Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wkq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 163.A OE2 no hydrogen 2.512 N/A MET 2.A N GLU 163.A OE2 no hydrogen 2.898 N/A ASN 7.A ND2 TYR 63.A OH no hydrogen 3.006 N/A ASN 7.A ND2 SER 67.A OG no hydrogen 2.918 N/A ALA 9.A N ASN 7.A OD1 no hydrogen 3.092 N/A LEU 14.A N ILE 79.A O no hydrogen 2.776 N/A LYS 15.A N GLU 18.A OE1 no hydrogen 2.957 N/A GLU 18.A N LYS 15.A O no hydrogen 3.021 N/A PHE 19.A N GLU 16.A O no hydrogen 3.396 N/A LYS 20.A N LEU 34.A O no hydrogen 2.875 N/A ILE 22.A N LYS 32.A O no hydrogen 2.965 N/A LYS 23.A N LYS 32.A O no hydrogen 3.520 N/A LEU 25.A N VAL 30.A O no hydrogen 2.795 N/A VAL 30.A N GLY 26.A O no hydrogen 3.128 N/A TYR 31.A N ILE 48.A O no hydrogen 2.920 N/A LYS 32.A N LYS 23.A O no hydrogen 2.863 N/A GLY 33.A N VAL 46.A O no hydrogen 2.897 N/A LEU 34.A N LYS 20.A O no hydrogen 2.838 N/A TRP 35.A N ILE 44.A O no hydrogen 2.765 N/A TRP 35.A NE1 GLU 18.A OE2 no hydrogen 2.727 N/A ILE 36.A N GLU 18.A O no hydrogen 2.751 N/A LYS 43.A N ASP 285.A O no hydrogen 2.984 N/A ILE 44.A N TRP 35.A O no hydrogen 2.828 N/A VAL 46.A N GLY 33.A O no hydrogen 2.927 N/A ALA 47.A N THR 89.A O no hydrogen 2.786 N/A ILE 48.A N TYR 31.A O no hydrogen 2.840 N/A LYS 49.A N LEU 87.A O no hydrogen 2.761 N/A LYS 49.A NZ GLU 61.A OE2 no hydrogen 2.777 N/A GLU 50.A N THR 29.A O no hydrogen 2.876 N/A ALA 54.A N SER 51.A O no hydrogen 3.111 N/A ILE 58.A N ALA 54.A O no hydrogen 3.219 N/A LEU 59.A N ASN 55.A O no hydrogen 3.049 N/A ASP 60.A N LYS 56.A O no hydrogen 3.075 N/A GLU 61.A N GLU 57.A O no hydrogen 3.032 N/A ALA 62.A N ILE 58.A O no hydrogen 2.928 N/A TYR 63.A N LEU 59.A O no hydrogen 2.984 N/A VAL 64.A N ASP 60.A O no hydrogen 3.117 N/A MET 65.A N GLU 61.A O no hydrogen 3.000 N/A ALA 66.A N ALA 62.A O no hydrogen 2.807 N/A SER 67.A N VAL 64.A O no hydrogen 2.904 N/A SER 67.A OG TYR 63.A O no hydrogen 2.781 N/A ASP 69.A N TYR 125.A OH no hydrogen 2.838 N/A HIS 72.A N ASN 70.A OD1 no hydrogen 3.013 N/A HIS 72.A ND1 VAL 149.A O no hydrogen 3.037 N/A VAL 73.A N ASN 70.A O no hydrogen 3.156 N/A CYS 74.A N ILE 151.A O no hydrogen 2.820 N/A CYS 74.A SG ILE 151.A O no hydrogen 3.639 N/A ARG 75.A NE VAL 68.A O no hydrogen 2.988 N/A ARG 75.A NH2 VAL 68.A O no hydrogen 3.055 N/A LEU 76.A N MET 65.A O no hydrogen 3.142 N/A LEU 77.A N ILE 88.A O no hydrogen 2.874 N/A GLY 78.A N ILE 88.A O no hydrogen 3.442 N/A ILE 79.A N ARG 12.A O no hydrogen 2.892 N/A CYS 80.A N GLN 86.A O no hydrogen 2.885 N/A CYS 80.A SG.A LEU 14.A O no hydrogen 3.541 N/A CYS 80.A SG.A GLN 86.A OE1 no hydrogen 3.454 N/A CYS 80.A SG.B LEU 14.A O no hydrogen 3.291 N/A THR 82.A OG1 THR 84.A O no hydrogen 2.298 N/A THR 82.A OG1 GLN 86.A OE1 no hydrogen 3.271 N/A GLN 86.A N CYS 80.A O no hydrogen 2.919 N/A GLN 86.A NE2 GLU 16.A OE1 no hydrogen 3.487 N/A LEU 87.A N LYS 49.A O no hydrogen 2.904 N/A ILE 88.A N GLY 78.A O no hydrogen 3.004 N/A THR 89.A N ALA 47.A O no hydrogen 2.928 N/A THR 89.A OG1 ARG 75.A O no hydrogen 2.735 N/A GLN 90.A NE2 ASP 288.A OD1 no hydrogen 3.214 N/A GLN 90.A NE2 ASP 290.A OD2 no hydrogen 3.163 N/A LEU 91.A N PRO 45.A O no hydrogen 3.051 N/A PHE 94.A N VAL 143.A O no hydrogen 3.193 N/A GLY 95.A N MET 92.A O no hydrogen 2.953 N/A LEU 97.A N ALA 138.A O no hydrogen 3.333 N/A VAL 100.A N LEU 96.A O no hydrogen 2.826 N/A ARG 101.A N LEU 97.A O no hydrogen 3.162 N/A ARG 101.A NE GLY 209.A O no hydrogen 2.795 N/A ARG 101.A NH2 GLY 209.A O no hydrogen 3.011 N/A GLU 102.A N ASP 98.A O no hydrogen 2.847 N/A HIS 103.A N TYR 99.A O no hydrogen 2.977 N/A HIS 103.A ND1 TYR 99.A O no hydrogen 3.034 N/A ASN 106.A N HIS 103.A O no hydrogen 2.851 N/A SER 109.A N ASP 282.A OD1 no hydrogen 2.900 N/A SER 109.A OG ASP 282.A OD1 no hydrogen 3.418 N/A SER 109.A OG ASP 282.A OD2 no hydrogen 2.493 N/A GLN 110.A NE2 ALA 270.A O no hydrogen 3.102 N/A TYR 111.A OH GLN 147.A OE1 no hydrogen 2.755 N/A LEU 112.A N GLY 108.A O no hydrogen 3.252 N/A LEU 113.A N SER 109.A O no hydrogen 3.001 N/A ASN 114.A N GLN 110.A O no hydrogen 3.005 N/A TRP 115.A N TYR 111.A O no hydrogen 2.846 N/A TRP 115.A NE1 PRO 146.A O no hydrogen 2.833 N/A CYS 116.A N LEU 112.A O no hydrogen 3.137 N/A CYS 116.A SG LEU 112.A O no hydrogen 3.336 N/A VAL 117.A N LEU 113.A O no hydrogen 3.015 N/A GLN 118.A N ASN 114.A O no hydrogen 3.020 N/A GLN 118.A NE2 GLN 147.A O no hydrogen 2.841 N/A ILE 119.A N TRP 115.A O no hydrogen 2.903 N/A ALA 120.A N CYS 116.A O no hydrogen 3.104 N/A LYS 121.A N VAL 117.A O no hydrogen 2.843 N/A GLY 122.A N GLN 118.A O no hydrogen 3.015 N/A MET 123.A N ILE 119.A O no hydrogen 2.920 N/A ASN 124.A N ALA 120.A O no hydrogen 2.797 N/A TYR 125.A N LYS 121.A O no hydrogen 3.021 N/A LEU 126.A N GLY 122.A O no hydrogen 3.037 N/A GLU 127.A N MET 123.A O no hydrogen 2.882 N/A ASP 128.A N ASN 124.A O no hydrogen 2.885 N/A ARG 129.A N TYR 125.A O no hydrogen 2.983 N/A ARG 129.A NH2 SER 67.A O no hydrogen 3.139 N/A ARG 130.A N GLU 127.A O no hydrogen 2.912 N/A LEU 131.A N LEU 126.A O no hydrogen 2.994 N/A VAL 132.A N LYS 158.A O no hydrogen 2.850 N/A HIS 133.A N ASP 194.A OD2 no hydrogen 2.768 N/A HIS 133.A NE2 THR 152.A O no hydrogen 2.842 N/A ARG 134.A N ASP 194.A OD1 no hydrogen 2.966 N/A ARG 134.A NH1 LEU 156.A O no hydrogen 2.820 N/A ASP 135.A N HIS 133.A ND1 no hydrogen 2.969 N/A ALA 138.A N GLU 204.A OE2 no hydrogen 2.853 N/A ARG 139.A NH1 ASP 135.A OD1 no hydrogen 2.892 N/A ASN 140.A N ALA 137.A O no hydrogen 2.963 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.672 N/A VAL 141.A N ALA 138.A O no hydrogen 3.234 N/A LEU 142.A N LYS 150.A O no hydrogen 2.748 N/A VAL 143.A N GLY 95.A O no hydrogen 2.720 N/A LYS 144.A N HIS 148.A O no hydrogen 2.899 N/A LYS 144.A NZ ASP 288.A OD2 no hydrogen 3.400 N/A LYS 144.A NZ ASP 290.A OD2 no hydrogen 2.830 N/A THR 145.A N HIS 148.A O no hydrogen 3.279 N/A GLN 147.A N THR 145.A OG1 no hydrogen 3.127 N/A HIS 148.A N THR 145.A O no hydrogen 2.870 N/A HIS 148.A NE2 PRO 71.A O no hydrogen 2.658 N/A VAL 149.A N GLN 118.A OE1 no hydrogen 2.868 N/A LYS 150.A N LEU 142.A O no hydrogen 2.881 N/A LYS 150.A NZ GLN 90.A OE1 no hydrogen 2.810 N/A LYS 150.A NZ ASP 290.A OD1 no hydrogen 3.026 N/A LYS 150.A NZ ASP 290.A OD2 no hydrogen 3.043 N/A ILE 151.A N HIS 72.A O no hydrogen 2.948 N/A THR 152.A N ASN 140.A O no hydrogen 3.001 N/A GLY 155.A N ASP 153.A OD1.A no hydrogen 3.118 N/A ALA 157.A N PHE 154.A O no hydrogen 3.104 N/A LYS 158.A N VAL 132.A O no hydrogen 2.920 N/A LEU 160.A N ARG 130.A O no hydrogen 2.754 N/A GLY 161.A N GLU 164.A OE1 no hydrogen 2.864 N/A ALA 162.A N GLU 4.A OE2 no hydrogen 2.755 N/A GLU 164.A N GLY 161.A O no hydrogen 3.147 N/A TYR 167.A N TYR 189.A O no hydrogen 2.783 N/A ALA 169.A N ARG 187.A O no hydrogen 2.889 N/A LYS 177.A NZ TYR 213.A O no hydrogen 3.363 N/A LYS 177.A NZ ILE 216.A O no hydrogen 2.815 N/A TRP 178.A N PRO 175.A O no hydrogen 3.205 N/A TRP 178.A NE1 GLU 204.A OE2 no hydrogen 2.891 N/A MET 179.A N ILE 176.A O no hydrogen 3.190 N/A GLU 182.A N GLU 182.A OE2 no hydrogen 2.811 N/A SER 183.A N ALA 180.A O no hydrogen 2.902 N/A SER 183.A OG ILE 188.A O no hydrogen 2.586 N/A ILE 184.A N ALA 180.A O no hydrogen 3.101 N/A LEU 185.A N LEU 181.A O no hydrogen 2.912 N/A HIS 186.A N GLU 182.A O no hydrogen 2.923 N/A ARG 187.A N SER 183.A O no hydrogen 2.916 N/A ARG 187.A NE ALA 169.A O no hydrogen 3.053 N/A TYR 189.A N TYR 167.A O no hydrogen 2.908 N/A THR 190.A N SER 193.A OG no hydrogen 2.809 N/A GLN 192.A NE2 ALA 253.A O no hydrogen 3.300 N/A GLN 192.A NE2 PRO 257.A O no hydrogen 3.143 N/A SER 193.A N THR 190.A OG1 no hydrogen 2.958 N/A SER 193.A OG THR 190.A O no hydrogen 2.852 N/A ASP 194.A N THR 190.A O no hydrogen 3.159 N/A VAL 195.A N HIS 191.A O no hydrogen 3.090 N/A TRP 196.A N GLN 192.A O no hydrogen 3.297 N/A SER 197.A N SER 193.A O no hydrogen 3.246 N/A SER 197.A OG TRP 178.A O no hydrogen 2.664 N/A SER 197.A OG SER 193.A O no hydrogen 3.433 N/A TYR 198.A N ASP 194.A O no hydrogen 2.900 N/A TYR 198.A OH CYS 116.A O no hydrogen 2.689 N/A GLY 199.A N VAL 195.A O no hydrogen 3.010 N/A VAL 200.A N TRP 196.A O no hydrogen 3.134 N/A THR 201.A N SER 197.A O no hydrogen 2.829 N/A THR 201.A OG1 SER 197.A O no hydrogen 2.846 N/A VAL 202.A N TYR 198.A O no hydrogen 2.789 N/A TRP 203.A N GLY 199.A O no hydrogen 2.999 N/A TRP 203.A NE1 PRO 232.A O no hydrogen 2.775 N/A GLU 204.A N VAL 200.A O no hydrogen 2.954 N/A LEU 205.A N THR 201.A O no hydrogen 3.091 N/A MET 206.A N VAL 202.A O no hydrogen 2.849 N/A THR 207.A N TRP 203.A O no hydrogen 2.971 N/A THR 207.A OG1 TRP 203.A O no hydrogen 2.909 N/A THR 207.A OG1 GLU 204.A O no hydrogen 3.198 N/A PHE 208.A N LEU 205.A O no hydrogen 2.916 N/A GLY 209.A N GLU 204.A O no hydrogen 2.662 N/A SER 210.A N THR 207.A OG1 no hydrogen 3.106 N/A SER 210.A OG THR 207.A O no hydrogen 3.370 N/A ILE 216.A N TYR 213.A O no hydrogen 3.003 N/A GLU 220.A N PRO 217.A O no hydrogen 2.866 N/A ILE 221.A N ALA 218.A O no hydrogen 3.083 N/A SER 222.A OG GLU 226.A OE1 no hydrogen 3.474 N/A SER 223.A OG GLU 220.A O no hydrogen 3.255 N/A ILE 224.A N GLU 220.A O no hydrogen 3.323 N/A LEU 225.A N ILE 221.A O no hydrogen 2.987 N/A GLU 226.A N SER 222.A O no hydrogen 2.951 N/A LYS 227.A N SER 223.A O no hydrogen 3.108 N/A GLY 228.A N LEU 225.A O no hydrogen 2.962 N/A GLU 229.A N ILE 224.A O no hydrogen 3.359 N/A ARG 230.A NE TRP 249.A O no hydrogen 2.877 N/A ARG 230.A NH1 TRP 249.A O no hydrogen 2.942 N/A ARG 230.A NH2 LEU 225.A O no hydrogen 2.987 N/A ARG 230.A NH2 GLU 229.A O no hydrogen 2.825 N/A GLN 233.A NE2 CYS 237.A O no hydrogen 3.088 N/A CYS 237.A N PRO 234.A O no hydrogen 3.030 N/A THR 238.A N TYR 276.A O no hydrogen 3.240 N/A THR 238.A OG1 TYR 276.A O no hydrogen 2.693 N/A TYR 242.A N THR 238.A O no hydrogen 3.098 N/A TYR 242.A OH LEU 231.A O no hydrogen 2.678 N/A MET 243.A N ILE 239.A O no hydrogen 2.780 N/A MET 245.A N VAL 241.A O no hydrogen 3.324 N/A VAL 246.A N TYR 242.A O no hydrogen 2.826 N/A LYS 247.A N MET 243.A O no hydrogen 2.858 N/A CYS 248.A N ILE 244.A O no hydrogen 3.133 N/A CYS 248.A SG ILE 244.A O no hydrogen 3.404 N/A TRP 249.A N VAL 246.A O no hydrogen 2.948 N/A MET 250.A N LYS 247.A O no hydrogen 3.469 N/A SER 255.A N ASP 252.A O no hydrogen 2.888 N/A SER 255.A OG ASP 252.A OD2 no hydrogen 2.937 N/A ARG 256.A N ALA 253.A O no hydrogen 3.166 N/A ARG 256.A NE.A GLN 192.A O no hydrogen 3.347 N/A ARG 256.A NE.B MET 250.A O no hydrogen 2.805 N/A ARG 256.A NH1.A GLU 182.A OE2 no hydrogen 3.378 N/A ARG 256.A NH1.A MET 250.A O no hydrogen 2.813 N/A ARG 256.A NH1.B GLU 182.A OE1 no hydrogen 3.496 N/A ARG 256.A NH1.B GLU 182.A OE2 no hydrogen 2.763 N/A ARG 256.A NH1.B MET 250.A O no hydrogen 2.888 N/A ARG 256.A NH2.A GLU 182.A OE1 no hydrogen 2.856 N/A ARG 256.A NH2.A GLN 192.A O no hydrogen 2.747 N/A ARG 256.A NH2.B GLU 182.A OE1 no hydrogen 2.813 N/A ARG 256.A NH2.B GLN 192.A O no hydrogen 3.047 N/A LYS 258.A N GLU 261.A OE1 no hydrogen 2.961 N/A LYS 258.A NZ GLU 127.A OE1 no hydrogen 2.636 N/A LYS 258.A NZ GLN 192.A OE1 no hydrogen 2.697 N/A LEU 262.A N LYS 258.A O no hydrogen 2.992 N/A ILE 263.A N PHE 259.A O no hydrogen 2.972 N/A ILE 264.A N ARG 260.A O no hydrogen 3.398 N/A GLU 265.A N GLU 261.A O no hydrogen 2.825 N/A PHE 266.A N LEU 262.A O no hydrogen 2.914 N/A SER 267.A N ILE 263.A O no hydrogen 2.951 N/A SER 267.A OG ILE 263.A O no hydrogen 2.600 N/A LYS 268.A N ILE 264.A O no hydrogen 3.007 N/A MET 269.A N GLU 265.A O no hydrogen 3.154 N/A ALA 270.A N PHE 266.A O no hydrogen 2.859 N/A ARG 271.A N LYS 268.A O no hydrogen 3.241 N/A ASP 272.A N MET 269.A O no hydrogen 2.979 N/A ARG 275.A N ASP 272.A O no hydrogen 2.963 N/A TYR 276.A N PRO 273.A O no hydrogen 3.030 N/A LEU 277.A N PRO 273.A O no hydrogen 3.066 N/A VAL 278.A N ILE 236.A O no hydrogen 2.936 N/A ASP 282.A N ILE 279.A O no hydrogen 3.289 N/A VAL 286.A N MET 283.A O no hydrogen 3.189 N/A VAL 287.A N LYS 43.A O no hydrogen 2.978 N/A ASP 290.A N ASP 288.A OD2 no hydrogen 2.746 N/A GLU 291.A N ASP 288.A O no hydrogen 2.833 N/A TYR 292.A N ALA 289.A O no hydrogen 3.108 N/A GLN 296.A NE2 ASP 69.A OD2 no hydrogen 3.548 N/A