Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4km9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 9.A N PHE 6.A O no hydrogen 3.214 N/A PHE 10.A N ALA 7.A O no hydrogen 3.015 N/A GLY 13.A N LEU 78.A O no hydrogen 2.880 N/A HIS 15.A N PRO 11.A O no hydrogen 2.804 N/A ALA 16.A N PRO 12.A O no hydrogen 3.281 N/A ALA 16.A N GLY 13.A O no hydrogen 2.999 N/A ILE 17.A N GLY 13.A O no hydrogen 3.498 N/A TYR 18.A N LEU 14.A O no hydrogen 3.185 N/A GLY 19.A N HIS 15.A O no hydrogen 2.949 N/A GLU 20.A N ALA 16.A O no hydrogen 3.315 N/A CYS 21.A N ILE 17.A O no hydrogen 3.114 N/A CYS 21.A SG ILE 17.A O no hydrogen 3.611 N/A ARG 22.A N TYR 18.A O no hydrogen 2.995 N/A ARG 22.A NH1 ALA 2.A O no hydrogen 2.813 N/A ARG 22.A NH2 ALA 2.A O no hydrogen 3.405 N/A ARG 23.A N GLY 19.A O no hydrogen 3.285 N/A LEU 24.A N GLU 20.A O no hydrogen 3.351 N/A TYR 25.A N CYS 21.A O no hydrogen 2.841 N/A TYR 25.A OH ASN 56.A OD1 no hydrogen 2.856 N/A TYR 25.A OH HIS 69.A ND1 no hydrogen 2.713 N/A GLN 33.A NE2 SER 52.A OG no hydrogen 2.776 N/A VAL 34.A N VAL 51.A O no hydrogen 3.117 N/A ALA 36.A N ASP 49.A O no hydrogen 2.829 N/A LYS 39.A NZ ALA 36.A O no hydrogen 3.006 N/A LEU 42.A N LYS 39.A O no hydrogen 3.048 N/A GLY 43.A N TYR 40.A O no hydrogen 3.284 N/A GLY 44.A N LYS 39.A O no hydrogen 2.974 N/A LEU 48.A N GLN 122.A OE1 no hydrogen 3.094 N/A ASP 49.A N PHE 73.A O no hydrogen 2.801 N/A VAL 51.A N VAL 34.A O no hydrogen 2.898 N/A SER 52.A N ILE 71.A O no hydrogen 2.967 N/A MET 53.A N LEU 32.A O no hydrogen 3.009 N/A TYR 54.A N HIS 69.A O no hydrogen 2.689 N/A ASN 56.A N HIS 67.A O no hydrogen 2.916 N/A SER 59.A N ILE 64.A O no hydrogen 2.850 N/A ALA 62.A N SER 59.A OG no hydrogen 2.997 N/A ILE 64.A N SER 59.A O no hydrogen 2.540 N/A HIS 67.A N ASN 56.A O no hydrogen 3.036 N/A HIS 67.A ND1 PRO 65.A O no hydrogen 2.851 N/A TRP 68.A N LEU 104.A O no hydrogen 2.698 N/A TRP 68.A NE1 GLU 110.A OE1 no hydrogen 2.621 N/A HIS 69.A N TYR 54.A O no hydrogen 3.012 N/A HIS 69.A ND1 TYR 25.A OH no hydrogen 2.713 N/A TYR 70.A N PHE 102.A O no hydrogen 2.928 N/A TYR 70.A OH PRO 114.A O no hydrogen 2.627 N/A ILE 71.A N SER 52.A O no hydrogen 2.966 N/A SER 72.A N LEU 100.A O no hydrogen 3.020 N/A SER 72.A OG GLU 99.A OE1 no hydrogen 2.584 N/A SER 72.A OG LEU 100.A O no hydrogen 3.456 N/A GLY 74.A N GLU 99.A OE2 no hydrogen 2.749 N/A LEU 75.A N GLU 99.A OE1 no hydrogen 3.290 N/A SER 76.A N GLU 99.A OE2 no hydrogen 2.758 N/A SER 76.A OG GLU 99.A OE2 no hydrogen 2.635 N/A ASP 77.A N SER 94.A OG no hydrogen 3.268 N/A TYR 79.A OH ASP 49.A OD2 no hydrogen 2.777 N/A GLY 80.A N ASP 77.A OD1 no hydrogen 2.976 N/A ARG 83.A NE ASP 81.A OD1 no hydrogen 3.336 N/A ARG 83.A NE ASP 81.A OD2 no hydrogen 2.665 N/A ARG 83.A NH1 ASP 81.A OD1 no hydrogen 2.495 N/A ARG 83.A NH1 ASP 81.A OD2 no hydrogen 3.411 N/A HIS 85.A NE2 GLY 74.A O no hydrogen 3.002 N/A PHE 87.A N ASN 82.A OD1 no hydrogen 3.188 N/A THR 88.A OG1 GLY 89.A O no hydrogen 2.698 N/A THR 88.A OG1 PRO 93.A O no hydrogen 3.120 N/A THR 88.A OG1 PHE 172.A O no hydrogen 2.717 N/A THR 90.A OG1 ASP 91.A OD1 no hydrogen 3.159 N/A SER 94.A N VAL 174.A O no hydrogen 3.104 N/A PHE 96.A N LEU 75.A O no hydrogen 2.940 N/A GLY 97.A N SER 94.A O no hydrogen 2.807 N/A GLU 99.A N THR 176.A O no hydrogen 3.245 N/A LEU 100.A N SER 72.A OG no hydrogen 3.020 N/A THR 101.A N LEU 178.A O no hydrogen 3.037 N/A THR 101.A OG1 ASP 162.A OD2 no hydrogen 2.625 N/A PHE 102.A N TYR 70.A O no hydrogen 3.091 N/A ARG 103.A NH1 HIS 67.A NE2 no hydrogen 2.976 N/A ARG 103.A NH2 ASP 162.A OD1 no hydrogen 2.830 N/A ARG 103.A NH2 ASP 162.A OD2 no hydrogen 3.541 N/A ARG 103.A NH2 GLN 164.A OE1 no hydrogen 3.452 N/A LEU 104.A N TRP 68.A O no hydrogen 2.983 N/A LYS 105.A N THR 216.A O no hydrogen 2.884 N/A ARG 106.A N GLU 66.A O no hydrogen 2.875 N/A GLU 107.A N GLU 110.A OE1 no hydrogen 2.819 N/A ALA 118.A N THR 115.A O no hydrogen 3.179 N/A GLU 119.A N THR 115.A O no hydrogen 3.381 N/A LEU 120.A N TRP 116.A O no hydrogen 2.972 N/A MET 121.A N PRO 117.A O no hydrogen 2.959 N/A GLN 122.A N ALA 118.A O no hydrogen 3.102 N/A GLN 122.A NE2 LEU 48.A O no hydrogen 3.202 N/A GLY 123.A N GLU 119.A O no hydrogen 3.234 N/A LEU 124.A N LEU 120.A O no hydrogen 2.833 N/A ALA 125.A N MET 121.A O no hydrogen 2.937 N/A ARG 126.A N GLN 122.A O no hydrogen 2.925 N/A ARG 126.A NE PRO 45.A O no hydrogen 3.506 N/A ARG 126.A NH2 ASP 46.A OD1 no hydrogen 2.806 N/A PHE 129.A N ALA 125.A O no hydrogen 3.089 N/A GLN 130.A N ARG 126.A O no hydrogen 3.194 N/A SER 131.A OG TYR 127.A O no hydrogen 2.810 N/A ASN 133.A ND2 TYR 127.A OH no hydrogen 2.803 N/A THR 134.A OG1 PHE 96.A O no hydrogen 3.566 N/A THR 134.A OG1 PHE 135.A O no hydrogen 3.536 N/A CYS 136.A N ASP 139.A OD2 no hydrogen 3.405 N/A CYS 136.A SG ASP 139.A OD1 no hydrogen 3.580 N/A CYS 136.A SG ASP 139.A OD2 no hydrogen 3.715 N/A SER 137.A OG GLN 197.A OE1 no hydrogen 3.250 N/A GLY 138.A N LEU 159.A O no hydrogen 2.626 N/A ASP 139.A N CYS 136.A O no hydrogen 3.280 N/A VAL 141.A N MET 157.A O no hydrogen 2.810 N/A LEU 147.A N ILE 154.A O no hydrogen 3.240 N/A ASN 149.A N PRO 146.A O no hydrogen 2.703 N/A SER 150.A N ASP 148.A OD1 no hydrogen 3.261 N/A SER 152.A OG MET 218.A O no hydrogen 2.847 N/A ARG 153.A NH1 GLY 221.A O no hydrogen 2.650 N/A ARG 153.A NH1 GLU 226.A OE2 no hydrogen 3.384 N/A ARG 153.A NH2 GLU 186.A OE2 no hydrogen 3.086 N/A ILE 154.A N SER 152.A OG no hydrogen 3.307 N/A GLN 155.A N VAL 183.A O no hydrogen 3.118 N/A HIS 156.A N VAL 183.A O no hydrogen 2.950 N/A HIS 156.A NE2 HIS 144.A ND1 no hydrogen 3.131 N/A MET 157.A N VAL 141.A O no hydrogen 3.192 N/A LEU 158.A N VAL 181.A O no hydrogen 2.679 N/A LEU 159.A N ASP 139.A O no hydrogen 2.857 N/A THR 160.A N GLN 179.A O no hydrogen 3.081 N/A THR 160.A OG1 GLU 161.A O no hydrogen 3.394 N/A ASP 162.A N PHE 177.A O no hydrogen 2.850 N/A GLN 164.A N ASP 162.A OD1 no hydrogen 3.050 N/A MET 165.A N ASP 162.A OD1 no hydrogen 3.053 N/A VAL 168.A N VAL 175.A O no hydrogen 3.127 N/A GLN 169.A NE2 THR 90.A O no hydrogen 2.856 N/A GLN 169.A NE2 THR 170.A O no hydrogen 3.007 N/A THR 170.A N GLY 173.A O no hydrogen 2.792 N/A THR 170.A OG1 GLY 173.A O no hydrogen 2.832 N/A PHE 172.A N THR 170.A OG1 no hydrogen 3.064 N/A GLY 173.A N THR 170.A O no hydrogen 3.160 N/A VAL 174.A N GLY 92.A O no hydrogen 3.065 N/A VAL 175.A N VAL 168.A O no hydrogen 2.930 N/A THR 176.A N GLY 97.A O no hydrogen 3.001 N/A THR 176.A OG1 GLY 97.A O no hydrogen 3.400 N/A LEU 178.A N GLU 99.A O no hydrogen 3.326 N/A GLN 179.A N THR 160.A O no hydrogen 2.547 N/A GLN 179.A NE2 ILE 180.A O no hydrogen 3.415 N/A GLN 179.A NE2 TRP 213.A O no hydrogen 3.645 N/A GLN 179.A NE2 LEU 214.A O no hydrogen 2.785 N/A ILE 180.A N THR 101.A O no hydrogen 2.898 N/A VAL 181.A N LEU 158.A O no hydrogen 2.758 N/A GLY 182.A N THR 216.A OG1 no hydrogen 3.104 N/A VAL 183.A N HIS 156.A O no hydrogen 2.760 N/A CYS 184.A SG GLU 187.A OE2 no hydrogen 3.183 N/A LEU 188.A N CYS 184.A O no hydrogen 2.883 N/A HIS 189.A N THR 185.A O no hydrogen 3.014 N/A HIS 189.A ND1 GLN 192.A OE1 no hydrogen 3.024 N/A SER 190.A N GLU 186.A O no hydrogen 3.170 N/A SER 190.A OG GLU 186.A O no hydrogen 2.963 N/A ALA 191.A N GLU 187.A O no hydrogen 3.276 N/A GLN 192.A N LEU 188.A O no hydrogen 2.939 N/A GLN 192.A NE2 HIS 140.A NE2 no hydrogen 3.650 N/A GLN 193.A N HIS 189.A O no hydrogen 3.059 N/A TRP 194.A N SER 190.A O no hydrogen 2.811 N/A TRP 194.A NE1 ASP 242.A OD2 no hydrogen 2.696 N/A ASN 195.A ND2 ASP 242.A OD2 no hydrogen 2.920 N/A GLN 197.A NE2 SER 137.A OG no hydrogen 3.072 N/A GLY 198.A N ASN 195.A OD1 no hydrogen 2.779 N/A LEU 200.A N GLY 196.A O no hydrogen 3.052 N/A GLU 201.A N GLN 197.A O no hydrogen 2.940 N/A LEU 202.A N GLY 198.A O no hydrogen 3.111 N/A LEU 203.A N ILE 199.A O no hydrogen 2.970 N/A ARG 204.A N LEU 200.A O no hydrogen 3.148 N/A THR 205.A N LEU 202.A O no hydrogen 3.189 N/A THR 205.A OG1 LEU 202.A O no hydrogen 2.636 N/A GLY 210.A N ILE 215.A O no hydrogen 3.245 N/A GLY 211.A N LEU 203.A O no hydrogen 3.197 N/A GLY 211.A N VAL 206.A O no hydrogen 2.791 N/A LEU 214.A N GLY 211.A O no hydrogen 2.923 N/A ILE 215.A N GLY 210.A O no hydrogen 3.235 N/A THR 216.A N ARG 103.A O no hydrogen 2.759 N/A ARG 219.A N ASP 217.A OD1 no hydrogen 3.198 N/A ARG 219.A NH2 ASP 148.A OD2 no hydrogen 3.379 N/A ARG 219.A NH2 MET 218.A O no hydrogen 3.306 N/A ARG 220.A N ASP 217.A O no hydrogen 3.482 N/A ARG 220.A NE ALA 209.A O no hydrogen 3.122 N/A ARG 220.A NH2 GLY 182.A O no hydrogen 3.290 N/A ARG 220.A NH2 ALA 209.A O no hydrogen 3.372 N/A THR 223.A N GLU 226.A OE2 no hydrogen 2.874 N/A ILE 224.A N GLU 187.A OE2 no hydrogen 3.372 N/A ILE 227.A N THR 223.A O no hydrogen 2.862 N/A ASP 228.A N ILE 224.A O no hydrogen 2.809 N/A HIS 230.A N ASP 228.A OD1 no hydrogen 2.730 N/A GLN 232.A N PRO 229.A O no hydrogen 3.033 N/A GLN 232.A NE2 GLN 232.A O no hydrogen 3.694 N/A ARG 234.A N LEU 231.A O no hydrogen 2.881 N/A VAL 235.A N LEU 231.A O no hydrogen 3.222 N/A LYS 237.A NZ GLU 240.A OE2 no hydrogen 3.115 N/A ILE 239.A N VAL 235.A O no hydrogen 2.880 N/A GLU 240.A N ASP 236.A O no hydrogen 2.734 N/A THR 241.A N LYS 237.A O no hydrogen 2.833 N/A THR 241.A OG1 LYS 237.A O no hydrogen 2.611 N/A ASP 242.A N GLY 238.A O no hydrogen 2.538 N/A SER 244.A N GLY 292.A O no hydrogen 3.280 N/A SER 244.A OG GLN 193.A O no hydrogen 2.525 N/A LEU 246.A N SER 244.A OG no hydrogen 3.213 N/A VAL 249.A N THR 301.A O no hydrogen 2.876 N/A ALA 251.A N LYS 303.A O no hydrogen 2.638 N/A CYS 253.A SG ALA 251.A O no hydrogen 3.800 N/A ALA 254.A N LYS 277.A O no hydrogen 2.911 N/A TRP 255.A NE1 PRO 334.A O no hydrogen 2.809 N/A ASP 256.A N HIS 275.A O no hydrogen 2.682 N/A LEU 258.A N SER 273.A O no hydrogen 3.113 N/A SER 259.A N ASP 257.A OD1 no hydrogen 3.385 N/A SER 259.A OG ASP 257.A OD1 no hydrogen 2.747 N/A THR 268.A OG1 ALA 331.A O no hydrogen 3.554 N/A ARG 269.A NH2 GLY 333.A O no hydrogen 3.447 N/A LEU 271.A N TYR 329.A O no hydrogen 2.640 N/A GLU 272.A N SER 259.A OG no hydrogen 3.261 N/A VAL 274.A N LYS 369.A O no hydrogen 3.068 N/A HIS 275.A N ASP 256.A O no hydrogen 2.811 N/A HIS 275.A ND1 LYS 371.A O no hydrogen 2.980 N/A LEU 276.A N LYS 371.A O no hydrogen 2.654 N/A LYS 277.A N ALA 254.A O no hydrogen 2.670 N/A LYS 277.A NZ ASP 256.A OD1 no hydrogen 2.763 N/A PHE 278.A N SER 373.A O no hydrogen 2.900 N/A ASN 279.A N SER 282.A OG no hydrogen 2.948 N/A SER 282.A N ASN 279.A OD1 no hydrogen 2.512 N/A SER 282.A OG LYS 252.A O no hydrogen 3.264 N/A GLY 283.A N ASN 279.A O no hydrogen 3.168 N/A LEU 285.A N SER 282.A O no hydrogen 3.093 N/A CYS 289.A N LEU 285.A O no hydrogen 2.821 N/A LEU 290.A N ILE 286.A O no hydrogen 2.686 N/A ARG 291.A N PRO 287.A O no hydrogen 2.656 N/A GLY 292.A N LEU 288.A O no hydrogen 2.793 N/A ARG 293.A NE SER 244.A O no hydrogen 3.060 N/A ARG 293.A NH1 HIS 299.A O no hydrogen 2.606 N/A ARG 293.A NH2 SER 244.A O no hydrogen 3.076 N/A LEU 294.A N CYS 289.A O no hydrogen 3.401 N/A LEU 295.A N LEU 290.A O no hydrogen 3.183 N/A HIS 296.A N ARG 293.A O no hydrogen 3.016 N/A HIS 296.A NE2 GLU 240.A O no hydrogen 2.844 N/A GLY 297.A N LEU 294.A O no hydrogen 3.235 N/A ARG 298.A N ARG 293.A O no hydrogen 2.804 N/A ARG 298.A NH2 ASP 242.A O no hydrogen 3.235 N/A PHE 300.A N PHE 313.A O no hydrogen 2.884 N/A THR 301.A N SER 247.A O no hydrogen 3.143 N/A THR 301.A OG1 THR 312.A OG1 no hydrogen 3.233 N/A TYR 302.A N ILE 311.A O no hydrogen 2.689 N/A LYS 303.A N VAL 249.A O no hydrogen 3.034 N/A SER 304.A N MET 309.A O no hydrogen 2.851 N/A SER 304.A OG THR 306.A O no hydrogen 3.398 N/A SER 304.A OG GLY 307.A O no hydrogen 3.506 N/A SER 304.A OG MET 309.A O no hydrogen 3.294 N/A ALA 310.A N PRO 334.A O no hydrogen 3.169 N/A ILE 311.A N TYR 302.A O no hydrogen 2.802 N/A THR 312.A N LEU 336.A O no hydrogen 2.796 N/A THR 312.A OG1 THR 301.A OG1 no hydrogen 3.233 N/A PHE 313.A N PHE 300.A O no hydrogen 2.683 N/A VAL 314.A N ILE 338.A O no hydrogen 2.798 N/A SER 315.A OG ARG 298.A O no hydrogen 3.345 N/A VAL 318.A N SER 315.A O no hydrogen 3.290 N/A PHE 322.A N GLN 337.A OE1 no hydrogen 3.145 N/A THR 324.A OG1 GLU 326.A OE1 no hydrogen 3.251 N/A TYR 329.A OH LYS 368.A O no hydrogen 2.768 N/A ALA 330.A N GLN 337.A O no hydrogen 3.272 N/A ALA 331.A N ARG 269.A O no hydrogen 3.004 N/A HIS 332.A N TRP 335.A O no hydrogen 2.841 N/A HIS 332.A NE2 HIS 263.A NE2 no hydrogen 3.088 N/A TRP 335.A N HIS 332.A O no hydrogen 2.925 N/A TRP 335.A NE1 THR 312.A OG1 no hydrogen 2.840 N/A LEU 336.A N ALA 310.A O no hydrogen 2.901 N/A GLN 337.A N ALA 330.A O no hydrogen 2.795 N/A ILE 338.A N THR 312.A O no hydrogen 2.784 N/A LEU 339.A N PRO 328.A O no hydrogen 2.974 N/A LEU 340.A N VAL 314.A O no hydrogen 3.245 N/A VAL 345.A N THR 341.A O no hydrogen 3.141 N/A MET 348.A N PHE 344.A O no hydrogen 2.996 N/A LEU 349.A N VAL 345.A O no hydrogen 3.060 N/A GLU 350.A N GLU 346.A O no hydrogen 3.413 N/A ASP 351.A N LYS 347.A O no hydrogen 3.254 N/A ASP 351.A N MET 348.A O no hydrogen 3.164 N/A LEU 352.A N LEU 349.A O no hydrogen 3.182 N/A THR 356.A OG1 LEU 355.A O no hydrogen 2.637 N/A LYS 361.A N ILE 374.A O no hydrogen 2.728 N/A TYR 363.A N VAL 372.A O no hydrogen 2.715 N/A TRP 365.A N LEU 370.A O no hydrogen 2.748 N/A LYS 368.A N TRP 365.A O no hydrogen 2.785 N/A LEU 370.A N TRP 365.A O no hydrogen 3.164 N/A LYS 371.A N VAL 274.A O no hydrogen 3.018 N/A VAL 372.A N TYR 363.A O no hydrogen 2.919 N/A SER 373.A N LEU 276.A O no hydrogen 2.765 N/A SER 373.A OG LEU 276.A O no hydrogen 3.147 N/A ILE 374.A N LYS 361.A O no hydrogen 2.789 N/A LEU 375.A N PHE 278.A O no hydrogen 3.048 N/A ASP 381.A N ASP 377.A O no hydrogen 3.359 N/A SER 382.A N VAL 379.A O no hydrogen 2.896 N/A