Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ckq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A N ASP 9.A OD2 no hydrogen 3.015 N/A ASP 9.A N ARG 6.A O no hydrogen 2.887 N/A THR 10.A N ASN 18.A O no hydrogen 2.997 N/A TRP 11.A N GLN 228.A O no hydrogen 2.832 N/A LEU 12.A N SER 16.A O no hydrogen 2.818 N/A SER 16.A OG ASP 14.A OD1 no hydrogen 3.339 N/A SER 16.A OG ASP 14.A OD2 no hydrogen 3.213 N/A ASN 18.A N THR 10.A O no hydrogen 2.874 N/A ARG 19.A NE ASP 9.A OD1 no hydrogen 3.526 N/A ARG 19.A NH2 ASP 9.A OD2 no hydrogen 3.103 N/A GLU 26.A N THR 23.A O no hydrogen 3.259 N/A GLU 26.A N THR 23.A OG1 no hydrogen 3.348 N/A LEU 27.A N THR 23.A O no hydrogen 3.226 N/A GLU 28.A N VAL 24.A O no hydrogen 3.419 N/A ALA 30.A N LEU 27.A O no hydrogen 2.959 N/A LYS 31.A N GLU 28.A O no hydrogen 3.418 N/A LYS 31.A NZ LEU 63.A O no hydrogen 2.694 N/A LYS 31.A NZ ASP 65.A OD2 no hydrogen 2.939 N/A ARG 34.A NH2 ALA 30.A O no hydrogen 2.787 N/A THR 35.A N ASP 119.A OD2 no hydrogen 3.369 N/A ILE 36.A N ASP 65.A OD2 no hydrogen 2.705 N/A SER 37.A N ILE 120.A O no hydrogen 2.785 N/A SER 37.A OG GLU 66.A OE2 no hydrogen 2.699 N/A VAL 38.A N GLU 66.A O no hydrogen 3.084 N/A VAL 39.A N VAL 122.A O no hydrogen 2.790 N/A LEU 40.A N ILE 68.A O no hydrogen 2.806 N/A ALA 42.A N LEU 70.A O no hydrogen 3.059 N/A LEU 43.A N GLU 45.A OE1 no hydrogen 3.093 N/A ASP 44.A N SER 74.A OG no hydrogen 2.877 N/A GLU 45.A N THR 78.A OG1 no hydrogen 3.050 N/A THR 48.A N GLU 45.A O no hydrogen 3.109 N/A THR 48.A OG1 GLU 45.A O no hydrogen 3.401 N/A THR 48.A OG1 SER 126.A O no hydrogen 2.850 N/A ILE 49.A N GLU 45.A O no hydrogen 2.976 N/A VAL 52.A N THR 48.A O no hydrogen 3.142 N/A ILE 53.A N ILE 49.A O no hydrogen 2.960 N/A ASP 54.A N GLY 50.A O no hydrogen 3.099 N/A SER 55.A OG VAL 52.A O no hydrogen 2.588 N/A ILE 56.A N ILE 53.A O no hydrogen 2.989 N/A SER 57.A N ILE 53.A O no hydrogen 2.917 N/A SER 57.A OG ILE 53.A O no hydrogen 3.096 N/A LEU 59.A N ILE 56.A O no hydrogen 3.040 N/A VAL 60.A N SER 57.A O no hydrogen 3.132 N/A ASP 61.A N VAL 64.A O no hydrogen 2.954 N/A GLY 62.A N LEU 59.A O no hydrogen 3.282 N/A VAL 64.A N LEU 59.A O no hydrogen 2.931 N/A ASP 65.A N ILE 36.A O no hydrogen 2.998 N/A ILE 68.A N VAL 38.A O no hydrogen 2.825 N/A VAL 69.A N ARG 88.A O no hydrogen 2.914 N/A LEU 70.A N LEU 40.A O no hydrogen 2.931 N/A ASP 71.A N VAL 90.A O no hydrogen 2.832 N/A SER 72.A N ALA 42.A O no hydrogen 2.852 N/A SER 74.A N ASP 71.A OD1 no hydrogen 2.877 N/A SER 74.A OG ALA 42.A O no hydrogen 3.501 N/A SER 74.A OG ASP 71.A OD1 no hydrogen 2.825 N/A THR 75.A N ASP 44.A OD1 no hydrogen 2.777 N/A THR 75.A OG1 ASP 44.A OD1 no hydrogen 3.319 N/A ASP 76.A N ASP 44.A OD1 no hydrogen 3.220 N/A THR 78.A OG1 ASP 76.A OD1 no hydrogen 2.612 N/A THR 78.A OG1 ASP 76.A OD2 no hydrogen 3.333 N/A ARG 81.A N ASP 77.A O no hydrogen 3.179 N/A ARG 81.A NH1 GLU 46.A O no hydrogen 3.175 N/A ALA 82.A N THR 78.A O no hydrogen 2.974 N/A ALA 84.A N ILE 80.A O no hydrogen 3.461 N/A ALA 85.A N ALA 82.A O no hydrogen 3.260 N/A GLY 86.A N VAL 83.A O no hydrogen 2.850 N/A ALA 87.A N ALA 82.A O no hydrogen 3.182 N/A VAL 90.A N VAL 69.A O no hydrogen 2.930 N/A SER 91.A OG GLU 93.A OE1 no hydrogen 2.798 N/A ARG 92.A N ASP 71.A O no hydrogen 3.077 N/A GLU 93.A N GLU 93.A OE1 no hydrogen 2.609 N/A GLN 94.A NE2 SER 91.A OG no hydrogen 2.579 N/A ALA 95.A N SER 91.A O no hydrogen 3.044 N/A VAL 99.A N LEU 96.A O no hydrogen 3.423 N/A ARG 102.A N GLU 107.A OE2 no hydrogen 3.194 N/A LYS 105.A NZ ASP 125.A OD1 no hydrogen 3.382 N/A LYS 105.A NZ GLU 210.A OE2 no hydrogen 2.739 N/A GLY 106.A N GLY 206.A O no hydrogen 3.096 N/A LEU 109.A N LYS 105.A O no hydrogen 3.117 N/A TRP 110.A N GLY 106.A O no hydrogen 3.040 N/A TRP 110.A NE1 PRO 294.A O no hydrogen 2.826 N/A ARG 111.A N GLU 107.A O no hydrogen 2.754 N/A ARG 111.A NE GLU 107.A OE2 no hydrogen 2.813 N/A ARG 111.A NH1 LEU 96.A O no hydrogen 2.684 N/A ARG 111.A NH1 VAL 99.A O no hydrogen 3.482 N/A ARG 111.A NH2 VAL 99.A O no hydrogen 2.636 N/A ARG 111.A NH2 GLU 107.A OE2 no hydrogen 3.058 N/A SER 112.A N ALA 108.A O no hydrogen 3.033 N/A SER 112.A OG LEU 109.A O no hydrogen 2.591 N/A LEU 113.A N TRP 110.A O no hydrogen 3.241 N/A ALA 114.A N ARG 111.A O no hydrogen 3.156 N/A ALA 115.A N ARG 111.A O no hydrogen 3.256 N/A SER 116.A N SER 112.A O no hydrogen 2.859 N/A SER 116.A OG SER 112.A O no hydrogen 2.843 N/A SER 116.A OG LEU 113.A O no hydrogen 3.381 N/A ARG 117.A N GLU 66.A OE2 no hydrogen 2.743 N/A GLY 118.A N SER 37.A OG no hydrogen 2.832 N/A ASP 119.A N THR 35.A OG1 no hydrogen 2.954 N/A ILE 120.A N THR 35.A O no hydrogen 2.750 N/A VAL 121.A N ALA 193.A O no hydrogen 2.883 N/A VAL 122.A N SER 37.A O no hydrogen 2.783 N/A PHE 123.A N TYR 191.A O no hydrogen 2.763 N/A VAL 124.A N VAL 39.A O no hydrogen 3.181 N/A ASP 125.A N GLU 190.A OE2 no hydrogen 3.135 N/A SER 126.A OG PRO 41.A O no hydrogen 2.740 N/A ILE 129.A N GLU 235.A O no hydrogen 2.961 N/A MET 134.A N HIS 132.A ND1 no hydrogen 3.130 N/A PHE 135.A N HIS 132.A O no hydrogen 2.985 N/A TRP 138.A N MET 134.A O no hydrogen 3.096 N/A LEU 139.A N PHE 135.A O no hydrogen 3.258 N/A VAL 140.A N VAL 136.A O no hydrogen 3.115 N/A GLY 141.A N PRO 137.A O no hydrogen 3.174 N/A LEU 143.A N VAL 140.A O no hydrogen 2.973 N/A LEU 144.A N VAL 140.A O no hydrogen 3.192 N/A THR 145.A OG1 GLY 141.A O no hydrogen 3.363 N/A HIS 150.A N ALA 225.A O no hydrogen 2.839 N/A HIS 150.A ND1 THR 194.A OG1 no hydrogen 2.783 N/A LEU 151.A N ALA 225.A O no hydrogen 2.988 N/A VAL 152.A N ALA 192.A O no hydrogen 2.781 N/A LYS 153.A N ALA 227.A O no hydrogen 2.765 N/A LYS 153.A NZ PRO 186.A O no hydrogen 3.176 N/A LYS 153.A NZ GLY 188.A O no hydrogen 3.103 N/A SER 154.A OG GLU 190.A O no hydrogen 2.586 N/A PHE 155.A N VAL 229.A O no hydrogen 3.105 N/A LEU 167.A N ARG 163.A O no hydrogen 2.820 N/A VAL 168.A N VAL 164.A O no hydrogen 2.942 N/A ALA 169.A N VAL 164.A O no hydrogen 3.035 N/A ARG 170.A N THR 165.A O no hydrogen 2.996 N/A ARG 170.A NE ILE 183.A O no hydrogen 3.060 N/A LEU 172.A N VAL 168.A O no hydrogen 3.100 N/A LEU 173.A N ALA 169.A O no hydrogen 2.883 N/A ALA 174.A N ARG 170.A O no hydrogen 2.984 N/A ALA 175.A N PRO 171.A O no hydrogen 2.984 N/A LEU 176.A N LEU 172.A O no hydrogen 2.866 N/A LEU 176.A N LEU 173.A O no hydrogen 3.174 N/A ARG 177.A N LEU 173.A O no hydrogen 2.711 N/A ARG 177.A NE ASP 219.A OD1 no hydrogen 2.974 N/A ARG 177.A NH1 LEU 176.A O no hydrogen 3.443 N/A ARG 177.A NH2 ASP 219.A OD2 no hydrogen 3.424 N/A LEU 180.A N ARG 177.A O no hydrogen 3.012 N/A GLY 181.A N PRO 178.A O no hydrogen 3.127 N/A CYS 182.A SG GLU 179.A O no hydrogen 3.420 N/A ILE 183.A N LEU 180.A O no hydrogen 3.278 N/A LEU 184.A N GLN 228.A OE1 no hydrogen 2.872 N/A GLN 185.A NE2 TYR 156.A O no hydrogen 3.482 N/A GLY 188.A N GLN 185.A O no hydrogen 3.370 N/A TYR 191.A N PHE 123.A O no hydrogen 3.040 N/A TYR 191.A OH GLU 210.A OE2 no hydrogen 2.740 N/A ALA 192.A N VAL 152.A O no hydrogen 3.113 N/A ALA 193.A N VAL 121.A O no hydrogen 2.957 N/A THR 194.A N HIS 150.A O no hydrogen 3.188 N/A THR 194.A OG1 HIS 150.A ND1 no hydrogen 2.783 N/A ARG 195.A N ASP 119.A O no hydrogen 2.829 N/A ARG 195.A NE GLY 118.A O no hydrogen 2.651 N/A ARG 195.A NH1 LEU 113.A O no hydrogen 2.854 N/A ARG 195.A NH2 SER 116.A OG no hydrogen 2.806 N/A ARG 195.A NH2 GLY 118.A O no hydrogen 2.890 N/A LEU 197.A N THR 194.A O no hydrogen 3.097 N/A LEU 197.A N THR 194.A OG1 no hydrogen 3.417 N/A LEU 198.A N THR 194.A O no hydrogen 2.985 N/A THR 199.A N ARG 195.A O no hydrogen 2.957 N/A THR 199.A OG1 ARG 195.A O no hydrogen 2.652 N/A SER 200.A N LEU 197.A O no hydrogen 3.050 N/A SER 200.A OG.A GLU 196.A O no hydrogen 2.987 N/A SER 200.A OG.A LEU 197.A O no hydrogen 2.683 N/A SER 200.A OG.B GLU 196.A O no hydrogen 2.953 N/A PHE 203.A N ARG 293.A O no hydrogen 2.817 N/A GLY 208.A N PRO 205.A O no hydrogen 3.078 N/A GLY 212.A N GLY 208.A O no hydrogen 2.986 N/A LEU 213.A N VAL 209.A O no hydrogen 3.030 N/A LEU 214.A N GLU 210.A O no hydrogen 2.976 N/A VAL 215.A N ILE 211.A O no hydrogen 3.136 N/A ASP 216.A N GLY 212.A O no hydrogen 2.904 N/A THR 217.A N LEU 213.A O no hydrogen 2.839 N/A THR 217.A OG1 LEU 213.A O no hydrogen 2.654 N/A PHE 218.A N LEU 214.A O no hydrogen 2.990 N/A ASP 219.A N VAL 215.A O no hydrogen 2.786 N/A ARG 220.A N ASP 216.A O no hydrogen 3.154 N/A ARG 220.A NH1 SER 200.A O no hydrogen 2.844 N/A LEU 221.A N THR 217.A O no hydrogen 2.846 N/A GLY 222.A N PHE 218.A O no hydrogen 2.867 N/A ALA 225.A N GLY 222.A O no hydrogen 3.501 N/A ILE 226.A N LEU 223.A O no hydrogen 3.130 N/A ALA 227.A N LEU 151.A O no hydrogen 2.943 N/A GLN 228.A N TRP 11.A O no hydrogen 3.127 N/A GLN 228.A NE2 CYS 182.A O no hydrogen 2.818 N/A VAL 229.A N LYS 153.A O no hydrogen 2.860 N/A ASN 230.A N ASP 9.A O no hydrogen 3.284 N/A ASN 230.A ND2 THR 5.A OG1 no hydrogen 3.386 N/A LEU 231.A N PHE 155.A O no hydrogen 3.102 N/A ARG 234.A N ARG 157.A O no hydrogen 3.290 N/A ARG 237.A N ASP 127.A OD2 no hydrogen 3.483 N/A LEU 244.A N PRO 240.A O no hydrogen 3.249 N/A GLY 245.A N LEU 241.A O no hydrogen 3.131 N/A MET 247.A N GLU 243.A O no hydrogen 3.057 N/A SER 248.A N LEU 244.A O no hydrogen 2.940 N/A SER 248.A OG.B LEU 244.A O no hydrogen 2.687 N/A ARG 249.A N GLY 245.A O no hydrogen 3.096 N/A ARG 249.A NE VAL 266.A O no hydrogen 2.916 N/A ARG 249.A NH1 ARG 249.A O no hydrogen 3.318 N/A ARG 249.A NH1 ASP 263.A OD1 no hydrogen 3.371 N/A ARG 249.A NH1 ASP 263.A OD2 no hydrogen 2.821 N/A ARG 249.A NH2 ASP 263.A OD1 no hydrogen 2.777 N/A ARG 249.A NH2 VAL 266.A O no hydrogen 2.729 N/A GLN 250.A N ALA 246.A O no hydrogen 3.143 N/A GLN 250.A NE2 THR 254.A OG1 no hydrogen 3.043 N/A GLN 250.A NE2 SER 289.A O no hydrogen 3.045 N/A VAL 251.A N MET 247.A O no hydrogen 2.850 N/A ILE 252.A N SER 248.A O no hydrogen 2.812 N/A ALA 253.A N ARG 249.A O no hydrogen 2.887 N/A THR 254.A N GLN 250.A O no hydrogen 2.853 N/A THR 254.A OG1 GLN 250.A O no hydrogen 3.103 N/A LEU 255.A N VAL 251.A O no hydrogen 2.869 N/A LEU 256.A N ILE 252.A O no hydrogen 2.748 N/A SER 257.A N ALA 253.A O no hydrogen 3.042 N/A SER 257.A OG.A ALA 253.A O no hydrogen 2.906 N/A SER 257.A OG.B ALA 253.A O no hydrogen 3.235 N/A SER 257.A OG.B THR 254.A O no hydrogen 2.612 N/A ARG 258.A N THR 254.A O no hydrogen 3.120 N/A ARG 258.A NE ASP 216.A OD2 no hydrogen 2.827 N/A ARG 258.A NH1 ASP 292.A OD1 no hydrogen 3.181 N/A ARG 258.A NH2 ASP 292.A OD1 no hydrogen 3.297 N/A CYS 259.A N LEU 256.A O no hydrogen 3.236 N/A CYS 259.A SG LEU 255.A O no hydrogen 3.332 N/A GLY 260.A N SER 257.A O no hydrogen 3.147 N/A ILE 261.A N LEU 256.A O no hydrogen 2.875 N/A GLY 265.A N ASP 263.A OD1 no hydrogen 2.828 N/A VAL 266.A N SER 264.A OG no hydrogen 3.100 N/A THR 269.A OG1 THR 285.A OG1 no hydrogen 2.740 N/A GLN 270.A N HIS 284.A O no hydrogen 2.617 N/A VAL 272.A N THR 282.A O no hydrogen 3.041 N/A ASP 274.A N SER 280.A O no hydrogen 2.782 N/A GLY 278.A N GLY 275.A O no hydrogen 3.306 N/A SER 280.A OG ASP 274.A OD2 no hydrogen 2.585 N/A THR 282.A N VAL 272.A O no hydrogen 2.789 N/A THR 282.A OG1 ASP 274.A OD1 no hydrogen 2.683 N/A THR 282.A OG1 ASP 274.A OD2 no hydrogen 3.547 N/A HIS 284.A N GLN 270.A O no hydrogen 2.873 N/A THR 285.A OG1 THR 269.A OG1 no hydrogen 2.740 N/A TRP 286.A N LEU 268.A O no hydrogen 3.103 N/A TRP 286.A NE1 GLN 270.A OE1 no hydrogen 2.744 N/A SER 289.A N GLN 250.A OE1 no hydrogen 3.089 N/A ALA 291.A N SER 289.A OG no hydrogen 3.054 N/A ARG 293.A N PHE 203.A O no hydrogen 2.785 N/A ARG 293.A NE GLU 107.A OE1 no hydrogen 2.804 N/A ARG 293.A NH2 PRO 100.A O no hydrogen 2.777 N/A ARG 293.A NH2 GLU 107.A OE1 no hydrogen 3.340 N/A ARG 293.A NH2 GLU 107.A OE2 no hydrogen 2.762 N/A GLN 297.A N THR 199.A O no hydrogen 3.100 N/A GLN 297.A NE2 THR 199.A OG1 no hydrogen 3.035 N/A ALA 298.A N PRO 295.A O no hydrogen 2.743 N/A ILE 299.A N MET 296.A O no hydrogen 2.961 N/A ARG 300.A N MET 296.A O no hydrogen 2.810 N/A ARG 300.A NH2 GLU 98.A OE1 no hydrogen 3.569 N/A ARG 300.A NH2 GLU 98.A OE2 no hydrogen 2.685 N/A