Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yca_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N ASP 62.A OD2 no hydrogen 2.806 N/A SER 2.A OG ASP 62.A OD2 no hydrogen 3.168 N/A ALA 4.A N VAL 63.A O no hydrogen 2.917 N/A ILE 5.A N THR 27.A O no hydrogen 2.782 N/A ILE 6.A N ILE 65.A O no hydrogen 2.774 N/A GLY 7.A N ILE 29.A O no hydrogen 2.863 N/A GLY 9.A N GLY 7.A O no hydrogen 2.911 N/A THR 13.A N GLY 9.A O no hydrogen 2.928 N/A THR 13.A OG1 GLY 9.A O no hydrogen 2.788 N/A THR 14.A N ALA 10.A O no hydrogen 3.304 N/A THR 14.A OG1 ALA 10.A O no hydrogen 3.041 N/A THR 14.A OG1 TYR 38.A OH no hydrogen 3.208 N/A ILE 15.A N VAL 11.A O no hydrogen 2.950 N/A ALA 16.A N GLY 12.A O no hydrogen 2.910 N/A TYR 17.A N THR 13.A O no hydrogen 2.824 N/A GLU 18.A N THR 14.A O no hydrogen 3.041 N/A LEU 19.A N ILE 15.A O no hydrogen 2.892 N/A GLN 20.A N ALA 16.A O no hydrogen 2.861 N/A GLN 20.A NE2 THR 26.A O no hydrogen 2.882 N/A GLN 21.A N GLU 18.A O no hydrogen 3.266 N/A GLN 21.A NE2 TYR 17.A O no hydrogen 3.034 N/A SER 22.A N LEU 19.A O no hydrogen 3.091 N/A LEU 23.A N LEU 19.A O no hydrogen 2.715 N/A HIS 25.A N HIS 25.A ND1.A no hydrogen 2.758 N/A THR 26.A N LEU 23.A O no hydrogen 2.952 N/A THR 26.A OG1 LEU 23.A O no hydrogen 2.706 N/A THR 27.A N VAL 3.A O no hydrogen 2.920 N/A THR 27.A OG1 HIS 25.A O no hydrogen 2.978 N/A ILE 29.A N ILE 5.A O no hydrogen 2.678 N/A GLY 30.A N LYS 52.A O no hydrogen 2.890 N/A LYS 34.A N VAL 51.A O no hydrogen 3.084 N/A LYS 34.A NZ ASP 120.A OD1 no hydrogen 2.776 N/A ILE 36.A N ILE 49.A O no hydrogen 2.901 N/A THR 37.A N ASP 120.A O no hydrogen 2.996 N/A THR 37.A OG1 ASP 48.A OD1 no hydrogen 2.893 N/A TYR 38.A N GLN 47.A O no hydrogen 2.593 N/A TYR 38.A OH THR 14.A OG1 no hydrogen 3.208 N/A TYR 39.A N VAL 122.A O no hydrogen 2.860 N/A ALA 44.A N VAL 41.A O no hydrogen 3.109 N/A GLN 47.A N TYR 38.A O no hydrogen 2.896 N/A ILE 49.A N ILE 36.A O no hydrogen 2.776 N/A VAL 51.A N LYS 34.A O no hydrogen 2.730 N/A LYS 52.A N LEU 28.A O no hydrogen 2.817 N/A GLY 53.A N ASP 56.A OD2 no hydrogen 2.906 N/A TYR 54.A N GLY 30.A O no hydrogen 3.170 N/A ASP 56.A N GLY 53.A O no hydrogen 2.792 N/A VAL 57.A N TYR 54.A O no hydrogen 3.270 N/A ASN 59.A ND2 THR 60.A O no hydrogen 3.041 N/A PHE 61.A N LEU 83.A O no hydrogen 2.742 N/A ASP 62.A N SER 2.A OG no hydrogen 2.846 N/A VAL 63.A N SER 2.A O no hydrogen 2.929 N/A ILE 64.A N LEU 89.A O no hydrogen 2.870 N/A ILE 65.A N ALA 4.A O no hydrogen 2.793 N/A ILE 66.A N ILE 91.A O no hydrogen 2.823 N/A ALA 67.A N ILE 6.A O no hydrogen 2.884 N/A LYS 69.A N GLN 72.A OE1 no hydrogen 2.769 N/A LYS 69.A NZ ASP 239.A OD1 no hydrogen 3.272 N/A LYS 69.A NZ ASP 239.A OD2 no hydrogen 2.732 N/A THR 70.A N GLU 247.A OE1 no hydrogen 2.884 N/A THR 70.A OG1 GLU 247.A OE1 no hydrogen 3.553 N/A GLN 72.A N LYS 69.A O no hydrogen 2.782 N/A LEU 73.A N THR 70.A O no hydrogen 3.254 N/A ALA 75.A N GLN 72.A O no hydrogen 3.277 N/A VAL 76.A N LEU 73.A O no hydrogen 2.899 N/A ILE 77.A N LEU 73.A O no hydrogen 3.030 N/A HIS 79.A N VAL 76.A O no hydrogen 2.908 N/A LEU 80.A N ILE 77.A O no hydrogen 2.942 N/A THR 81.A N PRO 78.A O no hydrogen 3.333 N/A THR 81.A OG1 PRO 78.A O no hydrogen 3.241 N/A TYR 82.A N HIS 79.A O no hydrogen 3.201 N/A LEU 83.A N HIS 79.A O no hydrogen 3.148 N/A LEU 83.A N LEU 80.A O no hydrogen 3.169 N/A ALA 84.A N LEU 80.A O no hydrogen 2.878 N/A HIS 85.A N THR 88.A OG1 no hydrogen 2.835 N/A HIS 85.A NE2 ASP 62.A OD1 no hydrogen 3.016 N/A ASP 87.A N HIS 85.A ND1 no hydrogen 3.329 N/A THR 88.A N HIS 85.A O no hydrogen 3.084 N/A THR 88.A OG1 PHE 61.A O no hydrogen 2.595 N/A THR 88.A OG1 HIS 85.A O no hydrogen 3.256 N/A LEU 89.A N ASP 62.A O no hydrogen 2.800 N/A ILE 90.A N ASN 105.A O no hydrogen 2.730 N/A ILE 91.A N ILE 64.A O no hydrogen 2.854 N/A LEU 92.A N CYS 107.A O no hydrogen 2.809 N/A ALA 93.A N ILE 66.A O no hydrogen 2.768 N/A GLN 94.A NE2 VAL 68.A O no hydrogen 2.590 N/A TYR 97.A N ALA 250.A O no hydrogen 2.927 N/A ILE 101.A N LEU 98.A O no hydrogen 3.041 N/A PHE 103.A N ILE 101.A O no hydrogen 2.744 N/A LYS 104.A NZ ASP 87.A OD1 no hydrogen 3.191 N/A ASN 105.A ND2 ASP 87.A O no hydrogen 3.345 N/A CYS 107.A N ILE 90.A O no hydrogen 2.655 N/A GLN 108.A NE2 ALA 109.A O no hydrogen 3.297 N/A ALA 109.A N LEU 92.A O no hydrogen 2.855 N/A VAL 110.A N ARG 131.A O no hydrogen 2.822 N/A TYR 112.A N GLN 129.A O no hydrogen 2.800 N/A SER 114.A N ARG 126.A O no hydrogen 2.903 N/A GLN 116.A N THR 123.A O no hydrogen 2.963 N/A LYS 117.A NZ PRO 8.A O no hydrogen 2.799 N/A LYS 118.A N VAL 121.A O no hydrogen 2.845 N/A VAL 121.A N LYS 118.A O no hydrogen 3.071 N/A VAL 122.A N THR 37.A O no hydrogen 2.830 N/A THR 123.A N GLN 116.A O no hydrogen 2.959 N/A HIS 124.A N TYR 39.A O no hydrogen 3.008 N/A HIS 124.A ND1 THR 40.A O no hydrogen 2.741 N/A HIS 124.A NE2 ASP 127.A O no hydrogen 2.687 N/A PHE 125.A N SER 114.A O no hydrogen 2.794 N/A ARG 126.A N SER 114.A O no hydrogen 3.393 N/A GLN 129.A N TYR 112.A O no hydrogen 2.983 N/A GLN 129.A NE2 ASP 151.A OD2 no hydrogen 3.359 N/A LEU 130.A N ASP 151.A O no hydrogen 2.943 N/A ARG 131.A N VAL 110.A O no hydrogen 2.914 N/A ARG 131.A NE GLU 155.A OE2 no hydrogen 2.924 N/A ARG 131.A NH1 GLN 129.A OE1 no hydrogen 2.867 N/A ARG 131.A NH2 GLU 155.A OE2 no hydrogen 2.732 N/A ILE 132.A N VAL 153.A O no hydrogen 2.908 N/A GLN 133.A NE2 ASP 134.A O no hydrogen 3.184 N/A GLN 133.A NE2 ALA 156.A O no hydrogen 3.121 N/A ASP 134.A N GLU 155.A O no hydrogen 2.841 N/A ASN 135.A N THR 138.A OG1 no hydrogen 2.939 N/A THR 138.A N ASN 135.A OD1 no hydrogen 3.014 N/A THR 138.A OG1 GLN 133.A O no hydrogen 2.819 N/A THR 138.A OG1 ASN 135.A O no hydrogen 3.141 N/A ARG 139.A N ASN 135.A O no hydrogen 2.940 N/A ARG 139.A NH1 ASP 134.A OD1 no hydrogen 2.701 N/A GLN 140.A N ALA 136.A O no hydrogen 3.065 N/A PHE 141.A N LEU 137.A O no hydrogen 2.892 N/A ARG 142.A N THR 138.A O no hydrogen 2.792 N/A ARG 142.A NE ASP 143.A OD2 no hydrogen 3.057 N/A ASP 143.A N ARG 139.A O no hydrogen 2.930 N/A LEU 144.A N GLN 140.A O no hydrogen 2.952 N/A VAL 145.A N PHE 141.A O no hydrogen 3.084 N/A VAL 145.A N ARG 142.A O no hydrogen 3.310 N/A GLN 146.A N ASP 143.A O no hydrogen 3.327 N/A SER 148.A N VAL 145.A O no hydrogen 2.853 N/A SER 148.A OG VAL 145.A O no hydrogen 2.687 N/A ILE 150.A N SER 148.A OG no hydrogen 3.197 N/A ASP 151.A N TYR 128.A O no hydrogen 2.886 N/A VAL 153.A N LEU 130.A O no hydrogen 2.858 N/A GLU 155.A N ILE 132.A O no hydrogen 2.846 N/A ILE 158.A N GLN 133.A OE1 no hydrogen 3.037 N/A GLN 159.A N ASN 157.A OD1 no hydrogen 3.140 N/A GLN 159.A NE2 TYR 97.A OH no hydrogen 2.637 N/A ILE 162.A N ILE 158.A O no hydrogen 3.030 N/A TRP 163.A N GLN 159.A O no hydrogen 2.928 N/A TYR 164.A N GLN 160.A O no hydrogen 2.852 N/A LYS 165.A N ALA 161.A O no hydrogen 3.194 N/A LYS 165.A NZ VAL 111.A O no hydrogen 3.234 N/A LEU 166.A N ILE 162.A O no hydrogen 2.876 N/A LEU 167.A N TRP 163.A O no hydrogen 2.936 N/A VAL 168.A N TYR 164.A O no hydrogen 2.976 N/A ASN 169.A N LYS 165.A O no hydrogen 2.844 N/A LEU 170.A N LEU 166.A O no hydrogen 2.834 N/A GLY 171.A N LEU 167.A O no hydrogen 3.294 N/A ILE 172.A N TYR 225.A OH no hydrogen 3.005 N/A ASN 173.A N ASN 169.A O no hydrogen 2.980 N/A ASN 173.A ND2 ASN 169.A O no hydrogen 3.487 N/A SER 174.A OG LEU 170.A O no hydrogen 2.551 N/A ILE 175.A N GLY 171.A O no hydrogen 3.204 N/A THR 176.A N ILE 172.A O no hydrogen 3.016 N/A THR 176.A OG1 ILE 172.A O no hydrogen 2.758 N/A THR 176.A OG1 ASN 173.A O no hydrogen 3.358 N/A THR 176.A OG1 THR 234.A OG1 no hydrogen 2.734 N/A ALA 177.A N ASN 173.A O no hydrogen 3.031 N/A LEU 178.A N SER 174.A O no hydrogen 2.952 N/A GLY 179.A N ILE 175.A O no hydrogen 2.956 N/A ARG 180.A N ALA 177.A O no hydrogen 3.082 N/A ARG 180.A NH1 ALA 177.A O no hydrogen 3.549 N/A ARG 180.A NH1 LEU 178.A O no hydrogen 3.149 N/A GLN 181.A N THR 176.A O no hydrogen 3.042 N/A THR 182.A OG1 ASP 230.A O no hydrogen 2.841 N/A VAL 183.A N MET 232.A O no hydrogen 2.953 N/A ILE 185.A N THR 182.A O no hydrogen 3.101 N/A MET 186.A N VAL 183.A O no hydrogen 2.879 N/A HIS 187.A N ALA 184.A O no hydrogen 2.973 N/A HIS 187.A NE2 ASP 230.A OD2 no hydrogen 2.661 N/A ASN 188.A N ILE 185.A O no hydrogen 3.140 N/A ASN 188.A ND2 ILE 185.A O no hydrogen 2.970 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 2.760 N/A ILE 191.A N ASN 188.A O no hydrogen 3.114 N/A ARG 192.A N ASN 188.A O no hydrogen 3.197 N/A ARG 192.A NH2 MET 186.A O no hydrogen 2.938 N/A ILE 193.A N PRO 189.A O no hydrogen 3.049 N/A LEU 194.A N GLU 190.A O no hydrogen 3.035 N/A CYS 195.A N ILE 191.A O no hydrogen 2.811 N/A ARG 196.A N ARG 192.A O no hydrogen 3.077 N/A ARG 196.A NH2 ASP 219.A OD1 no hydrogen 2.459 N/A GLN 197.A N ILE 193.A O no hydrogen 3.084 N/A LEU 198.A N LEU 194.A O no hydrogen 2.790 N/A LEU 199.A N CYS 195.A O no hydrogen 2.892 N/A LEU 200.A N ARG 196.A O no hydrogen 2.870 N/A ASP 201.A N GLN 197.A O no hydrogen 2.935 N/A GLY 202.A N LEU 198.A O no hydrogen 3.012 N/A CYS 203.A N LEU 199.A O no hydrogen 2.811 N/A CYS 203.A SG.A SER 214.A O no hydrogen 3.453 N/A CYS 203.A SG.B LEU 199.A O no hydrogen 3.523 N/A CYS 203.A SG.B SER 214.A O no hydrogen 3.923 N/A ARG 204.A N LEU 200.A O no hydrogen 2.985 N/A ARG 204.A NH1.A ASP 265.A O no hydrogen 3.475 N/A ARG 204.A NH2.A ASP 265.A O no hydrogen 2.611 N/A ARG 204.A NH2.B ASP 201.A OD1 no hydrogen 2.666 N/A ARG 204.A NH2.B ASP 265.A O no hydrogen 2.822 N/A VAL 205.A N ASP 201.A O no hydrogen 3.201 N/A ALA 206.A N GLY 202.A O no hydrogen 2.903 N/A GLN 207.A N CYS 203.A O no hydrogen 2.885 N/A GLN 207.A NE2 PHE 213.A O no hydrogen 2.878 N/A ALA 208.A N ARG 204.A O no hydrogen 3.092 N/A GLU 209.A N VAL 205.A O no hydrogen 2.982 N/A GLY 210.A N GLN 207.A O no hydrogen 2.775 N/A LEU 211.A N ALA 206.A O no hydrogen 2.946 N/A SER 214.A N THR 217.A OG1 no hydrogen 3.043 N/A VAL 218.A N SER 214.A O no hydrogen 3.332 N/A ASP 219.A N GLU 215.A O no hydrogen 2.947 N/A THR 220.A N GLN 216.A O no hydrogen 2.924 N/A THR 220.A OG1 GLN 216.A O no hydrogen 3.166 N/A ILE 221.A N THR 217.A O no hydrogen 3.016 N/A MET 222.A N VAL 218.A O no hydrogen 2.832 N/A THR 223.A N ASP 219.A O no hydrogen 2.904 N/A THR 223.A OG1 ASP 219.A O no hydrogen 3.014 N/A ILE 224.A N THR 220.A O no hydrogen 3.005 N/A TYR 225.A N ILE 221.A O no hydrogen 2.998 N/A TYR 225.A OH VAL 168.A O no hydrogen 2.467 N/A GLN 226.A N MET 222.A O no hydrogen 3.172 N/A GLN 226.A N THR 223.A O no hydrogen 3.234 N/A GLY 227.A N ILE 224.A O no hydrogen 2.968 N/A TYR 228.A N TYR 225.A O no hydrogen 3.155 N/A GLU 231.A N GLU 231.A OE1 no hydrogen 2.760 N/A MET 232.A N PRO 229.A O no hydrogen 2.955 N/A THR 234.A OG1 THR 176.A OG1 no hydrogen 2.734 N/A SER 235.A OG ASN 173.A OD1 no hydrogen 3.485 N/A MET 236.A N ASN 173.A OD1 no hydrogen 3.454 N/A TYR 237.A N THR 234.A OG1 no hydrogen 3.153 N/A TYR 238.A N THR 234.A O no hydrogen 2.983 N/A ASP 239.A N SER 235.A O no hydrogen 2.989 N/A ILE 240.A N MET 236.A O no hydrogen 2.972 N/A VAL 241.A N TYR 237.A O no hydrogen 2.988 N/A HIS 242.A N TYR 238.A O no hydrogen 3.096 N/A HIS 242.A ND1 TYR 238.A O no hydrogen 2.693 N/A GLN 243.A N ILE 240.A O no hydrogen 3.166 N/A GLN 244.A N ASP 239.A O no hydrogen 2.818 N/A GLN 244.A NE2 HIS 242.A O no hydrogen 3.187 N/A LEU 246.A N GLN 280.A OE1 no hydrogen 2.799 N/A ILE 251.A N VAL 248.A O no hydrogen 3.061 N/A GLN 252.A N GLN 252.A OE1 no hydrogen 2.749 N/A GLN 252.A NE2 SER 174.A OG no hydrogen 2.957 N/A GLY 253.A N VAL 248.A O no hydrogen 2.789 N/A ILE 255.A N ILE 251.A O no hydrogen 3.086 N/A TYR 256.A N GLN 252.A O no hydrogen 2.879 N/A ARG 257.A N GLY 253.A O no hydrogen 2.820 N/A ARG 257.A NH1 GLU 249.A O no hydrogen 3.555 N/A ARG 257.A NH1 GLU 249.A OE1 no hydrogen 2.982 N/A ARG 257.A NH2 GLU 249.A O no hydrogen 2.949 N/A ARG 258.A N PHE 254.A O no hydrogen 2.984 N/A ALA 259.A N ILE 255.A O no hydrogen 2.873 N/A ARG 260.A N TYR 256.A O no hydrogen 3.009 N/A ARG 260.A NH1 ASP 270.A OD1 no hydrogen 2.804 N/A ARG 260.A NH2 LEU 264.A O no hydrogen 2.771 N/A ARG 260.A NH2 THR 266.A OG1 no hydrogen 2.971 N/A GLU 261.A N ARG 257.A O no hydrogen 3.036 N/A HIS 262.A N ARG 258.A O no hydrogen 3.091 N/A HIS 262.A N ALA 259.A O no hydrogen 3.229 N/A HIS 262.A NE2 GLU 209.A OE2 no hydrogen 2.540 N/A ASN 263.A N ARG 260.A O no hydrogen 2.890 N/A LEU 264.A N ALA 259.A O no hydrogen 2.931 N/A THR 266.A OG1 ASP 270.A OD1 no hydrogen 2.836 N/A LEU 269.A N ASP 201.A OD2 no hydrogen 2.893 N/A ASP 270.A N THR 266.A O no hydrogen 2.844 N/A THR 271.A N PRO 267.A O no hydrogen 3.001 N/A THR 271.A OG1 PRO 267.A O no hydrogen 2.809 N/A ILE 272.A N TYR 268.A O no hydrogen 3.006 N/A TYR 273.A N LEU 269.A O no hydrogen 2.831 N/A TYR 273.A OH GLU 249.A OE1 no hydrogen 2.932 N/A TYR 273.A OH GLU 249.A OE2 no hydrogen 2.870 N/A SER 274.A N ASP 270.A O no hydrogen 2.934 N/A SER 274.A OG ASP 270.A O no hydrogen 2.602 N/A PHE 275.A N THR 271.A O no hydrogen 3.293 N/A LEU 276.A N ILE 272.A O no hydrogen 3.107 N/A ARG 277.A N TYR 273.A O no hydrogen 2.791 N/A ARG 277.A NH1 GLU 249.A OE2 no hydrogen 3.191 N/A ALA 278.A N SER 274.A O no hydrogen 2.978 N/A TYR 279.A N PHE 275.A O no hydrogen 2.972 N/A TYR 279.A OH GLN 244.A O no hydrogen 2.695 N/A GLN 280.A N LEU 276.A O no hydrogen 2.983 N/A GLN 280.A NE2 LEU 246.A O no hydrogen 3.193 N/A GLN 281.A N ARG 277.A O no hydrogen 2.866 N/A ASN 282.A N ALA 278.A O no hydrogen 2.993 N/A GLU 283.A N TYR 279.A O no hydrogen 3.018 N/A GLY 284.A N GLN 280.A O no hydrogen 3.148 N/A