Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cqw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 6.A SG GLN 4.A OE1 no hydrogen 3.951 N/A ASN 12.A N ASN 320.A OD1 no hydrogen 3.006 N/A ASN 12.A ND2 THR 29.A O no hydrogen 2.960 N/A SER 14.A N ASN 12.A OD1 no hydrogen 2.934 N/A SER 14.A OG VAL 28.A O no hydrogen 2.768 N/A SER 14.A OG THR 29.A O no hydrogen 3.534 N/A GLU 16.A N SER 14.A OG no hydrogen 3.113 N/A VAL 18.A N VAL 26.A O no hydrogen 3.009 N/A THR 20.A N GLU 23.A O no hydrogen 2.782 N/A THR 20.A OG1 GLU 23.A O no hydrogen 3.040 N/A GLU 23.A N THR 20.A OG1 no hydrogen 3.112 N/A LYS 24.A NZ THR 20.A O no hydrogen 2.873 N/A ASN 25.A N ASP 19.A OD1 no hydrogen 2.952 N/A VAL 26.A N VAL 18.A O no hydrogen 2.903 N/A VAL 28.A N GLU 16.A O no hydrogen 2.877 N/A THR 29.A N LEU 318.A O no hydrogen 2.760 N/A THR 29.A OG1 HIS 30.A ND1 no hydrogen 2.932 N/A THR 29.A OG1 LEU 318.A O no hydrogen 3.543 N/A HIS 30.A ND1 THR 29.A OG1 no hydrogen 2.932 N/A GLN 32.A N LEU 314.A O no hydrogen 2.768 N/A ILE 34.A N LEU 312.A O no hydrogen 3.141 N/A LEU 35.A N ASP 33.A OD1 no hydrogen 3.075 N/A GLU 36.A N PHE 292.A O no hydrogen 2.815 N/A LYS 37.A NZ ASP 33.A OD2 no hydrogen 2.927 N/A LYS 37.A NZ LEU 35.A O no hydrogen 2.932 N/A THR 38.A N GLU 36.A OE2 no hydrogen 2.892 N/A THR 38.A OG1 GLU 36.A OE2 no hydrogen 2.692 N/A ASN 40.A N ALA 285.A O no hydrogen 3.174 N/A GLY 41.A N HIS 39.A ND1 no hydrogen 3.129 N/A LYS 42.A N ASN 40.A OD1 no hydrogen 3.014 N/A CYS 44.A N GLN 280.A OE1 no hydrogen 2.793 N/A ASP 45.A N CYS 275.A O no hydrogen 2.670 N/A LEU 46.A N VAL 49.A O no hydrogen 2.814 N/A ASP 47.A N THR 277.A O no hydrogen 2.865 N/A GLY 48.A N ASN 276.A OD1 no hydrogen 2.750 N/A VAL 49.A N LEU 46.A O no hydrogen 3.013 N/A LEU 52.A N TYR 80.A O no hydrogen 2.805 N/A LEU 54.A N VAL 82.A O no hydrogen 3.020 N/A ARG 55.A NH1 GLU 71.A OE1 no hydrogen 2.915 N/A ARG 55.A NH1 GLU 71.A OE2 no hydrogen 3.261 N/A CYS 57.A N LEU 54.A O no hydrogen 2.883 N/A CYS 57.A SG MET 68.A O no hydrogen 4.019 N/A SER 58.A N ASN 89.A O no hydrogen 3.041 N/A SER 58.A OG ASN 89.A O no hydrogen 3.536 N/A SER 58.A OG ASP 90.A OD1 no hydrogen 2.608 N/A VAL 59.A N GLU 83.A OE2 no hydrogen 2.918 N/A ALA 60.A N TYR 100.A OH no hydrogen 2.890 N/A GLY 61.A N SER 58.A OG no hydrogen 3.022 N/A TRP 62.A N SER 58.A O no hydrogen 2.918 N/A LEU 63.A N VAL 59.A O no hydrogen 2.884 N/A LEU 64.A N ALA 60.A O no hydrogen 2.964 N/A GLY 65.A N GLY 61.A O no hydrogen 3.203 N/A ASN 66.A N GLY 61.A O no hydrogen 2.936 N/A ASN 66.A ND2 ASP 90.A O no hydrogen 3.055 N/A MET 68.A N ASN 66.A OD1 no hydrogen 2.840 N/A CYS 69.A N ASN 66.A O no hydrogen 2.737 N/A PHE 72.A N CYS 69.A O no hydrogen 2.759 N/A LEU 73.A N ASP 70.A O no hydrogen 3.356 N/A TRP 78.A N ASN 111.A O no hydrogen 2.984 N/A SER 79.A N LYS 50.A O no hydrogen 3.159 N/A SER 79.A OG VAL 49.A O no hydrogen 2.630 N/A TYR 80.A OH CYS 44.A O no hydrogen 2.721 N/A ILE 81.A N THR 264.A O no hydrogen 2.863 N/A VAL 82.A N LEU 52.A O no hydrogen 2.832 N/A GLU 83.A N MET 266.A O no hydrogen 2.819 N/A ILE 85.A N GLU 269.A OE2 no hydrogen 2.946 N/A ASN 89.A N ASP 56.A O no hydrogen 2.787 N/A TYR 93.A OH HIS 180.A NE2 no hydrogen 3.070 N/A ASN 96.A N MET 227.A O no hydrogen 3.131 N/A ASN 98.A N PHE 229.A O no hydrogen 2.853 N/A LEU 103.A N ASP 99.A O no hydrogen 3.125 N/A LYS 104.A N TYR 100.A O no hydrogen 2.928 N/A LYS 104.A NZ GLU 83.A OE1 no hydrogen 3.155 N/A HIS 105.A N GLU 101.A O no hydrogen 2.940 N/A LEU 106.A N GLU 102.A O no hydrogen 3.178 N/A LEU 107.A N LEU 103.A O no hydrogen 3.093 N/A SER 108.A N LYS 104.A O no hydrogen 3.298 N/A SER 108.A N HIS 105.A O no hydrogen 3.204 N/A SER 108.A OG LYS 104.A O no hydrogen 3.239 N/A ARG 109.A N LEU 106.A O no hydrogen 2.964 N/A ILE 110.A N LEU 107.A O no hydrogen 2.938 N/A ASN 111.A N LYS 259.A O no hydrogen 2.725 N/A ASN 111.A ND2 TRP 78.A O no hydrogen 2.989 N/A ASN 111.A ND2 ASP 262.A O no hydrogen 3.433 N/A HIS 112.A N LYS 259.A O no hydrogen 3.300 N/A GLU 114.A N LYS 256.A O no hydrogen 2.869 N/A LYS 115.A NZ LEU 73.A O no hydrogen 2.972 N/A LYS 115.A NZ ASN 147.A OD1 no hydrogen 3.080 N/A ILE 116.A N ALA 254.A O no hydrogen 2.729 N/A ILE 118.A N GLU 252.A O no hydrogen 2.731 N/A ILE 119.A N GLU 252.A O no hydrogen 3.135 N/A LYS 121.A NZ ALA 129.A O no hydrogen 2.720 N/A SER 123.A N PRO 120.A O no hydrogen 3.016 N/A SER 123.A OG PRO 120.A O no hydrogen 2.665 N/A HIS 127.A NE2 PRO 159.A O no hydrogen 2.906 N/A GLU 128.A N THR 152.A O no hydrogen 2.964 N/A SER 133.A N SER 143.A O no hydrogen 2.907 N/A ALA 135.A N SER 133.A OG no hydrogen 3.094 N/A CYS 136.A N SER 133.A O no hydrogen 3.115 N/A TYR 138.A N ARG 141.A O no hydrogen 2.856 N/A ARG 141.A N TYR 138.A O no hydrogen 3.139 N/A SER 143.A N SER 133.A O no hydrogen 3.282 N/A SER 143.A N CYS 136.A O no hydrogen 2.807 N/A ARG 146.A N GLY 65.A O no hydrogen 2.804 N/A ARG 146.A NE PHE 144.A O no hydrogen 3.507 N/A ARG 146.A NH2 SER 143.A OG no hydrogen 3.237 N/A ASN 147.A N LEU 64.A O no hydrogen 3.152 N/A ASN 147.A ND2 LEU 63.A O no hydrogen 2.763 N/A VAL 149.A N ALA 250.A O no hydrogen 2.661 N/A TRP 150.A NE1 TYR 192.A OH no hydrogen 2.859 N/A THR 152.A N GLU 128.A O no hydrogen 2.945 N/A LYS 153.A N LEU 191.A O no hydrogen 2.925 N/A LYS 153.A NZ ASN 156.A OD1 no hydrogen 3.038 N/A LYS 153.A NZ THR 189.A O no hydrogen 3.136 N/A LYS 153.A NZ GLN 193.A OE1 no hydrogen 2.894 N/A LYS 154.A N ALA 157.A O no hydrogen 2.935 N/A LYS 154.A NZ SER 125.A O no hydrogen 2.907 N/A ALA 157.A N LYS 154.A O no hydrogen 3.093 N/A ILE 161.A N SER 244.A O no hydrogen 2.658 N/A ARG 163.A N PHE 242.A O no hydrogen 3.031 N/A ARG 163.A NH1 SER 123.A O no hydrogen 3.504 N/A ARG 163.A NH1 SER 123.A OG no hydrogen 3.384 N/A ARG 163.A NH2 SER 123.A OG no hydrogen 2.938 N/A SER 164.A OG ASN 241.A OD1 no hydrogen 2.697 N/A TYR 165.A N ILE 240.A O no hydrogen 2.892 N/A ASN 167.A N ASP 238.A O no hydrogen 2.962 N/A ASN 167.A ND2 GLU 171.A O no hydrogen 3.066 N/A ASN 167.A ND2 LEU 234.A O no hydrogen 3.008 N/A ASN 169.A N ASN 167.A OD1 no hydrogen 3.109 N/A ASN 169.A ND2 ASN 167.A OD1 no hydrogen 3.015 N/A LEU 173.A N LEU 234.A O no hydrogen 2.969 N/A LEU 174.A N TYR 255.A O no hydrogen 2.810 N/A VAL 175.A N THR 232.A O no hydrogen 3.029 N/A TRP 177.A N PHE 230.A O no hydrogen 3.159 N/A TRP 177.A NE1 GLN 208.A OE1 no hydrogen 2.879 N/A GLY 178.A N ILE 249.A O no hydrogen 2.932 N/A ILE 179.A N GLU 228.A O no hydrogen 2.807 N/A HIS 180.A N ASN 247.A O no hydrogen 2.818 N/A HIS 180.A NE2 TYR 93.A OH no hydrogen 3.070 N/A HIS 181.A N ARG 226.A O no hydrogen 2.725 N/A HIS 181.A NE2 GLU 228.A OE1 no hydrogen 2.735 N/A ASN 183.A N GLU 187.A OE2 no hydrogen 2.818 N/A ASN 183.A ND2 GLU 187.A OE1 no hydrogen 2.762 N/A GLU 187.A N ASP 184.A OD1 no hydrogen 2.889 N/A GLN 188.A N ASP 184.A O no hydrogen 3.066 N/A GLN 188.A NE2 ASN 194.A O no hydrogen 2.920 N/A GLN 188.A NE2 ASN 247.A OD1 no hydrogen 3.026 N/A THR 189.A N ALA 185.A O no hydrogen 3.166 N/A THR 189.A OG1 ALA 186.A O no hydrogen 3.231 N/A ARG 190.A N ALA 186.A O no hydrogen 2.954 N/A LEU 191.A N GLU 187.A O no hydrogen 2.873 N/A TYR 192.A N GLN 188.A O no hydrogen 2.826 N/A TYR 192.A OH HIS 180.A ND1 no hydrogen 2.779 N/A GLN 193.A N THR 189.A O no hydrogen 2.788 N/A ASN 194.A N TYR 192.A O no hydrogen 2.666 N/A ASN 194.A ND2 TYR 158.A O no hydrogen 3.065 N/A ASN 194.A ND2 ASN 245.A O no hydrogen 2.736 N/A THR 197.A OG1 ASN 247.A OD1 no hydrogen 2.663 N/A TYR 198.A N ASN 245.A OD1 no hydrogen 3.054 N/A TYR 198.A OH GLU 243.A OE2 no hydrogen 2.542 N/A ILE 199.A N LEU 210.A O no hydrogen 2.948 N/A SER 200.A N GLU 243.A O no hydrogen 2.733 N/A VAL 201.A N GLN 208.A O no hydrogen 2.877 N/A GLY 202.A N ASN 241.A O no hydrogen 3.050 N/A THR 203.A N LEU 206.A O no hydrogen 3.118 N/A SER 204.A N ASP 238.A OD2 no hydrogen 3.042 N/A SER 204.A OG ASP 238.A OD2 no hydrogen 2.901 N/A THR 205.A N THR 203.A OG1 no hydrogen 3.026 N/A LEU 206.A N THR 203.A OG1 no hydrogen 2.892 N/A GLN 208.A N VAL 201.A O no hydrogen 2.886 N/A LEU 210.A N ILE 199.A O no hydrogen 2.798 N/A LYS 213.A N HIS 181.A ND1 no hydrogen 2.904 N/A ARG 217.A NE SER 224.A O no hydrogen 2.789 N/A ARG 217.A NH1 LYS 213.A O no hydrogen 3.038 N/A ARG 217.A NH2 PRO 182.A O no hydrogen 2.740 N/A ARG 217.A NH2 SER 224.A O no hydrogen 3.355 N/A VAL 220.A N GLN 223.A O no hydrogen 2.974 N/A ASN 221.A ND2 CYS 92.A O no hydrogen 2.787 N/A GLN 223.A N VAL 220.A O no hydrogen 3.072 N/A GLN 223.A NE2 SER 134.A OG no hydrogen 3.429 N/A SER 224.A OG ARG 217.A O no hydrogen 2.666 N/A ARG 226.A N HIS 181.A O no hydrogen 3.037 N/A ARG 226.A NH1 SER 218.A O no hydrogen 3.569 N/A ARG 226.A NH1 GLN 223.A O no hydrogen 3.168 N/A ARG 226.A NH1 GLY 225.A O no hydrogen 2.888 N/A ARG 226.A NH2 SER 218.A O no hydrogen 2.964 N/A MET 227.A N PRO 94.A O no hydrogen 2.812 N/A GLU 228.A N ILE 179.A O no hydrogen 2.966 N/A PHE 229.A N ASN 96.A O no hydrogen 2.912 N/A PHE 230.A N TRP 177.A O no hydrogen 2.753 N/A TRP 231.A NE1 ASP 99.A O no hydrogen 3.187 N/A THR 232.A N VAL 175.A O no hydrogen 3.208 N/A LEU 234.A N LEU 173.A O no hydrogen 2.744 N/A ASN 237.A N ASN 167.A O no hydrogen 2.764 N/A ASP 238.A N LYS 235.A O no hydrogen 3.076 N/A ILE 240.A N TYR 165.A O no hydrogen 2.829 N/A ASN 241.A N GLY 202.A O no hydrogen 2.884 N/A ASN 241.A ND2 GLY 202.A O no hydrogen 3.410 N/A PHE 242.A N ARG 163.A O no hydrogen 2.797 N/A GLU 243.A N SER 200.A O no hydrogen 2.899 N/A SER 244.A N ILE 161.A O no hydrogen 3.121 N/A SER 244.A OG TYR 198.A O no hydrogen 2.831 N/A ASN 245.A ND2 THR 196.A O no hydrogen 3.140 N/A GLY 246.A N SER 244.A OG no hydrogen 2.996 N/A ASN 247.A ND2 HIS 180.A O no hydrogen 2.921 N/A ASN 247.A ND2 GLN 188.A OE1 no hydrogen 2.937 N/A ILE 249.A N GLY 178.A O no hydrogen 2.800 N/A ALA 250.A N VAL 149.A O no hydrogen 2.937 N/A GLU 252.A N ASN 147.A O no hydrogen 2.791 N/A ASN 253.A N ASN 147.A O no hydrogen 3.034 N/A ASN 253.A ND2 ASN 147.A OD1 no hydrogen 2.901 N/A ALA 254.A N ILE 116.A O no hydrogen 2.789 N/A TYR 255.A N LEU 174.A O no hydrogen 2.970 N/A TYR 255.A OH LEU 63.A O no hydrogen 2.712 N/A LYS 256.A N GLU 114.A O no hydrogen 2.823 N/A LYS 256.A NZ ASN 169.A OD1 no hydrogen 3.549 N/A ILE 257.A N ASP 172.A O no hydrogen 2.952 N/A VAL 258.A N HIS 112.A O no hydrogen 3.136 N/A LYS 259.A N HIS 112.A O no hydrogen 3.465 N/A GLY 261.A N ARG 109.A O no hydrogen 3.176 N/A MET 266.A N ILE 81.A O no hydrogen 2.706 N/A LYS 267.A NZ GLU 83.A OE1 no hydrogen 2.685 N/A LYS 267.A NZ LYS 84.A O no hydrogen 2.980 N/A SER 268.A N GLU 83.A O no hydrogen 3.073 N/A SER 268.A OG PRO 282.A O no hydrogen 2.770 N/A LEU 270.A N SER 268.A OG no hydrogen 3.155 N/A TYR 272.A OH ASP 45.A OD1 no hydrogen 2.590 N/A TYR 272.A OH ASP 45.A OD2 no hydrogen 3.248 N/A GLY 273.A N LEU 43.A O no hydrogen 2.731 N/A THR 277.A N ASP 45.A O no hydrogen 2.825 N/A THR 277.A OG1 CYS 279.A O no hydrogen 3.028 N/A LYS 278.A NZ ASP 47.A OD1 no hydrogen 3.176 N/A LYS 278.A NZ ASP 47.A OD2 no hydrogen 3.180 N/A CYS 279.A N THR 277.A OG1 no hydrogen 3.143 N/A GLN 280.A N ILE 300.A O no hydrogen 3.061 N/A GLN 280.A NE2 LYS 42.A O no hydrogen 3.044 N/A GLN 280.A NE2 THR 281.A O no hydrogen 2.775 N/A THR 281.A N GLY 284.A O no hydrogen 3.013 N/A THR 281.A OG1 GLY 284.A O no hydrogen 2.723 N/A ILE 283.A N THR 281.A OG1 no hydrogen 3.190 N/A GLY 284.A N THR 281.A O no hydrogen 3.293 N/A GLY 284.A N THR 281.A OG1 no hydrogen 3.190 N/A ALA 285.A N ASN 40.A OD1 no hydrogen 2.769 N/A ILE 286.A N CYS 279.A O no hydrogen 2.829 N/A SER 288.A OG GLU 36.A OE1 no hydrogen 2.728 N/A MET 290.A N SER 288.A OG no hydrogen 3.157 N/A PHE 292.A N ILE 34.A O no hydrogen 3.226 N/A HIS 293.A N LYS 305.A O no hydrogen 2.948 N/A ASN 294.A N GLU 36.A O no hydrogen 3.188 N/A ASN 294.A ND2 SER 309.A O no hydrogen 2.937 N/A ILE 295.A N HIS 293.A ND1 no hydrogen 3.120 N/A LEU 298.A N HIS 296.A ND1 no hydrogen 3.109 N/A ILE 300.A N GLN 280.A O no hydrogen 3.084 N/A GLU 302.A N LYS 278.A O no hydrogen 2.906 N/A CYS 303.A SG THR 299.A OG1 no hydrogen 3.567 N/A CYS 303.A SG ILE 300.A O no hydrogen 3.697 N/A LYS 305.A N PRO 291.A O no hydrogen 2.836 N/A VAL 307.A N HIS 293.A O no hydrogen 2.916 N/A ARG 311.A NH2 GLN 17.A O no hydrogen 3.049 N/A LEU 314.A N GLN 32.A O no hydrogen 2.927 N/A THR 316.A N HIS 30.A O no hydrogen 3.309 N/A GLY 317.A N HIS 30.A O no hydrogen 2.931 N/A LEU 318.A N THR 29.A OG1 no hydrogen 3.034 N/A ARG 319.A NH1 GLU 23.A OE1 no hydrogen 3.343 N/A ARG 319.A NH1 GLU 23.A OE2 no hydrogen 2.733 N/A ARG 319.A NH2 GLU 23.A OE2 no hydrogen 3.140 N/A ASN 320.A N THR 27.A O no hydrogen 2.870 N/A ASN 320.A ND2 ASN 12.A O no hydrogen 3.023 N/A ASN 320.A ND2 SER 14.A O no hydrogen 2.974 N/A