Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4apq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N MET 101.A O no hydrogen 3.354 N/A PHE 5.A N CYS 99.A O no hydrogen 2.720 N/A ARG 6.A N TRP 26.A O no hydrogen 2.710 N/A CYS 7.A N ALA 97.A O no hydrogen 2.718 N/A LEU 8.A N VAL 24.A O no hydrogen 2.905 N/A GLN 9.A N LEU 95.A O no hydrogen 2.913 N/A GLN 9.A NE2 SER 11.A OG no hydrogen 2.689 N/A MET 10.A N ASP 22.A O no hydrogen 2.754 N/A SER 11.A N ILE 93.A O no hydrogen 2.934 N/A SER 11.A OG THR 21.A OG1 no hydrogen 3.406 N/A SER 12.A N ARG 20.A O no hydrogen 2.873 N/A SER 12.A OG GLU 92.A OE1 no hydrogen 3.042 N/A SER 12.A OG GLU 92.A OE2 no hydrogen 3.207 N/A PHE 13.A N ILE 91.A O no hydrogen 2.890 N/A ALA 14.A N TRP 18.A O no hydrogen 3.032 N/A SER 17.A OG ASN 15.A OD1 no hydrogen 2.895 N/A TRP 18.A N ASN 15.A OD1 no hydrogen 2.718 N/A ARG 20.A N SER 12.A O no hydrogen 3.024 N/A ARG 20.A NE ASP 22.A OD2 no hydrogen 2.821 N/A ARG 20.A NH2 ASP 22.A OD1 no hydrogen 3.044 N/A ARG 20.A NH2 ASP 22.A OD2 no hydrogen 3.502 N/A THR 21.A N ASN 37.A OD1 no hydrogen 2.825 N/A ASP 22.A N MET 10.A O no hydrogen 2.992 N/A SER 23.A N TRP 35.A O no hydrogen 3.047 N/A VAL 24.A N LEU 8.A O no hydrogen 3.065 N/A VAL 25.A N HIS 33.A O no hydrogen 2.977 N/A TRP 26.A N ARG 6.A O no hydrogen 2.717 N/A LEU 27.A N LEU 30.A O no hydrogen 2.960 N/A GLY 28.A N THR 4.A O no hydrogen 3.078 N/A LEU 30.A N LEU 27.A O no hydrogen 2.995 N/A GLN 31.A N GLU 238.A OE2 no hydrogen 3.151 N/A GLN 31.A NE2 HIS 33.A O no hydrogen 3.259 N/A THR 32.A N VAL 25.A O no hydrogen 2.788 N/A THR 32.A OG1 VAL 25.A O no hydrogen 3.149 N/A THR 32.A OG1 HIS 33.A ND1 no hydrogen 3.098 N/A HIS 33.A ND1 THR 32.A OG1 no hydrogen 3.098 N/A ARG 34.A N SER 43.A O no hydrogen 2.884 N/A TRP 35.A N SER 23.A O no hydrogen 3.076 N/A TRP 35.A NE1 SER 39.A O no hydrogen 2.794 N/A SER 36.A OG ASP 38.A OD2 no hydrogen 3.279 N/A ASN 37.A N ASP 22.A OD1 no hydrogen 2.690 N/A SER 39.A N SER 36.A O no hydrogen 3.229 N/A SER 39.A OG THR 41.A O no hydrogen 2.635 N/A SER 43.A N ARG 34.A O no hydrogen 2.956 N/A SER 43.A OG ARG 34.A O no hydrogen 3.519 N/A SER 43.A OG THR 41.A O no hydrogen 3.421 N/A THR 45.A N THR 32.A O no hydrogen 2.812 N/A THR 45.A OG1 GLN 31.A O no hydrogen 2.601 N/A LYS 46.A N SER 49.A OG no hydrogen 3.164 N/A LYS 46.A NZ GLN 31.A O no hydrogen 2.826 N/A LYS 46.A NZ THR 45.A O no hydrogen 3.301 N/A LYS 46.A NZ GLU 238.A OE1 no hydrogen 3.157 N/A LYS 46.A NZ GLU 238.A OE2 no hydrogen 3.434 N/A SER 49.A N LYS 46.A O no hydrogen 3.342 N/A SER 49.A OG THR 32.A O no hydrogen 2.613 N/A SER 49.A OG LYS 46.A O no hydrogen 3.019 N/A GLN 50.A NE2 LEU 53.A O no hydrogen 2.818 N/A GLN 50.A NE2 ASN 55.A OD1 no hydrogen 3.613 N/A GLY 51.A N TRP 48.A O no hydrogen 3.085 N/A LEU 53.A N GLN 50.A O no hydrogen 3.348 N/A SER 54.A N GLN 57.A OE1 no hydrogen 2.770 N/A SER 54.A OG GLN 57.A OE1 no hydrogen 3.389 N/A GLN 57.A N SER 54.A OG no hydrogen 3.246 N/A TRP 58.A N SER 54.A O no hydrogen 2.865 N/A GLU 59.A N ASN 55.A O no hydrogen 2.862 N/A LYS 60.A N GLN 56.A O no hydrogen 3.005 N/A LEU 61.A N GLN 57.A O no hydrogen 3.236 N/A GLN 62.A N TRP 58.A O no hydrogen 2.874 N/A GLN 62.A NE2 ILE 42.A O no hydrogen 3.283 N/A HIS 63.A N GLU 59.A O no hydrogen 3.002 N/A MET 64.A N LYS 60.A O no hydrogen 3.118 N/A PHE 65.A N LEU 61.A O no hydrogen 2.909 N/A GLN 66.A N GLN 62.A O no hydrogen 2.757 N/A GLN 66.A NE2 ALA 40.A O no hydrogen 2.713 N/A VAL 67.A N HIS 63.A O no hydrogen 3.098 N/A TYR 68.A N MET 64.A O no hydrogen 3.065 N/A TYR 68.A OH GLN 9.A OE1 no hydrogen 2.602 N/A ARG 69.A N PHE 65.A O no hydrogen 3.080 N/A ARG 69.A NH1 THR 21.A O no hydrogen 3.420 N/A ARG 69.A NH1 SER 36.A O no hydrogen 2.811 N/A ARG 69.A NH2 SER 39.A O no hydrogen 2.674 N/A SER 71.A N VAL 67.A O no hydrogen 3.277 N/A SER 71.A OG VAL 67.A O no hydrogen 2.735 N/A PHE 72.A N TYR 68.A O no hydrogen 2.780 N/A THR 73.A N ARG 69.A O no hydrogen 3.220 N/A THR 73.A OG1 ARG 69.A O no hydrogen 2.964 N/A ARG 74.A N VAL 70.A O no hydrogen 3.299 N/A ASP 75.A N SER 71.A O no hydrogen 2.866 N/A ILE 76.A N PHE 72.A O no hydrogen 3.000 N/A GLN 77.A N THR 73.A O no hydrogen 3.192 N/A GLU 78.A N ARG 74.A O no hydrogen 2.819 N/A LEU 79.A N ASP 75.A O no hydrogen 2.832 N/A VAL 80.A N ILE 76.A O no hydrogen 2.989 N/A LYS 81.A NZ GLU 78.A OE2 no hydrogen 2.755 N/A MET 82.A N GLU 78.A O no hydrogen 3.073 N/A MET 83.A N LEU 79.A O no hydrogen 2.859 N/A SER 84.A N LYS 81.A O no hydrogen 3.330 N/A GLU 87.A N MET 83.A O no hydrogen 3.225 N/A TYR 89.A N ASP 88.A OD1 no hydrogen 2.804 N/A ILE 91.A N PHE 13.A O no hydrogen 2.767 N/A GLU 92.A N GLN 116.A OE1 no hydrogen 3.253 N/A ILE 93.A N SER 11.A O no hydrogen 2.985 N/A GLN 94.A N ALA 114.A O no hydrogen 2.988 N/A LEU 95.A N GLN 9.A O no hydrogen 2.970 N/A SER 96.A N HIS 112.A O no hydrogen 2.790 N/A ALA 97.A N CYS 7.A O no hydrogen 3.034 N/A GLY 98.A N PHE 110.A O no hydrogen 2.984 N/A CYS 99.A N PHE 5.A O no hydrogen 3.055 N/A CYS 99.A SG SER 109.A OG no hydrogen 3.759 N/A GLU 100.A N GLU 108.A O no hydrogen 2.862 N/A MET 101.A N TYR 3.A O no hydrogen 2.801 N/A TYR 102.A N ALA 106.A O no hydrogen 2.945 N/A GLU 108.A N GLU 100.A O no hydrogen 3.118 N/A SER 109.A OG LEU 159.A O no hydrogen 2.633 N/A PHE 110.A N GLY 98.A O no hydrogen 2.933 N/A HIS 112.A N SER 96.A O no hydrogen 2.899 N/A VAL 113.A N VAL 121.A O no hydrogen 2.766 N/A ALA 114.A N GLN 94.A O no hydrogen 2.807 N/A PHE 115.A N LYS 118.A O no hydrogen 2.685 N/A GLN 116.A N GLU 92.A O no hydrogen 2.716 N/A GLN 116.A NE2 GLU 87.A OE2 no hydrogen 3.560 N/A GLN 116.A NE2 PRO 90.A O no hydrogen 2.922 N/A LYS 118.A N PHE 115.A O no hydrogen 3.021 N/A VAL 120.A N VAL 113.A O no hydrogen 3.077 N/A VAL 121.A N VAL 113.A O no hydrogen 3.143 N/A ARG 122.A N GLN 129.A O no hydrogen 2.808 N/A PHE 123.A N LEU 111.A O no hydrogen 3.014 N/A TRP 124.A N SER 127.A O no hydrogen 2.760 N/A SER 127.A N TRP 124.A O no hydrogen 3.356 N/A TRP 128.A N ASN 146.A OD1 no hydrogen 2.745 N/A GLN 129.A N ARG 122.A O no hydrogen 2.734 N/A VAL 131.A N VAL 120.A O no hydrogen 2.986 N/A ALA 134.A N VAL 131.A O no hydrogen 3.158 N/A LEU 138.A N PRO 135.A O no hydrogen 3.242 N/A ASP 139.A N SER 136.A O no hydrogen 3.148 N/A ILE 142.A N LEU 138.A O no hydrogen 3.030 N/A LYS 143.A N ASP 139.A O no hydrogen 2.958 N/A VAL 144.A N LEU 140.A O no hydrogen 2.799 N/A LEU 145.A N PRO 141.A O no hydrogen 2.864 N/A ASN 146.A N ILE 142.A O no hydrogen 2.802 N/A ASN 146.A ND2 TRP 128.A O no hydrogen 2.968 N/A ALA 147.A N VAL 144.A O no hydrogen 3.254 N/A ASP 148.A N LEU 145.A O no hydrogen 3.063 N/A THR 151.A N ASP 148.A OD1 no hydrogen 2.906 N/A THR 151.A OG1 ASP 148.A OD1 no hydrogen 3.365 N/A SER 152.A OG THR 126.A O no hydrogen 2.749 N/A ALA 153.A N GLN 149.A O no hydrogen 3.184 N/A THR 154.A N GLY 150.A O no hydrogen 2.850 N/A THR 154.A OG1 GLY 150.A O no hydrogen 3.062 N/A VAL 155.A N THR 151.A O no hydrogen 2.798 N/A GLN 156.A N SER 152.A O no hydrogen 2.762 N/A GLN 156.A NE2 SER 152.A O no hydrogen 3.505 N/A GLN 156.A NE2 SER 152.A OG no hydrogen 2.789 N/A MET 157.A N ALA 153.A O no hydrogen 2.952 N/A LEU 158.A N THR 154.A O no hydrogen 3.185 N/A LEU 159.A N VAL 155.A O no hydrogen 3.033 N/A ASN 160.A N GLN 156.A O no hydrogen 3.055 N/A ASP 161.A N MET 157.A O no hydrogen 3.142 N/A THR 162.A N MET 157.A O no hydrogen 2.984 N/A THR 162.A OG1 MET 157.A O no hydrogen 3.459 N/A CYS 163.A N LEU 158.A O no hydrogen 2.702 N/A LEU 165.A N ASP 161.A O no hydrogen 3.239 N/A PHE 166.A N THR 162.A O no hydrogen 2.769 N/A VAL 167.A N CYS 163.A O no hydrogen 2.978 N/A ARG 168.A N PRO 164.A O no hydrogen 2.954 N/A ARG 168.A NH2 ALA 106.A O no hydrogen 3.153 N/A GLY 169.A N LEU 165.A O no hydrogen 3.286 N/A LEU 170.A N PHE 166.A O no hydrogen 2.932 N/A LEU 171.A N VAL 167.A O no hydrogen 2.934 N/A GLU 172.A N ARG 168.A O no hydrogen 3.381 N/A ALA 173.A N GLY 169.A O no hydrogen 2.956 N/A GLY 174.A N LEU 170.A O no hydrogen 3.185 N/A LYS 175.A N GLU 172.A O no hydrogen 3.349 N/A LYS 175.A NZ GLU 179.A OE1 no hydrogen 3.441 N/A LYS 175.A NZ GLU 179.A OE2 no hydrogen 3.094 N/A SER 176.A OG ASP 177.A OD1 no hydrogen 3.437 N/A ASP 177.A N GLY 174.A O no hydrogen 2.954 N/A LEU 178.A N GLY 174.A O no hydrogen 2.902 N/A GLU 179.A N LYS 175.A O no hydrogen 2.934 N/A LYS 180.A NZ GLU 238.A O no hydrogen 3.348 N/A GLU 182.A N TYR 209.A O no hydrogen 2.822 N/A VAL 185.A N SER 206.A O no hydrogen 2.755 N/A TRP 187.A N HIS 204.A O no hydrogen 2.989 N/A SER 189.A N VAL 202.A O no hydrogen 2.865 N/A SER 189.A OG HIS 204.A NE2 no hydrogen 2.801 N/A VAL 191.A N GLN 200.A O no hydrogen 2.990 N/A SER 193.A N HIS 198.A O no hydrogen 2.789 N/A SER 193.A OG ASP 247.A OD1 no hydrogen 2.923 N/A SER 193.A OG ASP 247.A OD2 no hydrogen 3.464 N/A HIS 198.A ND1 ASP 247.A OD1 no hydrogen 3.370 N/A ARG 199.A N VAL 248.A O no hydrogen 2.838 N/A ARG 199.A NH1 SER 190.A OG no hydrogen 2.865 N/A GLN 200.A N VAL 191.A O no hydrogen 2.736 N/A LEU 201.A N LEU 246.A O no hydrogen 2.658 N/A VAL 202.A N SER 189.A O no hydrogen 2.899 N/A CYS 203.A N ALA 244.A O no hydrogen 2.851 N/A HIS 204.A N TRP 187.A O no hydrogen 2.761 N/A HIS 204.A ND1 TYR 241.A OH no hydrogen 2.584 N/A HIS 204.A NE2 SER 189.A OG no hydrogen 2.801 N/A VAL 205.A N LEU 242.A O no hydrogen 2.809 N/A SER 206.A N VAL 185.A O no hydrogen 3.186 N/A GLY 207.A N TRP 240.A O no hydrogen 2.860 N/A TYR 209.A N GLU 182.A O no hydrogen 3.100 N/A TYR 209.A OH ASP 29.A OD1 no hydrogen 2.823 N/A TRP 214.A N LYS 261.A O no hydrogen 3.161 N/A MET 216.A N ARG 259.A O no hydrogen 2.877 N/A TRP 217.A NE1 ALA 244.A O no hydrogen 3.067 N/A MET 218.A N ALA 257.A O no hydrogen 2.767 N/A ARG 219.A N GLN 222.A O no hydrogen 3.082 N/A ARG 219.A NH1 GLU 252.A O no hydrogen 3.297 N/A ARG 219.A NH2 GLU 252.A O no hydrogen 3.558 N/A GLN 224.A N TRP 217.A O no hydrogen 2.755 N/A GLN 224.A NE2 GLN 222.A O no hydrogen 2.764 N/A GLN 224.A NE2 GLN 222.A OE1 no hydrogen 3.590 N/A THR 227.A N GLN 224.A O no hydrogen 3.141 N/A THR 227.A OG1 GLN 224.A O no hydrogen 2.638 N/A HIS 228.A N THR 245.A O no hydrogen 3.025 N/A ARG 229.A NH2 VAL 213.A O no hydrogen 3.549 N/A GLY 230.A N GLN 243.A O no hydrogen 2.829 N/A LEU 233.A N TYR 241.A O no hydrogen 2.862 N/A ASN 235.A N THR 239.A O no hydrogen 3.048 N/A ASN 235.A ND2 SER 206.A OG no hydrogen 3.347 N/A ASN 235.A ND2 THR 239.A OG1 no hydrogen 2.970 N/A THR 239.A OG1 ASP 237.A OD2 no hydrogen 2.685 N/A TRP 240.A N PHE 208.A O no hydrogen 3.095 N/A TRP 240.A NE1 ASP 29.A OD2 no hydrogen 3.177 N/A TYR 241.A N LEU 233.A O no hydrogen 2.874 N/A TYR 241.A OH HIS 204.A ND1 no hydrogen 2.584 N/A TYR 241.A OH GLN 243.A OE1 no hydrogen 3.042 N/A LEU 242.A N VAL 205.A O no hydrogen 2.887 N/A ALA 244.A N CYS 203.A O no hydrogen 2.931 N/A THR 245.A N HIS 228.A O no hydrogen 3.184 N/A THR 245.A OG1 HIS 228.A O no hydrogen 3.240 N/A LEU 246.A N LEU 201.A O no hydrogen 3.007 N/A VAL 248.A N ARG 199.A O no hydrogen 2.775 N/A GLU 249.A N GLU 252.A OE1 no hydrogen 2.922 N/A ALA 250.A N GLY 197.A O no hydrogen 3.503 N/A GLY 251.A N GLU 253.A OE1 no hydrogen 2.903 N/A GLU 252.A N GLU 249.A O no hydrogen 2.929 N/A LEU 256.A N GLU 253.A O no hydrogen 3.111 N/A ALA 257.A N MET 218.A O no hydrogen 3.051 N/A CYS 258.A N LEU 272.A O no hydrogen 2.723 N/A CYS 258.A SG MET 216.A O no hydrogen 3.956 N/A ARG 259.A N MET 216.A O no hydrogen 2.690 N/A ARG 259.A NH2 ASP 269.A OD2 no hydrogen 3.285 N/A VAL 260.A N ILE 270.A O no hydrogen 2.755 N/A LYS 261.A N TRP 214.A O no hydrogen 2.809 N/A LYS 261.A NZ ASP 269.A OD2 no hydrogen 3.160 N/A HIS 262.A ND1 SER 264.A OG no hydrogen 2.761 N/A HIS 262.A NE2 PRO 210.A O no hydrogen 2.885 N/A SER 263.A OG GLN 181.A OE1 no hydrogen 2.778 N/A SER 264.A N HIS 262.A ND1 no hydrogen 3.353 N/A SER 264.A OG GLU 182.A O no hydrogen 3.268 N/A SER 264.A OG HIS 262.A ND1 no hydrogen 2.761 N/A LEU 265.A N HIS 262.A O no hydrogen 3.297 N/A ILE 270.A N VAL 260.A O no hydrogen 2.990 N/A LEU 272.A N CYS 258.A O no hydrogen 2.972 N/A TRP 274.A N LEU 256.A O no hydrogen 2.901 N/A GLY 275.A N HIS 279.A ND1 no hydrogen 2.975 N/A SER 276.A N TYR 273.A O no hydrogen 2.988 N/A SER 276.A OG TYR 273.A O no hydrogen 2.878 N/A HIS 279.A N SER 276.A OG no hydrogen 3.195 N/A ILE 280.A N SER 276.A O no hydrogen 3.050 N/A LEU 281.A N LEU 277.A O no hydrogen 3.236 N/A ASP 282.A N HIS 278.A O no hydrogen 2.555 N/A ALA 283.A N HIS 279.A O no hydrogen 2.782 N/A GLN 284.A N ILE 280.A O no hydrogen 3.113 N/A LYS 285.A N ASP 282.A O no hydrogen 3.196 N/A MET 286.A N ALA 283.A O no hydrogen 3.060 N/A ASN 289.A ND2 HIS 290.A O no hydrogen 3.329 N/A HIS 290.A ND1 TRP 288.A O no hydrogen 3.132 N/A