Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ru8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N LEU 10.A O no hydrogen 3.365 N/A VAL 4.A N TYR 8.A O no hydrogen 2.776 N/A ARG 7.A NE ASP 27.A OD1 no hydrogen 3.063 N/A ARG 7.A NH2 ASP 27.A OD1 no hydrogen 3.275 N/A ARG 7.A NH2 ASP 27.A OD2 no hydrogen 2.820 N/A TYR 8.A N VAL 4.A O no hydrogen 3.047 N/A ARG 9.A N THR 26.A O no hydrogen 2.851 N/A LEU 10.A N LEU 2.A O no hydrogen 2.906 N/A GLY 11.A N LEU 24.A O no hydrogen 2.687 N/A LYS 13.A NZ ASP 21.A OD1 no hydrogen 3.534 N/A ILE 14.A N ILE 22.A O no hydrogen 2.747 N/A GLY 15.A N ILE 22.A O no hydrogen 3.239 N/A SER 16.A OG ASP 21.A OD1 no hydrogen 2.595 N/A ASP 21.A N LEU 38.A O no hydrogen 3.101 N/A ILE 22.A N GLY 15.A O no hydrogen 2.839 N/A TYR 23.A N ILE 36.A O no hydrogen 2.734 N/A LEU 24.A N ARG 12.A O no hydrogen 2.881 N/A GLY 25.A N VAL 34.A O no hydrogen 2.861 N/A THR 26.A N ARG 9.A O no hydrogen 2.868 N/A THR 26.A OG1 GLU 33.A OE1 no hydrogen 2.500 N/A ASP 27.A N GLU 32.A O no hydrogen 2.741 N/A ILE 28.A N ARG 7.A O no hydrogen 2.725 N/A ALA 29.A N ASP 27.A OD1 no hydrogen 3.143 N/A ALA 30.A N ASP 27.A OD1 no hydrogen 3.229 N/A GLY 31.A N ASP 27.A O no hydrogen 2.757 N/A GLU 32.A N ASP 27.A O no hydrogen 3.286 N/A VAL 34.A N GLY 25.A O no hydrogen 2.884 N/A ALA 35.A N MET 81.A O no hydrogen 2.830 N/A ILE 36.A N TYR 23.A O no hydrogen 2.778 N/A LYS 37.A N MET 79.A O no hydrogen 2.749 N/A LYS 37.A NZ GLU 51.A OE1 no hydrogen 2.803 N/A LEU 38.A N ASP 21.A O no hydrogen 2.943 N/A GLU 39.A N ASN 77.A O no hydrogen 2.973 N/A CYS 40.A SG ASP 75.A O no hydrogen 3.921 N/A VAL 41.A N ASP 75.A O no hydrogen 2.792 N/A THR 43.A N CYS 40.A O no hydrogen 3.230 N/A THR 43.A OG1 CYS 40.A O no hydrogen 2.643 N/A GLN 47.A N GLU 39.A OE2 no hydrogen 2.787 N/A LEU 48.A N GLU 39.A OE1 no hydrogen 3.269 N/A LEU 48.A N GLU 39.A OE2 no hydrogen 3.229 N/A GLU 51.A N GLN 47.A O no hydrogen 2.925 N/A SER 52.A N LEU 48.A O no hydrogen 2.838 N/A SER 52.A OG HIS 49.A O no hydrogen 2.744 N/A LYS 53.A N HIS 49.A O no hydrogen 3.076 N/A ILE 54.A N ILE 50.A O no hydrogen 3.068 N/A TYR 55.A N GLU 51.A O no hydrogen 2.938 N/A LYS 56.A N SER 52.A O no hydrogen 2.845 N/A MET 57.A N LYS 53.A O no hydrogen 2.925 N/A MET 58.A N ILE 54.A O no hydrogen 3.064 N/A MET 58.A N TYR 55.A O no hydrogen 3.005 N/A GLN 59.A N LYS 56.A O no hydrogen 3.246 N/A GLN 59.A NE2 TYR 55.A O no hydrogen 2.820 N/A GLN 59.A NE2 PRO 65.A O no hydrogen 3.010 N/A GLY 61.A N MET 58.A O no hydrogen 3.314 N/A ILE 64.A N GLY 61.A O no hydrogen 3.282 N/A THR 66.A N GLU 82.A OE1 no hydrogen 3.081 N/A THR 66.A OG1 GLU 82.A OE1 no hydrogen 3.508 N/A ILE 67.A N GLN 59.A OE1 no hydrogen 3.034 N/A ARG 68.A N VAL 80.A O no hydrogen 2.781 N/A ARG 68.A NH1 GLU 32.A OE2 no hydrogen 2.929 N/A ARG 68.A NH2 ASP 27.A OD2 no hydrogen 2.772 N/A ARG 68.A NH2 GLU 32.A OE2 no hydrogen 2.694 N/A TRP 69.A N VAL 80.A O no hydrogen 3.459 N/A GLY 71.A N VAL 78.A O no hydrogen 3.009 N/A GLU 73.A N TYR 76.A O no hydrogen 2.782 N/A TYR 76.A N GLU 73.A O no hydrogen 2.938 N/A ASN 77.A N GLU 39.A O no hydrogen 2.716 N/A ASN 77.A ND2 GLU 39.A OE1 no hydrogen 3.004 N/A VAL 78.A N GLY 71.A O no hydrogen 2.770 N/A MET 79.A N LYS 37.A O no hydrogen 2.914 N/A VAL 80.A N TRP 69.A O no hydrogen 2.766 N/A MET 81.A N ALA 35.A O no hydrogen 2.738 N/A GLU 82.A N THR 66.A O no hydrogen 2.902 N/A GLY 85.A N MET 135.A O no hydrogen 2.712 N/A SER 87.A N ASP 90.A OD2 no hydrogen 3.132 N/A LEU 88.A N PHE 133.A O no hydrogen 2.798 N/A ASP 90.A N SER 87.A OG no hydrogen 2.901 N/A LEU 91.A N SER 87.A O no hydrogen 2.994 N/A PHE 92.A N LEU 88.A O no hydrogen 2.894 N/A ASN 93.A N GLU 89.A O no hydrogen 3.033 N/A PHE 94.A N ASP 90.A O no hydrogen 2.971 N/A CYS 95.A N LEU 91.A O no hydrogen 2.861 N/A CYS 95.A N PHE 92.A O no hydrogen 3.110 N/A CYS 95.A SG LEU 91.A O no hydrogen 3.284 N/A SER 96.A N ASN 93.A O no hydrogen 3.117 N/A ARG 97.A N PHE 92.A O no hydrogen 2.689 N/A ARG 97.A NH1 TYR 204.A OH no hydrogen 2.699 N/A ARG 97.A NH1 GLY 208.A O no hydrogen 3.064 N/A ARG 97.A NH2 GLU 89.A OE2 no hydrogen 3.040 N/A ARG 97.A NH2 ASN 93.A OD1 no hydrogen 2.776 N/A LYS 98.A N CYS 95.A O no hydrogen 3.307 N/A LYS 98.A NZ PHE 99.A O no hydrogen 3.513 N/A SER 100.A N ASP 288.A OD2 no hydrogen 2.604 N/A SER 100.A OG ASP 288.A OD1 no hydrogen 2.654 N/A SER 100.A OG ASP 288.A OD2 no hydrogen 3.374 N/A LYS 102.A NZ ASP 284.A OD1 no hydrogen 2.860 N/A LYS 102.A NZ ASP 284.A OD2 no hydrogen 3.327 N/A THR 103.A N SER 100.A OG no hydrogen 3.201 N/A VAL 104.A N SER 100.A O no hydrogen 3.094 N/A LEU 105.A N LEU 101.A O no hydrogen 2.945 N/A LEU 106.A N LYS 102.A O no hydrogen 2.803 N/A LEU 107.A N THR 103.A O no hydrogen 2.952 N/A ALA 108.A N VAL 104.A O no hydrogen 2.834 N/A ASP 109.A N LEU 105.A O no hydrogen 3.164 N/A GLN 110.A NE2 ASN 142.A O no hydrogen 2.922 N/A MET 111.A N LEU 107.A O no hydrogen 2.859 N/A ILE 112.A N ALA 108.A O no hydrogen 2.978 N/A SER 113.A N ASP 109.A O no hydrogen 3.330 N/A SER 113.A OG ASP 109.A O no hydrogen 3.128 N/A ARG 114.A N GLN 110.A O no hydrogen 2.858 N/A ARG 114.A NE VAL 144.A O no hydrogen 2.744 N/A ARG 114.A NH1 VAL 144.A O no hydrogen 3.374 N/A ILE 115.A N MET 111.A O no hydrogen 3.042 N/A GLU 116.A N ILE 112.A O no hydrogen 2.898 N/A TYR 117.A N SER 113.A O no hydrogen 2.928 N/A TYR 117.A OH MET 58.A O no hydrogen 2.789 N/A ILE 118.A N ARG 114.A O no hydrogen 3.079 N/A HIS 119.A N ILE 115.A O no hydrogen 2.961 N/A HIS 119.A ND1 TYR 265.A OH no hydrogen 2.624 N/A HIS 119.A NE2 ASP 194.A OD2 no hydrogen 2.775 N/A SER 120.A N GLU 116.A O no hydrogen 2.844 N/A SER 120.A OG TYR 117.A O no hydrogen 2.567 N/A LYS 121.A N TYR 117.A O no hydrogen 3.208 N/A LYS 121.A N ILE 118.A O no hydrogen 2.995 N/A LYS 121.A NZ TYR 117.A OH no hydrogen 3.470 N/A ASN 122.A N HIS 119.A O no hydrogen 2.965 N/A PHE 123.A N ILE 118.A O no hydrogen 3.302 N/A ILE 124.A N LYS 153.A O no hydrogen 2.840 N/A HIS 125.A N ASP 194.A OD2 no hydrogen 2.842 N/A HIS 125.A NE2 ILE 147.A O no hydrogen 2.854 N/A ARG 126.A N ASP 194.A OD1 no hydrogen 2.874 N/A ARG 126.A NE LEU 151.A O no hydrogen 2.659 N/A ARG 126.A NH1 GLN 189.A OE1.A no hydrogen 2.970 N/A ARG 126.A NH2 LEU 151.A O no hydrogen 2.982 N/A ASP 127.A N HIS 125.A ND1 no hydrogen 3.092 N/A LYS 129.A NZ THR 175.A OG1 no hydrogen 2.926 N/A ASN 132.A N LYS 129.A O no hydrogen 2.985 N/A ASN 132.A ND2 ASP 127.A O no hydrogen 2.883 N/A ASN 132.A ND2 ASP 127.A OD2 no hydrogen 3.061 N/A ASN 132.A ND2 ASP 148.A OD2 no hydrogen 3.329 N/A PHE 133.A N PRO 130.A O no hydrogen 3.417 N/A LEU 134.A N TYR 145.A O no hydrogen 2.963 N/A MET 135.A N PRO 86.A O no hydrogen 3.025 N/A GLY 136.A N LEU 143.A O no hydrogen 2.889 N/A LYS 140.A N LEU 137.A O no hydrogen 2.999 N/A GLY 141.A N GLY 138.A O no hydrogen 3.002 N/A LEU 143.A N LYS 140.A O no hydrogen 3.020 N/A VAL 144.A N GLN 110.A OE1 no hydrogen 2.861 N/A TYR 145.A N LEU 134.A O no hydrogen 2.665 N/A ILE 146.A N GLY 63.A O no hydrogen 3.107 N/A ILE 147.A N ASN 132.A O no hydrogen 2.950 N/A PHE 149.A N GLU 51.A OE2 no hydrogen 3.431 N/A GLY 150.A N ASP 148.A OD1 no hydrogen 3.282 N/A ALA 152.A N PHE 149.A O no hydrogen 3.153 N/A LYS 153.A N ILE 124.A O no hydrogen 3.077 N/A LYS 153.A NZ GLU 188.A OE1 no hydrogen 2.813 N/A TYR 155.A N ASN 122.A O no hydrogen 3.025 N/A TYR 155.A OH HIS 119.A O no hydrogen 2.609 N/A ARG 156.A NE ASN 122.A OD1 no hydrogen 2.581 N/A ARG 156.A NH2 SER 120.A O no hydrogen 3.409 N/A ARG 156.A NH2 ASN 122.A OD1 no hydrogen 2.986 N/A ASP 157.A N GLN 162.A O no hydrogen 2.908 N/A ARG 159.A N ASP 157.A OD1 no hydrogen 2.686 N/A THR 160.A N ASP 157.A OD1 no hydrogen 3.029 N/A HIS 161.A N ASP 157.A O no hydrogen 2.777 N/A GLN 162.A N THR 160.A OG1 no hydrogen 3.187 N/A HIS 163.A ND1 ILE 164.A O no hydrogen 2.919 N/A ILE 164.A N TYR 155.A O no hydrogen 2.772 N/A LYS 170.A N GLY 186.A O no hydrogen 2.818 N/A LYS 170.A NZ GLU 188.A OE1 no hydrogen 3.022 N/A LYS 170.A NZ GLN 189.A OE1.A no hydrogen 2.983 N/A THR 173.A OG1 GLN 189.A OE1.B no hydrogen 2.679 N/A THR 175.A OG1 ASP 127.A OD1 no hydrogen 2.751 N/A ARG 177.A NH1 TYR 178.A OH no hydrogen 3.102 N/A TYR 178.A N THR 175.A O no hydrogen 3.136 N/A ALA 179.A N ALA 176.A O no hydrogen 3.432 N/A SER 180.A OG THR 183.A OG1 no hydrogen 2.881 N/A SER 180.A OG ASP 193.A OD1 no hydrogen 2.542 N/A ILE 181.A N GLU 196.A OE2 no hydrogen 2.944 N/A THR 183.A N SER 180.A OG no hydrogen 2.990 N/A THR 183.A OG1 SER 180.A OG no hydrogen 2.881 N/A HIS 184.A N SER 180.A O no hydrogen 3.142 N/A LEU 185.A N ILE 181.A O no hydrogen 2.989 N/A GLY 186.A N THR 183.A O no hydrogen 2.995 N/A ILE 187.A N ASN 182.A O no hydrogen 3.010 N/A GLU 188.A N ARG 167.A O no hydrogen 2.847 N/A GLN 189.A NE2.B ARG 126.A O no hydrogen 3.698 N/A SER 190.A N ASP 193.A OD2 no hydrogen 2.846 N/A SER 190.A OG PHE 259.A O no hydrogen 2.659 N/A ARG 191.A NH2 ASP 260.A O no hydrogen 2.991 N/A ARG 192.A NH1 LEU 257.A O no hydrogen 2.892 N/A ASP 193.A N SER 190.A O no hydrogen 3.083 N/A LEU 195.A N ARG 191.A O no hydrogen 3.441 N/A GLU 196.A N ARG 192.A O no hydrogen 2.878 N/A SER 197.A N ASP 193.A O no hydrogen 2.959 N/A SER 197.A OG TYR 178.A O no hydrogen 2.587 N/A SER 197.A OG ASP 193.A O no hydrogen 3.186 N/A LEU 198.A N ASP 194.A O no hydrogen 3.128 N/A GLY 199.A N LEU 195.A O no hydrogen 3.061 N/A TYR 200.A N GLU 196.A O no hydrogen 3.120 N/A TYR 200.A OH GLU 196.A OE2 no hydrogen 2.606 N/A VAL 201.A N SER 197.A O no hydrogen 2.908 N/A LEU 202.A N LEU 198.A O no hydrogen 2.862 N/A MET 203.A N GLY 199.A O no hydrogen 3.144 N/A TYR 204.A N TYR 200.A O no hydrogen 2.832 N/A TYR 204.A OH GLU 89.A OE1 no hydrogen 2.720 N/A TYR 204.A OH GLU 89.A OE2 no hydrogen 2.911 N/A PHE 205.A N VAL 201.A O no hydrogen 3.001 N/A ASN 206.A N LEU 202.A O no hydrogen 3.029 N/A LEU 207.A N MET 203.A O no hydrogen 2.833 N/A GLY 208.A N TYR 204.A O no hydrogen 2.797 N/A LEU 210.A N GLN 213.A OE1 no hydrogen 2.808 N/A TRP 212.A NE1 ARG 177.A O no hydrogen 2.708 N/A GLN 213.A N LEU 210.A O no hydrogen 3.113 N/A ALA 218.A N GLN 222.A OE1 no hydrogen 3.374 N/A GLN 222.A N THR 219.A OG1 no hydrogen 3.148 N/A LYS 223.A N THR 219.A O no hydrogen 2.925 N/A LYS 223.A NZ LEU 215.A O no hydrogen 2.445 N/A TYR 224.A N LYS 220.A O no hydrogen 2.906 N/A GLU 225.A N ARG 221.A O no hydrogen 3.180 N/A ARG 226.A N GLN 222.A O no hydrogen 2.864 N/A ARG 226.A NH1 LYS 216.A O no hydrogen 2.730 N/A ILE 227.A N LYS 223.A O no hydrogen 2.950 N/A SER 228.A N TYR 224.A O no hydrogen 2.843 N/A GLU 229.A N GLU 225.A O no hydrogen 2.968 N/A LYS 230.A N ARG 226.A O no hydrogen 2.985 N/A LYS 231.A N ILE 227.A O no hydrogen 2.896 N/A LYS 231.A NZ ALA 176.A O no hydrogen 2.732 N/A LYS 231.A NZ ARG 177.A O no hydrogen 3.465 N/A LYS 231.A NZ ALA 179.A O no hydrogen 2.579 N/A LYS 231.A NZ HIS 184.A NE2 no hydrogen 2.778 N/A MET 232.A N SER 228.A O no hydrogen 2.953 N/A SER 233.A N GLU 229.A O no hydrogen 3.013 N/A SER 233.A N LYS 230.A O no hydrogen 3.250 N/A SER 233.A OG GLU 229.A O no hydrogen 3.006 N/A SER 233.A OG LYS 230.A O no hydrogen 3.245 N/A THR 234.A N LYS 231.A O no hydrogen 3.357 N/A THR 234.A OG1 LYS 230.A O no hydrogen 2.597 N/A VAL 238.A N PRO 235.A O no hydrogen 3.003 N/A LEU 239.A N PRO 235.A O no hydrogen 2.949 N/A CYS 240.A N ILE 236.A O no hydrogen 2.865 N/A CYS 240.A SG ILE 236.A O no hydrogen 3.396 N/A LYS 241.A N VAL 238.A O no hydrogen 3.280 N/A TYR 243.A N CYS 240.A O no hydrogen 3.078 N/A GLU 246.A N GLU 246.A OE1 no hydrogen 2.849 N/A PHE 247.A N PRO 244.A O no hydrogen 3.212 N/A THR 249.A N SER 245.A O no hydrogen 2.870 N/A THR 249.A OG1 SER 245.A O no hydrogen 3.156 N/A TYR 250.A N GLU 246.A O no hydrogen 2.880 N/A TYR 250.A OH LEU 195.A O no hydrogen 2.711 N/A LEU 251.A N PHE 247.A O no hydrogen 3.158 N/A ASN 252.A N ALA 248.A O no hydrogen 2.874 N/A PHE 253.A N THR 249.A O no hydrogen 2.912 N/A CYS 254.A N TYR 250.A O no hydrogen 3.047 N/A CYS 254.A SG TYR 250.A O no hydrogen 3.309 N/A ARG 255.A N LEU 251.A O no hydrogen 2.940 N/A SER 256.A N ASN 252.A O no hydrogen 3.051 N/A SER 256.A N PHE 253.A O no hydrogen 3.154 N/A SER 256.A OG ASN 252.A O no hydrogen 2.820 N/A LEU 257.A N CYS 254.A O no hydrogen 3.238 N/A ARG 258.A N ASP 261.A OD2 no hydrogen 2.772 N/A ARG 258.A NE ASP 261.A OD1 no hydrogen 2.989 N/A ARG 258.A NE ASP 261.A OD2 no hydrogen 3.292 N/A ARG 258.A NH1 ASP 261.A OD1 no hydrogen 2.922 N/A ASP 261.A N ARG 258.A O no hydrogen 3.093 N/A TYR 265.A OH HIS 119.A ND1 no hydrogen 2.624 N/A TYR 267.A N ASP 264.A OD1 no hydrogen 3.087 N/A LEU 268.A N ASP 264.A O no hydrogen 3.181 N/A ARG 269.A N TYR 265.A O no hydrogen 2.902 N/A ARG 269.A NH1 GLU 116.A OE1 no hydrogen 2.729 N/A ARG 269.A NH2 GLU 116.A OE1 no hydrogen 2.840 N/A GLN 270.A N SER 266.A O no hydrogen 2.840 N/A GLN 270.A NE2 ASN 274.A OD1 no hydrogen 2.705 N/A LEU 271.A N TYR 267.A O no hydrogen 2.911 N/A ARG 273.A N ARG 269.A O no hydrogen 2.875 N/A ASN 274.A N GLN 270.A O no hydrogen 2.804 N/A LEU 275.A N LEU 271.A O no hydrogen 3.272 N/A PHE 276.A N PHE 272.A O no hydrogen 2.765 N/A HIS 277.A N ARG 273.A O no hydrogen 2.929 N/A ARG 278.A N ASN 274.A O no hydrogen 2.930 N/A ARG 278.A NH2 GLU 246.A OE2 no hydrogen 2.522 N/A GLN 279.A N LEU 275.A O no hydrogen 2.978 N/A GLY 280.A N HIS 277.A O no hydrogen 2.902 N/A PHE 281.A N PHE 276.A O no hydrogen 3.150 N/A VAL 286.A N ASP 284.A OD1 no hydrogen 3.007 N/A PHE 287.A N ASN 290.A OD1 no hydrogen 2.921 N/A ASP 288.A N THR 103.A OG1 no hydrogen 2.854 N/A ASN 290.A N PHE 287.A O no hydrogen 2.897 N/A MET 291.A N ASP 288.A O no hydrogen 2.997 N/A LEU 292.A N TRP 289.A O no hydrogen 3.248 N/A