Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xl4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASN 1.A OD1 no hydrogen 2.928 N/A LEU 4.A N ASN 1.A O no hydrogen 3.251 N/A LEU 5.A N GLN 2.A O no hydrogen 3.409 N/A ARG 6.A N LEU 79.A O no hydrogen 3.151 N/A ARG 6.A NE GLU 12.A OE2 no hydrogen 3.329 N/A ARG 6.A NH2 GLU 12.A OE2 no hydrogen 2.671 N/A LEU 8.A N ILE 81.A O no hydrogen 2.794 N/A LYS 9.A N GLU 12.A OE1 no hydrogen 2.723 N/A GLU 12.A N LYS 9.A O no hydrogen 2.976 N/A LYS 14.A N LEU 31.A O no hydrogen 3.021 N/A LYS 15.A NZ GLN 88.A OE1 no hydrogen 2.866 N/A ILE 16.A N LYS 29.A O no hydrogen 2.756 N/A LYS 17.A N LYS 29.A O no hydrogen 3.189 N/A LEU 19.A N VAL 27.A O no hydrogen 2.802 N/A GLY 22.A N GLY 25.A O no hydrogen 3.106 N/A THR 26.A N GLU 47.A O no hydrogen 2.780 N/A VAL 27.A N GLY 20.A O no hydrogen 3.105 N/A TYR 28.A N ILE 45.A O no hydrogen 2.604 N/A TYR 28.A OH GLU 47.A OE1 no hydrogen 3.216 N/A LYS 29.A N LYS 17.A O no hydrogen 2.635 N/A GLY 30.A N VAL 43.A O no hydrogen 2.689 N/A LEU 31.A N LYS 14.A O no hydrogen 2.895 N/A TRP 32.A N ILE 41.A O no hydrogen 2.594 N/A TRP 32.A NE1 GLU 12.A OE2 no hydrogen 3.387 N/A ILE 33.A N GLU 12.A O no hydrogen 2.538 N/A GLU 37.A N PRO 34.A O no hydrogen 3.119 N/A ILE 41.A N TRP 32.A O no hydrogen 2.938 N/A VAL 43.A N GLY 30.A O no hydrogen 2.806 N/A ALA 44.A N MET 91.A O no hydrogen 3.006 N/A ILE 45.A N TYR 28.A O no hydrogen 2.870 N/A LYS 46.A N LEU 89.A O no hydrogen 2.748 N/A GLU 47.A N THR 26.A O no hydrogen 2.701 N/A LEU 48.A N VAL 87.A O no hydrogen 2.977 N/A THR 52.A N SER 85.A O no hydrogen 3.215 N/A THR 52.A OG1 ASN 57.A OD1 no hydrogen 2.422 N/A ALA 56.A N SER 53.A OG no hydrogen 3.199 N/A ASN 57.A N SER 53.A O no hydrogen 2.813 N/A LYS 58.A N PRO 54.A O no hydrogen 2.999 N/A GLU 59.A N LYS 55.A O no hydrogen 3.398 N/A ILE 60.A N ALA 56.A O no hydrogen 3.026 N/A LEU 61.A N ASN 57.A O no hydrogen 2.746 N/A ASP 62.A N LYS 58.A O no hydrogen 2.896 N/A GLU 63.A N GLU 59.A O no hydrogen 3.248 N/A ALA 64.A N ILE 60.A O no hydrogen 2.880 N/A TYR 65.A N LEU 61.A O no hydrogen 2.986 N/A MET 67.A N GLU 63.A O no hydrogen 2.956 N/A ALA 68.A N ALA 64.A O no hydrogen 2.892 N/A SER 69.A N VAL 66.A O no hydrogen 2.899 N/A SER 69.A OG VAL 66.A O no hydrogen 2.525 N/A ASP 71.A N TYR 128.A OH no hydrogen 2.847 N/A HIS 74.A N ASN 72.A OD1 no hydrogen 3.007 N/A VAL 75.A N ASN 72.A O no hydrogen 3.133 N/A CYS 76.A N ILE 154.A O no hydrogen 2.813 N/A ARG 77.A NH1 LEU 4.A O no hydrogen 2.901 N/A ARG 77.A NH1 ALA 68.A O no hydrogen 3.035 N/A LEU 78.A N MET 67.A O no hydrogen 3.220 N/A LEU 79.A N ILE 90.A O no hydrogen 2.980 N/A GLY 80.A N ILE 90.A O no hydrogen 3.045 N/A ILE 81.A N ARG 6.A O no hydrogen 3.008 N/A CYS 82.A N GLN 88.A O no hydrogen 2.679 N/A CYS 82.A SG LEU 8.A O no hydrogen 3.642 N/A THR 84.A OG1 THR 86.A O no hydrogen 2.258 N/A THR 86.A OG1 GLU 47.A OE2 no hydrogen 3.539 N/A GLN 88.A N CYS 82.A O no hydrogen 2.960 N/A LEU 89.A N LYS 46.A O no hydrogen 2.836 N/A ILE 90.A N GLY 80.A O no hydrogen 2.902 N/A MET 91.A N ALA 44.A O no hydrogen 3.011 N/A GLY 97.A N MET 94.A O no hydrogen 2.997 N/A LEU 99.A N VAL 144.A O no hydrogen 2.599 N/A LEU 100.A N ALA 141.A O no hydrogen 3.147 N/A TYR 102.A N CYS 98.A O no hydrogen 3.115 N/A VAL 103.A N LEU 99.A O no hydrogen 3.019 N/A ARG 104.A N LEU 100.A O no hydrogen 3.189 N/A ARG 104.A NE GLY 197.A O no hydrogen 2.837 N/A ARG 104.A NH2 GLY 197.A O no hydrogen 3.075 N/A GLU 105.A N ASP 101.A O no hydrogen 2.806 N/A HIS 106.A N TYR 102.A O no hydrogen 2.873 N/A HIS 106.A ND1 TYR 102.A O no hydrogen 2.981 N/A LYS 107.A N ARG 104.A O no hydrogen 3.397 N/A LYS 107.A NZ ASP 108.A OD1 no hydrogen 3.194 N/A ASN 109.A N HIS 106.A O no hydrogen 2.712 N/A SER 112.A N ASP 270.A OD1 no hydrogen 3.167 N/A SER 112.A OG ASP 270.A OD2 no hydrogen 2.640 N/A GLN 113.A NE2 GLN 113.A O no hydrogen 3.570 N/A GLN 113.A NE2 ASN 117.A OD1 no hydrogen 2.917 N/A GLN 113.A NE2 ALA 258.A O no hydrogen 2.886 N/A LEU 115.A N GLY 111.A O no hydrogen 3.357 N/A LEU 116.A N SER 112.A O no hydrogen 3.083 N/A ASN 117.A N GLN 113.A O no hydrogen 3.081 N/A TRP 118.A N TYR 114.A O no hydrogen 2.882 N/A TRP 118.A NE1 PRO 149.A O no hydrogen 2.949 N/A CYS 119.A N LEU 115.A O no hydrogen 3.167 N/A CYS 119.A SG LEU 115.A O no hydrogen 3.254 N/A VAL 120.A N LEU 116.A O no hydrogen 3.127 N/A GLN 121.A N ASN 117.A O no hydrogen 2.954 N/A GLN 121.A NE2 GLN 150.A O no hydrogen 2.916 N/A ILE 122.A N TRP 118.A O no hydrogen 2.931 N/A ALA 123.A N CYS 119.A O no hydrogen 3.123 N/A LYS 124.A N VAL 120.A O no hydrogen 2.801 N/A GLY 125.A N GLN 121.A O no hydrogen 2.938 N/A MET 126.A N ILE 122.A O no hydrogen 2.900 N/A ASN 127.A N ALA 123.A O no hydrogen 2.807 N/A TYR 128.A N LYS 124.A O no hydrogen 2.955 N/A LEU 129.A N GLY 125.A O no hydrogen 3.059 N/A GLU 130.A N MET 126.A O no hydrogen 2.912 N/A ASP 131.A N ASN 127.A O no hydrogen 2.906 N/A ARG 132.A N TYR 128.A O no hydrogen 2.893 N/A ARG 132.A NH1 SER 69.A O no hydrogen 3.124 N/A ARG 132.A NH1 TYR 128.A OH no hydrogen 2.801 N/A ARG 132.A NH2 SER 69.A OG no hydrogen 2.940 N/A ARG 133.A N GLU 130.A O no hydrogen 2.709 N/A LEU 134.A N LEU 129.A O no hydrogen 2.779 N/A HIS 136.A N ASP 182.A OD2 no hydrogen 3.003 N/A ARG 137.A N ASP 182.A OD1 no hydrogen 3.211 N/A ASP 138.A N HIS 136.A ND1 no hydrogen 3.100 N/A ALA 141.A N GLU 192.A OE1 no hydrogen 2.934 N/A ARG 142.A NH1 ASP 138.A OD2 no hydrogen 3.344 N/A ASN 143.A N ALA 140.A O no hydrogen 2.879 N/A ASN 143.A ND2 ASP 138.A O no hydrogen 2.752 N/A ASN 143.A ND2 ASP 138.A OD2 no hydrogen 3.180 N/A VAL 144.A N ALA 141.A O no hydrogen 3.385 N/A LEU 145.A N LYS 153.A O no hydrogen 2.666 N/A VAL 146.A N GLY 97.A O no hydrogen 2.760 N/A LYS 147.A N HIS 151.A O no hydrogen 2.856 N/A LYS 147.A NZ ASP 289.A OD1 no hydrogen 2.788 N/A LYS 147.A NZ GLU 291.A OE1 no hydrogen 3.127 N/A THR 148.A N HIS 151.A O no hydrogen 3.115 N/A THR 148.A OG1 GLN 150.A OE1 no hydrogen 3.498 N/A GLN 150.A N THR 148.A OG1 no hydrogen 3.263 N/A GLN 150.A NE2 TYR 114.A OH no hydrogen 2.956 N/A HIS 151.A N THR 148.A O no hydrogen 2.858 N/A HIS 151.A ND1 ASP 289.A OD2 no hydrogen 2.560 N/A HIS 151.A NE2 PRO 73.A O no hydrogen 2.503 N/A VAL 152.A N GLN 121.A OE1 no hydrogen 2.854 N/A LYS 153.A N LEU 145.A O no hydrogen 2.769 N/A LYS 153.A NZ GLU 291.A OE1 no hydrogen 3.213 N/A ILE 154.A N HIS 74.A O no hydrogen 2.994 N/A THR 155.A N ASN 143.A O no hydrogen 2.974 N/A GLY 158.A N HIS 136.A O no hydrogen 3.123 N/A ILE 164.A N VAL 162.A O no hydrogen 2.820 N/A LYS 165.A NZ TYR 201.A O no hydrogen 2.766 N/A LYS 165.A NZ ILE 204.A O no hydrogen 2.688 N/A TRP 166.A N PRO 163.A O no hydrogen 2.942 N/A TRP 166.A NE1 GLU 192.A OE1 no hydrogen 2.729 N/A MET 167.A N ILE 164.A O no hydrogen 3.056 N/A GLU 170.A N GLU 170.A OE2 no hydrogen 2.774 N/A SER 171.A OG ILE 176.A O no hydrogen 2.489 N/A ILE 172.A N ALA 168.A O no hydrogen 3.035 N/A LEU 173.A N LEU 169.A O no hydrogen 2.945 N/A HIS 174.A N GLU 170.A O no hydrogen 2.922 N/A ARG 175.A N SER 171.A O no hydrogen 2.904 N/A ILE 176.A N GLU 170.A O no hydrogen 3.517 N/A THR 178.A N SER 181.A OG no hydrogen 2.749 N/A GLN 180.A N THR 178.A OG1 no hydrogen 3.091 N/A GLN 180.A NE2 ALA 241.A O no hydrogen 2.967 N/A GLN 180.A NE2 ARG 244.A O no hydrogen 3.225 N/A GLN 180.A NE2 PRO 245.A O no hydrogen 3.474 N/A SER 181.A N THR 178.A OG1 no hydrogen 3.249 N/A SER 181.A OG THR 178.A O no hydrogen 2.684 N/A ASP 182.A N THR 178.A O no hydrogen 3.133 N/A VAL 183.A N HIS 179.A O no hydrogen 3.024 N/A TRP 184.A N GLN 180.A O no hydrogen 3.286 N/A SER 185.A N SER 181.A O no hydrogen 3.218 N/A SER 185.A OG TRP 166.A O no hydrogen 2.580 N/A SER 185.A OG SER 181.A O no hydrogen 3.373 N/A TYR 186.A N ASP 182.A O no hydrogen 2.763 N/A TYR 186.A OH CYS 119.A O no hydrogen 2.655 N/A GLY 187.A N VAL 183.A O no hydrogen 3.018 N/A VAL 188.A N TRP 184.A O no hydrogen 3.174 N/A THR 189.A N SER 185.A O no hydrogen 2.842 N/A THR 189.A OG1 SER 185.A O no hydrogen 2.837 N/A VAL 190.A N TYR 186.A O no hydrogen 2.911 N/A TRP 191.A N GLY 187.A O no hydrogen 3.005 N/A TRP 191.A NE1 PRO 220.A O no hydrogen 2.816 N/A GLU 192.A N VAL 188.A O no hydrogen 2.858 N/A LEU 193.A N THR 189.A O no hydrogen 3.092 N/A MET 194.A N VAL 190.A O no hydrogen 2.883 N/A THR 195.A N TRP 191.A O no hydrogen 2.970 N/A THR 195.A OG1 TRP 191.A O no hydrogen 2.819 N/A THR 195.A OG1 GLU 192.A O no hydrogen 3.149 N/A PHE 196.A N LEU 193.A O no hydrogen 2.992 N/A GLY 197.A N GLU 192.A O no hydrogen 2.660 N/A SER 198.A N THR 195.A OG1 no hydrogen 3.284 N/A SER 198.A OG THR 195.A O no hydrogen 3.227 N/A ILE 204.A N TYR 201.A O no hydrogen 3.101 N/A GLU 208.A N PRO 205.A O no hydrogen 3.091 N/A ILE 209.A N ALA 206.A O no hydrogen 3.181 N/A SER 211.A N GLU 208.A O no hydrogen 3.178 N/A ILE 212.A N GLU 208.A O no hydrogen 3.251 N/A LEU 213.A N ILE 209.A O no hydrogen 3.113 N/A GLU 214.A N SER 210.A O no hydrogen 3.344 N/A LYS 215.A N SER 211.A O no hydrogen 3.293 N/A LYS 215.A NZ SER 211.A O no hydrogen 3.424 N/A GLY 216.A N LEU 213.A O no hydrogen 3.065 N/A GLU 217.A N ILE 212.A O no hydrogen 3.022 N/A ARG 218.A NE TRP 237.A O no hydrogen 2.808 N/A ARG 218.A NH1 LEU 213.A O no hydrogen 2.934 N/A ARG 218.A NH1 GLU 217.A O no hydrogen 2.876 N/A ARG 218.A NH2 TRP 237.A O no hydrogen 2.847 N/A GLN 221.A NE2 CYS 225.A O no hydrogen 2.951 N/A CYS 225.A N PRO 222.A O no hydrogen 2.975 N/A THR 226.A N TYR 264.A O no hydrogen 3.250 N/A THR 226.A OG1 TYR 264.A O no hydrogen 2.700 N/A VAL 229.A N THR 226.A O no hydrogen 3.202 N/A TYR 230.A N THR 226.A O no hydrogen 3.176 N/A TYR 230.A OH LEU 219.A O no hydrogen 2.518 N/A MET 231.A N ILE 227.A O no hydrogen 2.799 N/A MET 233.A N VAL 229.A O no hydrogen 3.173 N/A ARG 234.A N TYR 230.A O no hydrogen 2.868 N/A ARG 234.A NH2 TYR 230.A OH no hydrogen 3.175 N/A LYS 235.A N MET 231.A O no hydrogen 3.000 N/A CYS 236.A N ILE 232.A O no hydrogen 3.183 N/A CYS 236.A SG ILE 232.A O no hydrogen 3.407 N/A TRP 237.A N ARG 234.A O no hydrogen 3.055 N/A TRP 237.A NE1 TRP 184.A O no hydrogen 3.136 N/A SER 243.A N ASP 240.A O no hydrogen 2.992 N/A SER 243.A OG ASP 240.A OD2 no hydrogen 2.587 N/A ARG 244.A N ALA 241.A O no hydrogen 3.293 N/A ARG 244.A NE MET 238.A O no hydrogen 2.836 N/A ARG 244.A NH1 GLU 170.A OE1 no hydrogen 2.690 N/A ARG 244.A NH1 GLN 180.A O no hydrogen 2.893 N/A ARG 244.A NH2 GLU 170.A OE1 no hydrogen 3.156 N/A ARG 244.A NH2 GLU 170.A OE2 no hydrogen 2.594 N/A ARG 244.A NH2 MET 238.A O no hydrogen 3.168 N/A LYS 246.A N GLU 249.A OE1 no hydrogen 2.989 N/A LYS 246.A NZ GLU 130.A OE2 no hydrogen 3.073 N/A LYS 246.A NZ GLN 180.A OE1 no hydrogen 2.402 N/A LEU 250.A N LYS 246.A O no hydrogen 2.996 N/A ILE 251.A N PHE 247.A O no hydrogen 2.786 N/A ILE 252.A N ARG 248.A O no hydrogen 3.260 N/A GLU 253.A N GLU 249.A O no hydrogen 2.979 N/A PHE 254.A N LEU 250.A O no hydrogen 3.030 N/A SER 255.A N ILE 251.A O no hydrogen 2.962 N/A SER 255.A OG ILE 251.A O no hydrogen 2.534 N/A LYS 256.A N ILE 252.A O no hydrogen 3.165 N/A MET 257.A N GLU 253.A O no hydrogen 3.225 N/A ALA 258.A N PHE 254.A O no hydrogen 2.826 N/A ARG 259.A N SER 255.A O no hydrogen 3.200 N/A ASP 260.A N MET 257.A O no hydrogen 3.139 N/A ARG 263.A N ASP 260.A O no hydrogen 3.195 N/A TYR 264.A N PRO 261.A O no hydrogen 3.133 N/A LEU 265.A N PRO 261.A O no hydrogen 3.124 N/A VAL 266.A N ILE 224.A O no hydrogen 2.621 N/A ASP 270.A N ILE 267.A O no hydrogen 3.137 N/A ARG 272.A N GLY 269.A O no hydrogen 3.092 N/A MET 273.A N GLY 269.A O no hydrogen 3.429 N/A ASP 280.A N SER 277.A OG no hydrogen 3.037 N/A SER 281.A N SER 277.A O no hydrogen 2.905 N/A ASN 282.A N PRO 278.A O no hydrogen 2.868 N/A PHE 283.A N THR 279.A O no hydrogen 3.161 N/A TYR 284.A N ASP 280.A O no hydrogen 3.007 N/A ARG 285.A N SER 281.A O no hydrogen 3.083 N/A ALA 286.A N ASN 282.A O no hydrogen 3.004 N/A LEU 287.A N PHE 283.A O no hydrogen 3.105 N/A LEU 287.A N TYR 284.A O no hydrogen 3.287 N/A MET 288.A N TYR 284.A O no hydrogen 3.000 N/A ASP 289.A N ARG 285.A O no hydrogen 3.145 N/A