Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4km5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ GLU 355.A O no hydrogen 2.676 N/A LYS 4.A NZ PHE 356.A O no hydrogen 2.734 N/A ARG 6.A N ALA 2.A O no hydrogen 2.659 N/A VAL 8.A N LYS 4.A O no hydrogen 3.189 N/A VAL 8.A N LEU 5.A O no hydrogen 3.015 N/A LEU 9.A N LEU 5.A O no hydrogen 3.139 N/A GLU 10.A N ARG 6.A O no hydrogen 3.115 N/A LYS 11.A N VAL 8.A O no hydrogen 3.276 N/A LYS 11.A NZ PHE 359.A O no hydrogen 3.226 N/A LYS 11.A NZ ASP 360.A OD1 no hydrogen 2.617 N/A LEU 12.A N VAL 8.A O no hydrogen 3.371 N/A LYS 13.A N LEU 9.A O no hydrogen 3.314 N/A LYS 13.A NZ LEU 9.A O no hydrogen 3.552 N/A SER 15.A OG LEU 12.A O no hydrogen 2.741 N/A ARG 16.A N LYS 13.A O no hydrogen 3.040 N/A THR 21.A OG1 ASP 18.A O no hydrogen 3.161 N/A ALA 23.A N ILE 19.A O no hydrogen 2.680 N/A GLY 24.A N SER 20.A O no hydrogen 3.425 N/A VAL 26.A N ALA 22.A O no hydrogen 3.079 N/A LYS 27.A N ALA 23.A O no hydrogen 3.177 N/A GLY 28.A N GLY 24.A O no hydrogen 3.193 N/A VAL 29.A N MET 25.A O no hydrogen 3.383 N/A VAL 30.A N VAL 26.A O no hydrogen 2.807 N/A ASP 31.A N LYS 27.A O no hydrogen 2.801 N/A HIS 32.A N GLY 28.A O no hydrogen 3.295 N/A LEU 33.A N VAL 29.A O no hydrogen 2.987 N/A LEU 34.A N VAL 30.A O no hydrogen 2.994 N/A LEU 35.A N ASP 31.A O no hydrogen 3.175 N/A ARG 36.A N HIS 32.A O no hydrogen 3.325 N/A ARG 36.A NE GLU 126.A OE1 no hydrogen 3.190 N/A ARG 36.A NE GLU 127.A OE2 no hydrogen 2.994 N/A ARG 36.A NH1 ARG 36.A O no hydrogen 3.556 N/A ARG 36.A NH2 GLU 126.A OE1 no hydrogen 2.639 N/A LEU 37.A N LEU 33.A O no hydrogen 2.874 N/A LYS 38.A N LEU 34.A O no hydrogen 3.057 N/A CYS 39.A N ARG 36.A O no hydrogen 2.887 N/A CYS 39.A SG LEU 35.A O no hydrogen 3.216 N/A ASP 40.A N LEU 37.A O no hydrogen 3.141 N/A ALA 42.A N ASP 40.A OD1 no hydrogen 2.911 N/A THR 51.A N ASN 50.A OD1 no hydrogen 2.753 N/A SER 53.A OG ALA 23.A O no hydrogen 3.085 N/A HIS 57.A NE2 PRO 63.A O no hydrogen 2.983 N/A ILE 60.A N GLU 258.A OE1 no hydrogen 3.333 N/A ILE 60.A N GLU 258.A OE2 no hydrogen 3.068 N/A SER 61.A N GLU 258.A OE1 no hydrogen 2.972 N/A GLU 65.A N ALA 62.A O no hydrogen 3.291 N/A PHE 66.A N SER 157.A O no hydrogen 2.714 N/A ASP 67.A N GLU 56.A O no hydrogen 3.140 N/A VAL 68.A N ASP 159.A O no hydrogen 2.597 N/A PHE 70.A N THR 161.A O no hydrogen 2.583 N/A LYS 71.A N GLY 47.A O no hydrogen 2.894 N/A LYS 71.A NZ GLU 165.A OE1 no hydrogen 2.673 N/A LYS 71.A NZ GLU 165.A OE2 no hydrogen 3.526 N/A LEU 72.A N ALA 163.A O no hydrogen 2.788 N/A VAL 74.A N GLU 165.A O no hydrogen 3.347 N/A GLN 78.A N LYS 92.A O no hydrogen 2.737 N/A GLU 80.A N PHE 90.A O no hydrogen 3.005 N/A TYR 82.A N TYR 88.A O no hydrogen 3.062 N/A TYR 82.A OH GLY 209.A O no hydrogen 2.727 N/A TYR 82.A OH GLN 211.A OE1 no hydrogen 3.278 N/A SER 83.A OG SER 83.A O no hydrogen 2.358 N/A THR 85.A N TYR 82.A O no hydrogen 3.127 N/A THR 85.A OG1 TYR 82.A O no hydrogen 2.559 N/A ARG 86.A NE GLU 327.A OE2 no hydrogen 3.463 N/A TYR 88.A OH HIS 203.A NE2 no hydrogen 2.691 N/A TYR 89.A N TRP 215.A O no hydrogen 2.783 N/A TYR 89.A OH SER 173.A OG no hydrogen 2.797 N/A PHE 90.A N GLU 80.A O no hydrogen 2.712 N/A LYS 92.A N GLN 78.A O no hydrogen 2.919 N/A LYS 92.A NZ GLU 80.A OE2 no hydrogen 2.720 N/A ARG 95.A NE LYS 94.A O no hydrogen 3.525 N/A ASN 96.A N LYS 94.A O no hydrogen 2.679 N/A ASN 100.A N SER 103.A OG no hydrogen 3.335 N/A LEU 102.A N ASN 100.A OD1 no hydrogen 3.334 N/A SER 103.A N ASN 100.A O no hydrogen 2.807 N/A SER 103.A OG ASN 100.A O no hydrogen 2.729 N/A PHE 105.A N LEU 102.A O no hydrogen 3.139 N/A GLU 107.A N ILE 110.A O no hydrogen 3.112 N/A LEU 111.A N VAL 91.A O no hydrogen 2.693 N/A SER 112.A N PHE 105.A O no hydrogen 2.843 N/A SER 112.A OG GLU 213.A OE1 no hydrogen 3.117 N/A ALA 113.A N GLU 213.A OE1 no hydrogen 2.516 N/A SER 114.A N GLU 213.A OE1 no hydrogen 3.335 N/A SER 114.A OG GLU 213.A OE2 no hydrogen 2.539 N/A LYS 115.A N SER 112.A OG no hydrogen 3.261 N/A LYS 115.A NZ LEU 106.A O no hydrogen 2.930 N/A LEU 117.A N ALA 113.A O no hydrogen 2.898 N/A SER 118.A N SER 114.A O no hydrogen 2.877 N/A SER 118.A OG LYS 115.A O no hydrogen 2.755 N/A LYS 119.A N LYS 115.A O no hydrogen 3.315 N/A LYS 119.A NZ ASP 40.A OD1 no hydrogen 2.819 N/A LYS 119.A NZ ASP 40.A OD2 no hydrogen 3.395 N/A PHE 120.A N MET 116.A O no hydrogen 3.050 N/A ARG 121.A N LEU 117.A O no hydrogen 2.850 N/A LYS 122.A N SER 118.A O no hydrogen 3.158 N/A ILE 123.A N LYS 119.A O no hydrogen 2.993 N/A ILE 124.A N PHE 120.A O no hydrogen 3.326 N/A LYS 125.A N ARG 121.A O no hydrogen 2.839 N/A GLU 126.A N LYS 122.A O no hydrogen 2.999 N/A GLU 127.A N ILE 124.A O no hydrogen 3.043 N/A ILE 128.A N ILE 124.A O no hydrogen 3.356 N/A ILE 131.A N ILE 128.A O no hydrogen 3.399 N/A ASP 133.A N ASP 133.A OD1 no hydrogen 2.475 N/A ILE 137.A N LEU 151.A O no hydrogen 3.270 N/A LYS 139.A N THR 149.A O no hydrogen 2.725 N/A SER 145.A OG ARG 142.A O no hydrogen 3.079 N/A VAL 148.A N ILE 160.A O no hydrogen 3.031 N/A THR 149.A OG1 ASP 159.A OD1 no hydrogen 2.680 N/A LEU 150.A N VAL 158.A O no hydrogen 2.806 N/A LEU 151.A N ILE 137.A O no hydrogen 2.885 N/A ILE 152.A N ILE 156.A O no hydrogen 2.928 N/A SER 153.A N ASP 135.A O no hydrogen 3.096 N/A LYS 155.A N ILE 152.A O no hydrogen 3.322 N/A ILE 156.A N ILE 152.A O no hydrogen 3.356 N/A SER 157.A N ASN 64.A O no hydrogen 2.881 N/A VAL 158.A N LEU 150.A O no hydrogen 2.663 N/A ASP 159.A N PHE 66.A O no hydrogen 2.862 N/A ILE 160.A N VAL 148.A O no hydrogen 2.811 N/A THR 161.A N VAL 68.A O no hydrogen 2.693 N/A ALA 163.A N PHE 70.A O no hydrogen 2.721 N/A LEU 164.A N LEU 199.A O no hydrogen 2.866 N/A GLU 165.A N LEU 72.A O no hydrogen 2.916 N/A SER 166.A N PHE 197.A O no hydrogen 3.077 N/A LYS 167.A NZ GLU 73.A OE2 no hydrogen 3.379 N/A SER 168.A N SER 166.A OG no hydrogen 3.387 N/A TRP 170.A NE1 LYS 195.A O no hydrogen 2.763 N/A SER 173.A OG ARG 86.A O no hydrogen 3.223 N/A SER 173.A OG TYR 89.A OH no hydrogen 2.797 N/A THR 174.A N PRO 171.A O no hydrogen 3.133 N/A THR 174.A OG1 PRO 171.A O no hydrogen 2.833 N/A GLN 175.A N ALA 172.A O no hydrogen 3.283 N/A LEU 178.A N TYR 323.A O no hydrogen 2.913 N/A GLN 181.A N GLN 181.A OE1 no hydrogen 2.641 N/A TRP 183.A N ILE 180.A O no hydrogen 3.203 N/A TRP 183.A NE1 HIS 230.A O no hydrogen 2.598 N/A LEU 184.A N ILE 180.A O no hydrogen 2.647 N/A SER 185.A OG LEU 184.A O no hydrogen 2.376 N/A ARG 189.A N SER 185.A O no hydrogen 3.455 N/A ARG 189.A NE GLY 177.A O no hydrogen 3.333 N/A ARG 189.A NE LEU 178.A O no hydrogen 2.850 N/A ARG 189.A NH2 GLN 175.A O no hydrogen 2.918 N/A ARG 189.A NH2 GLY 177.A O no hydrogen 2.652 N/A LYS 190.A N ALA 186.A O no hydrogen 3.038 N/A GLN 191.A N LYS 187.A O no hydrogen 2.957 N/A LEU 192.A N VAL 188.A O no hydrogen 2.894 N/A ARG 193.A N ARG 189.A O no hydrogen 3.097 N/A ARG 193.A NH2 THR 174.A O no hydrogen 3.119 N/A LEU 194.A N GLN 191.A O no hydrogen 3.191 N/A LYS 195.A N LEU 192.A O no hydrogen 3.155 N/A LYS 195.A NZ GLN 191.A O no hydrogen 3.442 N/A PHE 197.A N SER 166.A O no hydrogen 3.036 N/A TYR 198.A N SER 218.A O no hydrogen 3.340 N/A TYR 198.A OH GLU 165.A OE2 no hydrogen 2.931 N/A LEU 199.A N LEU 164.A O no hydrogen 2.968 N/A VAL 200.A N ARG 216.A O no hydrogen 2.660 N/A HIS 203.A NE2 TYR 88.A OH no hydrogen 2.691 N/A ASN 208.A N ASN 208.A OD1 no hydrogen 2.524 N/A TRP 215.A N TYR 89.A O no hydrogen 2.713 N/A TRP 215.A NE1 LEU 111.A O no hydrogen 3.260 N/A ARG 216.A N VAL 200.A O no hydrogen 2.633 N/A LEU 217.A N ALA 87.A O no hydrogen 3.426 N/A SER 218.A N TYR 198.A O no hydrogen 2.630 N/A HIS 221.A N HIS 221.A ND1 no hydrogen 2.931 N/A ILE 222.A N PHE 219.A O no hydrogen 2.981 N/A GLU 223.A N PHE 219.A O no hydrogen 3.052 N/A LYS 224.A N SER 220.A O no hydrogen 3.105 N/A GLU 225.A N HIS 221.A O no hydrogen 3.264 N/A ILE 226.A N ILE 222.A O no hydrogen 2.956 N/A LEU 227.A N GLU 223.A O no hydrogen 2.953 N/A ASN 228.A N LYS 224.A O no hydrogen 3.006 N/A ASN 229.A N GLU 225.A O no hydrogen 3.073 N/A ASN 229.A N ILE 226.A O no hydrogen 3.228 N/A HIS 230.A ND1 LEU 227.A O no hydrogen 2.666 N/A LYS 232.A N ASP 292.A OD1 no hydrogen 2.728 N/A LYS 232.A NZ ASN 182.A O no hydrogen 2.406 N/A SER 233.A N ASP 292.A OD2 no hydrogen 2.856 N/A SER 233.A OG THR 235.A OG1 no hydrogen 3.228 N/A SER 233.A OG GLU 242.A OE2 no hydrogen 2.672 N/A THR 235.A N SER 233.A OG no hydrogen 3.260 N/A THR 235.A OG1 SER 233.A OG no hydrogen 3.228 N/A THR 235.A OG1 GLU 242.A OE1 no hydrogen 2.367 N/A THR 235.A OG1 GLU 242.A OE2 no hydrogen 3.039 N/A CYS 236.A N SER 233.A O no hydrogen 3.358 N/A CYS 236.A SG GLU 242.A O no hydrogen 3.545 N/A CYS 237.A N GLU 242.A O no hydrogen 2.582 N/A CYS 237.A SG HIS 230.A NE2 no hydrogen 3.484 N/A CYS 237.A SG GLU 242.A O no hydrogen 3.611 N/A GLU 238.A N THR 235.A O no hydrogen 3.209 N/A ASN 239.A ND2 GLU 242.A OE1 no hydrogen 3.013 N/A GLU 242.A N ASN 239.A O no hydrogen 3.234 N/A CYS 244.A SG HIS 230.A NE2 no hydrogen 3.490 N/A CYS 245.A N TRP 295.A O no hydrogen 2.919 N/A CYS 245.A SG TRP 295.A O no hydrogen 3.430 N/A CYS 245.A SG ASP 296.A O no hydrogen 3.437 N/A ARG 246.A NH1 ASP 292.A OD1 no hydrogen 2.945 N/A ARG 246.A NH2 ASP 292.A OD1 no hydrogen 2.657 N/A CYS 249.A N CYS 245.A O no hydrogen 3.135 N/A CYS 249.A SG CYS 245.A O no hydrogen 3.210 N/A LEU 250.A N ARG 246.A O no hydrogen 3.169 N/A LYS 251.A N LYS 247.A O no hydrogen 2.974 N/A LEU 252.A N ASP 248.A O no hydrogen 2.935 N/A MET 253.A N CYS 249.A O no hydrogen 3.097 N/A LYS 254.A N LEU 250.A O no hydrogen 2.996 N/A TYR 255.A N LYS 251.A O no hydrogen 2.736 N/A LEU 256.A N LEU 252.A O no hydrogen 2.886 N/A LEU 257.A N MET 253.A O no hydrogen 3.309 N/A GLU 258.A N LYS 254.A O no hydrogen 3.147 N/A GLN 259.A N TYR 255.A O no hydrogen 3.052 N/A LEU 260.A N LEU 256.A O no hydrogen 3.078 N/A LYS 261.A N LEU 257.A O no hydrogen 2.824 N/A LYS 261.A NZ PHE 273.A O no hydrogen 3.337 N/A GLU 262.A N GLU 258.A O no hydrogen 2.877 N/A ARG 263.A N GLN 259.A O no hydrogen 3.142 N/A PHE 264.A N LEU 260.A O no hydrogen 3.068 N/A LYS 265.A NZ GLU 262.A OE1 no hydrogen 2.854 N/A LYS 267.A NZ HIS 269.A ND1 no hydrogen 3.476 N/A LYS 268.A N PHE 264.A O no hydrogen 3.376 N/A LYS 268.A NZ LYS 265.A O no hydrogen 3.483 N/A LYS 268.A NZ ASP 266.A O no hydrogen 2.960 N/A SER 274.A N HIS 277.A ND1 no hydrogen 3.024 N/A SER 274.A OG HIS 277.A ND1 no hydrogen 3.145 N/A TYR 276.A OH GLU 223.A OE2 no hydrogen 3.368 N/A HIS 277.A N SER 274.A O no hydrogen 3.135 N/A HIS 277.A ND1 SER 274.A OG no hydrogen 3.145 N/A LYS 279.A N SER 275.A O no hydrogen 2.854 N/A LYS 279.A NZ GLU 223.A OE1 no hydrogen 2.870 N/A THR 280.A N TYR 276.A O no hydrogen 2.833 N/A THR 280.A OG1 TYR 276.A O no hydrogen 2.633 N/A ALA 281.A N HIS 277.A O no hydrogen 3.103 N/A PHE 282.A N VAL 278.A O no hydrogen 2.950 N/A PHE 283.A N LYS 279.A O no hydrogen 3.278 N/A HIS 284.A N THR 280.A O no hydrogen 3.397 N/A HIS 284.A ND1 THR 280.A O no hydrogen 2.788 N/A VAL 285.A N ALA 281.A O no hydrogen 3.150 N/A CYS 286.A N PHE 282.A O no hydrogen 2.994 N/A CYS 286.A SG PHE 282.A O no hydrogen 3.386 N/A THR 287.A N PHE 283.A O no hydrogen 3.025 N/A THR 287.A OG1 PHE 283.A O no hydrogen 2.995 N/A GLN 288.A N HIS 284.A O no hydrogen 2.955 N/A ASN 289.A N VAL 285.A O no hydrogen 2.749 N/A ASN 289.A ND2 VAL 285.A O no hydrogen 2.870 N/A GLN 291.A N GLN 294.A OE1 no hydrogen 3.179 N/A GLN 294.A N GLN 291.A O no hydrogen 3.119 N/A TRP 295.A N ASP 292.A O no hydrogen 3.045 N/A TRP 295.A NE1 ASN 289.A O no hydrogen 2.758 N/A ARG 297.A NH1 ASP 248.A OD2 no hydrogen 2.319 N/A ASP 299.A N ASP 296.A O no hydrogen 3.091 N/A CYS 303.A N ASP 299.A O no hydrogen 2.733 N/A CYS 303.A SG GLN 294.A O no hydrogen 3.190 N/A CYS 303.A SG ASP 299.A O no hydrogen 3.132 N/A PHE 304.A N LEU 300.A O no hydrogen 2.988 N/A ASP 305.A N GLY 301.A O no hydrogen 3.229 N/A ASN 306.A N LEU 302.A O no hydrogen 3.294 N/A CYS 307.A N CYS 303.A O no hydrogen 3.299 N/A CYS 307.A SG CYS 303.A O no hydrogen 3.332 N/A VAL 308.A N PHE 304.A O no hydrogen 3.044 N/A THR 309.A N ASP 305.A O no hydrogen 2.963 N/A THR 309.A OG1 ASP 305.A O no hydrogen 3.070 N/A THR 309.A OG1 ASN 306.A O no hydrogen 3.069 N/A TYR 310.A N ASN 306.A O no hydrogen 3.025 N/A PHE 311.A N CYS 307.A O no hydrogen 3.115 N/A LEU 312.A N VAL 308.A O no hydrogen 2.926 N/A GLN 313.A N THR 309.A O no hydrogen 3.008 N/A CYS 314.A N TYR 310.A O no hydrogen 3.091 N/A CYS 314.A SG TYR 310.A O no hydrogen 3.242 N/A LEU 315.A N PHE 311.A O no hydrogen 3.193 N/A LEU 315.A N LEU 312.A O no hydrogen 3.060 N/A ARG 316.A N LEU 312.A O no hydrogen 2.974 N/A ARG 316.A NH2 GLU 349.A OE2 no hydrogen 2.851 N/A THR 317.A N GLN 313.A O no hydrogen 2.926 N/A THR 317.A OG1 GLN 313.A O no hydrogen 2.659 N/A GLU 318.A N LEU 315.A O no hydrogen 3.246 N/A LYS 319.A N CYS 314.A O no hydrogen 2.978 N/A LEU 320.A N ASN 329.A OD1 no hydrogen 3.026 N/A ASN 322.A N PHE 328.A O no hydrogen 2.890 N/A ASN 322.A ND2 TYR 276.A OH no hydrogen 3.491 N/A TYR 323.A OH THR 287.A OG1 no hydrogen 2.487 N/A PHE 324.A N ASN 322.A OD1 no hydrogen 2.888 N/A ILE 325.A N ASN 322.A OD1 no hydrogen 2.931 N/A PHE 328.A N ILE 325.A O no hydrogen 3.019 N/A ASN 329.A ND2 GLU 318.A O no hydrogen 3.244 N/A LEU 330.A N LEU 320.A O no hydrogen 2.837 N/A PHE 331.A N ASN 329.A OD1 no hydrogen 2.978 N/A SER 332.A N ASN 329.A O no hydrogen 3.432 N/A LEU 335.A N SER 332.A O no hydrogen 3.098 N/A ILE 336.A N SER 332.A O no hydrogen 3.116 N/A LYS 338.A NZ GLU 318.A OE1 no hydrogen 2.285 N/A ARG 339.A NH1 ARG 339.A O no hydrogen 3.263 N/A SER 340.A N ASP 337.A O no hydrogen 3.137 N/A LYS 341.A N ASP 337.A O no hydrogen 3.455 N/A LYS 341.A NZ GLU 318.A OE2 no hydrogen 2.971 N/A GLU 342.A N LYS 338.A O no hydrogen 3.039 N/A PHE 343.A N ARG 339.A O no hydrogen 2.884 N/A LEU 344.A N SER 340.A O no hydrogen 2.867 N/A THR 345.A N LYS 341.A O no hydrogen 2.690 N/A THR 345.A OG1 LYS 341.A O no hydrogen 2.505 N/A LYS 346.A N GLU 342.A O no hydrogen 3.057 N/A GLN 347.A N PHE 343.A O no hydrogen 3.126 N/A ILE 348.A N LEU 344.A O no hydrogen 2.959 N/A GLU 349.A N THR 345.A O no hydrogen 2.861 N/A TYR 350.A N LYS 346.A O no hydrogen 3.063 N/A GLU 351.A N GLN 347.A O no hydrogen 3.156 N/A ARG 352.A N ILE 348.A O no hydrogen 2.949 N/A ARG 352.A NE ASP 305.A OD1 no hydrogen 3.091 N/A ASN 353.A N GLU 349.A O no hydrogen 3.061 N/A ASN 354.A N TYR 350.A O no hydrogen 3.116 N/A ASN 354.A ND2 TYR 350.A O no hydrogen 2.961 N/A PHE 356.A N GLU 351.A O no hydrogen 2.544 N/A PHE 359.A N PHE 356.A O no hydrogen 3.346 N/A