Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wty_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 8.A N GLU 279.A OE2 no hydrogen 2.826 N/A SER 9.A N PRO 6.A O no hydrogen 2.889 N/A TYR 10.A N GLU 279.A OE2 no hydrogen 2.960 N/A ARG 12.A N SER 9.A O no hydrogen 3.126 N/A ALA 13.A N TYR 10.A O no hydrogen 2.967 N/A GLU 14.A N ALA 11.A O no hydrogen 3.032 N/A ARG 15.A NE ASP 18.A OD2 no hydrogen 2.933 N/A ARG 15.A NH1 ASP 18.A OD1 no hydrogen 3.085 N/A ARG 15.A NH1 ASP 18.A OD2 no hydrogen 3.378 N/A GLN 17.A N GLN 17.A OE1 no hydrogen 2.819 N/A ASP 18.A N ARG 15.A O no hydrogen 2.939 N/A PHE 19.A N PRO 16.A O no hydrogen 2.939 N/A PHE 22.A N TYR 117.A O no hydrogen 2.922 N/A VAL 23.A N TYR 117.A O no hydrogen 3.467 N/A ARG 25.A N SER 115.A O no hydrogen 2.715 N/A LEU 26.A N ALA 151.A O no hydrogen 2.943 N/A ASP 27.A N PRO 113.A O no hydrogen 2.879 N/A ASN 28.A ND2 ALA 75.A O no hydrogen 3.158 N/A GLY 30.A N ASN 28.A OD1 no hydrogen 2.687 N/A LYS 31.A N ASP 29.A OD1 no hydrogen 2.893 N/A ARG 36.A N SER 74.A OG no hydrogen 2.831 N/A ARG 36.A NH2 LEU 34.A O no hydrogen 3.092 N/A ASN 37.A ND2 ALA 222.A O no hydrogen 2.922 N/A ARG 39.A N GLY 72.A O no hydrogen 3.106 N/A ARG 39.A NH1 ASN 37.A O no hydrogen 2.891 N/A ARG 39.A NH1 GLY 223.A O no hydrogen 2.815 N/A ARG 39.A NH2 GLY 223.A O no hydrogen 3.090 N/A THR 40.A N ASP 43.A OD2 no hydrogen 2.919 N/A THR 40.A OG1 ASP 43.A OD1 no hydrogen 2.926 N/A SER 41.A N ILE 70.A O no hydrogen 2.934 N/A SER 41.A OG ILE 70.A O no hydrogen 3.190 N/A ALA 42.A N THR 40.A OG1 no hydrogen 3.009 N/A ASP 43.A N THR 40.A O no hydrogen 3.149 N/A ARG 46.A N GLU 253.A O no hydrogen 2.913 N/A GLU 49.A N HIS 252.A NE2 no hydrogen 3.100 N/A PHE 52.A N GLU 49.A O no hydrogen 3.160 N/A HIS 53.A N LYS 50.A O no hydrogen 2.933 N/A HIS 53.A ND1 LYS 51.A O no hydrogen 2.907 N/A ASP 55.A N TYR 249.A OH no hydrogen 2.983 N/A ALA 57.A N ASP 55.A OD1 no hydrogen 2.827 N/A TYR 58.A N ASP 55.A O no hydrogen 2.997 N/A TYR 58.A OH ASP 246.A OD1 no hydrogen 2.644 N/A SER 61.A N ASP 246.A OD1 no hydrogen 3.086 N/A ARG 62.A NH1 ASP 43.A O no hydrogen 2.958 N/A ARG 62.A NH2 ASP 43.A O no hydrogen 2.844 N/A GLU 63.A N SER 61.A OG no hydrogen 3.054 N/A MET 65.A N ARG 62.A O no hydrogen 2.951 N/A LEU 68.A N MET 65.A O no hydrogen 3.174 N/A ILE 70.A N SER 41.A OG no hydrogen 3.131 N/A SER 71.A N LEU 216.A O no hydrogen 2.943 N/A SER 71.A OG HIS 217.A ND1 no hydrogen 2.798 N/A GLY 72.A N ARG 39.A O no hydrogen 2.965 N/A SER 73.A N PHE 218.A O no hydrogen 3.119 N/A SER 73.A OG SER 74.A O no hydrogen 2.803 N/A SER 73.A OG HIS 217.A NE2 no hydrogen 2.928 N/A SER 74.A N ARG 36.A O no hydrogen 2.960 N/A SER 74.A OG ARG 36.A O no hydrogen 3.365 N/A SER 74.A OG ALA 75.A O no hydrogen 2.869 N/A ALA 75.A N GLU 221.A O no hydrogen 3.008 N/A THR 77.A N GLN 80.A OE1 no hydrogen 2.892 N/A GLN 80.A N THR 77.A OG1 no hydrogen 3.130 N/A GLN 80.A NE2 ASN 28.A OD1 no hydrogen 3.042 N/A GLN 80.A NE2 GLU 32.A O no hydrogen 2.907 N/A LEU 81.A N THR 77.A O no hydrogen 2.945 N/A LYS 82.A N PRO 78.A O no hydrogen 3.080 N/A ASN 83.A N ALA 79.A O no hydrogen 3.101 N/A ASN 83.A ND2 ALA 33.A O no hydrogen 2.766 N/A VAL 84.A N GLN 80.A O no hydrogen 2.962 N/A ALA 85.A N LEU 81.A O no hydrogen 2.901 N/A ALA 86.A N LYS 82.A O no hydrogen 2.973 N/A LYS 87.A N ASN 83.A O no hydrogen 3.067 N/A LEU 88.A N VAL 84.A O no hydrogen 2.921 N/A ARG 89.A N ALA 85.A O no hydrogen 2.902 N/A ARG 89.A NH1 GLY 94.A O no hydrogen 3.288 N/A ARG 89.A NH2 THR 92.A O no hydrogen 2.986 N/A ARG 89.A NH2 GLY 94.A O no hydrogen 2.737 N/A LYS 91.A N LEU 88.A O no hydrogen 2.729 N/A THR 92.A OG1 ASP 213.A O no hydrogen 3.450 N/A GLY 94.A N THR 92.A OG1 no hydrogen 3.026 N/A TYR 97.A N TRP 215.A O no hydrogen 2.848 N/A ASP 98.A N ARG 183.A O no hydrogen 2.689 N/A VAL 99.A N HIS 217.A O no hydrogen 2.841 N/A ASP 100.A N PHE 185.A O no hydrogen 2.880 N/A LEU 101.A N HIS 219.A O no hydrogen 3.004 N/A ARG 102.A N ASP 100.A OD1 no hydrogen 3.052 N/A ARG 102.A NE GLU 104.A OE2 no hydrogen 2.797 N/A ARG 102.A NH1 ASP 27.A OD2 no hydrogen 3.067 N/A ARG 102.A NH2 ASP 27.A OD1 no hydrogen 3.194 N/A ARG 102.A NH2 ASP 27.A OD2 no hydrogen 3.287 N/A ARG 102.A NH2 GLU 104.A OE2 no hydrogen 3.343 N/A GLN 103.A N ALA 189.A O no hydrogen 2.986 N/A GLU 104.A N GLU 104.A OE1 no hydrogen 2.804 N/A SER 105.A OG ASP 135.A OD1 no hydrogen 2.579 N/A HIS 106.A N GLU 136.A OE1 no hydrogen 2.886 N/A HIS 106.A ND1 GLU 104.A O no hydrogen 2.844 N/A HIS 106.A NE2 ASP 100.A OD2 no hydrogen 2.668 N/A HIS 106.A NE2 GLU 173.A OE1 no hydrogen 2.951 N/A GLY 107.A N VAL 114.A O no hydrogen 2.951 N/A TYR 108.A N GLN 171.A O no hydrogen 2.909 N/A TYR 108.A OH PHE 76.A O no hydrogen 3.369 N/A LEU 109.A N ILE 112.A O no hydrogen 3.038 N/A ASP 110.A N LYS 169.A O no hydrogen 2.871 N/A ILE 112.A N LEU 109.A O no hydrogen 2.870 N/A VAL 114.A N GLY 107.A O no hydrogen 2.985 N/A SER 115.A N ARG 25.A O no hydrogen 2.995 N/A SER 115.A OG ASP 27.A OD1 no hydrogen 2.604 N/A SER 115.A OG ASP 27.A OD2 no hydrogen 3.547 N/A TRP 116.A N SER 105.A O no hydrogen 2.841 N/A TYR 117.A N VAL 23.A O no hydrogen 2.875 N/A ARG 120.A NH1 GLU 14.A OE2 no hydrogen 3.394 N/A ASP 121.A N GLY 118.A O no hydrogen 2.689 N/A TRP 122.A N GLU 119.A O no hydrogen 3.065 N/A TRP 122.A NE1 ASP 191.A O no hydrogen 2.964 N/A ASN 124.A ND2 GLN 103.A O no hydrogen 2.865 N/A ASN 124.A ND2 SER 105.A OG no hydrogen 2.951 N/A LEU 125.A N TRP 122.A O no hydrogen 3.071 N/A LYS 127.A N ASN 124.A O no hydrogen 3.099 N/A LYS 127.A NZ ASN 124.A OD1 no hydrogen 3.087 N/A SER 128.A N GLU 131.A OE1 no hydrogen 2.998 N/A GLN 129.A NE2 ARG 186.A O no hydrogen 2.911 N/A GLU 131.A N SER 128.A OG no hydrogen 3.059 N/A ALA 132.A N SER 128.A O no hydrogen 2.905 N/A LEU 133.A N GLN 129.A O no hydrogen 2.970 N/A ALA 134.A N HIS 130.A O no hydrogen 3.030 N/A ASP 135.A N GLU 131.A O no hydrogen 2.951 N/A GLU 136.A N ALA 132.A O no hydrogen 3.060 N/A ARG 137.A N.A LEU 133.A O no hydrogen 2.932 N/A ARG 137.A N.B LEU 133.A O no hydrogen 2.945 N/A HIS 138.A N ALA 134.A O no hydrogen 3.009 N/A ARG 139.A N ASP 135.A O no hydrogen 2.870 N/A ARG 139.A NE ASP 135.A OD1 no hydrogen 2.905 N/A ARG 139.A NE ASP 135.A OD2 no hydrogen 2.893 N/A ARG 139.A NH2 ASP 135.A OD2 no hydrogen 3.192 N/A LEU 140.A N GLU 136.A O no hydrogen 2.964 N/A HIS 141.A N ARG 137.A O.A no hydrogen 3.178 N/A HIS 141.A N ARG 137.A O.B no hydrogen 3.112 N/A ALA 142.A N HIS 138.A O no hydrogen 2.934 N/A ALA 143.A N LEU 140.A O no hydrogen 3.085 N/A LEU 144.A N HIS 141.A O no hydrogen 3.168 N/A HIS 145.A N VAL 167.A O no hydrogen 2.797 N/A LYS 146.A N ALA 143.A O no hydrogen 2.977 N/A VAL 148.A N ARG 165.A O no hydrogen 2.869 N/A TYR 149.A OH GLY 161.A O no hydrogen 2.579 N/A ILE 150.A N GLU 163.A O no hydrogen 2.936 N/A ALA 151.A N TRP 24.A O no hydrogen 3.026 N/A GLY 154.A N LEU 158.A O no hydrogen 2.860 N/A LYS 155.A N GLU 160.A OE2 no hydrogen 2.993 N/A LYS 157.A N GLY 154.A O no hydrogen 3.335 N/A LEU 158.A N LYS 155.A O no hydrogen 3.325 N/A GLU 160.A N PRO 152.A O no hydrogen 3.166 N/A GLU 163.A N ILE 150.A O no hydrogen 2.915 N/A ARG 165.A N VAL 148.A O no hydrogen 3.065 N/A ARG 165.A NE ASP 110.A OD2 no hydrogen 2.848 N/A ARG 165.A NH1 GLU 163.A OE1 no hydrogen 2.877 N/A ARG 165.A NH2 ASP 110.A OD2 no hydrogen 3.150 N/A ARG 166.A NH1 HIS 145.A O no hydrogen 2.731 N/A VAL 167.A N LYS 146.A O no hydrogen 2.944 N/A GLN 168.A N ASP 110.A OD1 no hydrogen 2.823 N/A GLN 168.A NE2 ARG 166.A O no hydrogen 3.528 N/A LYS 169.A N ASP 110.A OD1 no hydrogen 2.969 N/A GLN 171.A N TYR 108.A O no hydrogen 2.959 N/A THR 172.A N GLU 175.A OE1 no hydrogen 2.946 N/A GLN 174.A NE2 GLU 178.A OE2 no hydrogen 3.283 N/A GLU 175.A N THR 172.A OG1 no hydrogen 3.164 N/A VAL 176.A N THR 172.A O no hydrogen 3.176 N/A ALA 177.A N GLU 173.A O no hydrogen 2.702 N/A GLU 178.A N GLN 174.A O no hydrogen 2.939 N/A ALA 179.A N GLU 175.A O no hydrogen 3.010 N/A ALA 180.A N VAL 176.A O no hydrogen 3.257 N/A ALA 180.A N ALA 177.A O no hydrogen 2.976 N/A GLY 181.A N GLU 178.A O no hydrogen 2.925 N/A MET 182.A N ALA 177.A O no hydrogen 2.962 N/A ARG 183.A N ILE 96.A O no hydrogen 2.862 N/A ARG 183.A NH1 TYR 97.A OH no hydrogen 2.824 N/A TYR 184.A OH ASP 100.A OD2 no hydrogen 2.769 N/A PHE 185.A N ASP 98.A O no hydrogen 2.991 N/A ARG 186.A NE ARG 102.A O no hydrogen 2.801 N/A ARG 186.A NH1 GLU 136.A OE1 no hydrogen 3.331 N/A ARG 186.A NH1 GLU 136.A OE2 no hydrogen 2.884 N/A ARG 186.A NH1 TYR 184.A OH no hydrogen 3.327 N/A ARG 186.A NH2 ARG 102.A O no hydrogen 2.774 N/A ARG 186.A NH2 GLU 136.A OE1 no hydrogen 2.863 N/A ILE 187.A N ASP 100.A O no hydrogen 2.825 N/A ALA 188.A N GLN 129.A OE1 no hydrogen 2.990 N/A ALA 189.A N LEU 101.A O no hydrogen 3.143 N/A ALA 189.A N ILE 187.A O no hydrogen 2.914 N/A THR 190.A OG1 GLN 103.A OE1 no hydrogen 2.708 N/A THR 196.A N ASN 199.A OD1 no hydrogen 3.170 N/A THR 196.A OG1 GLU 198.A OE1 no hydrogen 3.303 N/A ASN 199.A N THR 196.A OG1 no hydrogen 2.964 N/A ASN 199.A ND2 ALA 188.A O no hydrogen 3.085 N/A ILE 200.A N THR 196.A O no hydrogen 2.978 N/A ASP 201.A N PRO 197.A O no hydrogen 2.828 N/A ARG 202.A N GLU 198.A O no hydrogen 3.087 N/A ARG 202.A NE ARG 186.A O no hydrogen 2.762 N/A ARG 202.A NH2 ARG 186.A O no hydrogen 3.216 N/A PHE 203.A N ASN 199.A O no hydrogen 3.000 N/A LEU 204.A N ILE 200.A O no hydrogen 2.866 N/A ALA 205.A N ASP 201.A O no hydrogen 3.062 N/A PHE 206.A N ARG 202.A O no hydrogen 3.111 N/A TYR 207.A N PHE 203.A O no hydrogen 2.703 N/A ARG 208.A N.A LEU 204.A O no hydrogen 3.026 N/A ARG 208.A N.B LEU 204.A O no hydrogen 3.033 N/A ARG 208.A NH2.B GLY 298.A O no hydrogen 2.932 N/A THR 209.A N PHE 206.A O no hydrogen 3.097 N/A THR 209.A OG1 PHE 206.A O no hydrogen 2.737 N/A LEU 210.A N TYR 207.A O no hydrogen 3.296 N/A ALA 214.A N PRO 211.A O no hydrogen 3.104 N/A TRP 215.A N PRO 95.A O no hydrogen 2.964 N/A TRP 215.A NE1 SER 71.A OG no hydrogen 2.877 N/A LEU 216.A N HIS 69.A O no hydrogen 3.175 N/A HIS 217.A N TYR 97.A O no hydrogen 2.792 N/A HIS 217.A ND1 SER 71.A OG no hydrogen 2.798 N/A HIS 217.A NE2 SER 73.A OG no hydrogen 2.928 N/A PHE 218.A N SER 71.A O no hydrogen 2.900 N/A HIS 219.A N VAL 99.A O no hydrogen 3.034 N/A HIS 219.A NE2 GLU 173.A OE2 no hydrogen 2.470 N/A SER 220.A N SER 73.A O no hydrogen 3.464 N/A SER 220.A OG THR 227.A OG1 no hydrogen 2.625 N/A ARG 226.A NH1 GLU 104.A OE1 no hydrogen 2.874 N/A ARG 226.A NH1 GLU 104.A OE2 no hydrogen 3.495 N/A ARG 226.A NH1 ALA 189.A O no hydrogen 2.878 N/A ARG 226.A NH2 GLU 104.A OE2 no hydrogen 3.203 N/A THR 227.A OG1 SER 220.A OG no hydrogen 2.625 N/A THR 228.A N VAL 224.A O no hydrogen 2.954 N/A THR 228.A OG1 VAL 224.A O no hydrogen 2.664 N/A ALA 229.A N GLY 225.A O no hydrogen 3.117 N/A PHE 230.A N ARG 226.A O no hydrogen 3.202 N/A MET 231.A N THR 227.A O no hydrogen 3.014 N/A VAL 232.A N THR 228.A O no hydrogen 2.792 N/A MET 233.A N ALA 229.A O no hydrogen 2.883 N/A THR 234.A N PHE 230.A O no hydrogen 2.852 N/A THR 234.A OG1 PHE 230.A O no hydrogen 2.766 N/A ASP 235.A N MET 231.A O no hydrogen 2.984 N/A MET 236.A N VAL 232.A O no hydrogen 2.972 N/A LEU 237.A N MET 233.A O no hydrogen 3.024 N/A LYS 238.A N THR 234.A O no hydrogen 3.005 N/A LYS 238.A NZ ALA 67.A O no hydrogen 2.888 N/A LYS 238.A NZ LEU 68.A O no hydrogen 3.190 N/A ASN 239.A N ASP 235.A O no hydrogen 2.935 N/A ASN 239.A ND2 ASP 235.A O no hydrogen 3.483 N/A ASN 239.A ND2 ASP 235.A OD1 no hydrogen 2.795 N/A VAL 242.A N ASN 239.A O no hydrogen 3.155 N/A ASP 246.A N SER 243.A OG no hydrogen 2.965 N/A ILE 247.A N SER 243.A O no hydrogen 2.999 N/A LEU 248.A N LEU 244.A O no hydrogen 2.939 N/A TYR 249.A N LYS 245.A O no hydrogen 2.897 N/A ARG 250.A N ASP 246.A O no hydrogen 2.885 N/A ARG 250.A NE ASP 235.A OD2 no hydrogen 2.905 N/A ARG 250.A NH1 SER 61.A O no hydrogen 2.993 N/A ARG 250.A NH1 GLU 63.A O no hydrogen 2.867 N/A ARG 250.A NH2 GLU 63.A O no hydrogen 3.077 N/A ARG 250.A NH2 ASP 235.A OD1 no hydrogen 2.700 N/A ARG 250.A NH2 ASP 235.A OD2 no hydrogen 3.392 N/A GLN 251.A N ILE 247.A O no hydrogen 3.066 N/A GLN 251.A NE2 ASP 235.A OD2 no hydrogen 2.887 N/A HIS 252.A N LEU 248.A O no hydrogen 3.111 N/A HIS 252.A ND1 GLY 256.A O no hydrogen 2.735 N/A GLU 253.A N TYR 249.A O no hydrogen 2.785 N/A ILE 254.A N ARG 250.A O no hydrogen 3.118 N/A GLY 255.A N HIS 252.A O no hydrogen 2.994 N/A GLY 256.A N GLN 251.A O no hydrogen 3.108 N/A GLY 256.A N HIS 252.A O no hydrogen 3.215 N/A PHE 257.A N THR 228.A OG1 no hydrogen 3.044 N/A TYR 259.A OH GLY 225.A O no hydrogen 2.610 N/A ASP 270.A N LYS 267.A O no hydrogen 2.534 N/A SER 271.A N ASP 268.A O no hydrogen 3.184 N/A SER 271.A OG ASP 268.A O no hydrogen 2.753 N/A LYS 273.A N ASP 270.A O no hydrogen 3.215 N/A LYS 273.A NZ ASP 270.A OD1 no hydrogen 3.292 N/A THR 274.A OG1 SER 271.A O no hydrogen 3.411 N/A TYR 276.A OH GLU 14.A OE2 no hydrogen 2.694 N/A TYR 277.A N LYS 273.A O no hydrogen 2.997 N/A ARG 278.A N THR 274.A O no hydrogen 3.207 N/A GLU 279.A N LYS 275.A O no hydrogen 2.943 N/A LYS 280.A N TYR 276.A O no hydrogen 2.986 N/A LYS 280.A NZ TYR 259.A OH no hydrogen 3.368 N/A ILE 281.A N TYR 277.A O no hydrogen 3.075 N/A VAL 282.A N ARG 278.A O no hydrogen 3.066 N/A MET 283.A N GLU 279.A O no hydrogen 2.946 N/A ILE 284.A N LYS 280.A O no hydrogen 2.912 N/A GLU 285.A N ILE 281.A O no hydrogen 3.383 N/A GLN 286.A N VAL 282.A O no hydrogen 2.966 N/A GLN 286.A NE2 HIS 310.A O no hydrogen 2.711 N/A PHE 287.A N MET 283.A O no hydrogen 2.758 N/A TYR 288.A N ILE 284.A O no hydrogen 3.023 N/A TYR 288.A OH VAL 242.A O no hydrogen 3.347 N/A ARG 289.A N GLU 285.A O no hydrogen 3.072 N/A ARG 289.A NE GLU 293.A OE2 no hydrogen 2.806 N/A TYR 290.A N GLN 286.A O no hydrogen 2.888 N/A TYR 290.A OH THR 301.A O no hydrogen 2.630 N/A VAL 291.A N PHE 287.A O no hydrogen 2.912 N/A GLN 292.A N TYR 288.A O no hydrogen 3.019 N/A GLN 292.A NE2 PRO 240.A O no hydrogen 2.896 N/A GLU 293.A N ARG 289.A O no hydrogen 2.915 N/A ASN 294.A ND2 TYR 290.A O no hydrogen 2.986 N/A GLY 298.A N ARG 295.A O no hydrogen 2.984 N/A TYR 299.A N ASN 294.A O no hydrogen 2.888 N/A GLN 300.A N ASP 297.A OD1 no hydrogen 3.104 N/A GLN 300.A NE2 ASP 297.A O no hydrogen 3.283 N/A SER 304.A N ASP 201.A OD1 no hydrogen 2.976 N/A SER 304.A OG ASP 201.A OD2 no hydrogen 2.441 N/A TRP 306.A N PRO 302.A O no hydrogen 2.886 N/A LEU 307.A N TRP 303.A O no hydrogen 2.763 N/A LYS 308.A N SER 304.A O no hydrogen 3.272 N/A SER 309.A N VAL 305.A O no hydrogen 3.406 N/A SER 309.A N TRP 306.A O no hydrogen 3.242 N/A SER 309.A OG VAL 305.A O no hydrogen 3.548 N/A SER 309.A OG TRP 306.A O no hydrogen 3.190 N/A SER 309.A OG HIS 310.A ND1 no hydrogen 3.078 N/A HIS 310.A N TRP 306.A O no hydrogen 2.898 N/A HIS 310.A ND1 TRP 306.A O no hydrogen 2.955 N/A