Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pjv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 119.A OD1 no hydrogen 2.951 N/A ARG 4.A N ASP 2.A OD1 no hydrogen 2.945 N/A ARG 4.A NE ASP 163.A OD2 no hydrogen 3.147 N/A ARG 4.A NH1 LEU 132.A O no hydrogen 2.853 N/A ARG 4.A NH1 ASP 163.A OD1 no hydrogen 2.643 N/A GLN 6.A N ASP 2.A O no hydrogen 3.113 N/A GLU 7.A N LEU 3.A O no hydrogen 2.993 N/A LEU 8.A N ARG 4.A O no hydrogen 3.350 N/A ILE 9.A N VAL 5.A O no hydrogen 3.006 N/A LYS 10.A N GLN 6.A O no hydrogen 2.764 N/A LEU 11.A N GLU 7.A O no hydrogen 2.900 N/A ILE 12.A N LEU 8.A O no hydrogen 2.937 N/A CYS 13.A N ILE 9.A O no hydrogen 2.954 N/A ASN 14.A N LEU 11.A O no hydrogen 3.494 N/A ALA 17.A N ASN 14.A OD1 no hydrogen 2.706 N/A MET 18.A N ASN 14.A O no hydrogen 3.161 N/A GLU 19.A N VAL 15.A O no hydrogen 2.824 N/A GLU 20.A N GLN 16.A O no hydrogen 2.924 N/A MET 21.A N ALA 17.A O no hydrogen 2.717 N/A MET 22.A N MET 18.A O no hydrogen 3.061 N/A MET 23.A N GLU 19.A O no hydrogen 2.940 N/A GLU 24.A N GLU 20.A O no hydrogen 2.935 N/A MET 25.A N MET 21.A O no hydrogen 3.222 N/A MET 25.A N MET 22.A O no hydrogen 3.104 N/A LYS 26.A N MET 23.A O no hydrogen 2.723 N/A TYR 27.A N MET 22.A O no hydrogen 3.029 N/A TYR 27.A OH ALA 32.A O no hydrogen 2.862 N/A ASN 28.A N PRO 74.A O no hydrogen 3.112 N/A ASN 28.A ND2 HIS 75.A O no hydrogen 3.442 N/A THR 29.A OG1 GLU 19.A OE2 no hydrogen 3.350 N/A LYS 31.A N ASN 28.A OD1 no hydrogen 3.340 N/A ALA 32.A N ASN 28.A O no hydrogen 3.108 N/A LYS 36.A N PRO 33.A O no hydrogen 3.179 N/A LEU 37.A N LEU 34.A O no hydrogen 3.323 N/A GLN 41.A N THR 38.A OG1 no hydrogen 3.053 N/A GLN 41.A NE2 LYS 36.A O no hydrogen 2.388 N/A ILE 42.A N THR 38.A O no hydrogen 3.325 N/A LYS 43.A N VAL 39.A O no hydrogen 2.974 N/A LYS 43.A NZ GLU 209.A OE1 no hydrogen 3.171 N/A ALA 44.A N ALA 40.A O no hydrogen 3.000 N/A GLY 45.A N GLN 41.A O no hydrogen 3.058 N/A TYR 46.A N ILE 42.A O no hydrogen 3.043 N/A GLN 47.A N LYS 43.A O no hydrogen 2.739 N/A GLN 47.A NE2 GLU 209.A OE2 no hydrogen 2.507 N/A SER 48.A N ALA 44.A O no hydrogen 3.118 N/A SER 48.A N GLY 45.A O no hydrogen 3.076 N/A SER 48.A OG ALA 44.A O no hydrogen 3.162 N/A SER 48.A OG GLU 68.A OE2 no hydrogen 3.057 N/A LEU 49.A N GLY 45.A O no hydrogen 2.941 N/A LYS 50.A N TYR 46.A O no hydrogen 2.771 N/A LYS 51.A N GLN 47.A O no hydrogen 3.215 N/A ILE 52.A N SER 48.A O no hydrogen 3.113 N/A GLU 53.A N LEU 49.A O no hydrogen 2.880 N/A ASP 54.A N LYS 50.A O no hydrogen 2.923 N/A CYS 55.A N LYS 51.A O no hydrogen 3.347 N/A CYS 55.A SG LYS 51.A O no hydrogen 3.387 N/A ILE 56.A N ILE 52.A O no hydrogen 2.996 N/A ARG 57.A N GLU 53.A O no hydrogen 2.872 N/A ALA 58.A N ASP 54.A O no hydrogen 3.060 N/A GLY 59.A N CYS 55.A O no hydrogen 2.770 N/A MET 63.A N ARG 60.A O no hydrogen 2.971 N/A ALA 65.A N ALA 61.A O no hydrogen 2.799 N/A CYS 66.A N LEU 62.A O no hydrogen 2.651 N/A CYS 66.A SG ILE 85.A O no hydrogen 3.935 N/A ASN 67.A N MET 63.A O no hydrogen 2.878 N/A ASN 67.A ND2 MET 63.A O no hydrogen 3.469 N/A GLU 68.A N GLU 64.A O no hydrogen 3.119 N/A PHE 69.A N ALA 65.A O no hydrogen 3.195 N/A TYR 70.A N CYS 66.A O no hydrogen 2.921 N/A TYR 70.A OH PRO 83.A O no hydrogen 2.602 N/A THR 71.A N ASN 67.A O no hydrogen 2.697 N/A THR 71.A OG1 ASN 67.A O no hydrogen 3.254 N/A ARG 72.A N GLU 68.A O no hydrogen 2.951 N/A ARG 72.A NH1 ALA 44.A O no hydrogen 3.358 N/A ILE 73.A N PHE 69.A O no hydrogen 2.760 N/A HIS 75.A ND1 ILE 73.A O no hydrogen 2.821 N/A ASP 76.A N LYS 26.A O no hydrogen 2.826 N/A GLY 78.A N ASP 76.A OD1 no hydrogen 3.044 N/A ARG 80.A N PHE 77.A O no hydrogen 3.172 N/A ARG 86.A N GLU 90.A OE1 no hydrogen 2.854 N/A THR 87.A N GLU 90.A OE1 no hydrogen 3.026 N/A GLU 90.A N THR 87.A O no hydrogen 3.039 N/A GLU 90.A N THR 87.A OG1 no hydrogen 3.360 N/A LEU 91.A N THR 87.A O no hydrogen 3.036 N/A SER 92.A N GLN 88.A O no hydrogen 2.953 N/A GLU 93.A N LYS 89.A O no hydrogen 3.001 N/A LYS 94.A N GLU 90.A O no hydrogen 3.138 N/A LYS 94.A NZ HIS 75.A NE2 no hydrogen 2.663 N/A ILE 95.A N LEU 91.A O no hydrogen 3.050 N/A GLN 96.A N SER 92.A O no hydrogen 3.000 N/A LEU 97.A N GLU 93.A O no hydrogen 2.991 N/A LEU 98.A N LYS 94.A O no hydrogen 3.109 N/A GLU 99.A N ILE 95.A O no hydrogen 2.848 N/A ALA 100.A N GLN 96.A O no hydrogen 3.282 N/A LEU 101.A N LEU 97.A O no hydrogen 3.107 N/A GLY 102.A N LEU 98.A O no hydrogen 3.042 N/A ASP 103.A N GLU 99.A O no hydrogen 2.994 N/A ILE 104.A N ALA 100.A O no hydrogen 3.009 N/A GLU 105.A N LEU 101.A O no hydrogen 2.562 N/A ILE 106.A N GLY 102.A O no hydrogen 2.995 N/A ALA 107.A N ASP 103.A O no hydrogen 2.884 N/A ILE 108.A N ILE 104.A O no hydrogen 2.911 N/A LYS 109.A N GLU 105.A O no hydrogen 3.439 N/A LEU 110.A N ILE 106.A O no hydrogen 3.104 N/A VAL 111.A N ALA 107.A O no hydrogen 2.710 N/A LYS 112.A N LYS 109.A O no hydrogen 3.416 N/A GLU 114.A N GLN 120.A OE1 no hydrogen 2.759 N/A LEU 118.A N HIS 116.A ND1 no hydrogen 3.221 N/A GLN 120.A N HIS 116.A O no hydrogen 2.876 N/A HIS 121.A N PRO 117.A O no hydrogen 2.755 N/A TYR 122.A N LEU 118.A O no hydrogen 2.977 N/A ARG 123.A N ASP 119.A O no hydrogen 3.022 N/A ASN 124.A N GLN 120.A O no hydrogen 3.024 N/A ASN 124.A ND2 LEU 110.A O no hydrogen 3.379 N/A LEU 125.A N TYR 122.A O no hydrogen 2.975 N/A HIS 126.A N ARG 123.A O no hydrogen 3.187 N/A ALA 128.A N GLU 168.A O no hydrogen 2.847 N/A LEU 129.A N TYR 122.A OH no hydrogen 3.327 N/A ARG 130.A N GLU 166.A O no hydrogen 2.819 N/A ARG 130.A NH1 GLU 168.A OE2 no hydrogen 2.905 N/A ARG 130.A NH2 GLU 168.A OE2 no hydrogen 2.582 N/A LEU 132.A N LEU 164.A O no hydrogen 3.018 N/A HIS 134.A NE2 ASP 163.A OD1 no hydrogen 2.808 N/A GLU 135.A N ASP 133.A OD1 no hydrogen 2.649 N/A SER 136.A N ASP 133.A O no hydrogen 3.230 N/A SER 136.A OG ASP 133.A O no hydrogen 2.869 N/A SER 136.A OG GLU 138.A OE1 no hydrogen 3.278 N/A GLU 138.A N GLU 138.A OE1 no hydrogen 2.759 N/A LYS 140.A N SER 136.A O no hydrogen 3.105 N/A VAL 141.A N TYR 137.A O no hydrogen 3.111 N/A ILE 142.A N GLU 138.A O no hydrogen 3.082 N/A SER 143.A N PHE 139.A O no hydrogen 2.989 N/A SER 143.A OG PHE 139.A O no hydrogen 2.824 N/A GLN 144.A N LYS 140.A O no hydrogen 3.097 N/A TYR 145.A N VAL 141.A O no hydrogen 2.808 N/A TYR 145.A OH LEU 185.A O no hydrogen 2.684 N/A LEU 146.A N ILE 142.A O no hydrogen 2.759 N/A GLN 147.A N SER 143.A O no hydrogen 2.991 N/A GLN 147.A NE2 MET 159.A O no hydrogen 2.742 N/A SER 148.A N GLN 144.A O no hydrogen 2.760 N/A SER 148.A OG GLN 144.A O no hydrogen 2.364 N/A THR 149.A N TYR 145.A O no hydrogen 3.231 N/A THR 149.A OG1 TYR 145.A O no hydrogen 2.715 N/A THR 149.A OG1 ASP 225.A O no hydrogen 3.500 N/A HIS 150.A N GLN 147.A O no hydrogen 3.091 N/A HIS 150.A NE2 HIS 154.A O no hydrogen 2.812 N/A ALA 151.A N SER 228.A OG no hydrogen 2.953 N/A THR 153.A N TYR 316.A OH no hydrogen 3.327 N/A THR 153.A OG1 TYR 316.A OH no hydrogen 2.461 N/A HIS 154.A N ALA 151.A O no hydrogen 3.171 N/A HIS 154.A ND1 SER 228.A OG no hydrogen 2.383 N/A TYR 157.A OH ASN 232.A OD1 no hydrogen 2.792 N/A THR 158.A N ASN 338.A O no hydrogen 3.088 N/A THR 160.A N GLN 336.A O no hydrogen 2.843 N/A LEU 162.A N LYS 334.A O no hydrogen 2.673 N/A ASP 163.A N LYS 334.A O no hydrogen 3.246 N/A LEU 164.A N ASP 163.A OD1 no hydrogen 3.101 N/A PHE 165.A N LEU 332.A O no hydrogen 3.151 N/A GLU 166.A N ARG 130.A O no hydrogen 2.739 N/A VAL 167.A N ARG 330.A O no hydrogen 2.880 N/A GLU 168.A N ALA 128.A O no hydrogen 2.922 N/A LYS 169.A NZ SER 200.A O no hydrogen 3.417 N/A ASP 170.A N HIS 126.A O no hydrogen 2.916 N/A GLU 172.A N LYS 169.A O no hydrogen 3.019 N/A GLU 174.A N GLU 174.A OE1 no hydrogen 2.803 N/A ALA 175.A N GLY 171.A O no hydrogen 3.216 N/A PHE 176.A N GLU 172.A O no hydrogen 3.048 N/A ARG 177.A N ASN 325.A O no hydrogen 2.687 N/A ARG 177.A NE ASP 179.A OD1 no hydrogen 2.967 N/A ARG 177.A NE ASP 179.A OD2 no hydrogen 3.104 N/A ARG 177.A NH2 ASP 179.A OD2 no hydrogen 2.861 N/A LEU 180.A N ARG 177.A O no hydrogen 3.165 N/A ASN 182.A ND2 ASN 182.A O no hydrogen 2.964 N/A ARG 183.A NH2 GLU 178.A O no hydrogen 3.342 N/A MET 184.A N VAL 250.A O no hydrogen 3.079 N/A LEU 185.A N THR 295.A O no hydrogen 2.831 N/A LEU 186.A N SER 248.A O no hydrogen 3.184 N/A TRP 187.A N ALA 224.A O no hydrogen 2.921 N/A HIS 188.A N LEU 246.A O no hydrogen 2.887 N/A HIS 188.A ND1 TYR 222.A O no hydrogen 2.968 N/A ARG 191.A NH2 GLN 96.A OE1 no hydrogen 3.029 N/A SER 193.A OG ASN 194.A OD1 no hydrogen 2.615 N/A ASN 194.A N ARG 191.A O no hydrogen 2.932 N/A ASN 194.A ND2 SER 190.A OG no hydrogen 3.038 N/A TRP 195.A N MET 192.A O no hydrogen 3.390 N/A ILE 198.A N ASN 194.A O no hydrogen 3.031 N/A LEU 199.A N TRP 195.A O no hydrogen 2.738 N/A SER 200.A N VAL 196.A O no hydrogen 2.966 N/A SER 200.A OG VAL 196.A O no hydrogen 2.493 N/A SER 200.A OG GLY 197.A O no hydrogen 3.218 N/A SER 200.A OG HIS 201.A ND1 no hydrogen 3.024 N/A HIS 201.A N GLY 197.A O no hydrogen 2.781 N/A HIS 201.A ND1 SER 200.A OG no hydrogen 3.024 N/A GLY 202.A N ILE 198.A O no hydrogen 2.579 N/A ARG 204.A NE GLY 202.A O no hydrogen 2.959 N/A ARG 204.A NH1 ASP 103.A OD1 no hydrogen 3.191 N/A ARG 204.A NH2 ASP 103.A OD1 no hydrogen 3.000 N/A ARG 204.A NH2 GLY 202.A O no hydrogen 3.391 N/A GLU 209.A N HIS 207.A ND1 no hydrogen 3.021 N/A ALA 210.A N HIS 207.A O no hydrogen 3.098 N/A THR 213.A N GLU 53.A OE2 no hydrogen 2.632 N/A THR 213.A OG1 GLU 53.A OE2 no hydrogen 2.609 N/A TYR 215.A N ILE 212.A O no hydrogen 2.810 N/A TYR 215.A OH GLU 99.A OE1 no hydrogen 2.453 N/A PHE 217.A N TYR 222.A OH no hydrogen 2.910 N/A GLY 218.A N TYR 215.A O no hydrogen 2.912 N/A LYS 219.A NZ HIS 207.A O no hydrogen 2.718 N/A LYS 219.A NZ PRO 208.A O no hydrogen 2.652 N/A LYS 219.A NZ ALA 210.A O no hydrogen 2.880 N/A GLY 220.A N GLY 218.A O no hydrogen 2.920 N/A ILE 221.A N VAL 321.A O no hydrogen 2.833 N/A TYR 222.A OH GLY 218.A O no hydrogen 2.691 N/A PHE 223.A N TYR 319.A O no hydrogen 2.857 N/A ALA 224.A N TRP 187.A O no hydrogen 3.271 N/A SER 227.A N THR 149.A OG1 no hydrogen 3.051 N/A SER 227.A OG LEU 146.A O no hydrogen 2.746 N/A SER 227.A OG THR 149.A O no hydrogen 3.155 N/A SER 228.A OG HIS 154.A ND1 no hydrogen 2.383 N/A LYS 229.A N MET 226.A O no hydrogen 2.911 N/A LYS 229.A NZ TYR 316.A O no hydrogen 2.607 N/A LYS 229.A NZ ASN 317.A O no hydrogen 2.807 N/A LYS 229.A NZ GLU 318.A OE2 no hydrogen 2.834 N/A ALA 231.A N SER 227.A O no hydrogen 2.878 N/A ASN 232.A N SER 228.A O no hydrogen 2.859 N/A TYR 233.A N SER 230.A O no hydrogen 2.782 N/A CYS 234.A N ALA 231.A O no hydrogen 3.045 N/A CYS 234.A SG LEU 244.A O no hydrogen 3.073 N/A PHE 235.A N ASN 232.A O no hydrogen 3.198 N/A SER 237.A N LYS 240.A O no hydrogen 3.016 N/A LYS 240.A N SER 237.A OG no hydrogen 2.909 N/A GLY 243.A N VAL 335.A O no hydrogen 2.784 N/A LEU 245.A N LEU 333.A O no hydrogen 2.877 N/A LEU 246.A N HIS 188.A O no hydrogen 2.778 N/A LEU 247.A N TYR 331.A O no hydrogen 2.924 N/A SER 248.A N LEU 186.A O no hydrogen 3.000 N/A GLU 249.A N ARG 328.A O no hydrogen 2.701 N/A VAL 250.A N MET 184.A O no hydrogen 2.680 N/A ALA 251.A N GLN 326.A O no hydrogen 2.734 N/A GLY 253.A N HIS 181.A O no hydrogen 3.246 N/A GLN 254.A N HIS 273.A ND1 no hydrogen 3.010 N/A CYS 255.A SG SER 274.A OG no hydrogen 3.426 N/A ASN 256.A N SER 274.A O no hydrogen 2.848 N/A LEU 258.A N LYS 276.A O no hydrogen 2.815 N/A LYS 264.A N ASN 262.A OD1 no hydrogen 3.078 N/A ALA 265.A N ASN 262.A O no hydrogen 2.806 N/A GLY 267.A N LYS 264.A O no hydrogen 3.073 N/A LEU 268.A N ALA 265.A O no hydrogen 3.041 N/A LEU 269.A N GLU 266.A O no hydrogen 3.221 N/A GLN 270.A NE2 GLY 267.A O no hydrogen 2.782 N/A LYS 272.A N LEU 269.A O no hydrogen 3.167 N/A HIS 273.A N GLN 254.A O no hydrogen 3.033 N/A SER 274.A N GLN 254.A O no hydrogen 3.274 N/A SER 274.A OG LEU 252.A O no hydrogen 2.317 N/A SER 274.A OG GLN 254.A O no hydrogen 3.510 N/A THR 275.A N ILE 320.A O no hydrogen 3.008 N/A THR 275.A OG1 TYR 322.A OH no hydrogen 2.751 N/A LYS 276.A N ASN 256.A O no hydrogen 3.031 N/A GLY 277.A N GLU 318.A O no hydrogen 2.867 N/A LEU 278.A N LEU 258.A O no hydrogen 2.919 N/A GLY 279.A N ASN 317.A OD1 no hydrogen 2.476 N/A LYS 280.A N LEU 314.A O no hydrogen 2.824 N/A MET 281.A N ASN 315.A O no hydrogen 2.796 N/A ALA 282.A N SER 302.A O no hydrogen 3.109 N/A HIS 287.A N SER 284.A O no hydrogen 3.148 N/A PHE 288.A N SER 285.A O no hydrogen 3.211 N/A VAL 289.A N VAL 296.A O no hydrogen 3.206 N/A LEU 291.A N SER 294.A O no hydrogen 2.932 N/A SER 294.A N LEU 291.A O no hydrogen 3.214 N/A THR 295.A N ARG 183.A O no hydrogen 3.264 N/A VAL 296.A N VAL 289.A O no hydrogen 2.597 N/A LEU 298.A N VAL 296.A O no hydrogen 2.863 N/A GLY 299.A N SER 148.A OG no hydrogen 3.056 N/A SER 302.A N ALA 282.A O no hydrogen 2.863 N/A THR 304.A N LYS 280.A O no hydrogen 2.797 N/A THR 304.A OG1 GLY 279.A O no hydrogen 2.825 N/A THR 304.A OG1 LYS 280.A O no hydrogen 3.040 N/A ILE 306.A N THR 304.A OG1 no hydrogen 3.017 N/A ASN 308.A ND2 GLU 260.A OE1 no hydrogen 2.960 N/A ASN 308.A ND2 TYR 312.A O no hydrogen 2.777 N/A GLY 311.A N ASN 308.A O no hydrogen 3.108 N/A TYR 316.A OH THR 153.A OG1 no hydrogen 2.461 N/A ASN 317.A ND2 ASP 225.A OD2 no hydrogen 3.261 N/A GLU 318.A N GLY 277.A O no hydrogen 3.124 N/A TYR 319.A N PHE 223.A O no hydrogen 2.908 N/A TYR 319.A OH ASP 225.A OD2 no hydrogen 2.671 N/A ILE 320.A N THR 275.A O no hydrogen 2.841 N/A VAL 321.A N ILE 221.A O no hydrogen 3.101 N/A TYR 322.A OH PHE 217.A O no hydrogen 2.726 N/A TYR 322.A OH THR 275.A OG1 no hydrogen 2.751 N/A ASN 325.A N ASN 323.A OD1 no hydrogen 2.838 N/A GLN 326.A N ASN 323.A O no hydrogen 2.872 N/A GLN 326.A NE2 ALA 251.A O no hydrogen 3.243 N/A GLN 326.A NE2 HIS 273.A O no hydrogen 2.632 N/A VAL 327.A N PRO 324.A O no hydrogen 3.076 N/A ARG 328.A N GLU 249.A O no hydrogen 2.849 N/A MET 329.A N GLU 172.A OE1 no hydrogen 2.592 N/A ARG 330.A N LEU 247.A O no hydrogen 3.016 N/A ARG 330.A NE MET 329.A O no hydrogen 2.881 N/A TYR 331.A N LEU 247.A O no hydrogen 2.925 N/A LEU 332.A N PHE 165.A O no hydrogen 2.778 N/A LEU 333.A N LEU 245.A O no hydrogen 2.745 N/A LYS 334.A N ASP 163.A O no hydrogen 2.800 N/A VAL 335.A N GLY 243.A O no hydrogen 2.720 N/A GLN 336.A N THR 160.A O no hydrogen 3.024 N/A GLN 336.A NE2 ASN 338.A OD1 no hydrogen 3.060 N/A PHE 337.A N ASN 241.A O no hydrogen 2.724 N/A ASN 338.A N THR 158.A O no hydrogen 2.715 N/A ASN 338.A ND2 THR 158.A OG1 no hydrogen 2.578 N/A ASN 338.A ND2 THR 160.A OG1 no hydrogen 2.963 N/A