Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kvk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLN 107.A OE1 no hydrogen 3.477 N/A MET 1.A N GLU 146.A OE1 no hydrogen 3.442 N/A LEU 2.A N ALA 144.A O no hydrogen 2.809 N/A LEU 6.A N LEU 41.A O no hydrogen 3.033 N/A VAL 8.A N LEU 39.A O no hydrogen 3.152 N/A SER 9.A N SER 362.A O no hydrogen 2.791 N/A SER 9.A OG HIS 364.A NE2 no hydrogen 2.623 N/A ALA 10.A N THR 37.A O no hydrogen 2.893 N/A GLY 12.A N LEU 33.A O no hydrogen 3.136 N/A LYS 13.A N LEU 127.A O no hydrogen 2.916 N/A LYS 13.A NZ GLY 126.A O no hydrogen 2.990 N/A VAL 14.A N VAL 31.A O no hydrogen 3.167 N/A ILE 15.A N THR 316.A OG1 no hydrogen 3.210 N/A LEU 16.A N LEU 29.A O no hydrogen 2.763 N/A GLU 19.A N GLU 19.A OE2 no hydrogen 2.894 N/A HIS 20.A NE2 ALA 318.A O no hydrogen 2.962 N/A VAL 22.A N GLY 18.A O no hydrogen 3.040 N/A VAL 23.A N HIS 20.A O no hydrogen 3.256 N/A HIS 24.A N ALA 21.A O no hydrogen 2.948 N/A GLY 25.A N VAL 22.A O no hydrogen 3.170 N/A LYS 26.A N ALA 21.A O no hydrogen 3.093 N/A VAL 27.A N ASP 253.A OD2 no hydrogen 2.541 N/A ALA 28.A N TYR 200.A O no hydrogen 2.895 N/A LEU 29.A N HIS 17.A O no hydrogen 2.700 N/A ALA 30.A N LEU 198.A O no hydrogen 2.953 N/A VAL 31.A N VAL 14.A O no hydrogen 3.058 N/A ALA 32.A N GLY 196.A O no hydrogen 2.902 N/A LEU 33.A N GLY 12.A O no hydrogen 2.720 N/A ASN 34.A N SER 355.A O no hydrogen 2.933 N/A ARG 36.A N GLU 120.A OE1 no hydrogen 2.985 N/A ARG 36.A NE SER 9.A OG no hydrogen 2.663 N/A ARG 36.A NH1 ASN 34.A OD1 no hydrogen 3.168 N/A ARG 36.A NH2 SER 9.A O no hydrogen 3.333 N/A THR 37.A N ALA 10.A O no hydrogen 2.853 N/A PHE 38.A N TRP 118.A O no hydrogen 2.931 N/A LEU 39.A N VAL 8.A O no hydrogen 2.870 N/A VAL 40.A N MET 116.A O no hydrogen 2.741 N/A LEU 41.A N LEU 6.A O no hydrogen 2.890 N/A ARG 42.A N ASP 114.A O no hydrogen 2.846 N/A GLN 44.A N SER 112.A O no hydrogen 2.608 N/A GLN 44.A NE2 PRO 43.A O no hydrogen 3.004 N/A ASN 46.A ND2 GLN 44.A OE1 no hydrogen 3.471 N/A LYS 48.A N ASN 46.A O no hydrogen 2.573 N/A VAL 49.A N TRP 62.A O no hydrogen 2.941 N/A SER 50.A N LEU 113.A O no hydrogen 3.112 N/A SER 50.A OG ASP 114.A OD1 no hydrogen 2.559 N/A LEU 51.A N GLN 60.A O no hydrogen 2.930 N/A ASN 52.A N ILE 115.A O no hydrogen 2.926 N/A LEU 53.A N ILE 58.A O no hydrogen 2.824 N/A GLY 57.A N PRO 54.A O no hydrogen 2.527 N/A ILE 58.A N LEU 53.A O no hydrogen 3.160 N/A GLN 60.A N LEU 51.A O no hydrogen 2.902 N/A TRP 62.A N VAL 49.A O no hydrogen 2.992 N/A VAL 64.A N GLY 47.A O no hydrogen 2.758 N/A THR 66.A N ASP 63.A OD1 no hydrogen 2.889 N/A THR 66.A OG1 ASP 63.A OD1 no hydrogen 2.608 N/A LEU 67.A N ASP 63.A O no hydrogen 3.444 N/A GLN 68.A N VAL 64.A O no hydrogen 2.682 N/A LEU 69.A N THR 66.A O no hydrogen 3.088 N/A LEU 70.A N LEU 67.A O no hydrogen 3.129 N/A THR 72.A OG1 LEU 70.A O no hydrogen 3.465 N/A VAL 78.A N LYS 74.A O no hydrogen 2.902 N/A ALA 79.A N LEU 75.A O no hydrogen 2.862 N/A GLY 80.A N LYS 77.A O no hydrogen 2.946 N/A LEU 81.A N VAL 78.A O no hydrogen 2.851 N/A ALA 95.A N LEU 91.A O no hydrogen 2.750 N/A PHE 96.A N SER 92.A O no hydrogen 2.778 N/A LEU 97.A N LEU 93.A O no hydrogen 3.336 N/A TYR 98.A N LEU 94.A O no hydrogen 3.104 N/A LEU 99.A N ALA 95.A O no hydrogen 3.231 N/A TYR 100.A N PHE 96.A O no hydrogen 2.746 N/A TYR 100.A OH PRO 111.A O no hydrogen 2.486 N/A LEU 101.A N LEU 97.A O no hydrogen 2.884 N/A ALA 102.A N TYR 98.A O no hydrogen 3.027 N/A ILE 103.A N LEU 99.A O no hydrogen 3.315 N/A CYS 104.A N TYR 100.A O no hydrogen 3.101 N/A CYS 104.A SG TYR 100.A O no hydrogen 3.304 N/A ARG 105.A N LEU 101.A O no hydrogen 2.797 N/A LYS 106.A NZ ALA 102.A O no hydrogen 2.851 N/A GLN 107.A N CYS 104.A O no hydrogen 2.679 N/A THR 109.A OG1 ARG 108.A O no hydrogen 2.652 N/A SER 112.A OG ASN 46.A O no hydrogen 2.524 N/A ILE 115.A N SER 50.A O no hydrogen 2.831 N/A MET 116.A N VAL 40.A O no hydrogen 2.725 N/A VAL 117.A N ASN 52.A O no hydrogen 3.243 N/A TRP 118.A N PHE 38.A O no hydrogen 2.989 N/A SER 119.A N ASN 55.A OD1 no hydrogen 3.265 N/A SER 119.A OG ASN 55.A OD1 no hydrogen 3.525 N/A GLU 120.A N ARG 36.A O no hydrogen 2.897 N/A SER 130.A OG GLU 177.A OE1 no hydrogen 2.542 N/A SER 130.A OG GLU 177.A OE2 no hydrogen 3.451 N/A ALA 131.A N GLY 128.A O no hydrogen 3.317 N/A ALA 132.A N GLY 128.A O no hydrogen 3.327 N/A TYR 133.A N SER 129.A O no hydrogen 3.090 N/A TYR 133.A OH SER 92.A O no hydrogen 3.179 N/A SER 134.A N SER 130.A O no hydrogen 2.908 N/A SER 134.A OG SER 130.A O no hydrogen 2.939 N/A VAL 135.A N ALA 131.A O no hydrogen 2.695 N/A CYS 136.A N ALA 132.A O no hydrogen 3.111 N/A CYS 136.A SG VAL 8.A O no hydrogen 4.008 N/A CYS 136.A SG THR 37.A O no hydrogen 3.145 N/A CYS 136.A SG ALA 132.A O no hydrogen 3.273 N/A VAL 137.A N TYR 133.A O no hydrogen 2.930 N/A ALA 138.A N SER 134.A O no hydrogen 2.843 N/A ALA 139.A N VAL 135.A O no hydrogen 2.848 N/A ALA 140.A N CYS 136.A O no hydrogen 2.973 N/A LEU 141.A N VAL 137.A O no hydrogen 3.095 N/A LEU 142.A N ALA 138.A O no hydrogen 3.105 N/A THR 143.A N ALA 139.A O no hydrogen 3.206 N/A THR 143.A OG1 ALA 139.A O no hydrogen 2.857 N/A ALA 144.A N ALA 140.A O no hydrogen 2.889 N/A CYS 145.A N LEU 141.A O no hydrogen 2.884 N/A CYS 145.A SG LEU 141.A O no hydrogen 3.760 N/A GLU 146.A N THR 143.A O no hydrogen 3.138 N/A GLU 147.A N LEU 142.A O no hydrogen 2.728 N/A THR 149.A N ASP 165.A OD1 no hydrogen 3.203 N/A THR 149.A OG1 ASP 165.A OD1 no hydrogen 2.479 N/A LYS 153.A N ASN 150.A O no hydrogen 2.824 N/A ARG 155.A N LEU 152.A O no hydrogen 3.140 N/A ARG 155.A NH1 GLU 4.A OE2 no hydrogen 2.854 N/A GLY 159.A N MET 363.A O no hydrogen 3.066 N/A SER 160.A OG TRP 161.A O no hydrogen 3.397 N/A GLU 164.A N GLU 164.A OE1 no hydrogen 2.441 N/A LEU 166.A N PRO 162.A O no hydrogen 2.800 N/A LYS 167.A N GLU 163.A O no hydrogen 2.995 N/A SER 168.A N ASP 165.A O no hydrogen 3.027 N/A SER 168.A OG GLU 164.A O no hydrogen 3.490 N/A ILE 169.A N ASP 165.A O no hydrogen 3.099 N/A ASN 170.A N LEU 166.A O no hydrogen 2.924 N/A ASN 170.A ND2 ASN 189.A OD1 no hydrogen 2.656 N/A ASN 170.A ND2 THR 193.A OG1 no hydrogen 3.284 N/A LYS 171.A N LYS 167.A O no hydrogen 3.081 N/A TRP 172.A N SER 168.A O no hydrogen 3.139 N/A ALA 173.A N ILE 169.A O no hydrogen 2.777 N/A TYR 174.A N ASN 170.A O no hydrogen 2.760 N/A TYR 174.A OH PRO 184.A O no hydrogen 2.681 N/A GLU 175.A N LYS 171.A O no hydrogen 3.427 N/A GLY 176.A N TRP 172.A O no hydrogen 3.248 N/A GLU 177.A N ALA 173.A O no hydrogen 3.187 N/A GLU 177.A N TYR 174.A O no hydrogen 2.951 N/A ARG 178.A N TYR 174.A O no hydrogen 2.845 N/A VAL 179.A N GLU 175.A O no hydrogen 3.070 N/A HIS 181.A N GLU 177.A O no hydrogen 2.735 N/A GLY 182.A N ARG 178.A O no hydrogen 2.583 N/A VAL 187.A N SER 185.A OG no hydrogen 3.370 N/A SER 190.A N GLY 186.A O no hydrogen 3.065 N/A SER 190.A OG ASN 170.A OD1 no hydrogen 3.286 N/A SER 190.A OG GLY 186.A O no hydrogen 2.548 N/A VAL 191.A N VAL 187.A O no hydrogen 2.756 N/A SER 192.A N ASP 188.A O no hydrogen 2.988 N/A SER 192.A OG PRO 11.A O no hydrogen 2.733 N/A SER 192.A OG ASP 188.A O no hydrogen 3.405 N/A THR 193.A N ASN 189.A O no hydrogen 2.916 N/A THR 193.A OG1 ASN 189.A O no hydrogen 2.875 N/A TRP 194.A N SER 190.A O no hydrogen 3.049 N/A TRP 194.A NE1 GLU 163.A OE2 no hydrogen 2.877 N/A GLY 195.A N VAL 191.A O no hydrogen 2.815 N/A GLY 196.A N ALA 358.A O no hydrogen 2.774 N/A LEU 198.A N ALA 30.A O no hydrogen 2.599 N/A ARG 199.A N SER 206.A O no hydrogen 3.010 N/A ARG 199.A NH1 GLU 260.A OE2 no hydrogen 3.440 N/A TYR 200.A N ALA 28.A O no hydrogen 2.985 N/A GLN 201.A N LYS 204.A O no hydrogen 3.158 N/A SER 206.A N ARG 199.A O no hydrogen 3.087 N/A LEU 208.A N ALA 197.A O no hydrogen 3.161 N/A ILE 216.A N THR 354.A O no hydrogen 3.048 N/A LEU 217.A N THR 326.A O no hydrogen 2.800 N/A LEU 218.A N TRP 352.A O no hydrogen 2.688 N/A THR 219.A N GLY 324.A O no hydrogen 3.004 N/A ASN 220.A N ASP 350.A O no hydrogen 2.824 N/A THR 221.A N GLY 322.A O no hydrogen 3.347 N/A THR 221.A OG1 GLY 322.A O no hydrogen 2.763 N/A LYS 222.A N ASN 220.A OD1 no hydrogen 2.777 N/A LYS 222.A NZ GLY 348.A O no hydrogen 3.350 N/A ARG 225.A NH1 GLY 319.A O no hydrogen 3.255 N/A ALA 229.A N SER 226.A OG no hydrogen 3.104 N/A LEU 230.A N SER 226.A O no hydrogen 2.965 N/A VAL 231.A N THR 227.A O no hydrogen 3.210 N/A ALA 232.A N LYS 228.A O no hydrogen 3.293 N/A GLY 233.A N ALA 229.A O no hydrogen 2.927 N/A VAL 234.A N LEU 230.A O no hydrogen 2.997 N/A ARG 235.A N VAL 231.A O no hydrogen 3.074 N/A SER 236.A N ALA 232.A O no hydrogen 2.818 N/A ARG 237.A N GLY 233.A O no hydrogen 2.840 N/A ARG 237.A NH2 ALA 291.A O no hydrogen 2.468 N/A LEU 238.A N VAL 234.A O no hydrogen 2.828 N/A ILE 239.A N ARG 235.A O no hydrogen 3.029 N/A ILE 239.A N SER 236.A O no hydrogen 2.990 N/A LYS 240.A N SER 236.A O no hydrogen 2.956 N/A PHE 241.A N ARG 237.A O no hydrogen 3.017 N/A GLU 243.A N GLU 243.A OE1 no hydrogen 2.674 N/A ILE 244.A N PHE 241.A O no hydrogen 3.212 N/A MET 245.A N PHE 241.A O no hydrogen 2.926 N/A ALA 246.A N PRO 242.A O no hydrogen 3.016 N/A LEU 249.A N MET 245.A O no hydrogen 3.046 N/A THR 250.A N ALA 246.A O no hydrogen 3.262 N/A THR 250.A OG1 ALA 246.A O no hydrogen 3.427 N/A SER 251.A N PRO 247.A O no hydrogen 2.866 N/A SER 251.A OG HIS 288.A NE2 no hydrogen 2.930 N/A ILE 252.A N LEU 248.A O no hydrogen 3.037 N/A ASP 253.A N LEU 249.A O no hydrogen 2.998 N/A ALA 254.A N THR 250.A O no hydrogen 3.110 N/A ILE 255.A N SER 251.A O no hydrogen 3.159 N/A ILE 255.A N ILE 252.A O no hydrogen 2.926 N/A SER 256.A N ILE 252.A O no hydrogen 3.199 N/A SER 256.A OG VAL 27.A O no hydrogen 2.813 N/A LEU 257.A N ASP 253.A O no hydrogen 3.122 N/A GLU 258.A N ALA 254.A O no hydrogen 2.885 N/A CYS 259.A N ILE 255.A O no hydrogen 2.962 N/A GLU 260.A N SER 256.A O no hydrogen 2.867 N/A ARG 261.A N LEU 257.A O no hydrogen 3.090 N/A ARG 261.A NE GLU 265.A OE1 no hydrogen 2.926 N/A ARG 261.A NH1 GLU 265.A OE1 no hydrogen 3.333 N/A VAL 262.A N GLU 258.A O no hydrogen 3.001 N/A LEU 263.A N CYS 259.A O no hydrogen 2.899 N/A GLY 264.A N GLU 260.A O no hydrogen 3.301 N/A GLU 265.A N ARG 261.A O no hydrogen 3.135 N/A MET 266.A N VAL 262.A O no hydrogen 2.775 N/A MET 266.A N LEU 263.A O no hydrogen 3.208 N/A ALA 267.A N LEU 263.A O no hydrogen 3.115 N/A GLN 274.A N VAL 271.A O no hydrogen 2.642 N/A GLN 274.A NE2 ALA 269.A O no hydrogen 3.438 N/A GLN 274.A NE2 VAL 271.A O no hydrogen 3.633 N/A TYR 275.A N PRO 272.A O no hydrogen 3.044 N/A TYR 275.A OH ALA 213.A O no hydrogen 3.147 N/A LEU 278.A N GLN 274.A O no hydrogen 3.375 N/A GLU 279.A N TYR 275.A O no hydrogen 3.124 N/A GLU 280.A N LEU 276.A O no hydrogen 3.161 N/A LEU 281.A N VAL 277.A O no hydrogen 2.891 N/A MET 282.A N LEU 278.A O no hydrogen 2.958 N/A ASP 283.A N GLU 279.A O no hydrogen 2.984 N/A MET 284.A N GLU 280.A O no hydrogen 3.045 N/A ASN 285.A N LEU 281.A O no hydrogen 2.914 N/A ASN 285.A ND2 HIS 17.A ND1 no hydrogen 2.635 N/A GLN 286.A N MET 282.A O no hydrogen 2.911 N/A HIS 287.A N ASP 283.A O no hydrogen 3.204 N/A HIS 288.A N MET 284.A O no hydrogen 3.003 N/A LEU 289.A N ASN 285.A O no hydrogen 3.001 N/A ASN 290.A N GLN 286.A O no hydrogen 3.058 N/A ALA 291.A N HIS 287.A O no hydrogen 2.982 N/A LEU 292.A N HIS 288.A O no hydrogen 2.785 N/A GLY 293.A N LEU 289.A O no hydrogen 3.104 N/A VAL 294.A N LEU 289.A O no hydrogen 3.224 N/A SER 298.A N HIS 296.A ND1 no hydrogen 2.962 N/A SER 298.A OG HIS 296.A ND1 no hydrogen 2.599 N/A LEU 299.A N HIS 296.A O no hydrogen 2.740 N/A ASP 300.A N HIS 296.A O no hydrogen 2.986 N/A GLN 301.A N ALA 297.A O no hydrogen 3.048 N/A LEU 302.A N SER 298.A O no hydrogen 3.122 N/A CYS 303.A N LEU 299.A O no hydrogen 3.084 N/A CYS 303.A SG LEU 299.A O no hydrogen 3.302 N/A CYS 303.A SG SER 313.A O no hydrogen 4.047 N/A GLN 304.A N ASP 300.A O no hydrogen 2.851 N/A VAL 305.A N GLN 301.A O no hydrogen 3.010 N/A THR 306.A N LEU 302.A O no hydrogen 3.226 N/A THR 306.A OG1 LEU 302.A O no hydrogen 2.676 N/A THR 306.A OG1 SER 313.A OG no hydrogen 3.351 N/A ALA 307.A N CYS 303.A O no hydrogen 2.829 N/A ALA 308.A N GLN 304.A O no hydrogen 3.105 N/A HIS 309.A N THR 306.A O no hydrogen 2.985 N/A HIS 309.A ND1 VAL 305.A O no hydrogen 3.090 N/A GLY 310.A N ALA 307.A O no hydrogen 2.719 N/A LEU 311.A N THR 306.A O no hydrogen 2.921 N/A HIS 312.A ND1 ASP 283.A OD1 no hydrogen 2.794 N/A SER 313.A OG THR 326.A OG1 no hydrogen 2.809 N/A LYS 314.A N ILE 325.A O no hydrogen 2.967 N/A LYS 314.A NZ LEU 16.A O no hydrogen 2.719 N/A LYS 314.A NZ GLU 19.A OE2 no hydrogen 3.270 N/A LYS 314.A NZ LEU 315.A O no hydrogen 3.001 N/A THR 316.A N CYS 323.A O no hydrogen 3.160 N/A THR 316.A OG1 ILE 15.A O no hydrogen 2.979 N/A GLY 317.A N GLU 19.A OE1 no hydrogen 3.061 N/A GLY 320.A N VAL 294.A O no hydrogen 2.730 N/A GLY 322.A N VAL 223.A O no hydrogen 3.439 N/A CYS 323.A SG ALA 125.A O no hydrogen 3.769 N/A GLY 324.A N THR 219.A O no hydrogen 2.909 N/A ILE 325.A N LYS 314.A O no hydrogen 2.792 N/A THR 326.A N LEU 217.A O no hydrogen 3.064 N/A THR 326.A OG1 SER 313.A OG no hydrogen 2.809 N/A LEU 327.A N HIS 312.A O no hydrogen 3.023 N/A LEU 328.A N GLN 215.A O no hydrogen 2.843 N/A ARG 334.A NH1 GLU 353.A OE1 no hydrogen 3.300 N/A ARG 334.A NH2 GLU 353.A OE1 no hydrogen 3.559 N/A LYS 336.A N GLU 333.A O no hydrogen 2.767 N/A LYS 336.A NZ GLU 333.A OE2 no hydrogen 2.688 N/A GLU 338.A N ARG 334.A O no hydrogen 3.059 N/A ALA 339.A N ALA 335.A O no hydrogen 3.103 N/A ALA 340.A N LYS 336.A O no hydrogen 3.322 N/A LYS 341.A N VAL 337.A O no hydrogen 3.250 N/A LYS 341.A NZ GLU 353.A OE2 no hydrogen 3.275 N/A ALA 343.A N ALA 339.A O no hydrogen 2.904 N/A LEU 344.A N ALA 340.A O no hydrogen 2.773 N/A THR 345.A N LYS 341.A O no hydrogen 2.964 N/A THR 345.A OG1 LYS 341.A O no hydrogen 2.677 N/A GLY 346.A N GLN 342.A O no hydrogen 2.864 N/A CYS 347.A N ALA 343.A O no hydrogen 3.187 N/A CYS 347.A N LEU 344.A O no hydrogen 3.231 N/A CYS 347.A SG GLN 301.A OE1 no hydrogen 3.670 N/A CYS 347.A SG ALA 343.A O no hydrogen 3.313 N/A GLY 348.A N THR 345.A O no hydrogen 2.652 N/A PHE 349.A N LEU 344.A O no hydrogen 3.315 N/A ASP 350.A N ASN 220.A O no hydrogen 2.823 N/A CYS 351.A SG THR 219.A OG1 no hydrogen 3.763 N/A TRP 352.A N LEU 218.A O no hydrogen 2.877 N/A THR 354.A N ILE 216.A O no hydrogen 3.096 N/A THR 354.A OG1 SER 355.A O no hydrogen 3.533 N/A SER 355.A N THR 354.A OG1 no hydrogen 2.411 N/A ILE 356.A N LEU 214.A O no hydrogen 3.178 N/A GLY 357.A N ALA 32.A O no hydrogen 2.721 N/A ALA 358.A N ALA 32.A O no hydrogen 3.091 N/A VAL 361.A N THR 193.A O no hydrogen 3.117 N/A SER 362.A N SER 9.A O no hydrogen 2.938 N/A SER 362.A OG GLY 360.A O no hydrogen 3.037 N/A MET 363.A N GLY 159.A O no hydrogen 3.009 N/A HIS 364.A N LEU 7.A O no hydrogen 2.730 N/A HIS 364.A NE2 SER 9.A OG no hydrogen 2.623 N/A SER 365.A N SER 157.A O no hydrogen 3.175 N/A SER 365.A OG SER 157.A O no hydrogen 3.147 N/A SER 365.A OG THR 367.A OG1 no hydrogen 3.239 N/A THR 367.A OG1 SER 365.A OG no hydrogen 3.239 N/A SER 368.A N SER 365.A O no hydrogen 2.649 N/A ARG 374.A N GLU 370.A O no hydrogen 3.262 N/A ARG 374.A NE GLU 370.A O no hydrogen 3.353 N/A GLN 375.A N ASP 371.A O no hydrogen 2.699 N/A ALA 376.A N PRO 372.A O no hydrogen 3.140 N/A LEU 377.A N VAL 373.A O no hydrogen 2.913 N/A LEU 377.A N ARG 374.A O no hydrogen 3.307 N/A GLY 378.A N ARG 374.A O no hydrogen 2.599 N/A