Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4blu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 ASP 122.A OD1 no hydrogen 2.618 N/A SER 6.A N GLN 48.A O no hydrogen 3.385 N/A HIS 8.A N SER 6.A OG no hydrogen 3.274 N/A HIS 8.A ND1 GLU 59.A OE1 no hydrogen 2.974 N/A ALA 9.A N SER 6.A OG no hydrogen 3.102 N/A GLY 10.A N ASP 14.A OD2 no hydrogen 2.770 N/A ASN 11.A N HIS 8.A O no hydrogen 3.128 N/A ASN 11.A ND2 GLU 59.A OE1 no hydrogen 3.056 N/A ASP 14.A N ASN 11.A OD1 no hydrogen 3.006 N/A VAL 15.A N ASN 11.A O no hydrogen 3.032 N/A LEU 16.A N HIS 12.A O no hydrogen 3.105 N/A LYS 17.A N ALA 13.A O no hydrogen 2.877 N/A LYS 17.A NZ ASP 14.A OD1 no hydrogen 2.994 N/A LYS 17.A NZ ASP 163.A OD2 no hydrogen 2.688 N/A HIS 18.A N ASP 14.A O no hydrogen 2.897 N/A HIS 18.A ND1 TYR 96.A OH no hydrogen 2.684 N/A HIS 18.A NE2 SER 99.A OG no hydrogen 2.928 N/A THR 19.A N VAL 15.A O no hydrogen 2.970 N/A THR 19.A OG1 VAL 15.A O no hydrogen 2.810 N/A VAL 20.A N LEU 16.A O no hydrogen 3.039 N/A GLN 21.A N LYS 17.A O no hydrogen 2.876 N/A GLN 21.A NE2 SER 99.A O no hydrogen 3.020 N/A SER 22.A N HIS 18.A O no hydrogen 2.996 N/A SER 22.A OG.A HIS 18.A O no hydrogen 2.949 N/A SER 22.A OG.A THR 19.A O no hydrogen 2.916 N/A SER 22.A OG.B HIS 18.A O no hydrogen 2.817 N/A LEU 23.A N THR 19.A O no hydrogen 3.180 N/A ILE 24.A N VAL 20.A O no hydrogen 3.014 N/A ILE 25.A N GLN 21.A O no hydrogen 2.954 N/A GLU 26.A N SER 22.A O no hydrogen 2.895 N/A SER 27.A N LEU 23.A O no hydrogen 3.140 N/A SER 27.A OG.B LEU 23.A O no hydrogen 3.470 N/A LEU 28.A N ILE 24.A O no hydrogen 2.958 N/A LYS 29.A N ILE 25.A O no hydrogen 3.016 N/A LYS 29.A NZ GLU 26.A OE2 no hydrogen 2.961 N/A LYS 29.A NZ LEU 106.A O no hydrogen 2.824 N/A GLU 30.A N SER 27.A O no hydrogen 3.040 N/A LYS 31.A N LEU 28.A O no hydrogen 3.469 N/A PHE 35.A N ASP 111.A OD1 no hydrogen 2.992 N/A LEU 36.A N ARG 157.A O no hydrogen 2.963 N/A TYR 37.A N SER 112.A O no hydrogen 2.833 N/A TYR 37.A OH ASP 39.A OD2 no hydrogen 2.738 N/A LEU 38.A N LEU 159.A O no hydrogen 2.846 N/A ASP 39.A N GLN 114.A O no hydrogen 2.978 N/A THR 40.A N LEU 161.A O no hydrogen 3.301 N/A THR 40.A OG1 HIS 41.A ND1 no hydrogen 2.760 N/A HIS 41.A ND1 THR 40.A OG1 no hydrogen 2.760 N/A ALA 42.A N THR 116.A O no hydrogen 2.887 N/A GLY 43.A N GLU 117.A OE1 no hydrogen 2.814 N/A ALA 44.A N TYR 47.A OH no hydrogen 2.929 N/A ARG 46.A NE GLU 129.A OE2 no hydrogen 2.870 N/A ARG 46.A NH2 GLU 129.A OE1 no hydrogen 2.944 N/A TYR 47.A N TYR 96.A O no hydrogen 2.905 N/A GLN 48.A N ARG 4.A O no hydrogen 2.829 N/A GLN 48.A NE2 TYR 3.A O no hydrogen 2.955 N/A LEU 49.A N ARG 94.A O no hydrogen 2.807 N/A SER 51.A OG GLY 50.A O no hydrogen 2.639 N/A SER 51.A OG HIS 53.A O no hydrogen 3.462 N/A SER 51.A OG GLU 55.A O no hydrogen 3.288 N/A THR 57.A N GLY 50.A O no hydrogen 3.151 N/A GLU 59.A N PHE 7.A O no hydrogen 3.041 N/A LEU 61.A N GLY 58.A O no hydrogen 3.293 N/A GLU 62.A N GLU 59.A O no hydrogen 2.996 N/A GLY 63.A N TYR 60.A O no hydrogen 3.082 N/A ILE 64.A N GLY 10.A O no hydrogen 2.931 N/A ALA 65.A N TYR 60.A O no hydrogen 3.142 N/A ARG 66.A N GLY 63.A O no hydrogen 3.018 N/A ARG 66.A NH1 LEU 263.A O no hydrogen 2.908 N/A ILE 67.A N ILE 64.A O no hydrogen 3.132 N/A TRP 68.A N ILE 64.A O no hydrogen 3.050 N/A GLN 69.A NE2 GLY 91.A O no hydrogen 3.204 N/A GLN 70.A N ILE 67.A O no hydrogen 3.193 N/A GLU 76.A N GLU 76.A OE1 no hydrogen 2.742 N/A LEU 77.A N PRO 74.A O no hydrogen 2.968 N/A GLU 78.A N ALA 75.A O no hydrogen 3.234 N/A TYR 80.A OH TYR 96.A OH no hydrogen 2.556 N/A ILE 81.A N LEU 77.A O no hydrogen 2.970 N/A ASN 82.A N GLU 78.A O no hydrogen 2.941 N/A VAL 83.A N ALA 79.A O no hydrogen 3.324 N/A VAL 84.A N TYR 80.A O no hydrogen 3.179 N/A LYS 85.A N ILE 81.A O no hydrogen 2.854 N/A HIS 86.A N ASN 82.A O no hydrogen 3.032 N/A PHE 87.A N VAL 83.A O no hydrogen 3.397 N/A PHE 87.A N VAL 84.A O no hydrogen 3.199 N/A ASN 88.A N LYS 85.A O no hydrogen 2.978 N/A ASN 88.A ND2 VAL 84.A O no hydrogen 2.873 N/A ASN 88.A ND2 TYR 95.A O no hydrogen 2.905 N/A ARG 89.A NE HIS 86.A ND1 no hydrogen 3.290 N/A ARG 89.A NE HIS 86.A O no hydrogen 3.262 N/A ARG 89.A NH2 HIS 86.A ND1 no hydrogen 2.999 N/A GLY 91.A N ASN 88.A O no hydrogen 3.008 N/A GLN 92.A N SER 90.A OG no hydrogen 3.425 N/A ARG 94.A N ASN 88.A OD1 no hydrogen 2.772 N/A TYR 95.A N ASN 88.A OD1 no hydrogen 3.012 N/A TYR 96.A N TYR 47.A O no hydrogen 2.857 N/A TYR 96.A OH HIS 18.A ND1 no hydrogen 2.684 N/A TYR 96.A OH TYR 80.A OH no hydrogen 2.556 N/A GLY 98.A N GLY 45.A O no hydrogen 2.735 N/A SER 99.A OG HIS 18.A NE2 no hydrogen 2.928 N/A LEU 101.A N GLY 98.A O no hydrogen 2.996 N/A ILE 102.A N GLY 98.A O no hydrogen 3.213 N/A ALA 103.A N SER 99.A O no hydrogen 2.978 N/A ARG 104.A N PRO 100.A O no hydrogen 2.850 N/A ARG 104.A NH1 ASP 133.A OD2 no hydrogen 3.036 N/A LEU 105.A N LEU 101.A O no hydrogen 3.156 N/A LEU 106.A N ILE 102.A O no hydrogen 3.125 N/A LEU 106.A N ALA 103.A O no hydrogen 3.307 N/A LEU 107.A N ALA 103.A O no hydrogen 2.951 N/A ARG 108.A N ASP 111.A OD2 no hydrogen 2.774 N/A ARG 108.A NE ASP 111.A OD2 no hydrogen 2.880 N/A ARG 108.A NH1 LYS 31.A O no hydrogen 2.765 N/A ARG 108.A NH2 LYS 33.A O no hydrogen 2.867 N/A ARG 108.A NH2 ASP 111.A OD1 no hydrogen 2.837 N/A GLN 110.A N GLN 110.A OE1 no hydrogen 2.789 N/A GLN 110.A NE2 ASP 32.A O no hydrogen 3.218 N/A ASP 111.A N ARG 108.A O no hydrogen 3.230 N/A SER 112.A N PHE 35.A O no hydrogen 3.064 N/A LEU 113.A N ARG 135.A O no hydrogen 2.881 N/A GLN 114.A N TYR 37.A O no hydrogen 2.908 N/A LEU 115.A N ARG 137.A O no hydrogen 2.886 N/A THR 116.A N ASP 39.A O no hydrogen 3.258 N/A THR 116.A OG1 ASP 39.A O no hydrogen 3.542 N/A THR 116.A OG1 THR 40.A O no hydrogen 2.858 N/A GLU 117.A N GLU 139.A O no hydrogen 3.152 N/A HIS 119.A N GLU 117.A OE2 no hydrogen 2.889 N/A SER 121.A N HIS 119.A ND1 no hydrogen 3.014 N/A TYR 123.A N HIS 119.A O no hydrogen 2.869 N/A LEU 126.A N ASP 122.A O no hydrogen 2.835 N/A ARG 127.A N TYR 123.A O no hydrogen 2.920 N/A ARG 127.A NH1 TYR 123.A OH no hydrogen 3.023 N/A SER 128.A N PRO 124.A O no hydrogen 3.178 N/A SER 128.A OG.A PRO 124.A O no hydrogen 3.208 N/A GLU 129.A N LEU 125.A O no hydrogen 3.120 N/A PHE 130.A N ARG 127.A O no hydrogen 3.158 N/A GLN 131.A N.B ARG 127.A O no hydrogen 3.130 N/A ASP 133.A N PHE 130.A O no hydrogen 3.044 N/A ARG 135.A N ASP 133.A OD1 no hydrogen 3.205 N/A ARG 135.A NE ASP 133.A OD1 no hydrogen 2.982 N/A ARG 135.A NH1 ARG 108.A O no hydrogen 2.984 N/A ARG 135.A NH2 ARG 104.A O no hydrogen 3.150 N/A ARG 135.A NH2 ASP 133.A OD2 no hydrogen 2.832 N/A ALA 136.A N ASP 133.A O no hydrogen 3.238 N/A ARG 137.A N LEU 113.A O no hydrogen 2.876 N/A GLU 139.A N LEU 115.A O no hydrogen 2.843 N/A LYS 140.A NZ LEU 118.A O no hydrogen 2.717 N/A GLN 145.A N ASP 142.A OD2 no hydrogen 2.916 N/A GLN 146.A N GLY 143.A O no hydrogen 3.049 N/A GLN 146.A NE2 ASP 142.A O no hydrogen 3.223 N/A LEU 147.A N PHE 144.A O no hydrogen 3.188 N/A LYS 148.A N GLN 145.A O no hydrogen 3.118 N/A ALA 149.A N GLN 145.A O no hydrogen 3.100 N/A LYS 150.A N GLN 146.A O no hydrogen 2.930 N/A LYS 150.A NZ GLU 139.A OE2 no hydrogen 3.158 N/A LYS 150.A NZ GLN 146.A OE1 no hydrogen 2.772 N/A SER 155.A OG ARG 157.A O no hydrogen 3.158 N/A ARG 156.A N PRO 153.A O no hydrogen 2.957 N/A ARG 157.A NH1 LEU 28.A O no hydrogen 3.226 N/A ARG 157.A NH1 LYS 33.A O no hydrogen 2.842 N/A ARG 157.A NH2 LEU 28.A O no hydrogen 2.975 N/A LEU 159.A N LEU 36.A O no hydrogen 2.909 N/A ILE 160.A N ILE 190.A O no hydrogen 2.785 N/A LEU 161.A N LEU 38.A O no hydrogen 2.811 N/A ILE 162.A N ALA 192.A O no hydrogen 2.828 N/A TYR 166.A OH TRP 194.A O no hydrogen 2.667 N/A GLU 167.A N ASP 171.A OD2 no hydrogen 2.638 N/A MET 168.A N ASP 171.A OD2 no hydrogen 3.054 N/A ASP 171.A N MET 168.A O no hydrogen 2.781 N/A GLN 173.A N LYS 169.A O no hydrogen 3.288 N/A ALA 174.A N THR 170.A O no hydrogen 2.895 N/A SER 177.A N GLN 173.A O no hydrogen 3.204 N/A SER 177.A OG GLN 173.A O no hydrogen 3.324 N/A GLY 178.A N ALA 174.A O no hydrogen 2.951 N/A ILE 179.A N VAL 175.A O no hydrogen 3.102 N/A ALA 180.A N VAL 176.A O no hydrogen 2.985 N/A GLU 181.A N SER 177.A O no hydrogen 3.134 N/A GLY 182.A N GLY 178.A O no hydrogen 2.980 N/A TYR 183.A N ILE 179.A O no hydrogen 2.840 N/A LYS 184.A N ALA 180.A O no hydrogen 3.049 N/A ARG 185.A N GLU 181.A O no hydrogen 3.419 N/A ARG 185.A N GLY 182.A O no hydrogen 2.967 N/A ARG 185.A NH1 GLU 181.A O no hydrogen 2.906 N/A ARG 185.A NH1 GLU 181.A OE1 no hydrogen 2.854 N/A PHE 186.A N GLY 182.A O no hydrogen 2.784 N/A GLY 189.A N PHE 186.A O no hydrogen 3.278 N/A ILE 190.A N GLY 158.A O no hydrogen 3.013 N/A TYR 191.A N ILE 242.A O no hydrogen 3.098 N/A TYR 191.A OH PHE 186.A O no hydrogen 2.780 N/A ALA 192.A N ILE 160.A O no hydrogen 2.862 N/A LEU 193.A N ILE 240.A O no hydrogen 2.892 N/A TRP 194.A N ILE 162.A O no hydrogen 2.994 N/A TRP 194.A NE1 SER 237.A OG no hydrogen 3.210 N/A TYR 195.A N GLY 238.A O no hydrogen 3.039 N/A TYR 195.A OH GLU 222.A OE1 no hydrogen 2.669 N/A VAL 197.A N ALA 236.A O no hydrogen 2.907 N/A ARG 200.A NE ASP 228.A OD1 no hydrogen 3.451 N/A ARG 200.A NE ASP 228.A OD2 no hydrogen 2.795 N/A ARG 200.A NH1 GLU 222.A OE1 no hydrogen 2.984 N/A ARG 200.A NH1 GLU 222.A OE2 no hydrogen 3.481 N/A ARG 200.A NH2 GLU 222.A OE2 no hydrogen 2.892 N/A ARG 200.A NH2 ASP 228.A OD1 no hydrogen 2.906 N/A GLN 202.A N LEU 199.A O no hydrogen 3.091 N/A LYS 204.A N ARG 200.A O no hydrogen 2.849 N/A ARG 205.A N GLN 201.A O no hydrogen 3.007 N/A MET 206.A N GLN 202.A O no hydrogen 2.984 N/A ILE 207.A N ILE 203.A O no hydrogen 2.898 N/A HIS 208.A N LYS 204.A O no hydrogen 2.947 N/A ASP 209.A N ARG 205.A O no hydrogen 2.866 N/A LEU 210.A N MET 206.A O no hydrogen 2.939 N/A GLU 211.A N ILE 207.A O no hydrogen 2.920 N/A ALA 212.A N HIS 208.A O no hydrogen 3.100 N/A THR 213.A N LEU 210.A O no hydrogen 3.177 N/A THR 213.A OG1 LEU 210.A O no hydrogen 2.627 N/A GLY 214.A N GLU 211.A O no hydrogen 3.228 N/A ILE 215.A N THR 213.A OG1 no hydrogen 3.256 N/A ILE 218.A N VAL 277.A O no hydrogen 2.788 N/A LEU 219.A N VAL 241.A O no hydrogen 2.898 N/A GLN 220.A N SER 274.A O no hydrogen 2.704 N/A GLN 220.A NE2 TYR 195.A OH no hydrogen 2.913 N/A ILE 221.A N MET 239.A O no hydrogen 2.912 N/A GLU 222.A N THR 272.A O no hydrogen 2.949 N/A LEU 223.A N SER 237.A O no hydrogen 2.993 N/A ALA 224.A N HIS 270.A O no hydrogen 2.770 N/A VAL 225.A N THR 235.A O no hydrogen 3.030 N/A LEU 226.A N THR 235.A O no hydrogen 3.243 N/A ARG 231.A N SER 229.A OG no hydrogen 2.822 N/A THR 235.A N VAL 197.A O no hydrogen 3.068 N/A THR 235.A OG1 VAL 197.A O no hydrogen 3.546 N/A SER 237.A N LEU 223.A O no hydrogen 3.130 N/A GLY 238.A N TYR 195.A O no hydrogen 2.965 N/A MET 239.A N ILE 221.A O no hydrogen 2.791 N/A ILE 240.A N LEU 193.A O no hydrogen 2.912 N/A VAL 241.A N LEU 219.A O no hydrogen 2.808 N/A ILE 242.A N TYR 191.A O no hydrogen 2.784 N/A ASN 243.A N LYS 217.A O no hydrogen 2.938 N/A ASN 243.A ND2 ALA 187.A O no hydrogen 2.878 N/A ASN 243.A ND2 GLY 189.A O no hydrogen 2.894 N/A TRP 246.A NE1 GLU 30.A OE1 no hydrogen 3.322 N/A LEU 248.A N PRO 245.A O no hydrogen 3.135 N/A GLN 251.A N LYS 247.A O no hydrogen 2.884 N/A MET 252.A N LEU 248.A O no hydrogen 2.917 N/A ASN 253.A N GLU 249.A O no hydrogen 2.972 N/A ASN 254.A N GLN 250.A O no hydrogen 2.981 N/A ASN 254.A ND2 GLU 76.A OE2 no hydrogen 3.506 N/A VAL 255.A N GLN 251.A O no hydrogen 3.092 N/A VAL 255.A N MET 252.A O no hydrogen 3.259 N/A LEU 256.A N MET 252.A O no hydrogen 2.912 N/A TRP 258.A NE1 ASP 72.A OD2 no hydrogen 3.031 N/A LEU 259.A N VAL 255.A O no hydrogen 2.902 N/A HIS 260.A N LEU 256.A O no hydrogen 2.818 N/A SER 261.A N PRO 257.A O no hydrogen 3.056 N/A SER 261.A OG.B PRO 257.A O no hydrogen 3.398 N/A SER 261.A OG.B TRP 258.A O no hydrogen 2.689 N/A LYS 262.A N TRP 258.A O no hydrogen 2.983 N/A LEU 263.A N LEU 259.A O no hydrogen 2.877 N/A VAL 264.A N HIS 260.A O no hydrogen 2.830 N/A GLY 267.A N VAL 264.A O no hydrogen 2.875 N/A THR 268.A OG1 VAL 225.A O no hydrogen 2.808 N/A HIS 270.A N ALA 224.A O no hydrogen 3.088 N/A HIS 270.A NE2 GLU 222.A OE2 no hydrogen 2.821 N/A THR 272.A N GLU 222.A O no hydrogen 2.970 N/A SER 274.A N GLN 220.A O no hydrogen 2.916 N/A TRP 275.A NE1 GLU 249.A OE2 no hydrogen 3.120 N/A ILE 276.A N ILE 218.A O no hydrogen 2.834 N/A VAL 277.A N ILE 218.A O no hydrogen 3.334 N/A