Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yth_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N TYR 27.A OH no hydrogen 3.066 N/A GLU 5.A N SER 78.A OG no hydrogen 2.950 N/A HIS 7.A N GLU 4.A O no hydrogen 3.124 N/A LEU 8.A N GLU 5.A O no hydrogen 3.102 N/A LYS 9.A N ARG 26.A O no hydrogen 2.847 N/A LYS 9.A NZ ASP 28.A OD2 no hydrogen 2.804 N/A LYS 9.A NZ ASN 33.A OD1 no hydrogen 2.950 N/A LEU 11.A N MET 24.A O no hydrogen 3.005 N/A GLN 12.A N MET 24.A O no hydrogen 3.347 N/A GLN 12.A NE2 GLN 13.A O no hydrogen 3.612 N/A LEU 14.A N VAL 22.A O no hydrogen 2.780 N/A GLY 15.A N VAL 22.A O no hydrogen 3.196 N/A GLY 17.A N GLY 20.A O no hydrogen 2.915 N/A GLY 20.A N GLY 17.A O no hydrogen 2.934 N/A SER 21.A N LYS 42.A O no hydrogen 2.966 N/A VAL 22.A N GLY 15.A O no hydrogen 2.805 N/A GLU 23.A N VAL 40.A O no hydrogen 2.923 N/A MET 24.A N GLN 12.A O no hydrogen 2.780 N/A CYS 25.A N VAL 38.A O no hydrogen 2.910 N/A ARG 26.A N LYS 9.A O no hydrogen 2.833 N/A ARG 26.A NH1 GLY 35.A O no hydrogen 2.780 N/A TYR 27.A N GLU 36.A O no hydrogen 2.776 N/A ASP 28.A N HIS 7.A O no hydrogen 2.853 N/A GLN 31.A N ASP 28.A O no hydrogen 3.223 N/A GLN 31.A NE2 PRO 29.A O no hydrogen 3.031 N/A ASN 33.A N ASP 28.A OD2 no hydrogen 2.798 N/A THR 34.A N ASP 32.A OD1 no hydrogen 3.278 N/A THR 34.A OG1 ASP 32.A OD1 no hydrogen 2.662 N/A THR 34.A OG1 ASP 32.A OD2 no hydrogen 3.364 N/A GLY 35.A N ASP 28.A OD1 no hydrogen 2.940 N/A VAL 38.A N CYS 25.A O no hydrogen 2.771 N/A ALA 39.A N MET 88.A O no hydrogen 2.786 N/A VAL 40.A N GLU 23.A O no hydrogen 2.774 N/A LYS 41.A N LEU 86.A O no hydrogen 2.824 N/A LYS 41.A NZ GLU 57.A OE1 no hydrogen 2.868 N/A LYS 41.A NZ GLU 57.A OE2 no hydrogen 3.061 N/A LYS 42.A N SER 21.A O no hydrogen 3.146 N/A GLN 44.A N PHE 19.A O no hydrogen 3.083 N/A THR 47.A OG1 HIS 50.A ND1 no hydrogen 2.777 N/A GLU 48.A N GLU 48.A OE2 no hydrogen 3.110 N/A LEU 51.A N THR 47.A O no hydrogen 2.916 N/A ARG 52.A N GLU 48.A O no hydrogen 3.285 N/A ASP 53.A N GLU 49.A O no hydrogen 3.084 N/A PHE 54.A N HIS 50.A O no hydrogen 2.901 N/A GLU 55.A N LEU 51.A O no hydrogen 2.878 N/A ARG 56.A N ARG 52.A O no hydrogen 3.163 N/A ARG 56.A NH2 ASP 53.A OD1 no hydrogen 2.793 N/A GLU 57.A N ASP 53.A O no hydrogen 3.051 N/A ILE 58.A N PHE 54.A O no hydrogen 2.962 N/A GLU 59.A N GLU 55.A O no hydrogen 3.040 N/A ILE 60.A N ARG 56.A O no hydrogen 2.961 N/A LEU 61.A N GLU 57.A O no hydrogen 2.897 N/A LYS 62.A N ILE 58.A O no hydrogen 3.028 N/A LYS 62.A NZ GLU 59.A OE1 no hydrogen 2.825 N/A SER 63.A N GLU 59.A O no hydrogen 3.103 N/A SER 63.A N ILE 60.A O no hydrogen 3.185 N/A SER 63.A OG.A ILE 60.A O no hydrogen 2.703 N/A SER 63.A OG.A TYR 131.A OH no hydrogen 2.691 N/A SER 63.A OG.B ILE 60.A O no hydrogen 2.702 N/A SER 63.A OG.B TYR 131.A OH no hydrogen 2.691 N/A LEU 64.A N LEU 61.A O no hydrogen 3.109 N/A GLN 65.A N TYR 125.A OH no hydrogen 2.931 N/A GLN 65.A NE2 LYS 62.A O no hydrogen 3.349 N/A ASN 68.A N HIS 66.A ND1 no hydrogen 3.000 N/A ASN 68.A ND2 VAL 149.A O no hydrogen 3.037 N/A ILE 69.A N HIS 66.A O no hydrogen 3.331 N/A VAL 70.A N ILE 151.A O.A no hydrogen 2.962 N/A VAL 70.A N ILE 151.A O.B no hydrogen 2.917 N/A LYS 71.A N GLU 89.A OE2 no hydrogen 3.062 N/A LYS 73.A N ILE 87.A O no hydrogen 2.862 N/A LYS 73.A NZ GLU 36.A OE1 no hydrogen 2.748 N/A LYS 73.A NZ GLU 36.A OE2 no hydrogen 3.046 N/A GLY 74.A N ILE 87.A O no hydrogen 3.225 N/A CYS 76.A N LYS 85.A O no hydrogen 2.932 N/A CYS 76.A SG PHE 3.A O no hydrogen 3.348 N/A CYS 76.A SG SER 78.A OG no hydrogen 3.588 N/A GLY 80.A N TYR 77.A O no hydrogen 2.774 N/A ARG 81.A NH1 GLU 55.A OE2 no hydrogen 2.328 N/A ASN 83.A N GLY 80.A O no hydrogen 2.869 N/A ASN 83.A ND2 ALA 79.A O no hydrogen 3.618 N/A LYS 85.A N CYS 76.A O no hydrogen 3.132 N/A LYS 85.A NZ GLU 5.A OE1 no hydrogen 3.271 N/A LEU 86.A N LYS 41.A O no hydrogen 2.788 N/A ILE 87.A N GLY 74.A O no hydrogen 2.769 N/A MET 88.A N ALA 39.A O no hydrogen 2.823 N/A GLU 89.A N LYS 71.A O no hydrogen 3.058 N/A GLY 94.A N LEU 91.A O no hydrogen 3.077 N/A LEU 96.A N ILE 141.A O no hydrogen 2.758 N/A ARG 97.A N THR 138.A O no hydrogen 3.227 N/A ASP 98.A N SER 95.A OG no hydrogen 3.072 N/A TYR 99.A N SER 95.A O no hydrogen 2.949 N/A LEU 100.A N LEU 96.A O no hydrogen 2.823 N/A GLN 101.A N ARG 97.A O no hydrogen 3.014 N/A GLN 101.A NE2 ILE 208.A O no hydrogen 3.454 N/A LYS 102.A N ASP 98.A O no hydrogen 3.062 N/A HIS 103.A N TYR 99.A O no hydrogen 3.000 N/A LYS 104.A NZ TYR 207.A O no hydrogen 2.898 N/A ARG 106.A N HIS 103.A O no hydrogen 3.169 N/A ARG 106.A NH1 LYS 102.A O no hydrogen 3.219 N/A ARG 106.A NH2 LYS 102.A O no hydrogen 3.046 N/A ILE 107.A N LYS 104.A O no hydrogen 3.372 N/A HIS 109.A NE2 GLY 250.A O no hydrogen 3.077 N/A LYS 111.A N ASP 108.A OD1 no hydrogen 3.182 N/A LYS 111.A NZ GLN 114.A OE1 no hydrogen 2.776 N/A LYS 111.A NZ GLU 146.A O no hydrogen 3.128 N/A LEU 112.A N ASP 108.A O no hydrogen 3.090 N/A LEU 113.A N HIS 109.A O no hydrogen 3.022 N/A GLN 114.A N ILE 110.A O no hydrogen 3.077 N/A GLN 114.A NE2 ASN 147.A OD1 no hydrogen 3.389 N/A TYR 115.A N LYS 111.A O no hydrogen 3.171 N/A TYR 115.A OH GLU 146.A O no hydrogen 2.717 N/A THR 116.A N LEU 112.A O no hydrogen 2.970 N/A THR 116.A OG1 LEU 112.A O no hydrogen 2.816 N/A SER 117.A N LEU 113.A O no hydrogen 2.952 N/A SER 117.A OG ASP 281.A OD1 no hydrogen 2.661 N/A GLN 118.A N GLN 114.A O no hydrogen 3.209 N/A GLN 118.A NE2 ASN 147.A O no hydrogen 2.839 N/A ILE 119.A N TYR 115.A O no hydrogen 2.985 N/A CYS 120.A N THR 116.A O no hydrogen 3.003 N/A CYS 120.A SG THR 116.A O no hydrogen 3.467 N/A LYS 121.A N SER 117.A O no hydrogen 2.918 N/A LYS 121.A NZ ASP 281.A OD2 no hydrogen 3.371 N/A GLY 122.A N GLN 118.A O no hydrogen 2.956 N/A MET 123.A N ILE 119.A O no hydrogen 2.925 N/A GLU 124.A N CYS 120.A O no hydrogen 2.792 N/A TYR 125.A N LYS 121.A O no hydrogen 3.062 N/A LEU 126.A N GLY 122.A O no hydrogen 2.961 N/A GLY 127.A N MET 123.A O no hydrogen 2.946 N/A THR 128.A N GLU 124.A O no hydrogen 3.138 N/A THR 128.A N TYR 125.A O no hydrogen 3.178 N/A THR 128.A OG1 TYR 125.A O no hydrogen 2.683 N/A LYS 129.A N LEU 126.A O no hydrogen 3.225 N/A ARG 130.A N GLY 127.A O no hydrogen 3.009 N/A ARG 130.A NH1 GLU 165.A OE2 no hydrogen 3.008 N/A ARG 130.A NH2 PRO 161.A O no hydrogen 2.929 N/A ARG 130.A NH2 LYS 164.A O no hydrogen 2.770 N/A ARG 130.A NH2 GLU 165.A OE2 no hydrogen 3.072 N/A TYR 131.A N LEU 126.A O no hydrogen 3.338 N/A TYR 131.A OH SER 63.A OG.A no hydrogen 2.691 N/A TYR 131.A OH SER 63.A OG.B no hydrogen 2.691 N/A ILE 132.A N LYS 158.A O no hydrogen 2.789 N/A HIS 133.A N ASP 193.A OD2 no hydrogen 2.820 N/A HIS 133.A NE2 GLY 152.A O no hydrogen 3.065 N/A ARG 134.A N ASP 193.A OD1 no hydrogen 2.929 N/A ARG 134.A NH2 LEU 156.A O no hydrogen 2.867 N/A ASP 135.A N HIS 133.A ND1 no hydrogen 3.029 N/A THR 138.A N GLU 203.A OE2 no hydrogen 3.132 N/A THR 138.A OG1 GLU 203.A OE1 no hydrogen 2.717 N/A ARG 139.A NH2 ASP 135.A OD1 no hydrogen 3.418 N/A ARG 139.A NH2 ASP 135.A OD2 no hydrogen 3.407 N/A ASN 140.A N ALA 137.A O no hydrogen 2.929 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.784 N/A ILE 141.A N THR 138.A O no hydrogen 3.340 N/A LEU 142.A N LYS 150.A O no hydrogen 2.801 N/A VAL 143.A N GLY 94.A O no hydrogen 2.873 N/A GLU 144.A N ARG 148.A O no hydrogen 2.761 N/A ASN 145.A N ARG 148.A O no hydrogen 3.374 N/A ASN 147.A N ASN 145.A OD1 no hydrogen 2.876 N/A ARG 148.A N ASN 145.A O no hydrogen 3.090 N/A ARG 148.A NE GLU 144.A OE2 no hydrogen 2.805 N/A ARG 148.A NH1 GLU 144.A OE2 no hydrogen 2.963 N/A VAL 149.A N GLN 118.A OE1 no hydrogen 3.070 N/A LYS 150.A N LEU 142.A O no hydrogen 2.824 N/A LYS 150.A NZ GLU 89.A OE1 no hydrogen 3.393 N/A LYS 150.A NZ GLU 89.A OE2 no hydrogen 2.805 N/A ILE 151.A N.A ASN 68.A O no hydrogen 2.853 N/A ILE 151.A N.B ASN 68.A O no hydrogen 2.837 N/A GLY 152.A N ASN 140.A O no hydrogen 3.021 N/A GLY 155.A N ASP 153.A OD1 no hydrogen 3.079 N/A THR 157.A N PHE 154.A O no hydrogen 3.204 N/A THR 157.A OG1 PHE 154.A O no hydrogen 3.375 N/A LYS 158.A N ILE 132.A O no hydrogen 2.922 N/A LEU 160.A N ARG 130.A O no hydrogen 2.855 N/A LYS 164.A N PRO 161.A O no hydrogen 3.281 N/A VAL 167.A N SER 186.A O no hydrogen 2.961 N/A SER 173.A OG GLY 171.A O no hydrogen 3.232 N/A ILE 175.A N SER 173.A O no hydrogen 2.921 N/A TRP 177.A N PRO 174.A O no hydrogen 3.008 N/A TRP 177.A NE1 GLU 203.A OE2 no hydrogen 2.876 N/A TYR 178.A N ILE 175.A O no hydrogen 3.166 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.791 N/A SER 182.A N ALA 179.A O no hydrogen 3.034 N/A SER 182.A OG LYS 187.A O no hydrogen 2.767 N/A LEU 183.A N ALA 179.A O no hydrogen 3.157 N/A THR 184.A N PRO 180.A O no hydrogen 2.931 N/A THR 184.A OG1 PRO 180.A O no hydrogen 3.012 N/A GLU 185.A N GLU 181.A O no hydrogen 2.967 N/A SER 186.A N SER 182.A O no hydrogen 3.090 N/A SER 186.A OG VAL 167.A O no hydrogen 2.755 N/A LYS 187.A N GLU 181.A O no hydrogen 3.299 N/A SER 189.A N SER 192.A OG no hydrogen 2.824 N/A SER 192.A N SER 189.A OG no hydrogen 3.341 N/A SER 192.A OG SER 189.A O no hydrogen 2.918 N/A ASP 193.A N SER 189.A O no hydrogen 3.032 N/A VAL 194.A N VAL 190.A O no hydrogen 2.861 N/A TRP 195.A N ALA 191.A O no hydrogen 3.009 N/A SER 196.A N SER 192.A O no hydrogen 2.983 N/A SER 196.A OG TRP 177.A O no hydrogen 2.822 N/A SER 196.A OG SER 192.A O no hydrogen 3.341 N/A PHE 197.A N ASP 193.A O no hydrogen 2.873 N/A GLY 198.A N VAL 194.A O no hydrogen 3.073 N/A VAL 199.A N TRP 195.A O no hydrogen 3.258 N/A VAL 200.A N SER 196.A O no hydrogen 2.900 N/A LEU 201.A N PHE 197.A O no hydrogen 2.893 N/A TYR 202.A N GLY 198.A O no hydrogen 3.124 N/A TYR 202.A OH LYS 212.A O no hydrogen 2.640 N/A GLU 203.A N VAL 199.A O no hydrogen 2.944 N/A LEU 204.A N VAL 200.A O no hydrogen 3.000 N/A PHE 205.A N LEU 201.A O no hydrogen 3.130 N/A THR 206.A N TYR 202.A O no hydrogen 3.026 N/A THR 206.A N GLU 203.A O no hydrogen 3.278 N/A THR 206.A OG1 GLU 203.A O no hydrogen 2.715 N/A TYR 207.A N LEU 204.A O no hydrogen 2.962 N/A TYR 207.A OH ILE 107.A O no hydrogen 2.894 N/A TYR 207.A OH HIS 109.A ND1 no hydrogen 3.389 N/A ILE 208.A N GLU 203.A O no hydrogen 3.411 N/A GLU 209.A N THR 206.A O no hydrogen 3.050 N/A LYS 212.A N GLU 209.A O no hydrogen 3.131 N/A LYS 212.A NZ GLU 209.A OE1 no hydrogen 3.555 N/A SER 213.A N LYS 210.A O no hydrogen 3.464 N/A SER 213.A OG LYS 210.A O no hydrogen 3.480 N/A ALA 216.A N SER 213.A OG no hydrogen 3.280 N/A GLU 217.A N SER 213.A O no hydrogen 2.961 N/A PHE 218.A N PRO 214.A O no hydrogen 2.939 N/A MET 219.A N PRO 215.A O no hydrogen 3.003 N/A ARG 220.A N ALA 216.A O no hydrogen 3.149 N/A ARG 220.A NE GLU 217.A OE1 no hydrogen 3.378 N/A ARG 220.A NH2 GLU 217.A OE1 no hydrogen 2.821 N/A MET 221.A N GLU 217.A O no hydrogen 3.106 N/A ILE 222.A N PHE 218.A O no hydrogen 2.935 N/A GLY 223.A N MET 219.A O no hydrogen 2.793 N/A LYS 226.A N GLY 223.A O no hydrogen 3.088 N/A LYS 226.A NZ ILE 222.A O no hydrogen 2.819 N/A LYS 226.A NZ ASP 225.A OD2 no hydrogen 3.189 N/A MET 230.A N GLN 227.A O no hydrogen 3.222 N/A ILE 231.A N GLY 228.A O no hydrogen 2.990 N/A PHE 233.A N GLN 229.A O no hydrogen 3.036 N/A HIS 234.A N MET 230.A O no hydrogen 3.005 N/A HIS 234.A ND1 MET 230.A O no hydrogen 2.875 N/A LEU 235.A N ILE 231.A O no hydrogen 2.880 N/A ILE 236.A N VAL 232.A O no hydrogen 2.988 N/A GLU 237.A N PHE 233.A O no hydrogen 3.357 N/A LEU 238.A N HIS 234.A O no hydrogen 2.849 N/A LEU 239.A N LEU 235.A O no hydrogen 2.945 N/A LYS 240.A N ILE 236.A O no hydrogen 2.906 N/A LYS 240.A NZ GLU 237.A OE1 no hydrogen 3.131 N/A LYS 240.A NZ GLU 237.A OE2 no hydrogen 3.233 N/A ASN 241.A N GLU 237.A O no hydrogen 3.103 N/A ASN 241.A N LEU 238.A O no hydrogen 3.110 N/A ASN 241.A ND2 GLU 237.A O no hydrogen 2.816 N/A ASN 242.A N LEU 239.A O no hydrogen 3.273 N/A GLY 243.A N LEU 238.A O no hydrogen 2.986 N/A ARG 244.A NE TRP 263.A O no hydrogen 2.878 N/A ARG 244.A NH1 LEU 239.A O no hydrogen 2.958 N/A ARG 244.A NH1 GLY 243.A O no hydrogen 2.957 N/A ARG 244.A NH2 TRP 263.A O no hydrogen 2.816 N/A ARG 244.A NH2 ASN 265.A OD1 no hydrogen 3.005 N/A ARG 247.A NH1 CYS 251.A O no hydrogen 3.292 N/A ARG 247.A NH1 ASP 253.A OD2 no hydrogen 3.288 N/A ARG 247.A NH2 ASP 253.A OD2 no hydrogen 2.780 N/A CYS 251.A N PRO 248.A O no hydrogen 3.018 N/A CYS 251.A SG PRO 252.A O no hydrogen 3.375 N/A ILE 255.A N PRO 252.A O no hydrogen 3.038 N/A TYR 256.A N PRO 252.A O no hydrogen 3.147 N/A TYR 256.A OH LEU 245.A O no hydrogen 2.845 N/A MET 257.A N ASP 253.A O no hydrogen 2.953 N/A ILE 258.A N GLU 254.A O no hydrogen 3.331 N/A MET 259.A N ILE 255.A O no hydrogen 3.177 N/A THR 260.A N TYR 256.A O no hydrogen 3.063 N/A THR 260.A OG1 TYR 256.A O no hydrogen 3.554 N/A THR 260.A OG1 MET 257.A O no hydrogen 2.796 N/A GLU 261.A N MET 257.A O no hydrogen 2.989 N/A CYS 262.A N ILE 258.A O no hydrogen 3.062 N/A CYS 262.A SG ILE 258.A O no hydrogen 3.354 N/A TRP 263.A N MET 259.A O no hydrogen 2.994 N/A ASN 264.A ND2 GLN 269.A OE1 no hydrogen 3.103 N/A ASN 265.A ND2 LEU 239.A O no hydrogen 3.142 N/A ASN 266.A N ASN 264.A OD1 no hydrogen 2.901 N/A ASN 268.A N ASN 266.A OD1 no hydrogen 3.222 N/A GLN 269.A N ASN 266.A O no hydrogen 3.229 N/A ARG 270.A N VAL 267.A O no hydrogen 3.465 N/A ARG 270.A NE ASN 264.A O no hydrogen 2.772 N/A ARG 270.A NH1 GLU 181.A OE2 no hydrogen 2.781 N/A ARG 270.A NH1 ALA 191.A O no hydrogen 3.110 N/A ARG 270.A NH2 GLU 181.A OE1 no hydrogen 2.879 N/A ARG 270.A NH2 GLU 181.A OE2 no hydrogen 3.513 N/A ARG 270.A NH2 ASN 264.A O no hydrogen 3.068 N/A ASP 275.A N SER 272.A OG no hydrogen 3.068 N/A LEU 276.A N SER 272.A O no hydrogen 2.988 N/A ALA 277.A N PHE 273.A O no hydrogen 2.995 N/A LEU 278.A N ARG 274.A O no hydrogen 3.307 N/A ARG 279.A N ASP 275.A O no hydrogen 2.880 N/A ARG 279.A NH1 GLU 261.A OE1 no hydrogen 2.872 N/A ARG 279.A NH2 GLU 261.A OE1 no hydrogen 3.383 N/A ARG 279.A NH2 GLU 261.A OE2 no hydrogen 2.742 N/A VAL 280.A N LEU 276.A O no hydrogen 2.806 N/A ASP 281.A N ALA 277.A O no hydrogen 2.907 N/A GLN 282.A N LEU 278.A O no hydrogen 3.164 N/A GLN 282.A NE2 GLN 282.A O no hydrogen 3.341 N/A GLN 282.A NE2 ASN 286.A OD1 no hydrogen 3.085 N/A ILE 283.A N ARG 279.A O no hydrogen 3.080 N/A ARG 284.A N VAL 280.A O no hydrogen 2.996 N/A ARG 284.A NH1 ASP 281.A OD1 no hydrogen 3.004 N/A ASP 285.A N ASP 281.A O no hydrogen 3.078 N/A ASN 286.A N GLN 282.A O no hydrogen 2.995 N/A MET 287.A N ILE 283.A O no hydrogen 3.004 N/A