Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4grz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N GLU 4.A OE1 no hydrogen 2.753 N/A GLU 5.A N GLY 1.A O no hydrogen 3.240 N/A PHE 6.A N PHE 2.A O no hydrogen 2.925 N/A GLU 7.A N TRP 3.A O no hydrogen 2.889 N/A SER 8.A N GLU 4.A O no hydrogen 3.122 N/A LEU 9.A N GLU 5.A O no hydrogen 3.046 N/A GLN 10.A N PHE 6.A O no hydrogen 2.873 N/A LYS 11.A N GLU 7.A O no hydrogen 2.953 N/A GLN 12.A N SER 8.A O no hydrogen 3.041 N/A GLU 13.A N LEU 9.A O no hydrogen 2.986 N/A VAL 14.A N GLN 10.A O no hydrogen 3.188 N/A LYS 15.A N GLN 12.A O no hydrogen 3.032 N/A ASN 16.A N GLU 13.A O no hydrogen 3.005 N/A ASN 16.A ND2 GLU 13.A OE1 no hydrogen 2.920 N/A ASN 16.A ND2 ARG 250.A O no hydrogen 2.796 N/A LEU 17.A N LYS 15.A O no hydrogen 2.876 N/A ARG 20.A NH1 ASN 36.A O no hydrogen 3.270 N/A LEU 21.A N ASP 41.A OD2 no hydrogen 2.963 N/A GLU 22.A N ASP 41.A OD1 no hydrogen 3.028 N/A GLN 24.A N ARG 20.A O no hydrogen 3.272 N/A GLN 24.A N LEU 21.A O no hydrogen 3.135 N/A ARG 25.A N GLU 22.A O no hydrogen 3.173 N/A ARG 25.A NH1 GLU 22.A OE1 no hydrogen 2.833 N/A GLU 27.A N GLU 27.A OE1 no hydrogen 2.717 N/A ASN 28.A N ARG 25.A O no hydrogen 2.891 N/A ASN 28.A ND2 GLU 22.A O no hydrogen 2.909 N/A LYS 29.A N PRO 26.A O no hydrogen 3.093 N/A LYS 31.A N ASN 28.A O no hydrogen 2.879 N/A LYS 31.A NZ ASN 28.A OD1 no hydrogen 2.884 N/A ASN 32.A N LYS 29.A O no hydrogen 3.424 N/A ASN 32.A ND2 GLY 23.A O no hydrogen 3.025 N/A ARG 33.A N GLN 83.A OE1 no hydrogen 2.916 N/A ARG 33.A NE.A GLY 84.A O no hydrogen 2.962 N/A ARG 33.A NH1.A ASN 117.A O.A no hydrogen 3.081 N/A ARG 33.A NH1.B ASN 117.A O.B no hydrogen 3.117 N/A ARG 33.A NH2.A GLY 84.A O no hydrogen 3.522 N/A ARG 33.A NH2.A CYS 85.A O no hydrogen 2.707 N/A ARG 33.A NH2.B GLY 84.A O no hydrogen 3.252 N/A ARG 33.A NH2.B CYS 85.A O no hydrogen 3.190 N/A ILE 37.A N TYR 34.A O no hydrogen 3.134 N/A ASP 41.A N GLN 19.A O no hydrogen 2.835 N/A HIS 42.A NE2 ALA 251.A O no hydrogen 3.201 N/A SER 43.A N PHE 40.A O no hydrogen 3.242 N/A SER 43.A OG GLN 252.A O no hydrogen 2.687 N/A ARG 44.A NH1 ASP 58.A OD1 no hydrogen 3.042 N/A ARG 44.A NH2 ASP 58.A OD1 no hydrogen 3.382 N/A ARG 44.A NH2 ASP 58.A OD2 no hydrogen 2.951 N/A VAL 45.A N ALA 62.A O no hydrogen 2.988 N/A LEU 47.A N ASP 58.A O no hydrogen 2.847 N/A GLN 48.A N GLN 99.A OE1 no hydrogen 2.822 N/A ARG 50.A NH1 SER 57.A O no hydrogen 2.875 N/A ARG 50.A NH1 ASP 92.A OD1 no hydrogen 2.907 N/A ARG 50.A NH2 ASP 92.A OD1 no hydrogen 2.867 N/A ASN 53.A N ASP 51.A OD1 no hydrogen 2.816 N/A ILE 54.A N ASP 51.A O no hydrogen 2.950 N/A SER 57.A N ILE 54.A O no hydrogen 3.054 N/A SER 57.A OG ASP 51.A O no hydrogen 2.797 N/A SER 57.A OG ILE 54.A O no hydrogen 3.100 N/A TYR 59.A N GLY 56.A O no hydrogen 3.072 N/A TYR 59.A OH ASN 32.A OD1 no hydrogen 2.683 N/A ASN 61.A ND2 ASN 32.A OD1 no hydrogen 2.988 N/A ASN 61.A ND2 ILE 37.A O no hydrogen 2.944 N/A ASN 63.A N ALA 81.A O no hydrogen 2.930 N/A ASN 63.A ND2 PHE 40.A O no hydrogen 3.386 N/A ASN 63.A ND2 SER 43.A OG no hydrogen 2.825 N/A TYR 64.A N SER 43.A O no hydrogen 3.002 N/A TYR 64.A OH GLU 100.A OE2 no hydrogen 2.566 N/A ILE 65.A N TYR 79.A O no hydrogen 2.846 N/A LYS 66.A N GLN 252.A OE1 no hydrogen 2.900 N/A LEU 69.A N ASN 67.A OD1 no hydrogen 3.026 N/A LEU 70.A N ASN 67.A O no hydrogen 3.429 N/A GLY 71.A N GLU 74.A OE2 no hydrogen 2.991 N/A GLU 74.A N GLY 71.A O no hydrogen 3.177 N/A LYS 77.A N GLU 229.A OE1 no hydrogen 3.090 N/A LYS 77.A NZ ASN 195.A OD1 no hydrogen 3.391 N/A LYS 77.A NZ GLU 229.A OE1 no hydrogen 2.945 N/A TYR 79.A N ILE 65.A O no hydrogen 2.910 N/A TYR 79.A OH ASP 225.A OD2 no hydrogen 2.670 N/A ILE 80.A N ILE 207.A O no hydrogen 2.877 N/A ALA 81.A N ASN 63.A O no hydrogen 2.872 N/A SER 82.A N VAL 209.A O no hydrogen 2.924 N/A SER 82.A OG GLN 83.A O no hydrogen 2.935 N/A GLN 83.A N ASN 61.A O no hydrogen 3.009 N/A GLN 83.A NE2 LYS 31.A O no hydrogen 2.903 N/A GLY 84.A N SER 212.A O no hydrogen 2.846 N/A LEU 86.A N THR 89.A OG1 no hydrogen 2.930 N/A THR 89.A N LEU 86.A O no hydrogen 2.876 N/A THR 89.A OG1 LEU 86.A O no hydrogen 3.312 N/A PHE 93.A N THR 89.A O no hydrogen 2.975 N/A TRP 94.A N VAL 90.A O no hydrogen 3.216 N/A TRP 94.A NE1 TYR 122.A O no hydrogen 2.807 N/A GLN 95.A N ASN 91.A O no hydrogen 3.019 N/A GLN 95.A NE2 GLN 99.A OE1 no hydrogen 2.997 N/A MET 96.A N ASP 92.A O no hydrogen 3.008 N/A ALA 97.A N PHE 93.A O no hydrogen 2.926 N/A TRP 98.A N TRP 94.A O no hydrogen 2.905 N/A GLN 99.A N GLN 95.A O no hydrogen 2.909 N/A GLN 99.A NE2 ILE 46.A O no hydrogen 2.894 N/A GLN 99.A NE2 GLU 100.A OE2 no hydrogen 3.043 N/A GLU 100.A N MET 96.A O no hydrogen 3.100 N/A ASN 101.A N TRP 98.A O no hydrogen 3.118 N/A SER 102.A N ALA 97.A O no hydrogen 3.246 N/A SER 102.A OG PRO 206.A O no hydrogen 2.788 N/A ARG 103.A NE.A GLU 166.A O no hydrogen 2.781 N/A ARG 103.A NE.B ASN 101.A OD1 no hydrogen 2.815 N/A ARG 103.A NH2.A GLU 166.A O no hydrogen 2.773 N/A ARG 103.A NH2.B ASN 101.A OD1 no hydrogen 2.759 N/A ILE 105.A N TRP 168.A O no hydrogen 2.959 N/A VAL 106.A N ILE 208.A O no hydrogen 2.743 N/A MET 107.A N TYR 170.A O no hydrogen 2.790 N/A THR 108.A N HIS 210.A O no hydrogen 2.934 N/A THR 108.A OG1 HIS 210.A O no hydrogen 2.953 N/A THR 109.A OG1 ARG 110.A O no hydrogen 2.888 N/A THR 109.A OG1 GLU 113.A OE2 no hydrogen 3.047 N/A ARG 110.A N GLU 113.A OE2 no hydrogen 3.069 N/A ARG 110.A NE.B LEU 173.A O no hydrogen 2.930 N/A GLU 113.A N ARG 116.A O no hydrogen 2.929 N/A ARG 116.A N GLU 113.A O no hydrogen 2.872 N/A LYS 118.A N GLU 111.A O no hydrogen 2.803 N/A LYS 118.A NZ ASP 177.A OD2 no hydrogen 2.729 N/A CYS 119.A N GLU 111.A O no hydrogen 3.107 N/A CYS 119.A SG VAL 120.A O no hydrogen 3.418 N/A VAL 120.A N CYS 85.A O no hydrogen 2.988 N/A TYR 122.A OH HIS 169.A NE2 no hydrogen 2.785 N/A TYR 122.A OH HIS 210.A NE2 no hydrogen 2.636 N/A GLY 127.A N ASN 139.A O no hydrogen 2.988 N/A MET 128.A N GLU 125.A O no hydrogen 3.000 N/A GLN 129.A NE2 SER 136.A OG no hydrogen 2.803 N/A ARG 130.A N VAL 137.A O no hydrogen 2.883 N/A TYR 132.A N TYR 135.A O no hydrogen 2.790 N/A TYR 135.A N TYR 132.A O no hydrogen 3.169 N/A TYR 135.A OH GLN 95.A OE1 no hydrogen 2.670 N/A SER 136.A N SER 156.A O no hydrogen 2.783 N/A VAL 137.A N ARG 130.A O no hydrogen 2.858 N/A THR 138.A N GLN 154.A O no hydrogen 2.849 N/A ASN 139.A N MET 128.A O no hydrogen 3.019 N/A ASN 139.A ND2 PRO 124.A O no hydrogen 2.987 N/A ASN 139.A ND2 GLU 142.A OE1 no hydrogen 3.175 N/A CYS 140.A N THR 152.A O no hydrogen 2.888 N/A CYS 140.A SG.A THR 138.A O no hydrogen 3.867 N/A CYS 140.A SG.B THR 152.A O no hydrogen 3.303 N/A CYS 140.A SG.B THR 152.A OG1.B no hydrogen 3.446 N/A GLY 141.A N ASN 139.A OD1 no hydrogen 3.176 N/A HIS 143.A N LEU 150.A O no hydrogen 2.851 N/A THR 145.A N TYR 148.A O no hydrogen 2.862 N/A THR 145.A OG1 TYR 148.A O no hydrogen 3.167 N/A GLU 147.A N THR 145.A OG1 no hydrogen 3.148 N/A TYR 148.A N THR 145.A OG1 no hydrogen 3.142 N/A LYS 149.A N GLN 171.A O no hydrogen 2.813 N/A LEU 150.A N HIS 143.A O no hydrogen 2.916 N/A ARG 151.A N HIS 169.A O no hydrogen 2.819 N/A ARG 151.A NE GLU 142.A OE1 no hydrogen 3.348 N/A ARG 151.A NH1 GLN 171.A OE1 no hydrogen 3.123 N/A THR 152.A N GLY 141.A O no hydrogen 2.836 N/A THR 152.A OG1.B GLY 141.A O no hydrogen 3.064 N/A LEU 153.A N ILE 167.A O no hydrogen 2.846 N/A GLN 154.A N THR 138.A O no hydrogen 2.861 N/A VAL 155.A N ARG 165.A O no hydrogen 2.810 N/A SER 156.A N SER 136.A O no hydrogen 3.004 N/A SER 156.A OG.A LEU 163.A O no hydrogen 2.942 N/A SER 156.A OG.C PRO 157.A O no hydrogen 3.380 N/A SER 156.A OG.C LEU 163.A O no hydrogen 2.671 N/A LEU 158.A N PRO 134.A O no hydrogen 2.785 N/A ASN 160.A N PRO 157.A O no hydrogen 3.039 N/A LEU 163.A N ASN 160.A O no hydrogen 3.062 N/A ARG 165.A N VAL 155.A O no hydrogen 2.851 N/A ARG 165.A NH1.A TRP 98.A O no hydrogen 2.774 N/A ARG 165.A NH1.B TRP 98.A O no hydrogen 2.945 N/A ILE 167.A N LEU 153.A O no hydrogen 2.809 N/A TRP 168.A N ARG 103.A O no hydrogen 2.839 N/A HIS 169.A N ARG 151.A O no hydrogen 2.853 N/A HIS 169.A NE2 TYR 122.A OH no hydrogen 2.785 N/A TYR 170.A N ILE 105.A O no hydrogen 2.830 N/A GLN 171.A N LYS 149.A O no hydrogen 2.842 N/A GLN 171.A NE2 THR 109.A O no hydrogen 2.997 N/A TYR 172.A N MET 107.A O no hydrogen 2.858 N/A LEU 173.A N GLU 147.A O no hydrogen 2.842 N/A TRP 175.A NE1 GLY 179.A O no hydrogen 2.774 N/A ASP 177.A N GLU 113.A OE1 no hydrogen 2.952 N/A HIS 178.A ND1 GLN 258.A OE1 no hydrogen 2.727 N/A GLY 179.A N PRO 176.A O no hydrogen 2.947 N/A GLY 185.A N GLU 183.A OE1 no hydrogen 2.834 N/A GLY 185.A N GLU 183.A OE2 no hydrogen 2.951 N/A LEU 188.A N PRO 184.A O no hydrogen 3.062 N/A SER 189.A N GLY 185.A O no hydrogen 2.973 N/A SER 189.A OG.B GLY 185.A O no hydrogen 3.339 N/A SER 189.A OG.B GLY 186.A O no hydrogen 2.831 N/A PHE 190.A N GLY 186.A O no hydrogen 2.945 N/A LEU 191.A N VAL 187.A O no hydrogen 2.833 N/A ASP 192.A N LEU 188.A O no hydrogen 2.892 N/A GLN 193.A N SER 189.A O no hydrogen 3.112 N/A ILE 194.A N PHE 190.A O no hydrogen 3.060 N/A ASN 195.A N LEU 191.A O no hydrogen 2.761 N/A GLN 196.A N ASP 192.A O no hydrogen 2.990 N/A GLN 196.A NE2 ASP 192.A OD1.B no hydrogen 3.056 N/A ARG 197.A N GLN 193.A O no hydrogen 2.922 N/A ARG 197.A NE TYR 170.A OH no hydrogen 3.107 N/A GLN 198.A N ILE 194.A O no hydrogen 2.973 N/A GLN 198.A NE2 GLY 205.A O no hydrogen 2.955 N/A GLU 199.A N ASN 195.A O no hydrogen 2.904 N/A SER 200.A N GLN 196.A O no hydrogen 3.048 N/A SER 200.A N ARG 197.A O no hydrogen 3.123 N/A SER 200.A OG ARG 197.A O no hydrogen 2.650 N/A LEU 201.A N GLN 198.A O no hydrogen 3.147 N/A ALA 204.A N LEU 201.A O no hydrogen 3.240 N/A GLY 205.A N ASN 101.A O no hydrogen 2.857 N/A ILE 207.A N THR 78.A O no hydrogen 3.077 N/A ILE 208.A N VAL 104.A O no hydrogen 3.144 N/A VAL 209.A N ILE 80.A O no hydrogen 2.785 N/A HIS 210.A N VAL 106.A O no hydrogen 2.861 N/A HIS 210.A ND1 SER 211.A O no hydrogen 2.984 N/A HIS 210.A NE2 TYR 122.A OH no hydrogen 2.636 N/A SER 211.A OG THR 218.A OG1 no hydrogen 2.714 N/A SER 212.A OG LYS 118.A O no hydrogen 2.761 N/A GLY 214.A N SER 211.A OG no hydrogen 3.007 N/A ARG 217.A NH1 GLU 113.A OE2 no hydrogen 2.899 N/A ARG 217.A NH1 TRP 175.A O no hydrogen 2.900 N/A ARG 217.A NH2 THR 109.A OG1 no hydrogen 3.045 N/A THR 218.A OG1 SER 211.A OG no hydrogen 2.714 N/A GLY 219.A N ILE 215.A O no hydrogen 3.116 N/A THR 220.A N GLY 216.A O no hydrogen 2.970 N/A THR 220.A OG1 GLY 216.A O no hydrogen 2.765 N/A ILE 221.A N ARG 217.A O no hydrogen 2.970 N/A ILE 222.A N THR 218.A O no hydrogen 3.056 N/A VAL 223.A N GLY 219.A O no hydrogen 3.031 N/A ILE 224.A N THR 220.A O no hydrogen 3.000 N/A ASP 225.A N ILE 221.A O no hydrogen 2.919 N/A MET 226.A N ILE 222.A O no hydrogen 2.859 N/A LEU 227.A N VAL 223.A O no hydrogen 3.044 N/A MET 228.A N ILE 224.A O no hydrogen 2.854 N/A GLU 229.A N ASP 225.A O no hydrogen 2.998 N/A ASN 230.A N MET 226.A O no hydrogen 3.083 N/A ILE 231.A N LEU 227.A O no hydrogen 3.007 N/A SER 232.A N MET 228.A O no hydrogen 2.821 N/A SER 232.A OG MET 228.A O no hydrogen 3.086 N/A THR 233.A N GLU 229.A O no hydrogen 2.888 N/A THR 233.A OG1 GLU 229.A O no hydrogen 2.905 N/A LYS 234.A N ASN 230.A O no hydrogen 2.748 N/A LYS 234.A NZ GLU 74.A OE1 no hydrogen 2.403 N/A GLY 235.A N ILE 231.A O no hydrogen 3.037 N/A CYS 238.A N GLY 235.A O no hydrogen 3.229 N/A CYS 238.A SG GLY 235.A O no hydrogen 3.315 N/A LYS 244.A N ASP 241.A OD1 no hydrogen 3.124 N/A THR 245.A N ASP 241.A O no hydrogen 3.048 N/A THR 245.A OG1 ASP 241.A O no hydrogen 2.788 N/A ILE 246.A N ILE 242.A O no hydrogen 2.910 N/A GLN 247.A N GLN 243.A O no hydrogen 2.955 N/A GLN 247.A NE2 GLN 12.A OE1 no hydrogen 2.335 N/A MET 248.A N LYS 244.A O no hydrogen 2.984 N/A VAL 249.A N THR 245.A O no hydrogen 2.951 N/A ARG 250.A N ILE 246.A O no hydrogen 2.857 N/A ARG 250.A NE MET 256.A O no hydrogen 2.764 N/A ARG 250.A NH1 GLN 10.A OE1 no hydrogen 2.977 N/A ARG 250.A NH2 GLN 10.A OE1 no hydrogen 2.946 N/A ARG 250.A NH2 MET 256.A O no hydrogen 3.356 N/A ARG 250.A NH2 VAL 257.A O no hydrogen 2.778 N/A ALA 251.A N GLN 247.A O no hydrogen 3.065 N/A GLN 252.A N VAL 249.A O no hydrogen 2.953 N/A GLN 252.A NE2 LYS 66.A O no hydrogen 2.971 N/A GLN 252.A NE2 MET 248.A O no hydrogen 3.147 N/A ARG 253.A N VAL 249.A O no hydrogen 3.104 N/A ARG 253.A NE GLY 214.A O no hydrogen 2.839 N/A ARG 253.A NH1 ASN 61.A OD1 no hydrogen 2.903 N/A ARG 253.A NH1 ASN 63.A OD1 no hydrogen 2.843 N/A ARG 253.A NH2 ASN 61.A OD1 no hydrogen 2.936 N/A ARG 253.A NH2 ALA 213.A O no hydrogen 3.046 N/A GLY 255.A N GLU 13.A OE2 no hydrogen 2.897 N/A VAL 257.A N ILE 215.A O no hydrogen 2.878 N/A GLN 258.A N GLN 262.A OE1 no hydrogen 2.866 N/A THR 259.A N GLN 262.A OE1 no hydrogen 3.266 N/A GLN 262.A N THR 259.A OG1 no hydrogen 3.010 N/A GLN 262.A NE2 GLY 179.A O no hydrogen 3.076 N/A TYR 263.A N THR 259.A O no hydrogen 3.004 N/A TYR 263.A OH GLU 5.A OE1 no hydrogen 2.583 N/A LYS 264.A N GLU 260.A O no hydrogen 2.904 N/A PHE 265.A N ALA 261.A O no hydrogen 2.872 N/A ILE 266.A N GLN 262.A O no hydrogen 3.137 N/A ILE 266.A N TYR 263.A O no hydrogen 3.206 N/A TYR 267.A OH TYR 263.A OH no hydrogen 3.036 N/A VAL 268.A N LYS 264.A O no hydrogen 2.982 N/A ALA 269.A N PHE 265.A O no hydrogen 2.810 N/A ILE 270.A N ILE 266.A O no hydrogen 2.967 N/A ALA 271.A N TYR 267.A O no hydrogen 2.933 N/A GLN 272.A N VAL 268.A O no hydrogen 3.080 N/A GLN 272.A NE2 GLU 183.A OE2 no hydrogen 3.089 N/A PHE 273.A N ALA 269.A O no hydrogen 2.900 N/A ILE 274.A N ILE 270.A O no hydrogen 2.879 N/A GLU 275.A N ALA 271.A O no hydrogen 3.100 N/A THR 276.A N GLN 272.A O no hydrogen 2.944 N/A THR 276.A OG1 GLN 272.A O no hydrogen 3.316 N/A THR 277.A N PHE 273.A O no hydrogen 2.888 N/A THR 277.A OG1 PHE 273.A O no hydrogen 2.781 N/A LYS 278.A N ILE 274.A O no hydrogen 2.797 N/A LYS 278.A NZ GLU 275.A OE1 no hydrogen 3.323 N/A LYS 279.A N GLU 275.A O no hydrogen 2.954 N/A LYS 280.A N THR 276.A O no hydrogen 3.061 N/A LEU 281.A N THR 277.A O no hydrogen 3.241 N/A GLU 282.A N LYS 278.A O no hydrogen 3.249 N/A