Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8var_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ALA 131.A O no hydrogen 2.785 N/A ARG 3.A NE GLN 136.A OE1 no hydrogen 2.776 N/A ARG 3.A NH2 GLN 136.A OE1 no hydrogen 3.539 N/A LEU 4.A N GLN 136.A O no hydrogen 2.912 N/A GLN 8.A N TYR 5.A O no hydrogen 3.166 N/A LEU 9.A N PRO 6.A O no hydrogen 3.480 N/A GLN 12.A N GLN 8.A O no hydrogen 3.074 N/A GLN 12.A NE2 GLU 15.A OE2 no hydrogen 3.288 N/A LEU 13.A N LEU 9.A O no hydrogen 2.927 N/A ASN 14.A N ARG 10.A O no hydrogen 2.916 N/A GLU 15.A N ALA 11.A O no hydrogen 2.929 N/A TYR 21.A N LEU 110.A O no hydrogen 2.889 N/A TYR 21.A OH GLN 12.A OE1 no hydrogen 2.511 N/A LEU 22.A N VAL 135.A O no hydrogen 2.880 N/A LEU 23.A N VAL 112.A O no hydrogen 3.040 N/A LEU 24.A N VAL 137.A O no hydrogen 2.934 N/A GLY 25.A N GLY 114.A O no hydrogen 2.994 N/A GLN 32.A N PRO 28.A O no hydrogen 2.898 N/A GLN 32.A NE2 ASP 36.A OD2 no hydrogen 2.747 N/A GLU 33.A N LEU 29.A O no hydrogen 2.912 N/A SER 34.A N LEU 30.A O no hydrogen 2.900 N/A SER 34.A OG LEU 30.A O no hydrogen 2.844 N/A GLN 35.A N LEU 31.A O no hydrogen 2.919 N/A ASP 36.A N GLN 32.A O no hydrogen 2.888 N/A ALA 37.A N GLU 33.A O no hydrogen 2.908 N/A VAL 38.A N SER 34.A O no hydrogen 2.923 N/A ARG 39.A N GLN 35.A O no hydrogen 2.900 N/A GLN 40.A N ASP 36.A O no hydrogen 2.899 N/A VAL 41.A N ALA 37.A O no hydrogen 2.945 N/A ALA 42.A N VAL 38.A O no hydrogen 2.887 N/A ALA 43.A N ARG 39.A O no hydrogen 2.894 N/A ALA 44.A N GLN 40.A O no hydrogen 2.905 N/A GLN 45.A N VAL 41.A O no hydrogen 2.892 N/A GLY 46.A N ALA 43.A O no hydrogen 3.388 N/A PHE 47.A N ALA 42.A O no hydrogen 2.660 N/A GLU 48.A N ARG 77.A O no hydrogen 2.916 N/A GLU 49.A N ARG 77.A O no hydrogen 3.171 N/A HIS 50.A ND1 GLU 48.A O no hydrogen 2.748 N/A HIS 51.A N THR 79.A O no hydrogen 2.703 N/A HIS 51.A NE2 GLU 49.A OE2 no hydrogen 2.290 N/A ILE 55.A N LEU 83.A O no hydrogen 3.300 N/A THR 59.A N ASN 58.A OD1 no hydrogen 2.657 N/A PHE 65.A N ASN 62.A O no hydrogen 3.102 N/A SER 66.A N ALA 63.A O no hydrogen 2.925 N/A SER 66.A OG HIS 51.A ND1 no hydrogen 3.076 N/A LEU 67.A N ILE 64.A O no hydrogen 3.183 N/A CYS 68.A N ILE 64.A O no hydrogen 3.295 N/A CYS 68.A SG ILE 64.A O no hydrogen 3.896 N/A THR 79.A N GLU 49.A O no hydrogen 2.446 N/A LEU 80.A N LEU 109.A O no hydrogen 2.780 N/A LEU 81.A N HIS 51.A O no hydrogen 2.834 N/A LEU 82.A N ILE 111.A O no hydrogen 2.663 N/A LEU 84.A N ARG 113.A O no hydrogen 2.560 N/A GLU 86.A N GLU 86.A OE1 no hydrogen 2.607 N/A GLY 88.A N PRO 85.A O no hydrogen 3.444 N/A ILE 93.A N ASN 90.A OD1 no hydrogen 2.594 N/A ASN 94.A N ASN 90.A O no hydrogen 2.606 N/A GLU 95.A N ALA 91.A O no hydrogen 2.937 N/A GLN 96.A N ALA 92.A O no hydrogen 2.901 N/A LEU 97.A N ILE 93.A O no hydrogen 2.870 N/A LEU 98.A N ASN 94.A O no hydrogen 2.919 N/A THR 99.A N GLU 95.A O no hydrogen 2.890 N/A THR 99.A OG1 GLU 95.A O no hydrogen 3.474 N/A THR 99.A OG1 GLN 96.A O no hydrogen 2.309 N/A LEU 100.A N GLN 96.A O no hydrogen 2.887 N/A THR 101.A N LEU 97.A O no hydrogen 2.888 N/A GLY 102.A N THR 99.A O no hydrogen 3.124 N/A LEU 108.A N HIS 105.A O no hydrogen 3.134 N/A LEU 109.A N GLN 78.A O no hydrogen 2.887 N/A ILE 111.A N LEU 80.A O no hydrogen 2.566 N/A VAL 112.A N TYR 21.A O no hydrogen 3.238 N/A ARG 113.A N LEU 82.A O no hydrogen 2.615 N/A ARG 113.A NH1 GLN 32.A OE1 no hydrogen 3.398 N/A ARG 113.A NH1 GLN 35.A OE1 no hydrogen 3.322 N/A SER 118.A N GLN 121.A OE1 no hydrogen 3.180 N/A LYS 119.A NZ GLU 122.A OE1 no hydrogen 2.906 N/A LYS 119.A NZ GLU 122.A OE2 no hydrogen 3.341 N/A GLU 122.A N SER 118.A O no hydrogen 2.821 N/A ASN 123.A N LYS 119.A O no hydrogen 3.022 N/A THR 128.A N ALA 124.A O no hydrogen 3.069 N/A THR 128.A OG1 ALA 124.A O no hydrogen 3.391 N/A THR 128.A OG1 ALA 125.A O no hydrogen 2.731 N/A ALA 129.A N ALA 125.A O no hydrogen 2.888 N/A LEU 130.A N TRP 126.A O no hydrogen 2.954 N/A ALA 131.A N THR 128.A O no hydrogen 3.159 N/A SER 134.A N LEU 130.A O no hydrogen 3.393 N/A SER 134.A OG LEU 130.A O no hydrogen 2.294 N/A VAL 135.A N ALA 20.A O no hydrogen 2.924 N/A GLN 136.A N ILE 2.A O no hydrogen 2.905 N/A VAL 137.A N LEU 22.A O no hydrogen 2.890 N/A THR 138.A N LEU 4.A O no hydrogen 2.887 N/A THR 138.A OG1 LEU 4.A O no hydrogen 3.365 N/A CYS 139.A N LEU 24.A O no hydrogen 2.878 N/A THR 141.A N ASN 26.A OD1 no hydrogen 3.345 N/A GLN 146.A N GLU 143.A O no hydrogen 2.686 N/A LEU 147.A N GLU 143.A O no hydrogen 2.788 N/A ARG 149.A NE GLN 146.A OE1 no hydrogen 2.752 N/A VAL 151.A N LEU 147.A O no hydrogen 2.894 N/A ALA 152.A N PRO 148.A O no hydrogen 2.905 N/A ALA 153.A N ARG 149.A O no hydrogen 2.923 N/A ARG 154.A N TRP 150.A O no hydrogen 2.913 N/A ALA 155.A N VAL 151.A O no hydrogen 2.874 N/A LYS 156.A N ALA 152.A O no hydrogen 2.937 N/A GLN 157.A N ALA 153.A O no hydrogen 2.901 N/A GLN 157.A NE2 ALA 153.A O no hydrogen 3.654 N/A LEU 158.A N ARG 154.A O no hydrogen 3.167 N/A ASN 159.A N LYS 156.A O no hydrogen 3.397 N/A LEU 160.A N ALA 155.A O no hydrogen 2.838 N/A GLU 161.A N GLY 195.A O no hydrogen 3.243 N/A ASN 167.A ND2 PRO 148.A O no hydrogen 3.071 N/A GLN 168.A N ASP 164.A O no hydrogen 2.977 N/A VAL 169.A N ALA 165.A O no hydrogen 2.924 N/A LEU 170.A N ALA 166.A O no hydrogen 2.903 N/A CYS 171.A N ASN 167.A O no hydrogen 2.902 N/A CYS 171.A SG GLN 144.A O no hydrogen 3.909 N/A CYS 171.A SG GLU 175.A OE1 no hydrogen 3.580 N/A TYR 172.A N GLN 168.A O no hydrogen 2.916 N/A TYR 172.A OH HIS 231.A ND1 no hydrogen 2.678 N/A CYS 173.A N VAL 169.A O no hydrogen 2.898 N/A CYS 173.A SG VAL 169.A O no hydrogen 3.248 N/A TYR 174.A N LEU 170.A O no hydrogen 3.000 N/A ASN 177.A N TYR 174.A O no hydrogen 3.105 N/A ALA 180.A N ASN 177.A OD1 no hydrogen 3.138 N/A LEU 181.A N ASN 177.A O no hydrogen 3.309 N/A ALA 182.A N LEU 178.A O no hydrogen 2.902 N/A GLN 183.A N LEU 179.A O no hydrogen 2.958 N/A ALA 184.A N ALA 180.A O no hydrogen 2.829 N/A LEU 185.A N LEU 181.A O no hydrogen 2.915 N/A GLU 186.A N ALA 182.A O no hydrogen 2.954 N/A ARG 187.A N GLN 183.A O no hydrogen 2.867 N/A ARG 187.A NH2 ALA 205.A O no hydrogen 3.382 N/A LEU 188.A N ALA 184.A O no hydrogen 2.838 N/A SER 189.A N LEU 185.A O no hydrogen 2.931 N/A LEU 190.A N GLU 186.A O no hydrogen 2.926 N/A LEU 191.A N ARG 187.A O no hydrogen 2.859 N/A TRP 192.A N LEU 188.A O no hydrogen 3.056 N/A GLY 195.A N TRP 192.A O no hydrogen 3.095 N/A ARG 201.A N THR 198.A O no hydrogen 3.152 N/A VAL 202.A N THR 198.A O no hydrogen 3.020 N/A GLU 203.A N LEU 199.A O no hydrogen 2.944 N/A GLN 204.A N ARG 201.A O no hydrogen 3.283 N/A GLN 204.A N GLN 204.A OE1 no hydrogen 2.573 N/A GLN 204.A NE2 PRO 200.A O no hydrogen 2.514 N/A ALA 205.A N ARG 201.A O no hydrogen 3.129 N/A ASN 207.A N TYR 174.A OH no hydrogen 2.704 N/A ASP 208.A N ASN 207.A OD1 no hydrogen 2.694 N/A HIS 211.A N GLU 175.A O no hydrogen 3.275 N/A HIS 216.A N THR 213.A O no hydrogen 2.763 N/A VAL 218.A N PRO 214.A O no hydrogen 2.931 N/A ASP 219.A N PHE 215.A O no hydrogen 2.911 N/A ALA 220.A N HIS 216.A O no hydrogen 2.873 N/A LEU 221.A N TRP 217.A O no hydrogen 2.937 N/A LEU 222.A N VAL 218.A O no hydrogen 2.911 N/A MET 223.A N ASP 219.A O no hydrogen 2.917 N/A GLY 224.A N LEU 221.A O no hydrogen 2.985 N/A LYS 225.A N ALA 220.A O no hydrogen 2.950 N/A ALA 229.A N LYS 225.A O no hydrogen 2.857 N/A LEU 230.A N SER 226.A O no hydrogen 2.937 N/A HIS 231.A N LYS 227.A O no hydrogen 2.872 N/A ILE 232.A N ARG 228.A O no hydrogen 2.883 N/A LEU 233.A N ALA 229.A O no hydrogen 2.947 N/A GLN 234.A N LEU 230.A O no hydrogen 2.901 N/A GLN 235.A N HIS 231.A O no hydrogen 2.901 N/A GLN 235.A NE2 GLN 234.A OE1 no hydrogen 3.031 N/A LEU 236.A N ILE 232.A O no hydrogen 2.872 N/A ARG 237.A N LEU 233.A O no hydrogen 2.900 N/A LEU 238.A N GLN 234.A O no hydrogen 2.957 N/A GLU 239.A N GLN 235.A O no hydrogen 2.867 N/A GLY 240.A N LEU 236.A O no hydrogen 2.856 N/A GLY 240.A N ARG 237.A O no hydrogen 3.206 N/A SER 241.A N LEU 236.A O no hydrogen 3.157 N/A ILE 245.A N GLU 242.A O no hydrogen 3.262 N/A LEU 247.A N PRO 243.A O no hydrogen 2.910 N/A ARG 248.A N VAL 244.A O no hydrogen 2.911 N/A ARG 248.A NE GLN 251.A OE1 no hydrogen 2.650 N/A ARG 248.A NH1 GLU 309.A OE2 no hydrogen 2.650 N/A ARG 248.A NH2 GLN 251.A OE1 no hydrogen 2.406 N/A ARG 248.A NH2 GLU 309.A OE1 no hydrogen 2.275 N/A ARG 248.A NH2 GLU 309.A OE2 no hydrogen 3.071 N/A THR 249.A N ILE 245.A O no hydrogen 2.915 N/A THR 249.A OG1 ILE 245.A O no hydrogen 2.820 N/A THR 249.A OG1 LEU 246.A O no hydrogen 2.773 N/A LEU 250.A N LEU 246.A O no hydrogen 2.949 N/A GLN 251.A N LEU 247.A O no hydrogen 2.862 N/A ARG 252.A N ARG 248.A O no hydrogen 2.993 N/A LEU 254.A N LEU 250.A O no hydrogen 2.857 N/A LEU 255.A N GLN 251.A O no hydrogen 2.858 N/A LEU 256.A N ARG 252.A O no hydrogen 3.016 N/A LEU 257.A N GLU 253.A O no hydrogen 2.843 N/A VAL 258.A N LEU 254.A O no hydrogen 2.887 N/A ASN 259.A N LEU 255.A O no hydrogen 2.948 N/A LEU 260.A N LEU 256.A O no hydrogen 2.886 N/A LYS 261.A N LEU 257.A O no hydrogen 2.886 N/A LYS 261.A NZ LEU 290.A O no hydrogen 3.555 N/A LYS 261.A NZ LEU 293.A O no hydrogen 2.145 N/A ARG 262.A N VAL 258.A O no hydrogen 2.921 N/A GLN 263.A N ASN 259.A O no hydrogen 2.928 N/A SER 264.A N LYS 261.A O no hydrogen 3.340 N/A SER 264.A OG LYS 261.A O no hydrogen 3.141 N/A HIS 266.A N GLN 263.A O no hydrogen 3.318 N/A THR 267.A N GLN 263.A O no hydrogen 3.113 N/A LEU 272.A N PRO 268.A O no hydrogen 3.200 N/A PHE 273.A N LEU 269.A O no hydrogen 2.910 N/A LYS 275.A N ALA 271.A O no hydrogen 2.913 N/A HIS 276.A N LEU 272.A O no hydrogen 2.896 N/A HIS 276.A ND1 LEU 272.A O no hydrogen 3.083 N/A ARG 277.A N ASP 274.A O no hydrogen 3.424 N/A VAL 278.A N PHE 273.A O no hydrogen 3.386 N/A TRP 279.A NE1 ASN 281.A OD1 no hydrogen 2.759 N/A ARG 282.A N TRP 279.A O no hydrogen 3.279 N/A ARG 282.A NE GLU 253.A OE2 no hydrogen 3.269 N/A ARG 282.A NH2 GLU 253.A OE2 no hydrogen 3.458 N/A MET 286.A N ARG 282.A O no hydrogen 2.745 N/A GLY 287.A N ARG 283.A O no hydrogen 2.757 N/A GLU 288.A N GLY 284.A O no hydrogen 2.806 N/A ALA 289.A N MET 285.A O no hydrogen 2.994 N/A LEU 290.A N MET 286.A O no hydrogen 2.699 N/A ASN 291.A N GLY 287.A O no hydrogen 2.756 N/A ARG 292.A N ALA 289.A O no hydrogen 2.947 N/A LEU 293.A N ALA 289.A O no hydrogen 2.908 N/A SER 294.A N GLN 297.A OE1 no hydrogen 2.852 N/A SER 294.A OG THR 296.A OG1 no hydrogen 2.856 N/A SER 294.A OG GLN 297.A OE1 no hydrogen 2.305 N/A GLN 295.A N GLN 295.A OE1 no hydrogen 2.530 N/A THR 296.A OG1 SER 294.A OG no hydrogen 2.856 N/A LEU 298.A N SER 294.A O no hydrogen 3.244 N/A ARG 299.A N GLN 295.A O no hydrogen 2.895 N/A GLN 300.A N THR 296.A O no hydrogen 2.947 N/A ALA 301.A N GLN 297.A O no hydrogen 2.858 N/A VAL 302.A N LEU 298.A O no hydrogen 2.903 N/A GLN 303.A N ARG 299.A O no hydrogen 2.917 N/A LEU 304.A N GLN 300.A O no hydrogen 2.905 N/A LEU 305.A N ALA 301.A O no hydrogen 2.857 N/A THR 306.A N VAL 302.A O no hydrogen 2.875 N/A THR 306.A OG1 VAL 302.A O no hydrogen 2.759 N/A ARG 307.A N GLN 303.A O no hydrogen 2.950 N/A ARG 307.A NH2 GLU 323.A OE1 no hydrogen 3.139 N/A ARG 307.A NH2 GLU 323.A OE2 no hydrogen 3.398 N/A THR 308.A N LEU 304.A O no hydrogen 2.908 N/A THR 308.A OG1 LEU 304.A O no hydrogen 2.774 N/A GLU 309.A N LEU 305.A O no hydrogen 2.897 N/A LEU 310.A N THR 306.A O no hydrogen 2.913 N/A THR 311.A N ARG 307.A O no hydrogen 2.908 N/A THR 311.A OG1 ARG 307.A O no hydrogen 2.826 N/A THR 311.A OG1 THR 308.A O no hydrogen 2.901 N/A LEU 312.A N THR 308.A O no hydrogen 2.880 N/A LYS 313.A N GLU 309.A O no hydrogen 2.946 N/A LYS 313.A NZ GLU 309.A OE2 no hydrogen 2.447 N/A GLN 314.A N LEU 310.A O no hydrogen 2.878 N/A GLU 323.A N SER 319.A O no hydrogen 3.181 N/A LEU 324.A N VAL 320.A O no hydrogen 2.873 N/A GLU 325.A N TRP 321.A O no hydrogen 2.979 N/A GLY 326.A N ALA 322.A O no hydrogen 2.921 N/A LEU 327.A N GLU 323.A O no hydrogen 2.913 N/A SER 328.A N LEU 324.A O no hydrogen 2.892 N/A SER 328.A OG GLU 325.A O no hydrogen 2.287 N/A LEU 329.A N GLU 325.A O no hydrogen 2.937 N/A LEU 330.A N GLY 326.A O no hydrogen 2.905 N/A LEU 331.A N LEU 327.A O no hydrogen 2.705 N/A CYS 332.A SG LEU 222.A O no hydrogen 3.776 N/A PHE 340.A N ASP 338.A O no hydrogen 2.392 N/A ASP 342.A N VAL 339.A O no hydrogen 2.899 N/A