Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gyb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 7.A N ASP 149.A O no hydrogen 2.832 N/A GLY 11.A N ASP 50.A OD1 no hydrogen 2.753 N/A GLU 12.A N ASP 50.A OD1 no hydrogen 3.041 N/A ARG 14.A N THR 51.A O no hydrogen 2.780 N/A MET 18.A N GLU 55.A O no hydrogen 3.127 N/A TYR 19.A N GLY 31.A O no hydrogen 2.942 N/A ALA 20.A N THR 57.A O no hydrogen 3.162 N/A GLU 21.A N GLY 29.A O no hydrogen 2.963 N/A LYS 22.A NZ ASP 61.A OD1 no hydrogen 2.814 N/A LEU 23.A N GLN 27.A O no hydrogen 2.766 N/A GLY 26.A N LEU 23.A O no hydrogen 3.028 N/A GLN 27.A N ASP 25.A OD2 no hydrogen 3.173 N/A GLN 27.A NE2 ASP 25.A OD1 no hydrogen 3.221 N/A GLN 27.A NE2 ASP 25.A OD2 no hydrogen 3.539 N/A MET 28.A N ASN 136.A O no hydrogen 2.939 N/A GLY 29.A N GLU 21.A O no hydrogen 3.047 N/A TYR 30.A OH SER 65.A O no hydrogen 2.667 N/A GLY 31.A N TYR 19.A O no hydrogen 3.057 N/A GLY 35.A N GLU 21.A OE1 no hydrogen 2.855 N/A LYS 36.A N GLU 33.A O no hydrogen 2.973 N/A SER 38.A N TYR 30.A O no hydrogen 2.975 N/A SER 38.A OG PRO 40.A O no hydrogen 2.877 N/A GLY 41.A N TYR 139.A O no hydrogen 2.772 N/A ILE 44.A N PRO 141.A O no hydrogen 3.114 N/A VAL 46.A N ILE 143.A O no hydrogen 3.014 N/A ASN 47.A N ASP 50.A OD2 no hydrogen 2.935 N/A GLU 48.A N ARG 145.A O no hydrogen 2.905 N/A GLY 49.A N THR 99.A OG1 no hydrogen 2.807 N/A ASP 50.A N ASN 47.A O no hydrogen 2.831 N/A THR 51.A N GLU 12.A O no hydrogen 2.943 N/A LEU 52.A N TRP 97.A O no hydrogen 2.770 N/A HIS 53.A N ARG 14.A O no hydrogen 2.830 N/A HIS 53.A ND1 THR 96.A OG1 no hydrogen 2.870 N/A ILE 54.A N TYR 95.A O no hydrogen 2.777 N/A GLU 55.A N LEU 16.A O no hydrogen 2.748 N/A PHE 56.A N ARG 93.A O no hydrogen 2.729 N/A THR 57.A N MET 18.A O no hydrogen 2.907 N/A THR 57.A OG1 THR 92.A OG1 no hydrogen 2.802 N/A ASN 58.A N GLY 91.A O no hydrogen 2.940 N/A ASN 58.A ND2 VAL 62.A O no hydrogen 2.885 N/A ASN 58.A ND2 VAL 87.A O no hydrogen 3.141 N/A ASN 58.A ND2 GLU 88.A O no hydrogen 3.436 N/A THR 59.A N ALA 20.A O no hydrogen 3.113 N/A THR 59.A OG1 ALA 20.A O no hydrogen 2.852 N/A MET 60.A N ASN 58.A OD1 no hydrogen 2.863 N/A ARG 63.A NE ASP 86.A OD2 no hydrogen 2.829 N/A ARG 63.A NH2 ASP 86.A OD1 no hydrogen 3.212 N/A ALA 64.A N VAL 87.A O no hydrogen 3.182 N/A SER 65.A N ASP 122.A OD1 no hydrogen 3.067 N/A SER 65.A OG GLY 79.A O no hydrogen 2.623 N/A LEU 66.A N TYR 95.A OH no hydrogen 3.468 N/A HIS 67.A N HIS 121.A O no hydrogen 2.849 N/A HIS 67.A ND1 ASP 78.A O no hydrogen 2.971 N/A HIS 69.A N HIS 119.A O no hydrogen 2.934 N/A LEU 71.A N HIS 69.A O no hydrogen 2.795 N/A ASP 72.A N ARG 98.A O no hydrogen 2.903 N/A SER 77.A N GLU 74.A O no hydrogen 2.854 N/A ASP 78.A N ILE 75.A O no hydrogen 3.156 N/A THR 80.A N SER 85.A OG no hydrogen 3.158 N/A THR 80.A OG1 ASP 78.A OD1 no hydrogen 2.534 N/A ASN 83.A ND2 ASP 78.A OD1 no hydrogen 2.675 N/A LYS 84.A N ALA 81.A O no hydrogen 2.952 N/A SER 85.A N THR 80.A O no hydrogen 2.947 N/A SER 85.A OG THR 80.A O no hydrogen 3.419 N/A VAL 87.A N ALA 64.A O no hydrogen 2.853 N/A GLU 88.A N GLU 88.A OE2 no hydrogen 2.582 N/A GLY 90.A N ASN 58.A O no hydrogen 2.808 N/A GLY 91.A N GLU 88.A O no hydrogen 2.856 N/A THR 92.A OG1 THR 57.A OG1 no hydrogen 2.802 N/A ARG 93.A N PHE 56.A O no hydrogen 2.772 N/A ARG 93.A NH2 SER 76.A O no hydrogen 3.006 N/A TYR 95.A N ILE 54.A O no hydrogen 2.911 N/A TYR 95.A OH SER 85.A O no hydrogen 2.672 N/A THR 96.A N SER 77.A OG no hydrogen 3.115 N/A THR 96.A OG1 HIS 53.A ND1 no hydrogen 2.870 N/A TRP 97.A N LEU 52.A O no hydrogen 2.883 N/A ARG 98.A N ASP 72.A O no hydrogen 2.730 N/A ARG 98.A NH1 GLU 74.A OE2 no hydrogen 3.469 N/A THR 99.A N ASP 50.A O no hydrogen 3.183 N/A THR 99.A OG1 ASN 47.A O no hydrogen 3.401 N/A THR 99.A OG1 ASP 50.A O no hydrogen 2.898 N/A HIS 100.A N SER 114.A OG no hydrogen 2.930 N/A HIS 100.A ND1 ASP 72.A OD2 no hydrogen 2.646 N/A HIS 100.A NE2 PRO 112.A O no hydrogen 2.687 N/A GLY 103.A N ARG 111.A O no hydrogen 3.180 N/A ARG 104.A NE GLY 108.A O no hydrogen 2.959 N/A ARG 104.A NH2 GLY 108.A O no hydrogen 3.317 N/A ARG 105.A N THR 109.A O no hydrogen 2.806 N/A ARG 105.A NH1 THR 109.A OG1 no hydrogen 2.935 N/A GLY 108.A N ARG 105.A O no hydrogen 3.024 N/A THR 109.A N ASP 107.A OD1 no hydrogen 2.948 N/A THR 109.A OG1 ASP 107.A OD1 no hydrogen 2.608 N/A THR 109.A OG1 ASP 107.A OD2 no hydrogen 3.568 N/A ARG 111.A N GLY 103.A O no hydrogen 2.825 N/A SER 114.A N HIS 100.A O no hydrogen 3.045 N/A SER 114.A OG HIS 100.A ND1 no hydrogen 3.134 N/A SER 114.A OG HIS 100.A O no hydrogen 3.535 N/A ALA 115.A N GLU 48.A OE2 no hydrogen 2.914 N/A GLY 116.A N VAL 144.A O no hydrogen 3.030 N/A TYR 117.A OH GLU 185.A OE2 no hydrogen 2.621 N/A TRP 118.A N VAL 142.A O no hydrogen 2.722 N/A TRP 118.A NE1 SER 114.A O no hydrogen 2.841 N/A HIS 119.A NE2 ALA 231.A O no hydrogen 2.984 N/A TYR 120.A N GLY 140.A O no hydrogen 2.865 N/A TYR 120.A OH PRO 42.A O no hydrogen 2.699 N/A HIS 121.A N HIS 67.A O no hydrogen 2.857 N/A HIS 121.A ND1 ASP 122.A O no hydrogen 2.804 N/A ASP 122.A N LEU 138.A O no hydrogen 3.138 N/A HIS 123.A N SER 65.A OG no hydrogen 3.234 N/A HIS 123.A ND1 HIS 123.A O no hydrogen 2.770 N/A HIS 123.A ND1 GLU 128.A O no hydrogen 2.884 N/A VAL 124.A N ASP 122.A OD1 no hydrogen 3.160 N/A VAL 125.A N ASP 122.A OD2 no hydrogen 2.850 N/A THR 127.A OG1 THR 131.A OG1 no hydrogen 3.334 N/A HIS 129.A N THR 127.A OG1 no hydrogen 3.014 N/A GLY 130.A N THR 127.A O no hydrogen 3.046 N/A THR 131.A N THR 127.A OG1 no hydrogen 3.376 N/A THR 131.A OG1 THR 127.A OG1 no hydrogen 3.334 N/A GLY 132.A N VAL 125.A O no hydrogen 2.920 N/A GLY 133.A N VAL 125.A O no hydrogen 3.112 N/A ILE 134.A N GLY 130.A O no hydrogen 2.830 N/A ARG 135.A N THR 131.A O no hydrogen 3.072 N/A ASN 136.A N GLY 132.A O no hydrogen 2.925 N/A GLY 137.A N GLY 133.A O no hydrogen 3.059 N/A GLY 137.A N ILE 134.A O no hydrogen 3.190 N/A LEU 138.A N GLY 133.A O no hydrogen 2.936 N/A TYR 139.A N GLY 137.A O no hydrogen 2.860 N/A TYR 139.A OH ASN 167.A OD1 no hydrogen 2.667 N/A GLY 140.A N TYR 120.A O no hydrogen 2.923 N/A VAL 142.A N TRP 118.A O no hydrogen 3.038 N/A ILE 143.A N ILE 44.A O no hydrogen 2.836 N/A VAL 144.A N GLY 116.A O no hydrogen 3.014 N/A ARG 145.A N VAL 46.A O no hydrogen 2.890 N/A ARG 145.A NE GLU 45.A OE2 no hydrogen 2.688 N/A ARG 145.A NH1 GLU 185.A OE2 no hydrogen 2.738 N/A ARG 145.A NH2 GLU 45.A OE1 no hydrogen 3.231 N/A ARG 145.A NH2 GLU 45.A OE2 no hydrogen 3.381 N/A ARG 145.A NH2 GLU 185.A OE1 no hydrogen 2.804 N/A ARG 145.A NH2 GLU 185.A OE2 no hydrogen 3.459 N/A ARG 146.A N ASP 149.A OD2 no hydrogen 2.930 N/A ARG 146.A NE GLU 48.A OE1 no hydrogen 2.882 N/A ARG 146.A NE GLU 48.A OE2 no hydrogen 3.362 N/A ARG 146.A NH2 GLU 48.A OE2 no hydrogen 2.600 N/A GLY 148.A N ALA 7.A O no hydrogen 2.954 N/A ASP 149.A N ARG 146.A O no hydrogen 2.901 N/A LEU 151.A N ARG 5.A O no hydrogen 2.943 N/A ASP 153.A N ARG 183.A O no hydrogen 2.751 N/A THR 155.A OG1 GLU 185.A OE1 no hydrogen 2.610 N/A HIS 156.A N GLU 185.A O no hydrogen 2.785 N/A ILE 158.A N VAL 187.A O no hydrogen 2.838 N/A VAL 159.A N ASN 166.A OD1 no hydrogen 2.788 N/A PHE 160.A N ILE 189.A O no hydrogen 2.857 N/A ASN 161.A N THR 164.A O no hydrogen 2.926 N/A ASN 161.A ND2 ILE 134.A O no hydrogen 3.071 N/A ASN 161.A ND2 ARG 135.A O no hydrogen 3.674 N/A ASN 161.A ND2 ASN 167.A OD1 no hydrogen 2.854 N/A ASP 162.A N HIS 191.A O no hydrogen 3.051 N/A THR 164.A N ASN 161.A O no hydrogen 2.933 N/A THR 164.A OG1 ASN 161.A O no hydrogen 2.890 N/A ASN 166.A N VAL 159.A O no hydrogen 2.830 N/A ASN 166.A ND2 THR 157.A O no hydrogen 3.167 N/A ASN 167.A N THR 164.A OG1 no hydrogen 3.132 N/A ASN 167.A ND2 GLN 27.A OE1 no hydrogen 3.004 N/A ASN 167.A ND2 ARG 135.A O no hydrogen 2.978 N/A ARG 168.A N ILE 165.A O no hydrogen 3.110 N/A HIS 171.A N GLY 262.A O no hydrogen 3.161 N/A THR 172.A OG1 LYS 169.A O no hydrogen 2.662 N/A PHE 176.A N LEU 266.A O no hydrogen 2.925 N/A ALA 178.A N LEU 268.A O no hydrogen 2.833 N/A THR 179.A N ASP 182.A OD2 no hydrogen 2.668 N/A VAL 180.A N LYS 270.A O no hydrogen 2.945 N/A GLY 181.A N ALA 240.A O no hydrogen 2.836 N/A ASP 182.A N THR 179.A O no hydrogen 2.987 N/A ARG 183.A N ASP 153.A OD2 no hydrogen 2.811 N/A ARG 183.A NH1 GLN 237.A OE1 no hydrogen 2.897 N/A VAL 184.A N ILE 238.A O no hydrogen 2.923 N/A GLU 185.A N ALA 154.A O no hydrogen 2.809 N/A ILE 186.A N PHE 236.A O no hydrogen 2.884 N/A VAL 187.A N HIS 156.A O no hydrogen 2.830 N/A MET 188.A N PHE 234.A O no hydrogen 2.809 N/A ILE 189.A N ILE 158.A O no hydrogen 2.973 N/A THR 190.A N ASP 232.A O no hydrogen 3.100 N/A THR 190.A OG1 THR 228.A OG1 no hydrogen 2.666 N/A HIS 191.A N PHE 160.A O no hydrogen 2.796 N/A GLU 193.A N ASP 162.A OD1 no hydrogen 2.920 N/A HIS 196.A N THR 228.A O no hydrogen 2.816 N/A PHE 198.A N LYS 226.A O no hydrogen 2.927 N/A HIS 199.A N HIS 252.A O no hydrogen 2.962 N/A HIS 199.A ND1 ASP 224.A O no hydrogen 2.714 N/A MET 200.A N ASP 224.A O no hydrogen 3.295 N/A HIS 201.A N MET 250.A O no hydrogen 2.851 N/A HIS 203.A ND1 HIS 201.A O no hydrogen 2.882 N/A TRP 205.A N ILE 223.A O no hydrogen 2.921 N/A ALA 206.A N GLY 211.A O no hydrogen 2.950 N/A ASP 207.A N ARG 221.A O no hydrogen 3.006 N/A ASN 208.A ND2 ILE 212.A O no hydrogen 3.018 N/A ASN 208.A ND2 ASP 218.A OD2 no hydrogen 2.867 N/A ARG 209.A NH1 ASP 149.A OD2 no hydrogen 2.994 N/A ARG 209.A NH2 ASP 149.A OD1 no hydrogen 2.928 N/A ARG 209.A NH2 ASP 149.A OD2 no hydrogen 3.565 N/A GLY 211.A N ASN 208.A OD1 no hydrogen 2.833 N/A ILE 212.A N THR 210.A OG1 no hydrogen 3.207 N/A ASP 218.A N GLY 215.A O no hydrogen 3.472 N/A SER 220.A N ASP 218.A OD1 no hydrogen 2.986 N/A SER 220.A OG ASP 218.A OD1 no hydrogen 2.492 N/A ILE 223.A N TRP 205.A O no hydrogen 2.811 N/A LYS 226.A N PHE 198.A O no hydrogen 2.965 N/A LYS 226.A NZ ASP 207.A OD1 no hydrogen 3.564 N/A LYS 226.A NZ ASP 207.A OD2 no hydrogen 3.120 N/A THR 228.A N HIS 196.A O no hydrogen 2.828 N/A THR 228.A OG1 THR 190.A OG1 no hydrogen 2.666 N/A GLY 229.A N ASP 232.A OD2 no hydrogen 2.990 N/A ALA 231.A N THR 190.A O no hydrogen 2.600 N/A ASP 232.A N GLY 229.A O no hydrogen 2.931 N/A SER 233.A OG TYR 117.A O no hydrogen 2.723 N/A PHE 234.A N MET 188.A O no hydrogen 3.029 N/A PHE 236.A N ILE 186.A O no hydrogen 3.062 N/A GLN 237.A NE2 VAL 150.A O no hydrogen 2.875 N/A GLN 237.A NE2 GLU 185.A OE2 no hydrogen 3.184 N/A ILE 238.A N VAL 184.A O no hydrogen 2.974 N/A ALA 240.A N ASP 182.A O no hydrogen 2.819 N/A GLY 241.A N HIS 203.A NE2 no hydrogen 2.979 N/A GLU 242.A N ILE 239.A O no hydrogen 2.965 N/A VAL 244.A N GLY 241.A O no hydrogen 2.885 N/A GLY 245.A N GLY 241.A O no hydrogen 2.714 N/A GLY 247.A N VAL 269.A O no hydrogen 2.860 N/A TRP 249.A N PHE 267.A O no hydrogen 3.024 N/A TRP 249.A NE1 GLY 245.A O no hydrogen 3.179 N/A TYR 251.A N GLY 265.A O no hydrogen 3.164 N/A TYR 251.A OH PRO 174.A O no hydrogen 2.835 N/A HIS 252.A N HIS 199.A O no hydrogen 2.976 N/A HIS 252.A ND1 CYS 253.A O no hydrogen 2.764 N/A CYS 253.A N MET 263.A O no hydrogen 3.109 N/A CYS 253.A SG HIS 196.A ND1 no hydrogen 3.892 N/A CYS 253.A SG THR 197.A O no hydrogen 3.748 N/A CYS 253.A SG HIS 258.A ND1 no hydrogen 3.643 N/A HIS 254.A N THR 197.A O no hydrogen 2.734 N/A HIS 254.A N THR 197.A OG1 no hydrogen 3.244 N/A HIS 254.A ND1 HIS 254.A O no hydrogen 2.621 N/A HIS 258.A N VAL 255.A O no hydrogen 2.962 N/A SER 259.A N VAL 255.A O no hydrogen 3.170 N/A SER 259.A OG GLN 256.A O no hydrogen 3.050 N/A ASP 260.A N GLN 256.A O no hydrogen 3.138 N/A MET 261.A N SER 257.A O no hydrogen 2.918 N/A MET 261.A N HIS 258.A O no hydrogen 3.249 N/A GLY 262.A N SER 259.A O no hydrogen 3.156 N/A MET 263.A N HIS 258.A O no hydrogen 2.955 N/A VAL 264.A N GLY 262.A O no hydrogen 2.874 N/A GLY 265.A N TYR 251.A O no hydrogen 2.904 N/A LEU 266.A N ASP 175.A OD2 no hydrogen 2.945 N/A PHE 267.A N TRP 249.A O no hydrogen 2.685 N/A LEU 268.A N PHE 176.A O no hydrogen 2.707 N/A VAL 269.A N GLY 247.A O no hydrogen 3.014 N/A LYS 270.A N ALA 178.A O no hydrogen 2.744 N/A LYS 270.A NZ GLU 177.A OE1 no hydrogen 2.985 N/A LYS 271.A N THR 275.A O no hydrogen 3.038 N/A GLY 274.A N LYS 271.A O no hydrogen 2.717 N/A THR 275.A N ASP 273.A OD1 no hydrogen 2.785 N/A THR 275.A OG1 ASP 273.A OD1 no hydrogen 2.473 N/A THR 275.A OG1 ASP 273.A OD2 no hydrogen 3.266 N/A TYR 279.A N.A ILE 276.A O no hydrogen 3.295 N/A TYR 279.A N.B ILE 276.A O no hydrogen 2.679 N/A