Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5lbs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH2 GLU 44.A OE1 no hydrogen 2.872 N/A ILE 4.A N ARG 2.A O no hydrogen 2.818 N/A VAL 6.A N CYS 3.A O no hydrogen 3.043 N/A ASN 8.A ND2 GLU 26.A OE1 no hydrogen 3.397 N/A ARG 9.A NE THR 32.A OG1 no hydrogen 3.089 N/A ARG 9.A NH1 GLU 358.A OE2 no hydrogen 2.890 N/A ARG 9.A NH2 THR 32.A OG1 no hydrogen 3.015 N/A ARG 9.A NH2 GLU 358.A OE1 no hydrogen 2.775 N/A ASP 10.A N CYS 30.A O no hydrogen 2.862 N/A VAL 12.A N THR 32.A O no hydrogen 2.883 N/A GLY 14.A N MET 34.A O no hydrogen 2.796 N/A SER 16.A OG GLN 36.A OE1 no hydrogen 3.130 N/A GLY 18.A N MET 15.A O no hydrogen 3.018 N/A VAL 21.A N LEU 274.A O no hydrogen 3.213 N/A VAL 23.A N CYS 272.A O no hydrogen 3.012 N/A LEU 25.A N LEU 270.A O no hydrogen 2.798 N/A CYS 30.A N ASN 8.A O no hydrogen 3.112 N/A VAL 31.A N ILE 43.A O no hydrogen 2.946 N/A THR 32.A N ASP 10.A O no hydrogen 2.809 N/A THR 32.A OG1 ASP 42.A OD1 no hydrogen 3.147 N/A VAL 33.A N VAL 41.A O no hydrogen 2.765 N/A MET 34.A N VAL 12.A O no hydrogen 2.882 N/A LYS 38.A N ALA 35.A O no hydrogen 3.169 N/A LYS 38.A NZ MET 276.A O no hydrogen 3.488 N/A LYS 38.A NZ LEU 279.A O no hydrogen 2.797 N/A THR 40.A OG1 ILE 340.A O no hydrogen 2.739 N/A VAL 41.A N VAL 33.A O no hydrogen 2.937 N/A ASP 42.A N SER 142.A O no hydrogen 2.736 N/A ILE 43.A N VAL 31.A O no hydrogen 2.865 N/A GLU 44.A N MET 140.A O no hydrogen 3.078 N/A VAL 46.A N ARG 138.A O no hydrogen 2.807 N/A THR 47.A N ARG 138.A O no hydrogen 3.354 N/A THR 48.A OG1 HIS 27.A NE2 no hydrogen 2.921 N/A THR 49.A N GLU 136.A O no hydrogen 2.792 N/A THR 49.A OG1 GLU 136.A O no hydrogen 3.412 N/A VAL 50.A N GLY 263.A O no hydrogen 3.006 N/A SER 51.A N ASN 134.A O no hydrogen 3.358 N/A SER 51.A OG ASN 52.A OD1 no hydrogen 3.312 N/A VAL 56.A N GLY 127.A O no hydrogen 2.900 N/A ARG 57.A N GLY 127.A O no hydrogen 3.500 N/A ARG 57.A NH1 TYR 59.A OH no hydrogen 3.189 N/A SER 58.A N HIS 209.A O no hydrogen 2.826 N/A SER 58.A OG GLU 55.A OE2 no hydrogen 2.685 N/A TYR 59.A N MET 125.A O no hydrogen 2.789 N/A TYR 59.A OH PHE 201.A O no hydrogen 2.718 N/A CYS 60.A N PRO 207.A O no hydrogen 2.822 N/A CYS 60.A SG GLU 62.A O no hydrogen 3.435 N/A CYS 60.A SG LYS 123.A O no hydrogen 3.869 N/A TYR 61.A N LYS 123.A O no hydrogen 3.192 N/A GLU 62.A N LYS 123.A O no hydrogen 3.412 N/A SER 64.A N ALA 120.A O no hydrogen 2.840 N/A SER 64.A OG ALA 120.A O no hydrogen 3.491 N/A SER 66.A N LYS 118.A O no hydrogen 3.146 N/A ALA 69.A N CYS 116.A O no hydrogen 3.044 N/A ASP 71.A N VAL 114.A O no hydrogen 2.994 N/A SER 72.A OG ARG 73.A O no hydrogen 3.431 N/A SER 72.A OG SER 112.A O no hydrogen 2.795 N/A ARG 73.A N SER 112.A O no hydrogen 3.047 N/A CYS 74.A SG GLY 104.A O no hydrogen 4.029 N/A GLN 77.A N CYS 74.A O no hydrogen 2.959 N/A ALA 80.A N SER 112.A OG no hydrogen 2.803 N/A TYR 81.A N ASP 71.A OD2 no hydrogen 3.259 N/A TYR 81.A OH ASP 83.A OD1 no hydrogen 3.421 N/A LYS 84.A NZ ASP 67.A O no hydrogen 2.816 N/A LYS 84.A NZ ASP 67.A OD1 no hydrogen 3.344 N/A GLN 85.A N LEU 82.A O no hydrogen 3.178 N/A SER 86.A N ASP 83.A O no hydrogen 3.224 N/A SER 86.A OG ASP 83.A O no hydrogen 2.736 N/A ASP 87.A N LYS 84.A O no hydrogen 3.250 N/A GLN 89.A N ASP 87.A OD1 no hydrogen 3.004 N/A TYR 90.A N ASP 87.A O no hydrogen 3.278 N/A VAL 91.A N ALA 117.A O no hydrogen 2.816 N/A CYS 92.A SG LYS 84.A O no hydrogen 3.866 N/A LYS 93.A N THR 115.A O no hydrogen 3.135 N/A ARG 94.A NH2 ALA 80.A O no hydrogen 3.051 N/A THR 95.A N LEU 113.A O no hydrogen 2.810 N/A THR 95.A OG1 ASP 228.A OD2 no hydrogen 2.949 N/A LEU 96.A N THR 95.A OG1 no hydrogen 2.672 N/A VAL 97.A N GLY 111.A O no hydrogen 2.863 N/A ASP 98.A N ALA 231.A O no hydrogen 2.947 N/A ARG 99.A N GLY 109.A O no hydrogen 2.873 N/A ARG 99.A NE ASN 103.A OD1 no hydrogen 2.895 N/A ARG 99.A NH2 ASN 103.A O no hydrogen 3.033 N/A GLY 100.A N ASN 103.A OD1 no hydrogen 3.092 N/A TRP 101.A NE1 GLY 106.A O no hydrogen 2.880 N/A ASN 103.A N GLY 100.A O no hydrogen 3.099 N/A ASN 103.A ND2 ASP 98.A O no hydrogen 3.178 N/A CYS 105.A N GLY 100.A O no hydrogen 2.977 N/A GLY 109.A N ARG 99.A O no hydrogen 3.096 N/A LYS 110.A NZ ASP 98.A OD1 no hydrogen 2.813 N/A GLY 111.A N VAL 97.A O no hydrogen 2.809 N/A SER 112.A OG GLU 79.A OE2 no hydrogen 2.938 N/A LEU 113.A N THR 95.A O no hydrogen 3.057 N/A VAL 114.A N ASP 71.A O no hydrogen 2.829 N/A THR 115.A N LYS 93.A O no hydrogen 3.116 N/A CYS 116.A N ALA 69.A O no hydrogen 2.883 N/A ALA 117.A N VAL 91.A O no hydrogen 3.029 N/A LYS 118.A N SER 66.A O no hydrogen 2.763 N/A PHE 119.A N GLN 89.A O no hydrogen 2.832 N/A ALA 120.A N SER 64.A O no hydrogen 2.838 N/A CYS 121.A SG GLU 62.A O no hydrogen 3.874 N/A CYS 121.A SG LYS 123.A O no hydrogen 3.333 N/A SER 122.A N GLU 62.A O no hydrogen 2.888 N/A LYS 123.A N GLU 62.A O no hydrogen 3.208 N/A LYS 124.A NZ SER 58.A OG no hydrogen 3.248 N/A LYS 124.A NZ ASP 213.A O no hydrogen 3.528 N/A MET 125.A N TYR 59.A O no hydrogen 2.812 N/A THR 126.A N THR 188.A O no hydrogen 3.062 N/A GLY 127.A N ARG 57.A O no hydrogen 2.884 N/A LYS 128.A N TYR 186.A O no hydrogen 2.888 N/A SER 129.A N ALA 54.A O no hydrogen 2.917 N/A GLN 131.A NE2 GLU 133.A OE1 no hydrogen 2.966 N/A GLU 133.A N GLU 133.A OE1 no hydrogen 2.950 N/A ASN 134.A N GLN 131.A O no hydrogen 3.191 N/A ASN 134.A ND2 SER 51.A O no hydrogen 3.682 N/A ASN 134.A ND2 ASN 52.A O no hydrogen 3.629 N/A GLU 136.A N THR 49.A O no hydrogen 2.822 N/A TYR 137.A N ILE 157.A O no hydrogen 2.925 N/A ARG 138.A N THR 47.A O no hydrogen 2.812 N/A ILE 139.A N VAL 155.A O no hydrogen 2.927 N/A MET 140.A N GLU 44.A O no hydrogen 2.853 N/A LEU 141.A N ALA 153.A O no hydrogen 2.956 N/A SER 142.A N ASP 42.A O no hydrogen 2.877 N/A VAL 143.A N ASN 151.A O no hydrogen 3.112 N/A HIS 144.A N THR 40.A O no hydrogen 2.775 N/A HIS 144.A ND1 ASP 42.A OD2 no hydrogen 2.723 N/A HIS 144.A NE2 GLU 358.A OE1 no hydrogen 2.771 N/A GLN 147.A NE2 SER 353.A OG no hydrogen 3.380 N/A GLN 147.A NE2 LYS 354.A O no hydrogen 2.872 N/A ASN 151.A N ASP 149.A OD1 no hydrogen 2.942 N/A ARG 152.A N ASP 149.A O no hydrogen 3.445 N/A ALA 153.A N LEU 141.A O no hydrogen 2.856 N/A VAL 155.A N ILE 139.A O no hydrogen 2.851 N/A ILE 157.A N TYR 137.A O no hydrogen 2.717 N/A THR 158.A N SER 161.A O no hydrogen 3.130 N/A SER 161.A N THR 158.A OG1 no hydrogen 3.382 N/A ALA 164.A N LEU 176.A O no hydrogen 3.045 N/A ALA 166.A N LEU 174.A O no hydrogen 2.792 N/A LEU 168.A N GLY 172.A O no hydrogen 2.935 N/A PHE 171.A N LEU 168.A O no hydrogen 3.070 N/A SER 173.A N LYS 278.A O no hydrogen 3.237 N/A SER 173.A OG GLU 165.A OE2 no hydrogen 3.459 N/A SER 173.A OG ALA 166.A O no hydrogen 3.376 N/A LEU 174.A N ALA 166.A O no hydrogen 2.816 N/A LEU 176.A N ALA 164.A O no hydrogen 2.863 N/A ASP 177.A N ARG 273.A O no hydrogen 2.925 N/A CYS 178.A N PRO 162.A O no hydrogen 3.187 N/A GLU 179.A N LYS 271.A O no hydrogen 3.214 N/A LEU 184.A N PHE 181.A O no hydrogen 3.315 N/A TYR 185.A N VAL 196.A O no hydrogen 2.814 N/A TYR 186.A N LYS 128.A O no hydrogen 2.778 N/A TYR 186.A OH GLU 257.A O no hydrogen 2.760 N/A LEU 187.A N TRP 194.A O no hydrogen 2.804 N/A THR 188.A N THR 126.A O no hydrogen 2.867 N/A THR 188.A OG1 HIS 193.A ND1 no hydrogen 2.766 N/A MET 189.A N LYS 192.A O no hydrogen 2.805 N/A LYS 192.A N MET 189.A O no hydrogen 3.190 N/A LYS 192.A NZ HIS 247.A NE2 no hydrogen 3.152 N/A HIS 193.A ND1 THR 188.A OG1 no hydrogen 2.766 N/A TRP 194.A N LEU 187.A O no hydrogen 2.831 N/A LEU 195.A N LEU 254.A O no hydrogen 2.863 N/A VAL 196.A N TYR 185.A O no hydrogen 3.052 N/A LYS 198.A N ASP 183.A O no hydrogen 3.251 N/A LYS 198.A NZ SER 182.A O no hydrogen 2.797 N/A PHE 201.A N HIS 197.A O no hydrogen 3.230 N/A HIS 202.A N LYS 198.A O no hydrogen 3.217 N/A ASP 203.A N TRP 200.A O no hydrogen 3.173 N/A LEU 206.A N ILE 204.A O no hydrogen 2.990 N/A TRP 208.A N ASN 218.A O no hydrogen 2.842 N/A HIS 209.A N SER 58.A O no hydrogen 2.930 N/A HIS 209.A ND1 HIS 216.A O no hydrogen 2.985 N/A HIS 209.A NE2 ALA 212.A O no hydrogen 3.122 N/A GLY 211.A N VAL 56.A O no hydrogen 2.733 N/A ASN 218.A N TRP 208.A O no hydrogen 2.787 N/A ASN 219.A ND2 GLU 221.A OE1 no hydrogen 3.528 N/A LYS 220.A NZ THR 88.A O no hydrogen 3.163 N/A LYS 220.A NZ TRP 217.A O no hydrogen 2.762 N/A ALA 222.A N ASN 219.A O no hydrogen 3.231 N/A LEU 223.A N LYS 220.A O no hydrogen 3.304 N/A GLU 225.A N VAL 237.A O no hydrogen 2.795 N/A LYS 227.A N THR 235.A O no hydrogen 3.036 N/A ALA 229.A N ARG 233.A O no hydrogen 3.045 N/A LYS 232.A N ALA 229.A O no hydrogen 3.188 N/A GLN 234.A NE2 LYS 93.A O no hydrogen 3.208 N/A GLN 234.A NE2 THR 115.A OG1 no hydrogen 2.841 N/A THR 235.A N LYS 227.A O no hydrogen 2.820 N/A THR 235.A OG1 LYS 227.A O no hydrogen 3.341 N/A VAL 237.A N GLU 225.A O no hydrogen 3.003 N/A LEU 239.A N LEU 223.A O no hydrogen 2.771 N/A GLN 242.A N TYR 61.A O no hydrogen 2.745 N/A GLN 242.A NE2 GLY 240.A O no hydrogen 3.241 N/A VAL 246.A N GLN 242.A O no hydrogen 2.894 N/A HIS 247.A N GLU 243.A O no hydrogen 2.847 N/A HIS 247.A ND1 GLU 243.A O no hydrogen 3.068 N/A THR 248.A N GLY 244.A O no hydrogen 3.032 N/A THR 248.A OG1 GLY 244.A O no hydrogen 3.262 N/A THR 248.A OG1 ALA 245.A O no hydrogen 2.883 N/A ALA 249.A N ALA 245.A O no hydrogen 3.029 N/A LEU 250.A N HIS 247.A O no hydrogen 3.068 N/A ALA 256.A N HIS 193.A O no hydrogen 3.035 N/A GLU 257.A N ARG 264.A O no hydrogen 2.810 N/A LYS 262.A NZ GLU 136.A OE1 no hydrogen 2.810 N/A GLY 263.A N VAL 50.A O no hydrogen 2.860 N/A ARG 264.A N GLU 257.A O no hydrogen 3.074 N/A LEU 265.A N THR 48.A O no hydrogen 2.807 N/A SER 266.A OG GLU 255.A O no hydrogen 3.104 N/A LEU 270.A N LEU 25.A O no hydrogen 2.833 N/A CYS 272.A N VAL 23.A O no hydrogen 2.783 N/A ARG 273.A N ASP 177.A O no hydrogen 2.803 N/A LEU 274.A N VAL 21.A O no hydrogen 2.963 N/A LYS 275.A N GLY 175.A O no hydrogen 2.799 N/A LYS 275.A NZ GLU 165.A OE2 no hydrogen 3.445 N/A MET 276.A N THR 19.A O no hydrogen 2.838 N/A LEU 279.A N MET 276.A O no hydrogen 2.904 N/A ARG 280.A N PHE 171.A O no hydrogen 3.037 N/A TYR 286.A N GLY 283.A O no hydrogen 3.122 N/A CYS 289.A N LYS 321.A O no hydrogen 2.891 N/A CYS 289.A SG LYS 321.A O no hydrogen 3.212 N/A ALA 291.A N TYR 313.A OH no hydrogen 3.023 N/A THR 294.A N GLN 312.A O no hydrogen 2.983 N/A THR 296.A N GLU 310.A O no hydrogen 3.023 N/A THR 296.A OG1 GLU 310.A O no hydrogen 3.115 N/A THR 296.A OG1 GLU 310.A OE1 no hydrogen 2.732 N/A ALA 300.A N THR 308.A O no hydrogen 3.089 N/A THR 302.A N THR 306.A O no hydrogen 2.970 N/A THR 302.A OG1 THR 306.A O no hydrogen 3.521 N/A THR 302.A OG1 THR 306.A OG1 no hydrogen 2.682 N/A HIS 304.A N THR 302.A OG1 no hydrogen 3.345 N/A HIS 304.A NE2 SER 7.A O no hydrogen 2.949 N/A THR 306.A OG1 THR 302.A OG1 no hydrogen 2.682 N/A THR 306.A OG1 GLU 358.A OE2 no hydrogen 2.647 N/A VAL 307.A N LEU 359.A O no hydrogen 2.871 N/A THR 308.A N ALA 300.A O no hydrogen 2.821 N/A THR 308.A OG1 LEU 357.A O no hydrogen 3.466 N/A VAL 309.A N LEU 357.A O no hydrogen 2.857 N/A VAL 311.A N MET 355.A O no hydrogen 2.952 N/A GLN 312.A N THR 294.A O no hydrogen 2.891 N/A TYR 313.A N SER 353.A O no hydrogen 2.918 N/A TYR 313.A OH ASP 317.A OD1 no hydrogen 2.584 N/A ALA 314.A N ALA 292.A O no hydrogen 3.134 N/A GLY 318.A N THR 316.A O no hydrogen 2.882 N/A CYS 320.A N ILE 346.A O no hydrogen 3.011 N/A LYS 321.A N SER 287.A O no hydrogen 2.768 N/A LYS 321.A NZ VAL 284.A O no hydrogen 3.456 N/A VAL 322.A N PRO 344.A O no hydrogen 2.884 N/A GLN 325.A N VAL 369.A O no hydrogen 3.052 N/A GLN 325.A NE2 MET 326.A O no hydrogen 3.319 N/A GLN 325.A NE2 LEU 333.A O no hydrogen 3.094 N/A ALA 327.A N TYR 367.A O no hydrogen 3.045 N/A LEU 333.A N ASP 329.A O no hydrogen 3.269 N/A VAL 336.A N MET 326.A O no hydrogen 2.803 N/A ARG 338.A N ASP 360.A O no hydrogen 3.086 N/A ARG 338.A NE ASP 360.A OD2 no hydrogen 3.381 N/A ARG 338.A NH1 GLU 13.A OE1 no hydrogen 2.987 N/A ARG 338.A NH2 GLU 13.A OE1 no hydrogen 3.041 N/A LEU 339.A N GLY 385.A O no hydrogen 2.774 N/A ILE 340.A N GLU 358.A O no hydrogen 2.773 N/A THR 341.A N GLU 358.A O no hydrogen 3.141 N/A THR 341.A OG1.B GLU 358.A O no hydrogen 3.402 N/A ALA 342.A N ILE 340.A O no hydrogen 2.805 N/A ASN 343.A N GLY 386.A O no hydrogen 2.720 N/A ILE 346.A N CYS 320.A O no hydrogen 2.853 N/A THR 347.A N GLN 147.A OE1 no hydrogen 2.849 N/A THR 347.A OG1 GLN 147.A OE1 no hydrogen 3.252 N/A GLU 348.A N GLN 147.A OE1 no hydrogen 3.050 N/A MET 355.A N VAL 311.A O no hydrogen 2.929 N/A LEU 357.A N VAL 309.A O no hydrogen 2.790 N/A GLU 358.A N THR 341.A OG1.B no hydrogen 2.901 N/A LEU 359.A N VAL 307.A O no hydrogen 2.924 N/A ASP 360.A N ARG 338.A O no hydrogen 2.751 N/A GLY 364.A N ARG 383.A O no hydrogen 3.090 N/A SER 366.A N TRP 381.A O no hydrogen 2.987 N/A TYR 367.A N ALA 327.A O no hydrogen 2.812 N/A ILE 368.A N HIS 379.A O no hydrogen 2.803 N/A VAL 369.A N GLN 325.A O no hydrogen 2.875 N/A ILE 370.A N ILE 377.A O no hydrogen 2.949 N/A GLY 371.A N PRO 323.A O no hydrogen 2.786 N/A LYS 376.A N GLY 373.A O no hydrogen 3.385 N/A LYS 376.A NZ GLY 373.A O no hydrogen 3.351 N/A LYS 376.A NZ GLU 394.A OE1 no hydrogen 2.940 N/A LYS 376.A NZ GLU 394.A OE2 no hydrogen 3.128 N/A ILE 377.A N ILE 370.A O no hydrogen 2.779 N/A HIS 379.A N ILE 368.A O no hydrogen 3.150 N/A HIS 380.A NE2 ASP 365.A OD1 no hydrogen 3.288 N/A TRP 381.A N SER 366.A O no hydrogen 2.755 N/A HIS 382.A ND1 ASP 365.A OD1 no hydrogen 3.063 N/A ARG 383.A N GLY 364.A O no hydrogen 3.021 N/A ARG 383.A NH1 ASP 360.A OD1 no hydrogen 2.941 N/A ARG 383.A NH1 PRO 361.A O no hydrogen 2.796 N/A SER 387.A OG ALA 324.A O no hydrogen 2.718 N/A TRP 388.A NE1 PRO 344.A O no hydrogen 2.782 N/A HIS 390.A ND1 PRO 391.A O no hydrogen 2.866 N/A