Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xs9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N SER 167.A O no hydrogen 2.713 N/A VAL 5.A N ALA 173.A O no hydrogen 2.793 N/A ALA 6.A N VAL 165.A O no hydrogen 2.882 N/A CYS 8.A SG ASP 300.A OD1 no hydrogen 3.431 N/A GLY 9.A N ALA 163.A O no hydrogen 3.040 N/A TRP 11.A N GLY 161.A O no hydrogen 2.878 N/A VAL 16.A N VAL 40.A O no hydrogen 2.851 N/A THR 17.A N GLN 20.A OE1 no hydrogen 3.029 N/A THR 18.A N LEU 38.A O no hydrogen 2.918 N/A THR 18.A OG1 MET 37.A O no hydrogen 2.576 N/A GLU 19.A N GLU 19.A OE1 no hydrogen 2.887 N/A GLN 20.A N THR 17.A OG1 no hydrogen 3.136 N/A ALA 21.A N THR 17.A O no hydrogen 2.993 N/A LEU 22.A N THR 18.A O no hydrogen 2.685 N/A ALA 23.A N GLU 19.A O no hydrogen 2.961 N/A ALA 24.A N GLN 20.A O no hydrogen 2.857 N/A GLY 25.A N LEU 22.A O no hydrogen 3.051 N/A HIS 26.A N ALA 21.A O no hydrogen 2.871 N/A CYS 27.A SG ASP 28.A O no hydrogen 3.414 N/A LEU 31.A N ASP 28.A OD1 no hydrogen 2.593 N/A ALA 32.A N ASP 28.A O no hydrogen 3.075 N/A SER 33.A N ARG 29.A O no hydrogen 3.108 N/A SER 34.A N ARG 30.A O no hydrogen 2.953 N/A SER 34.A OG ARG 30.A O no hydrogen 3.303 N/A SER 34.A OG LEU 31.A O no hydrogen 3.225 N/A THR 35.A N LEU 31.A O no hydrogen 2.929 N/A THR 35.A OG1 LEU 31.A O no hydrogen 2.992 N/A ARG 36.A N ALA 32.A O no hydrogen 2.935 N/A MET 37.A N THR 35.A OG1 no hydrogen 3.345 N/A LEU 38.A N ARG 285.A O no hydrogen 2.776 N/A SER 39.A N ARG 285.A O no hydrogen 3.131 N/A SER 39.A OG ARG 286.A O no hydrogen 2.879 N/A VAL 40.A N VAL 16.A O no hydrogen 2.888 N/A ALA 41.A N THR 287.A O no hydrogen 3.001 N/A VAL 42.A N PRO 14.A O no hydrogen 3.129 N/A ALA 43.A N ASP 159.A OD2 no hydrogen 2.735 N/A LYS 45.A NZ ASP 44.A OD1 no hydrogen 2.829 N/A THR 47.A N GLU 50.A OE1 no hydrogen 3.474 N/A MET 51.A N THR 47.A O no hydrogen 3.106 N/A ALA 52.A N PRO 48.A O no hydrogen 3.000 N/A ALA 53.A N ALA 49.A O no hydrogen 2.859 N/A LEU 54.A N GLU 50.A O no hydrogen 3.070 N/A ALA 55.A N MET 51.A O no hydrogen 3.110 N/A ALA 56.A N ALA 52.A O no hydrogen 2.965 N/A GLN 57.A N ALA 53.A O no hydrogen 2.955 N/A GLN 57.A NE2 VAL 95.A O no hydrogen 3.396 N/A THR 58.A N LEU 54.A O no hydrogen 3.215 N/A THR 58.A OG1 LEU 54.A O no hydrogen 3.408 N/A ALA 59.A N ALA 55.A O no hydrogen 2.855 N/A LEU 60.A N ALA 56.A O no hydrogen 2.796 N/A ASP 61.A N GLN 57.A O no hydrogen 2.971 N/A ARG 62.A N THR 58.A O no hydrogen 2.995 N/A ARG 62.A NH1 CYS 8.A O no hydrogen 2.934 N/A ARG 62.A NH1 ASP 300.A OD1 no hydrogen 2.805 N/A SER 63.A N ALA 59.A O no hydrogen 3.004 N/A SER 63.A OG LEU 60.A O no hydrogen 2.722 N/A GLY 64.A N LEU 60.A O no hydrogen 3.143 N/A GLY 64.A N ASP 61.A O no hydrogen 3.358 N/A VAL 65.A N SER 63.A OG no hydrogen 3.145 N/A HIS 69.A N ALA 66.A O no hydrogen 2.770 N/A VAL 70.A N PRO 67.A O no hydrogen 2.984 N/A ASP 71.A N ALA 132.A O no hydrogen 2.665 N/A VAL 73.A N PRO 102.A O no hydrogen 2.985 N/A LEU 74.A N LEU 134.A O no hydrogen 2.830 N/A HIS 75.A N MET 104.A O no hydrogen 2.937 N/A HIS 75.A ND1 THR 136.A OG1 no hydrogen 2.869 N/A HIS 75.A NE2 GLN 81.A OE1 no hydrogen 2.693 N/A ALA 76.A N THR 136.A O no hydrogen 2.701 N/A LEU 78.A N ASP 139.A OD1 no hydrogen 2.838 N/A TYR 79.A N ASP 139.A OD2 no hydrogen 3.085 N/A GLN 81.A NE2 TYR 79.A O no hydrogen 3.067 N/A GLN 81.A NE2 GLY 138.A O no hydrogen 3.229 N/A SER 90.A N ALA 87.A O no hydrogen 3.114 N/A TYR 91.A N ALA 87.A O no hydrogen 3.286 N/A VAL 92.A N PRO 88.A O no hydrogen 2.961 N/A GLN 93.A N SER 89.A O no hydrogen 2.912 N/A GLN 93.A NE2 ASN 99.A OD1 no hydrogen 3.089 N/A GLN 93.A NE2 CYS 101.A O no hydrogen 2.754 N/A ARG 94.A N SER 90.A O no hydrogen 2.769 N/A VAL 95.A N TYR 91.A O no hydrogen 2.946 N/A ALA 96.A N VAL 92.A O no hydrogen 2.844 N/A VAL 97.A N GLN 93.A O no hydrogen 3.167 N/A GLY 98.A N GLN 93.A O no hydrogen 2.688 N/A CYS 101.A SG VAL 70.A O no hydrogen 3.478 N/A CYS 101.A SG PRO 102.A O no hydrogen 3.476 N/A MET 104.A N VAL 73.A O no hydrogen 2.935 N/A VAL 106.A N HIS 75.A O no hydrogen 3.099 N/A ARG 107.A NE SER 77.A O no hydrogen 3.258 N/A ARG 107.A NH2 SER 77.A OG no hydrogen 3.092 N/A SER 110.A OG HIS 289.A NE2 no hydrogen 2.713 N/A ASN 111.A N GLN 108.A O no hydrogen 2.894 N/A ASN 111.A ND2 GLN 108.A OE1 no hydrogen 2.693 N/A ASN 111.A ND2 SER 326.A OG no hydrogen 3.038 N/A GLY 112.A N VAL 109.A O no hydrogen 2.984 N/A ALA 115.A N ASN 111.A O no hydrogen 2.957 N/A ALA 116.A N GLY 112.A O no hydrogen 2.950 N/A LEU 117.A N GLY 113.A O no hydrogen 2.915 N/A GLU 118.A N MET 114.A O no hydrogen 2.881 N/A LEU 119.A N ALA 115.A O no hydrogen 3.173 N/A ALA 120.A N ALA 116.A O no hydrogen 2.820 N/A ARG 121.A N LEU 117.A O no hydrogen 2.914 N/A ARG 121.A NH2 GLU 118.A OE2 no hydrogen 3.129 N/A ARG 121.A NH2 LEU 178.A O no hydrogen 2.939 N/A ALA 122.A N GLU 118.A O no hydrogen 3.219 N/A TYR 123.A N LEU 119.A O no hydrogen 2.908 N/A LEU 124.A N ALA 120.A O no hydrogen 2.916 N/A LEU 125.A N ARG 121.A O no hydrogen 2.976 N/A ALA 126.A N TYR 123.A O no hydrogen 3.301 N/A ASP 129.A N ASP 129.A OD1 no hydrogen 2.484 N/A ARG 130.A N ALA 127.A O no hydrogen 3.271 N/A ARG 130.A NH1 TYR 123.A O no hydrogen 2.844 N/A VAL 131.A N ASP 71.A OD2 no hydrogen 2.677 N/A ALA 132.A N HIS 69.A O no hydrogen 2.905 N/A ALA 133.A N LEU 166.A O no hydrogen 2.892 N/A LEU 134.A N LEU 72.A O no hydrogen 2.818 N/A ILE 135.A N LEU 164.A O no hydrogen 2.883 N/A THR 136.A N LEU 74.A O no hydrogen 2.807 N/A THR 136.A OG1 HIS 75.A ND1 no hydrogen 2.869 N/A THR 137.A N THR 162.A O no hydrogen 2.950 N/A THR 137.A OG1 THR 162.A OG1 no hydrogen 2.714 N/A GLY 138.A N ALA 76.A O no hydrogen 3.339 N/A ASP 139.A N GLY 160.A O no hydrogen 3.380 N/A ARG 140.A NH1 ASP 44.A O no hydrogen 3.065 N/A ARG 140.A NH1 GLU 46.A O no hydrogen 2.742 N/A ARG 140.A NH2 ASP 44.A O no hydrogen 3.063 N/A MET 141.A N ASP 159.A OD1 no hydrogen 2.769 N/A PHE 146.A N HIS 142.A O no hydrogen 3.280 N/A ASP 147.A N SER 151.A OG no hydrogen 2.897 N/A ARG 148.A NH1 TYR 157.A O no hydrogen 2.966 N/A ARG 148.A NH1 ASP 159.A OD1 no hydrogen 2.819 N/A ARG 148.A NH2 ASP 159.A OD1 no hydrogen 3.202 N/A ARG 148.A NH2 ASP 159.A OD2 no hydrogen 2.983 N/A TRP 149.A N ASP 147.A OD1 no hydrogen 2.922 N/A SER 150.A N ASP 147.A O no hydrogen 3.116 N/A SER 150.A N ASP 147.A OD1 no hydrogen 3.029 N/A SER 151.A N ASP 147.A O no hydrogen 2.894 N/A SER 151.A OG ASP 147.A O no hydrogen 3.338 N/A SER 151.A OG VAL 207.A O no hydrogen 2.824 N/A THR 155.A N ASP 152.A O no hydrogen 3.223 N/A TYR 157.A N ARG 148.A O no hydrogen 3.000 N/A TYR 157.A OH ASP 152.A OD2 no hydrogen 2.581 N/A ALA 158.A N HIS 289.A O no hydrogen 2.718 N/A ASP 159.A N ALA 41.A O no hydrogen 2.977 N/A GLY 160.A N ASP 139.A O no hydrogen 3.302 N/A GLY 161.A N TRP 11.A O no hydrogen 2.918 N/A THR 162.A N THR 137.A O no hydrogen 3.054 N/A THR 162.A OG1 THR 137.A OG1 no hydrogen 2.714 N/A ALA 163.A N GLY 9.A O no hydrogen 2.905 N/A LEU 164.A N ILE 135.A O no hydrogen 2.823 N/A VAL 165.A N GLY 7.A O no hydrogen 2.805 N/A LEU 166.A N ALA 133.A O no hydrogen 2.901 N/A SER 167.A N TYR 4.A O no hydrogen 2.842 N/A SER 167.A OG GLY 170.A O no hydrogen 3.463 N/A ARG 168.A N VAL 131.A O no hydrogen 2.855 N/A ARG 168.A NH1 LEU 124.A O no hydrogen 3.052 N/A GLN 169.A N SER 167.A OG no hydrogen 2.909 N/A ALA 173.A N VAL 5.A O no hydrogen 3.396 N/A ARG 174.A N GLU 331.A O no hydrogen 2.785 N/A LEU 175.A N LEU 3.A O no hydrogen 2.904 N/A ARG 176.A N VAL 329.A O no hydrogen 2.848 N/A ARG 176.A NH1 GLU 331.A OE1 no hydrogen 2.735 N/A ARG 176.A NH2 ALA 244.A O no hydrogen 2.793 N/A SER 177.A N VAL 329.A O no hydrogen 3.321 N/A SER 177.A OG ALA 240.A O no hydrogen 2.656 N/A VAL 179.A N CYS 327.A O no hydrogen 2.857 N/A THR 180.A OG1 GLU 118.A OE1 no hydrogen 2.619 N/A THR 180.A OG1 SER 326.A OG no hydrogen 2.656 N/A VAL 181.A N TRP 325.A O no hydrogen 2.775 N/A GLU 183.A N PHE 323.A O no hydrogen 2.958 N/A LEU 186.A N GLU 183.A O no hydrogen 3.272 N/A GLU 187.A N PRO 184.A O no hydrogen 3.051 N/A MET 189.A N LEU 186.A O no hydrogen 2.983 N/A HIS 190.A N GLU 187.A O no hydrogen 3.344 N/A ARG 191.A N GLY 188.A O no hydrogen 3.314 N/A ARG 191.A NE GLU 187.A OE1 no hydrogen 2.839 N/A ARG 191.A NE GLU 187.A OE2 no hydrogen 3.447 N/A ARG 191.A NH1 GLY 192.A O no hydrogen 3.149 N/A ARG 191.A NH1 HIS 194.A O no hydrogen 2.916 N/A ARG 191.A NH2 GLU 187.A OE2 no hydrogen 2.814 N/A ARG 191.A NH2 HIS 194.A O no hydrogen 2.965 N/A PHE 196.A N HIS 194.A ND1 no hydrogen 3.012 N/A GLY 197.A N HIS 194.A O no hydrogen 2.944 N/A SER 200.A N GLY 192.A O no hydrogen 3.245 N/A SER 200.A OG GLU 202.A O no hydrogen 3.234 N/A GLU 202.A N SER 200.A OG no hydrogen 3.063 N/A GLN 204.A NE2 ASP 208.A O no hydrogen 3.378 N/A VAL 207.A N GLY 145.A O no hydrogen 3.059 N/A ASP 208.A N GLN 204.A OE1 no hydrogen 2.919 N/A LEU 209.A N SER 151.A O no hydrogen 2.764 N/A ASP 210.A N ASP 208.A OD1 no hydrogen 3.208 N/A ALA 211.A N ASP 208.A OD1 no hydrogen 3.375 N/A LYS 213.A N LEU 209.A O no hydrogen 2.872 N/A ARG 214.A N ASP 210.A O no hydrogen 2.986 N/A ARG 214.A NH1 ASP 210.A OD2 no hydrogen 2.276 N/A ALA 215.A N ALA 211.A O no hydrogen 3.074 N/A TYR 216.A N HIS 212.A O no hydrogen 3.007 N/A TYR 216.A OH VAL 185.A O no hydrogen 2.793 N/A VAL 217.A N LYS 213.A O no hydrogen 2.912 N/A ALA 218.A N ARG 214.A O no hydrogen 2.978 N/A GLU 219.A N TYR 216.A O no hydrogen 3.108 N/A ALA 220.A N TYR 216.A O no hydrogen 2.719 N/A GLY 221.A N VAL 217.A O no hydrogen 2.751 N/A SER 225.A N GLY 221.A O no hydrogen 3.082 N/A SER 225.A OG GLY 221.A O no hydrogen 2.789 N/A VAL 226.A N SER 222.A O no hydrogen 2.966 N/A ALA 227.A N SER 223.A O no hydrogen 3.112 N/A ARG 228.A N PHE 224.A O no hydrogen 3.000 N/A ARG 228.A NH1 GLU 183.A OE1 no hydrogen 3.239 N/A VAL 229.A N SER 225.A O no hydrogen 3.097 N/A SER 230.A N VAL 226.A O no hydrogen 2.871 N/A ALA 231.A N ALA 227.A O no hydrogen 2.883 N/A GLY 232.A N ARG 228.A O no hydrogen 3.099 N/A GLN 233.A N VAL 229.A O no hydrogen 3.061 N/A GLN 233.A NE2 GLN 233.A O no hydrogen 3.211 N/A GLU 234.A N SER 230.A O no hydrogen 2.980 N/A GLU 235.A N ALA 231.A O no hydrogen 2.866 N/A ALA 236.A N GLY 232.A O no hydrogen 3.128 N/A LEU 237.A N GLN 233.A O no hydrogen 3.130 N/A THR 238.A N GLU 234.A O no hydrogen 3.006 N/A THR 238.A OG1 GLU 234.A O no hydrogen 3.418 N/A THR 238.A OG1 GLU 234.A OE2 no hydrogen 3.137 N/A GLY 239.A N GLU 235.A O no hydrogen 2.897 N/A ALA 240.A N ALA 236.A O no hydrogen 3.048 N/A LEU 241.A N LEU 237.A O no hydrogen 2.991 N/A GLU 242.A N THR 238.A O no hydrogen 2.861 N/A ALA 243.A N GLY 239.A O no hydrogen 2.916 N/A ALA 244.A N ALA 240.A O no hydrogen 3.225 N/A ALA 244.A N LEU 241.A O no hydrogen 3.091 N/A GLY 245.A N GLU 242.A O no hydrogen 2.955 N/A ALA 246.A N LEU 241.A O no hydrogen 2.898 N/A GLY 247.A N ASP 250.A OD2 no hydrogen 2.594 N/A ASP 250.A N GLY 247.A O no hydrogen 2.834 N/A ILE 251.A N LEU 248.A O no hydrogen 3.030 N/A SER 252.A N LEU 313.A O no hydrogen 2.997 N/A ARG 253.A NE ARG 307.A O no hydrogen 3.197 N/A ARG 253.A NH2 ARG 307.A O no hydrogen 3.495 N/A VAL 254.A N ARG 278.A O no hydrogen 2.783 N/A VAL 255.A N LEU 315.A O no hydrogen 2.643 N/A LEU 256.A N THR 280.A OG1 no hydrogen 3.324 N/A HIS 258.A N ASP 294.A OD2 no hydrogen 2.834 N/A HIS 258.A ND1 GLY 288.A O no hydrogen 2.794 N/A GLY 260.A N GLY 154.A O no hydrogen 2.802 N/A TRP 261.A N THR 35.A O no hydrogen 2.731 N/A ARG 262.A N SER 34.A O no hydrogen 3.266 N/A ARG 263.A NH1 ASP 152.A OD1 no hydrogen 3.080 N/A ARG 263.A NH1 ASP 152.A OD2 no hydrogen 3.513 N/A ARG 263.A NH1 THR 155.A OG1 no hydrogen 2.903 N/A ARG 263.A NH2 ASP 152.A OD1 no hydrogen 3.112 N/A LEU 264.A N GLY 260.A O no hydrogen 3.076 N/A SER 265.A N TRP 261.A O no hydrogen 2.848 N/A SER 265.A OG TRP 261.A O no hydrogen 2.736 N/A ALA 266.A N ARG 262.A O no hydrogen 3.078 N/A ALA 267.A N ARG 263.A O no hydrogen 2.849 N/A TYR 268.A N LEU 264.A O no hydrogen 2.755 N/A TYR 268.A OH GLN 233.A OE1 no hydrogen 2.765 N/A PHE 269.A N LEU 264.A O no hydrogen 3.091 N/A ASN 270.A N SER 265.A O no hydrogen 2.879 N/A LYS 271.A N TYR 268.A O no hydrogen 3.246 N/A LYS 271.A NZ SER 230.A OG no hydrogen 3.076 N/A TRP 272.A N TYR 268.A O no hydrogen 2.717 N/A GLU 277.A N GLU 277.A OE1 no hydrogen 2.730 N/A ARG 278.A N GLN 275.A O no hydrogen 2.870 N/A ARG 278.A NH2 ILE 251.A O no hydrogen 2.951 N/A THR 279.A N PRO 276.A O no hydrogen 2.891 N/A THR 279.A OG1 PRO 276.A O no hydrogen 2.796 N/A THR 280.A N VAL 254.A O no hydrogen 3.222 N/A TRP 281.A N THR 279.A OG1 no hydrogen 3.008 N/A GLY 284.A N THR 280.A O no hydrogen 2.851 N/A ARG 285.A N TRP 281.A O no hydrogen 2.956 N/A ARG 285.A NE ARG 36.A O no hydrogen 3.028 N/A ARG 285.A NH1 GLU 282.A OE1 no hydrogen 3.314 N/A ARG 285.A NH2 ARG 36.A O no hydrogen 2.754 N/A ARG 286.A N PHE 283.A O no hydrogen 3.226 N/A ARG 286.A NH1 GLU 282.A O no hydrogen 2.834 N/A ARG 286.A NH1 GLU 282.A OE1 no hydrogen 2.725 N/A THR 287.A N GLY 284.A O no hydrogen 2.993 N/A THR 287.A OG1 PHE 283.A O no hydrogen 2.768 N/A GLY 288.A N GLY 284.A O no hydrogen 2.804 N/A HIS 289.A N VAL 156.A O no hydrogen 2.867 N/A HIS 289.A ND1 ASP 294.A OD2 no hydrogen 2.490 N/A HIS 289.A NE2 SER 110.A OG no hydrogen 2.713 N/A LEU 290.A N ASP 294.A OD1 no hydrogen 2.615 N/A GLY 293.A N LEU 290.A O no hydrogen 2.958 N/A ASP 294.A N GLY 291.A O no hydrogen 3.419 N/A ILE 296.A N GLY 293.A O no hydrogen 2.994 N/A ALA 297.A N GLY 293.A O no hydrogen 2.967 N/A GLY 298.A N ASP 294.A O no hydrogen 2.779 N/A PHE 299.A N PRO 295.A O no hydrogen 3.034 N/A ASP 300.A N ILE 296.A O no hydrogen 2.851 N/A HIS 301.A N ALA 297.A O no hydrogen 2.861 N/A LEU 302.A N GLY 298.A O no hydrogen 3.001 N/A VAL 303.A N PHE 299.A O no hydrogen 2.944 N/A GLY 304.A N ASP 300.A O no hydrogen 2.880 N/A SER 305.A N HIS 301.A O no hydrogen 2.978 N/A SER 305.A OG HIS 301.A O no hydrogen 2.849 N/A SER 305.A OG LEU 302.A O no hydrogen 3.357 N/A GLY 306.A N VAL 303.A O no hydrogen 3.059 N/A ARG 307.A N LEU 302.A O no hydrogen 3.004 N/A ARG 307.A NH1 SER 305.A OG no hydrogen 3.059 N/A ALA 309.A N GLU 312.A OE1 no hydrogen 2.899 N/A GLY 311.A N LEU 332.A O no hydrogen 2.651 N/A GLU 312.A N ALA 309.A O no hydrogen 2.933 N/A CYS 314.A N VAL 330.A O no hydrogen 2.741 N/A CYS 314.A SG ARG 253.A O no hydrogen 3.728 N/A LEU 315.A N ARG 253.A O no hydrogen 3.021 N/A LEU 316.A N ALA 328.A O no hydrogen 2.810 N/A VAL 317.A N VAL 255.A O no hydrogen 2.852 N/A SER 318.A N SER 326.A O no hydrogen 3.033 N/A SER 318.A OG ASN 111.A OD1 no hydrogen 2.693 N/A GLY 320.A N SER 324.A O no hydrogen 2.812 N/A PHE 323.A N GLU 183.A O no hydrogen 3.031 N/A SER 324.A N GLY 320.A O no hydrogen 2.952 N/A TRP 325.A N VAL 181.A O no hydrogen 2.917 N/A SER 326.A N SER 318.A O no hydrogen 3.019 N/A SER 326.A OG THR 180.A OG1 no hydrogen 2.656 N/A CYS 327.A N VAL 179.A O no hydrogen 3.047 N/A ALA 328.A N LEU 316.A O no hydrogen 3.141 N/A VAL 329.A N SER 177.A O no hydrogen 3.019 N/A VAL 329.A N SER 177.A OG no hydrogen 3.298 N/A VAL 330.A N CYS 314.A O no hydrogen 2.803 N/A GLU 331.A N ARG 174.A O no hydrogen 2.848 N/A LEU 332.A N GLU 312.A O no hydrogen 2.974 N/A LEU 333.A N PHE 172.A O no hydrogen 2.758 N/A GLU 334.A N PHE 172.A O no hydrogen 3.125 N/A ALA 339.A N PRO 336.A O no hydrogen 2.963 N/A ALA 340.A N GLY 304.A O no hydrogen 2.977 N/A