2.963 N/A ALA 168.A N TRP 14.A O no hydrogen 3.070 N/A ALA 169.A N THR 144.A O no hydrogen 3.315 N/A ALA 169.A N THR 144.A OG1 no hydrogen 3.257 N/A ALA 170.A N ALA 12.A O no hydrogen 2.795 N/A LEU 171.A N LEU 142.A O no hydrogen 2.796 N/A VAL 172.A N GLY 10.A O no hydrogen 2.885 N/A LEU 173.A N ALA 140.A O no hydrogen 2.946 N/A SER 174.A N PHE 7.A O no hydrogen 2.862 N/A SER 174.A OG HIS 138.A ND1 no hydrogen 2.954 N/A SER 174.A OG ASP 177.A O no hydrogen 3.297 N/A THR 175.A N HIS 138.A O no hydrogen 3.022 N/A ARG 176.A N SER 174.A OG no hydrogen 3.030 N/A ASP 177.A N SER 174.A OG no hydrogen 3.369 N/A ALA 180.A N VAL 8.A O no hydrogen 3.198 N/A ARG 181.A N GLU 337.A O no hydrogen 2.715 N/A ARG 181.A NH1 GLU 4.A O no hydrogen 2.845 N/A VAL 182.A N LEU 6.A O no hydrogen 2.842 N/A LEU 183.A N VAL 335.A O no hydrogen 2.950 N/A SER 184.A OG ALA 247.A O no hydrogen 2.723 N/A THR 185.A N MET 1.A O no hydrogen 3.046 N/A THR 185.A OG1 GLU 124.A OE1 no hydrogen 2.721 N/A ALA 186.A N ALA 333.A O no hydrogen 2.909 N/A THR 187.A OG1 GLU 124.A OE2 no hydrogen 2.722 N/A THR 187.A OG1 THR 332.A OG1 no hydrogen 2.635 N/A GLY 188.A N CYS 331.A O no hydrogen 2.818 N/A ASP 190.A N TYR 329.A O no hydrogen 2.856 N/A SER 192.A N ASP 190.A OD1 no hydrogen 3.175 N/A SER 192.A OG ASP 190.A OD1 no hydrogen 2.476 N/A LEU 193.A N ASP 190.A O no hydrogen 3.179 N/A GLU 194.A N ASN 191.A O no hydrogen 3.229 N/A LEU 196.A N LEU 193.A O no hydrogen 2.982 N/A ALA 197.A N GLU 194.A O no hydrogen 3.037 N/A ARG 198.A N ILE 195.A O no hydrogen 3.173 N/A ARG 198.A NE GLU 194.A OE1 no hydrogen 2.941 N/A ARG 198.A NH2 GLU 194.A OE2 no hydrogen 2.834 N/A GLY 199.A N ILE 195.A O no hydrogen 2.875 N/A GLU 201.A N ARG 198.A O no hydrogen 3.179 N/A HIS 206.A ND1 PRO 207.A O no hydrogen 2.776 N/A ALA 214.A N ARG 152.A O no hydrogen 2.686 N/A LEU 216.A N SER 158.A O no hydrogen 2.866 N/A THR 218.A N ASP 215.A OD1 no hydrogen 3.180 N/A THR 218.A OG1 ASP 215.A OD2 no hydrogen 2.589 N/A ARG 219.A N ASP 215.A O no hydrogen 3.334 N/A ARG 219.A NH2 ALA 197.A O no hydrogen 2.744 N/A THR 220.A N LEU 216.A O no hydrogen 3.169 N/A THR 220.A OG1 LEU 216.A O no hydrogen 3.207 N/A VAL 221.A N GLY 217.A O no hydrogen 3.315 N/A ARG 222.A N THR 218.A O no hydrogen 2.904 N/A ARG 222.A NE GLU 225.A OE2 no hydrogen 3.235 N/A ARG 222.A NH1 GLU 225.A OE1 no hydrogen 3.102 N/A ARG 222.A NH1 GLU 225.A OE2 no hydrogen 3.556 N/A GLY 223.A N ARG 219.A O no hydrogen 2.740 N/A ALA 224.A N THR 220.A O no hydrogen 2.888 N/A GLU 225.A N VAL 221.A O no hydrogen 3.215 N/A LEU 226.A N ARG 222.A O no hydrogen 3.015 N/A ALA 227.A N GLY 223.A O no hydrogen 2.873 N/A ASP 228.A N ALA 224.A O no hydrogen 2.893 N/A ARG 235.A N ASP 231.A O no hydrogen 2.943 N/A ARG 235.A NE ASP 231.A OD1 no hydrogen 3.369 N/A ARG 235.A NE ASP 231.A OD2 no hydrogen 2.961 N/A ARG 235.A NH1 SER 192.A OG no hydrogen 3.089 N/A ARG 235.A NH2 ASP 231.A OD2 no hydrogen 3.548 N/A TYR 236.A N LEU 232.A O no hydrogen 3.312 N/A ILE 237.A N THR 233.A O no hydrogen 3.013 N/A ASP 238.A N HIS 234.A O no hydrogen 2.802 N/A LEU 239.A N ARG 235.A O no hydrogen 3.264 N/A LEU 240.A N TYR 236.A O no hydrogen 3.281 N/A VAL 241.A N ILE 237.A O no hydrogen 2.942 N/A ALA 242.A N ASP 238.A O no hydrogen 2.940 N/A ALA 243.A N LEU 239.A O no hydrogen 3.030 N/A LYS 244.A N LEU 240.A O no hydrogen 2.997 N/A THR 245.A N VAL 241.A O no hydrogen 2.864 N/A THR 245.A OG1 VAL 241.A O no hydrogen 2.510 N/A GLN 246.A N ALA 242.A O no hydrogen 3.149 N/A GLN 246.A NE2 ASP 250.A OD2 no hydrogen 3.037 N/A ALA 247.A N ALA 243.A O no hydrogen 3.030 N/A LEU 248.A N LYS 244.A O no hydrogen 2.983 N/A GLU 249.A N THR 245.A O no hydrogen 2.976 N/A ASP 250.A N GLN 246.A O no hydrogen 2.874 N/A ALA 251.A N ALA 247.A O no hydrogen 3.107 N/A GLY 252.A N GLU 249.A O no hydrogen 3.146 N/A THR 253.A N LEU 248.A O no hydrogen 2.938 N/A THR 253.A OG1 ALA 251.A O no hydrogen 2.729 N/A ASP 257.A N ALA 254.A O no hydrogen 3.140 N/A ILE 258.A N ILE 255.A O no hydrogen 3.076 N/A ALA 259.A N ARG 319.A O no hydrogen 2.888 N/A ALA 261.A N ARG 284.A O no hydrogen 2.838 N/A VAL 262.A N LEU 321.A O no hydrogen 2.791 N/A ILE 263.A N SER 286.A OG no hydrogen 2.916 N/A VAL 265.A N ASP 300.A OD2 no hydrogen 3.167 N/A ARG 267.A N VAL 161.A O no hydrogen 2.899 N/A ARG 267.A NH2 ASP 282.A OD1 no hydrogen 2.977 N/A ARG 268.A N GLU 273.A OE1 no hydrogen 2.997 N/A ARG 268.A NH1 HIS 272.A O no hydrogen 2.922 N/A GLY 269.A N GLU 273.A OE2 no hydrogen 2.689 N/A GLU 273.A N ASP 276.A OD2 no hydrogen 3.005 N/A ASP 276.A N GLU 273.A O no hydrogen 2.929 N/A LEU 278.A N LEU 274.A O no hydrogen 2.901 N/A GLY 279.A N HIS 275.A O no hydrogen 2.911 N/A LEU 280.A N HIS 275.A O no hydrogen 3.032 N/A ARG 284.A N PRO 281.A O no hydrogen 3.010 N/A ARG 284.A NE ILE 258.A O no hydrogen 3.267 N/A ARG 284.A NH1 ILE 258.A O no hydrogen 2.864 N/A THR 285.A N ASP 282.A O no hydrogen 3.267 N/A THR 285.A OG1 ASP 282.A O no hydrogen 2.943 N/A SER 286.A N ALA 261.A O no hydrogen 3.006 N/A TRP 287.A N THR 285.A OG1 no hydrogen 3.344 N/A TYR 289.A N SER 286.A O no hydrogen 2.890 N/A GLY 290.A N SER 286.A O no hydrogen 2.751 N/A ARG 291.A N TRP 287.A O no hydrogen 2.759 N/A ARG 291.A NE GLY 39.A O no hydrogen 3.105 N/A ARG 291.A NH2 GLY 39.A O no hydrogen 3.070 N/A THR 292.A N TYR 289.A O no hydrogen 2.789 N/A THR 292.A OG1 TYR 289.A O no hydrogen 2.588 N/A THR 293.A N GLY 290.A O no hydrogen 3.252 N/A THR 293.A OG1 GLY 290.A O no hydrogen 3.363 N/A THR 293.A OG1 GLY 294.A O no hydrogen 2.809 N/A GLY 294.A N GLY 290.A O no hydrogen 3.045 N/A HIS 295.A N MET 163.A O no hydrogen 2.894 N/A HIS 295.A ND1 ASP 300.A OD2 no hydrogen 2.541 N/A VAL 296.A N ASP 300.A OD1 no hydrogen 2.690 N/A GLY 297.A N HIS 295.A O no hydrogen 3.006 N/A GLY 299.A N VAL 296.A O no hydrogen 2.970 N/A GLN 301.A NE2 PHE 323.A O no hydrogen 2.924 N/A TYR 302.A OH GLY 119.A O no hydrogen 2.660 N/A ALA 303.A N GLY 299.A O no hydrogen 2.920 N/A GLY 304.A N ASP 300.A O no hydrogen 3.025 N/A LEU 305.A N GLN 301.A O no hydrogen 3.048 N/A ALA 306.A N TYR 302.A O no hydrogen 2.912 N/A HIS 307.A N ALA 303.A O no hydrogen 2.931 N/A LEU 308.A N GLY 304.A O no hydrogen 3.066 N/A VAL 309.A N LEU 305.A O no hydrogen 3.033 N/A GLU 310.A N ALA 306.A O no hydrogen 2.809 N/A ASN 311.A N HIS 307.A O no hydrogen 3.295 N/A ASN 311.A ND2 HIS 307.A O no hydrogen 2.858 N/A ALA 312.A N VAL 309.A O no hydrogen 3.127 N/A LEU 313.A N LEU 308.A O no hydrogen 2.890 N/A GLN 315.A N ASP 318.A OD2 no hydrogen 2.954 N/A GLY 317.A N ILE 338.A O no hydrogen 2.820 N/A ASP 318.A N GLN 315.A O no hydrogen 3.093 N/A ARG 319.A NH1 THR 253.A OG1 no hydrogen 2.750 N/A VAL 320.A N VAL 336.A O no hydrogen 2.723 N/A LEU 321.A N HIS 260.A O no hydrogen 2.942 N/A LEU 322.A N ALA 334.A O no hydrogen 2.795 N/A PHE 323.A N VAL 262.A O no hydrogen 2.854 N/A GLY 324.A N THR 332.A O no hydrogen 2.923 N/A GLY 325.A N ASN 117.A OD1 no hydrogen 2.901 N/A GLY 326.A N THR 330.A O no hydrogen 2.872 N/A TYR 329.A N ASP 190.A O no hydrogen 2.947 N/A THR 330.A N GLY 326.A O no hydrogen 2.975 N/A CYS 331.A N GLY 188.A O no hydrogen 2.853 N/A THR 332.A N ASN 117.A OD1 no hydrogen 2.947 N/A THR 332.A OG1 THR 187.A OG1 no hydrogen 2.635 N/A ALA 333.A N ALA 186.A O no hydrogen 2.811 N/A ALA 334.A N LEU 322.A O no hydrogen 2.829 N/A VAL 335.A N SER 184.A O no hydrogen 3.116 N/A VAL 336.A N VAL 320.A O no hydrogen 2.813 N/A GLU 337.A N ARG 181.A O no hydrogen 2.769 N/A ILE 338.A N ASP 318.A O no hydrogen 2.966 N/A LEU 339.A N PHE 179.A O no hydrogen 2.743 N/A ARG 340.A N PHE 179.A O no hydrogen 3.187 N/A ARG 340.A NH2 ASP 177.A OD2 no hydrogen 3.034 N/A