Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4j9w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N LEU 298.A O no hydrogen 3.423 N/A ILE 4.A N LEU 296.A O no hydrogen 2.896 N/A THR 5.A N ASP 21.A O no hydrogen 2.933 N/A VAL 6.A N ALA 294.A O no hydrogen 2.857 N/A ILE 7.A N LEU 18.A O no hydrogen 2.933 N/A ASP 8.A N ALA 292.A O no hydrogen 2.881 N/A SER 9.A N THR 16.A O no hydrogen 2.950 N/A HIS 10.A N HIS 289.A O no hydrogen 2.980 N/A THR 11.A N GLU 14.A O no hydrogen 2.770 N/A THR 11.A OG1 HIS 90.A O no hydrogen 2.890 N/A GLY 13.A N HIS 10.A ND1 no hydrogen 3.008 N/A GLU 14.A N THR 11.A O no hydrogen 3.155 N/A THR 16.A N SER 9.A O no hydrogen 2.824 N/A THR 16.A OG1 HIS 90.A NE2 no hydrogen 3.023 N/A ARG 17.A N VAL 60.A O no hydrogen 2.855 N/A ARG 17.A NE ASP 8.A OD1 no hydrogen 2.873 N/A ARG 17.A NH1 CYS 49.A O no hydrogen 2.941 N/A ARG 17.A NH1 ARG 54.A O no hydrogen 2.837 N/A ARG 17.A NH2 ASP 8.A OD2 no hydrogen 2.881 N/A LEU 18.A N ILE 7.A O no hydrogen 2.931 N/A VAL 19.A N ALA 62.A O no hydrogen 2.817 N/A ILE 20.A N THR 5.A O no hydrogen 2.907 N/A GLY 27.A N ASP 25.A OD2 no hydrogen 2.978 N/A SER 30.A N GLU 33.A OE1 no hydrogen 2.793 N/A GLU 33.A N SER 30.A OG no hydrogen 3.070 N/A ARG 34.A N SER 30.A O no hydrogen 2.941 N/A ARG 34.A NE GLY 29.A O no hydrogen 2.856 N/A ARG 34.A NH1 GLN 66.A O no hydrogen 2.738 N/A ARG 34.A NH2 GLY 29.A O no hydrogen 3.180 N/A ARG 34.A NH2 GLN 66.A O no hydrogen 3.140 N/A LEU 35.A N MET 31.A O no hydrogen 2.918 N/A GLN 36.A N ALA 32.A O no hydrogen 3.221 N/A ILE 37.A N GLU 33.A O no hydrogen 3.251 N/A LEU 38.A N ARG 34.A O no hydrogen 2.793 N/A GLU 39.A N LEU 35.A O no hydrogen 2.926 N/A ARG 40.A N GLN 36.A O no hydrogen 3.052 N/A ARG 40.A NH2 GLU 41.A OE1 no hydrogen 2.272 N/A GLU 41.A N ILE 37.A O no hydrogen 2.939 N/A HIS 42.A N LEU 38.A O no hydrogen 2.921 N/A TRP 45.A N HIS 42.A O no hydrogen 2.917 N/A ARG 46.A NE ASP 43.A OD1 no hydrogen 2.739 N/A ARG 46.A NH1 ASN 80.A O no hydrogen 2.989 N/A ARG 46.A NH1 ASN 81.A O no hydrogen 3.117 N/A ARG 46.A NH2 ASP 43.A OD1 no hydrogen 3.481 N/A ARG 46.A NH2 ASP 43.A OD2 no hydrogen 2.898 N/A ARG 47.A N ASP 43.A O no hydrogen 3.175 N/A ARG 47.A NH1 SER 310.A O no hydrogen 3.103 N/A ARG 47.A NH1 SER 310.A OXT no hydrogen 3.405 N/A ARG 47.A NH2 GLY 309.A O no hydrogen 2.823 N/A ALA 48.A N GLN 44.A O no hydrogen 2.840 N/A CYS 49.A N TRP 45.A O no hydrogen 3.005 N/A VAL 50.A N ARG 46.A O no hydrogen 3.000 N/A LEU 51.A N ARG 47.A O no hydrogen 2.999 N/A ARG 54.A NE LEU 297.A O no hydrogen 2.648 N/A ARG 54.A NH1 ASP 302.A OD2 no hydrogen 3.019 N/A ARG 54.A NH2 LEU 297.A O no hydrogen 2.985 N/A ARG 54.A NH2 ASP 302.A OD2 no hydrogen 2.864 N/A GLY 55.A N LEU 51.A O no hydrogen 2.706 N/A SER 56.A N.A VAL 50.A O no hydrogen 2.876 N/A VAL 58.A N SER 56.A OG.B no hydrogen 3.237 N/A LEU 59.A N SER 56.A O.A no hydrogen 2.998 N/A LEU 59.A N SER 56.A O.B no hydrogen 3.030 N/A GLY 61.A N PHE 79.A O no hydrogen 2.767 N/A ALA 62.A N ARG 17.A O no hydrogen 2.867 N/A LEU 63.A N ILE 77.A O no hydrogen 2.853 N/A LEU 64.A N VAL 19.A O no hydrogen 3.013 N/A CYS 65.A N GLY 75.A O no hydrogen 2.760 N/A CYS 65.A SG LEU 63.A O no hydrogen 3.604 N/A GLN 68.A N GLU 113.A OE1 no hydrogen 2.945 N/A GLN 68.A NE2 ARG 28.A O no hydrogen 2.759 N/A ALA 69.A N GLU 113.A OE2 no hydrogen 2.932 N/A ALA 72.A N ALA 69.A O no hydrogen 3.180 N/A CYS 73.A N ARG 111.A O no hydrogen 2.959 N/A CYS 73.A SG ARG 111.A O no hydrogen 3.978 N/A GLY 75.A N CYS 65.A O no hydrogen 2.826 N/A VAL 76.A N GLU 113.A O no hydrogen 2.899 N/A ILE 77.A N LEU 63.A O no hydrogen 3.197 N/A PHE 79.A N GLY 61.A O no hydrogen 2.928 N/A ASN 80.A N GLY 83.A O no hydrogen 2.901 N/A ASN 81.A ND2 GLY 228.A O no hydrogen 3.030 N/A SER 82.A N ASN 80.A OD1 no hydrogen 2.850 N/A SER 82.A OG ASN 80.A OD1 no hydrogen 2.884 N/A GLY 83.A N ASN 80.A OD1 no hydrogen 2.944 N/A TYR 84.A OH ASP 43.A OD1 no hydrogen 2.751 N/A LEU 85.A N PHE 78.A O no hydrogen 2.921 N/A GLY 86.A N ASN 162.A OD1 no hydrogen 2.812 N/A MET 87.A N GLY 161.A O no hydrogen 2.995 N/A CYS 88.A SG HIS 90.A ND1 no hydrogen 3.245 N/A HIS 90.A NE2 PRO 15.A O no hydrogen 3.085 N/A THR 92.A N CYS 88.A O no hydrogen 2.979 N/A THR 92.A OG1 CYS 88.A O no hydrogen 2.658 N/A ILE 93.A N GLY 89.A O no hydrogen 3.160 N/A GLY 94.A N HIS 90.A O no hydrogen 2.974 N/A LEU 95.A N GLY 91.A O no hydrogen 2.802 N/A VAL 96.A N THR 92.A O no hydrogen 2.954 N/A ARG 97.A N ILE 93.A O no hydrogen 3.055 N/A ARG 97.A NH1 ARG 97.A O no hydrogen 3.088 N/A SER 98.A N GLY 94.A O no hydrogen 2.877 N/A SER 98.A OG GLY 94.A O no hydrogen 2.734 N/A LEU 99.A N LEU 95.A O no hydrogen 2.926 N/A TYR 100.A N VAL 96.A O no hydrogen 3.141 N/A HIS 101.A N ARG 97.A O no hydrogen 3.026 N/A HIS 101.A NE2 GLU 293.A OE2 no hydrogen 2.691 N/A LEU 102.A N SER 98.A O no hydrogen 2.944 N/A GLY 103.A N TYR 100.A O no hydrogen 2.903 N/A ARG 104.A N LEU 99.A O no hydrogen 2.893 N/A GLN 107.A N ASP 106.A OD1 no hydrogen 2.516 N/A GLY 108.A N LEU 123.A O no hydrogen 3.049 N/A HIS 110.A N ALA 121.A O no hydrogen 2.716 N/A HIS 110.A NE2 ASP 106.A O no hydrogen 2.847 N/A ILE 112.A N VAL 119.A O no hydrogen 2.888 N/A GLU 113.A N ALA 74.A O no hydrogen 2.903 N/A THR 114.A N GLY 117.A O no hydrogen 3.131 N/A THR 114.A OG1 GLY 117.A O no hydrogen 2.627 N/A VAL 116.A N THR 114.A OG1 no hydrogen 3.123 N/A GLY 117.A N THR 114.A O no hydrogen 3.104 N/A VAL 119.A N ILE 112.A O no hydrogen 2.873 N/A GLU 120.A N ARG 132.A O no hydrogen 3.125 N/A ALA 121.A N HIS 110.A O no hydrogen 2.739 N/A THR 122.A N SER 130.A O no hydrogen 2.824 N/A LEU 123.A N GLY 108.A O no hydrogen 2.816 N/A HIS 124.A N SER 128.A O no hydrogen 2.923 N/A HIS 124.A NE2 SER 130.A OG no hydrogen 2.711 N/A LEU 127.A N HIS 124.A O no hydrogen 2.891 N/A SER 128.A N ASP 126.A OD1 no hydrogen 2.939 N/A SER 128.A OG ASP 126.A OD1 no hydrogen 2.582 N/A SER 128.A OG ASP 126.A OD2 no hydrogen 3.528 N/A VAL 129.A N GLY 286.A O no hydrogen 2.889 N/A SER 130.A N THR 122.A O no hydrogen 3.006 N/A SER 130.A OG HIS 124.A NE2 no hydrogen 2.711 N/A VAL 131.A N LEU 284.A O no hydrogen 2.651 N/A ARG 132.A N GLU 120.A O no hydrogen 2.738 N/A ARG 132.A NH1 GLU 274.A OE1 no hydrogen 2.808 N/A ARG 132.A NH2 GLU 274.A OE1 no hydrogen 3.544 N/A ASN 133.A N PRO 282.A O no hydrogen 2.913 N/A ASN 133.A ND2 GLY 160.A O no hydrogen 2.978 N/A ASN 133.A ND2 SER 241.A OG no hydrogen 3.078 N/A VAL 134.A N ASN 133.A OD1 no hydrogen 2.739 N/A ALA 136.A N LEU 280.A O no hydrogen 2.992 N/A TYR 137.A N TRP 159.A O no hydrogen 3.061 N/A ARG 138.A NH1 ASP 156.A OD2 no hydrogen 2.972 N/A ARG 138.A NH1 ASP 250.A OD1 no hydrogen 2.992 N/A ARG 138.A NH1 ASP 250.A OD2 no hydrogen 3.228 N/A ARG 138.A NH2 ASP 250.A OD1 no hydrogen 2.940 N/A TYR 139.A N ILE 157.A O no hydrogen 2.765 N/A ARG 140.A N ILE 157.A O no hydrogen 3.322 N/A THR 141.A OG1 ASP 156.A OD1 no hydrogen 2.714 N/A GLN 142.A N ASP 156.A OD1 no hydrogen 2.923 N/A GLN 142.A NE2 ASP 156.A OD1 no hydrogen 3.184 N/A VAL 143.A N GLY 155.A O no hydrogen 2.722 N/A LEU 145.A N VAL 153.A O no hydrogen 2.710 N/A HIS 150.A N LEU 147.A O no hydrogen 2.683 N/A VAL 153.A N LEU 145.A O no hydrogen 2.647 N/A HIS 154.A N ASP 169.A OD1 no hydrogen 3.235 N/A GLY 155.A N VAL 143.A O no hydrogen 2.993 N/A ASP 156.A N LEU 166.A O no hydrogen 2.917 N/A ILE 157.A N ARG 140.A O no hydrogen 2.956 N/A ALA 158.A N PHE 164.A O no hydrogen 3.087 N/A TRP 159.A N TYR 137.A O no hydrogen 2.921 N/A GLY 160.A N ASN 162.A O no hydrogen 3.109 N/A ASN 162.A ND2 MET 87.A O no hydrogen 2.861 N/A ASN 162.A ND2 THR 238.A OG1 no hydrogen 3.077 N/A PHE 164.A N ALA 158.A O no hydrogen 2.995 N/A PHE 165.A N HIS 208.A O no hydrogen 3.036 N/A LEU 166.A N ASP 156.A O no hydrogen 2.856 N/A ILE 167.A N GLU 210.A O no hydrogen 2.848 N/A HIS 170.A NE2 PHE 212.A O no hydrogen 2.756 N/A GLN 172.A N HIS 170.A ND1 no hydrogen 2.840 N/A GLN 172.A NE2 HIS 170.A O no hydrogen 3.214 N/A ARG 173.A NH1 ASP 177.A OD1 no hydrogen 2.858 N/A ARG 173.A NH2 ASP 177.A OD1 no hydrogen 2.990 N/A ASN 178.A N ALA 175.A O no hydrogen 2.888 N/A ASN 178.A ND2 ARG 173.A O no hydrogen 2.907 N/A VAL 179.A N LEU 176.A O no hydrogen 3.397 N/A LEU 182.A N ASN 178.A O no hydrogen 3.088 N/A THR 183.A N VAL 179.A O no hydrogen 2.878 N/A THR 183.A OG1 VAL 179.A O no hydrogen 2.678 N/A HIS 184.A N GLU 180.A O no hydrogen 3.164 N/A TYR 185.A N ALA 181.A O no hydrogen 2.987 N/A THR 186.A N LEU 182.A O no hydrogen 3.067 N/A THR 186.A OG1 LEU 182.A O no hydrogen 2.883 N/A THR 186.A OG1 THR 183.A O no hydrogen 3.193 N/A ARG 187.A N THR 183.A O no hydrogen 2.933 N/A ASP 188.A N HIS 184.A O no hydrogen 2.988 N/A VAL 189.A N TYR 185.A O no hydrogen 2.995 N/A ARG 190.A N THR 186.A O no hydrogen 2.958 N/A ARG 190.A NE GLU 194.A OE2 no hydrogen 3.168 N/A ARG 190.A NH2 PRO 227.A O no hydrogen 3.254 N/A GLN 191.A N ARG 187.A O no hydrogen 2.869 N/A ALA 192.A N ASP 188.A O no hydrogen 2.779 N/A LEU 193.A N VAL 189.A O no hydrogen 2.907 N/A GLU 194.A N ARG 190.A O no hydrogen 2.992 N/A ALA 195.A N GLN 191.A O no hydrogen 2.949 N/A ALA 196.A N ALA 192.A O no hydrogen 3.143 N/A GLY 197.A N GLU 194.A O no hydrogen 3.145 N/A ILE 198.A N LEU 193.A O no hydrogen 3.060 N/A THR 199.A OG1 GLY 200.A O no hydrogen 2.928 N/A GLY 200.A N GLY 204.A O no hydrogen 2.627 N/A GLY 204.A N ALA 201.A O no hydrogen 3.069 N/A HIS 208.A N TRP 163.A O no hydrogen 3.219 N/A HIS 208.A ND1 ASP 207.A OD1 no hydrogen 2.945 N/A ILE 209.A N LEU 225.A O no hydrogen 3.047 N/A GLU 210.A N PHE 165.A O no hydrogen 2.805 N/A LEU 211.A N PHE 223.A O no hydrogen 2.946 N/A PHE 212.A N ILE 167.A O no hydrogen 2.830 N/A ALA 213.A N ARG 221.A O no hydrogen 2.821 N/A GLN 217.A N ASP 215.A OD1 no hydrogen 2.780 N/A ASP 219.A N ARG 260.A O no hydrogen 2.827 N/A SER 220.A OG ALA 213.A O no hydrogen 3.217 N/A SER 220.A OG ARG 221.A O no hydrogen 3.515 N/A ARG 221.A N ALA 213.A O no hydrogen 2.744 N/A ARG 221.A NE ASP 215.A OD2 no hydrogen 2.591 N/A ARG 221.A NH1 ILE 174.A O no hydrogen 2.883 N/A ARG 221.A NH2 ASP 215.A OD2 no hydrogen 2.947 N/A ASN 222.A N ALA 262.A O no hydrogen 2.972 N/A ASN 222.A ND2 PRO 235.A O no hydrogen 2.915 N/A PHE 223.A N LEU 211.A O no hydrogen 3.012 N/A LEU 225.A N ILE 209.A O no hydrogen 2.771 N/A CYS 226.A N ALA 230.A O no hydrogen 2.860 N/A LYS 229.A N CYS 226.A O no hydrogen 3.007 N/A ASP 232.A N VAL 224.A O no hydrogen 3.034 N/A ARG 233.A N GLU 14.A OE1 no hydrogen 2.871 N/A ARG 233.A NH1 TYR 231.A O no hydrogen 2.912 N/A SER 234.A N ASP 232.A OD1 no hydrogen 2.786 N/A SER 234.A OG ASP 232.A OD1 no hydrogen 2.762 N/A SER 234.A OG ASP 232.A OD2 no hydrogen 3.110 N/A CYS 236.A N SER 234.A OG no hydrogen 2.958 N/A THR 240.A N CYS 236.A O no hydrogen 2.762 N/A THR 240.A OG1 PRO 235.A O no hydrogen 3.038 N/A THR 240.A OG1 CYS 236.A O no hydrogen 3.020 N/A SER 241.A N GLY 237.A O no hydrogen 2.974 N/A SER 241.A OG GLY 237.A O no hydrogen 2.901 N/A ALA 242.A N THR 238.A O no hydrogen 3.021 N/A LYS 243.A N GLY 239.A O no hydrogen 3.119 N/A LEU 244.A N THR 240.A O no hydrogen 2.945 N/A ALA 245.A N SER 241.A O no hydrogen 3.229 N/A CYS 246.A N ALA 242.A O no hydrogen 3.072 N/A CYS 246.A SG ASP 156.A OD2 no hydrogen 3.492 N/A CYS 246.A SG ALA 242.A O no hydrogen 3.447 N/A LEU 247.A N LYS 243.A O no hydrogen 2.873 N/A ALA 248.A N LEU 244.A O no hydrogen 2.911 N/A ALA 249.A N ALA 245.A O no hydrogen 3.091 N/A ASP 250.A N CYS 246.A O no hydrogen 3.012 N/A GLY 251.A N ALA 248.A O no hydrogen 2.950 N/A LYS 252.A N LEU 247.A O no hydrogen 2.838 N/A ALA 254.A N GLN 257.A OE1 no hydrogen 2.919 N/A GLY 256.A N TYR 273.A O no hydrogen 2.921 N/A GLN 257.A N ALA 254.A O no hydrogen 3.222 N/A TRP 259.A N ALA 271.A O no hydrogen 2.676 N/A TRP 259.A NE1 GLN 261.A OE1 no hydrogen 2.905 N/A ARG 260.A N ASP 219.A OD2 no hydrogen 2.761 N/A GLN 261.A N PHE 269.A O no hydrogen 2.908 N/A GLN 261.A NE2 SER 220.A OG no hydrogen 3.244 N/A GLN 261.A NE2 ALA 262.A O no hydrogen 3.401 N/A ALA 262.A N SER 220.A O no hydrogen 2.812 N/A SER 263.A N SER 267.A O no hydrogen 2.775 N/A SER 263.A OG ARG 233.A O no hydrogen 2.875 N/A SER 263.A OG SER 267.A OG no hydrogen 2.970 N/A ILE 265.A N SER 263.A OG no hydrogen 3.076 N/A GLY 266.A N SER 263.A O no hydrogen 3.002 N/A SER 267.A N SER 263.A OG no hydrogen 3.246 N/A SER 267.A OG GLY 12.A O no hydrogen 2.848 N/A SER 267.A OG ARG 233.A O no hydrogen 3.336 N/A SER 267.A OG SER 263.A OG no hydrogen 2.970 N/A GLN 268.A NE2 GLN 217.A O no hydrogen 3.344 N/A PHE 269.A N GLN 261.A O no hydrogen 2.960 N/A SER 270.A N ARG 285.A O no hydrogen 3.134 N/A ALA 271.A N TRP 259.A O no hydrogen 2.907 N/A HIS 272.A N ILE 283.A O no hydrogen 3.088 N/A TYR 273.A OH LEU 253.A O no hydrogen 2.688 N/A GLU 274.A N ILE 281.A O no hydrogen 2.867 N/A VAL 276.A N GLN 279.A O no hydrogen 2.951 N/A GLN 279.A N VAL 276.A O no hydrogen 2.990 N/A ILE 281.A N GLU 274.A O no hydrogen 2.813 N/A ILE 283.A N HIS 272.A O no hydrogen 2.759 N/A LEU 284.A N VAL 131.A O no hydrogen 2.901 N/A ARG 285.A N SER 270.A O no hydrogen 2.800 N/A ARG 285.A NE SER 128.A OG no hydrogen 3.077 N/A ARG 285.A NH2 ASP 126.A OD2 no hydrogen 3.324 N/A ARG 285.A NH2 SER 128.A OG no hydrogen 3.113 N/A GLY 286.A N VAL 129.A O no hydrogen 3.104 N/A HIS 289.A N HIS 10.A O no hydrogen 2.961 N/A SER 291.A N ASP 8.A O no hydrogen 2.743 N/A ALA 292.A N ASP 8.A O no hydrogen 3.090 N/A ALA 294.A N VAL 6.A O no hydrogen 3.166 N/A LEU 296.A N ILE 4.A O no hydrogen 2.767 N/A LEU 298.A N LYS 2.A O no hydrogen 2.821 N/A SER 301.A N ASP 299.A OD1 no hydrogen 2.971 N/A SER 301.A OG ASP 299.A OD1 no hydrogen 2.826 N/A SER 301.A OG ASP 299.A OD2 no hydrogen 3.168 N/A ASP 302.A N ASP 299.A O no hydrogen 2.946 N/A PHE 304.A N ASP 302.A OD1 no hydrogen 2.873 N/A VAL 305.A N ASP 302.A O no hydrogen 3.054 N/A GLY 307.A N PHE 304.A O no hydrogen 2.862 N/A ILE 308.A N GLU 52.A O no hydrogen 2.855 N/A