Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ny4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N VAL 75.A O no hydrogen 3.185 N/A GLU 5.A N TYR 77.A O no hydrogen 2.789 N/A HIS 7.A N GLU 4.A O no hydrogen 2.973 N/A LEU 8.A N GLU 5.A O no hydrogen 3.025 N/A LYS 9.A N ARG 26.A O no hydrogen 2.845 N/A TYR 10.A OH GLN 13.A OE1 no hydrogen 3.307 N/A ILE 11.A N LEU 24.A O no hydrogen 2.997 N/A LEU 14.A N VAL 22.A O no hydrogen 2.891 N/A GLY 15.A N VAL 22.A O no hydrogen 2.690 N/A GLY 20.A N ASN 18.A O no hydrogen 2.774 N/A SER 21.A N GLN 42.A O no hydrogen 3.028 N/A GLU 23.A N VAL 40.A O no hydrogen 2.804 N/A LEU 24.A N SER 12.A O no hydrogen 3.052 N/A CYS 25.A N VAL 38.A O no hydrogen 2.940 N/A ARG 26.A N LYS 9.A O no hydrogen 2.897 N/A ARG 26.A NH1 GLY 35.A O no hydrogen 2.958 N/A TYR 27.A N ALA 36.A O no hydrogen 2.767 N/A ASP 28.A N HIS 7.A O no hydrogen 2.761 N/A GLY 31.A N ASP 28.A O no hydrogen 3.088 N/A ASN 33.A N ASP 28.A OD2 no hydrogen 2.869 N/A THR 34.A N ASP 28.A OD1 no hydrogen 3.364 N/A THR 34.A N ASP 32.A OD1 no hydrogen 3.213 N/A THR 34.A OG1 ASP 32.A OD1 no hydrogen 2.667 N/A THR 34.A OG1 ASP 32.A OD2 no hydrogen 3.383 N/A VAL 38.A N CYS 25.A O no hydrogen 2.727 N/A ALA 39.A N MET 84.A O no hydrogen 2.997 N/A VAL 40.A N GLU 23.A O no hydrogen 2.853 N/A LYS 41.A N LEU 82.A O no hydrogen 2.788 N/A LYS 41.A NZ GLU 57.A OE1 no hydrogen 3.154 N/A LYS 41.A NZ GLU 57.A OE2 no hydrogen 2.777 N/A GLN 42.A N SER 21.A O no hydrogen 3.084 N/A GLN 44.A N PHE 19.A O no hydrogen 2.930 N/A GLN 51.A N GLY 47.A O no hydrogen 3.424 N/A ASP 53.A N ASP 49.A O no hydrogen 3.287 N/A PHE 54.A N GLN 50.A O no hydrogen 2.791 N/A GLN 55.A N GLN 51.A O no hydrogen 2.926 N/A ARG 56.A N ARG 52.A O no hydrogen 3.082 N/A GLU 57.A N ASP 53.A O no hydrogen 3.269 N/A ILE 58.A N PHE 54.A O no hydrogen 3.132 N/A GLN 59.A N GLN 55.A O no hydrogen 2.931 N/A GLN 59.A NE2 GLN 55.A O no hydrogen 2.802 N/A ILE 60.A N ARG 56.A O no hydrogen 2.906 N/A LEU 61.A N GLU 57.A O no hydrogen 3.018 N/A LYS 62.A N ILE 58.A O no hydrogen 2.883 N/A ALA 63.A N GLN 59.A O no hydrogen 3.413 N/A LEU 64.A N LEU 61.A O no hydrogen 3.096 N/A HIS 65.A N TYR 121.A OH no hydrogen 2.791 N/A PHE 68.A N SER 66.A OG no hydrogen 3.011 N/A ILE 69.A N SER 66.A O no hydrogen 3.458 N/A VAL 70.A N ILE 147.A O no hydrogen 2.975 N/A LYS 71.A N GLU 85.A OE2 no hydrogen 3.034 N/A ARG 73.A N VAL 83.A O no hydrogen 2.832 N/A GLY 74.A N VAL 83.A O no hydrogen 3.036 N/A VAL 75.A N THR 1.A O no hydrogen 3.243 N/A SER 76.A N ARG 81.A O no hydrogen 2.829 N/A SER 76.A OG PHE 3.A O no hydrogen 2.716 N/A TYR 77.A N PHE 3.A O no hydrogen 2.904 N/A ARG 81.A NE GLU 5.A OE2 no hydrogen 2.849 N/A ARG 81.A NH2 GLU 5.A OE1 no hydrogen 2.960 N/A LEU 82.A N LYS 41.A O no hydrogen 2.791 N/A VAL 83.A N GLY 74.A O no hydrogen 2.753 N/A MET 84.A N ALA 39.A O no hydrogen 2.830 N/A GLU 85.A N LYS 71.A O no hydrogen 3.159 N/A GLY 90.A N LEU 87.A O no hydrogen 2.894 N/A CYS 91.A SG ASP 94.A OD2 no hydrogen 3.298 N/A LEU 92.A N ILE 137.A O no hydrogen 2.774 N/A ARG 93.A N ALA 134.A O no hydrogen 3.241 N/A PHE 95.A N CYS 91.A O no hydrogen 3.073 N/A LEU 96.A N LEU 92.A O no hydrogen 2.926 N/A GLN 97.A N ASP 94.A O no hydrogen 3.126 N/A GLN 97.A NE2 CYS 202.A O no hydrogen 2.809 N/A ARG 98.A N ASP 94.A O no hydrogen 2.975 N/A ARG 98.A NH2 SER 89.A O no hydrogen 2.958 N/A HIS 99.A N PHE 95.A O no hydrogen 2.986 N/A ARG 102.A N HIS 99.A O no hydrogen 3.133 N/A ARG 102.A NE GLU 142.A OE2 no hydrogen 2.727 N/A ARG 102.A NH2 GLU 142.A OE1 no hydrogen 2.781 N/A LEU 103.A N ARG 100.A O no hydrogen 3.267 N/A SER 106.A OG ASP 104.A OD1 no hydrogen 2.722 N/A ARG 107.A N ASP 104.A OD1 no hydrogen 3.282 N/A LEU 108.A N ASP 104.A O no hydrogen 3.132 N/A LEU 109.A N ALA 105.A O no hydrogen 2.855 N/A LEU 110.A N SER 106.A O no hydrogen 2.775 N/A TYR 111.A N ARG 107.A O no hydrogen 2.971 N/A TYR 111.A OH GLU 142.A O no hydrogen 2.652 N/A SER 112.A N LEU 108.A O no hydrogen 2.916 N/A SER 112.A OG LEU 108.A O no hydrogen 2.786 N/A SER 113.A N LEU 109.A O no hydrogen 2.909 N/A SER 113.A OG ASP 274.A OD1 no hydrogen 2.687 N/A GLN 114.A N LEU 110.A O no hydrogen 2.971 N/A GLN 114.A NE2 ALA 143.A O no hydrogen 2.870 N/A ILE 115.A N TYR 111.A O no hydrogen 2.883 N/A CYS 116.A N SER 112.A O no hydrogen 2.993 N/A CYS 116.A SG PHE 266.A O no hydrogen 3.207 N/A LYS 117.A N SER 113.A O no hydrogen 2.893 N/A GLY 118.A N GLN 114.A O no hydrogen 3.025 N/A MET 119.A N ILE 115.A O no hydrogen 2.940 N/A GLU 120.A N CYS 116.A O no hydrogen 2.887 N/A TYR 121.A N LYS 117.A O no hydrogen 3.027 N/A LEU 122.A N GLY 118.A O no hydrogen 2.942 N/A GLY 123.A N MET 119.A O no hydrogen 2.795 N/A SER 124.A N GLU 120.A O no hydrogen 2.935 N/A SER 124.A OG TYR 121.A O no hydrogen 2.709 N/A ARG 125.A N TYR 121.A O no hydrogen 3.231 N/A ARG 125.A N LEU 122.A O no hydrogen 3.072 N/A ARG 126.A N GLY 123.A O no hydrogen 2.778 N/A ARG 126.A NE LEU 156.A O no hydrogen 3.068 N/A ARG 126.A NH2 PRO 157.A O no hydrogen 3.196 N/A ARG 126.A NH2 LYS 160.A O no hydrogen 2.725 N/A ARG 126.A NH2 ASP 161.A OD1 no hydrogen 3.489 N/A CYS 127.A N LEU 122.A O no hydrogen 2.993 N/A CYS 127.A SG VAL 128.A O no hydrogen 3.798 N/A VAL 128.A N LYS 154.A O no hydrogen 2.843 N/A HIS 129.A N ASP 187.A OD2 no hydrogen 2.803 N/A HIS 129.A NE2 ALA 148.A O no hydrogen 2.739 N/A ARG 130.A N ASP 187.A OD1 no hydrogen 3.048 N/A ARG 130.A NH1 LEU 152.A O no hydrogen 3.283 N/A ASP 131.A N HIS 129.A ND1 no hydrogen 3.020 N/A ALA 134.A N GLU 197.A OE1 no hydrogen 2.918 N/A ASN 136.A N ALA 133.A O no hydrogen 2.808 N/A ASN 136.A ND2 ASP 131.A O no hydrogen 2.918 N/A ILE 137.A N ALA 134.A O no hydrogen 3.341 N/A LEU 138.A N LYS 146.A O no hydrogen 2.799 N/A VAL 139.A N GLY 90.A O no hydrogen 2.906 N/A GLU 140.A N HIS 144.A O no hydrogen 2.924 N/A SER 141.A N HIS 144.A O no hydrogen 3.297 N/A HIS 144.A N SER 141.A O no hydrogen 3.027 N/A HIS 144.A NE2 ASP 67.A O no hydrogen 2.705 N/A VAL 145.A N GLN 114.A OE1 no hydrogen 2.886 N/A LYS 146.A N LEU 138.A O no hydrogen 2.920 N/A LYS 146.A NZ GLU 85.A OE2 no hydrogen 2.793 N/A LYS 146.A NZ GLU 140.A OE1 no hydrogen 3.300 N/A ILE 147.A N PHE 68.A O no hydrogen 2.886 N/A ALA 148.A N ASN 136.A O no hydrogen 2.817 N/A GLY 151.A N ASP 149.A OD1 no hydrogen 3.476 N/A ALA 153.A N PHE 150.A O no hydrogen 3.272 N/A LYS 154.A N VAL 128.A O no hydrogen 3.041 N/A LEU 156.A N ARG 126.A O no hydrogen 2.706 N/A LYS 160.A N PRO 157.A O no hydrogen 3.160 N/A LYS 160.A NZ TYR 162.A OH no hydrogen 2.989 N/A TYR 163.A N PHE 182.A O no hydrogen 2.779 N/A VAL 165.A N ASN 180.A O no hydrogen 3.044 N/A GLN 166.A N TYR 172.A OH no hydrogen 3.277 N/A SER 167.A N TYR 172.A OH no hydrogen 3.044 N/A SER 167.A OG ASP 131.A OD1 no hydrogen 3.262 N/A TRP 171.A NE1 GLU 197.A OE1 no hydrogen 2.991 N/A TYR 172.A N ILE 169.A O no hydrogen 3.309 N/A GLU 175.A N GLU 175.A OE1 no hydrogen 2.891 N/A SER 176.A N ALA 173.A O no hydrogen 2.861 N/A SER 176.A OG ILE 181.A O no hydrogen 2.799 N/A LEU 177.A N ALA 173.A O no hydrogen 2.931 N/A SER 178.A N PRO 174.A O no hydrogen 2.761 N/A SER 178.A OG PRO 174.A O no hydrogen 2.976 N/A SER 178.A OG ASP 179.A OD1 no hydrogen 2.985 N/A ASP 179.A N GLU 175.A O no hydrogen 2.940 N/A ASN 180.A N SER 176.A O no hydrogen 3.075 N/A ILE 181.A N GLU 175.A O no hydrogen 3.427 N/A PHE 182.A N TYR 163.A O no hydrogen 2.729 N/A SER 183.A N SER 186.A OG no hydrogen 2.920 N/A SER 183.A OG GLN 185.A OE1 no hydrogen 2.877 N/A ARG 184.A NH1 GLY 123.A O no hydrogen 2.919 N/A GLN 185.A N SER 183.A OG no hydrogen 3.112 N/A SER 186.A N SER 183.A O no hydrogen 3.209 N/A SER 186.A N SER 183.A OG no hydrogen 3.237 N/A SER 186.A OG SER 183.A O no hydrogen 2.901 N/A ASP 187.A N SER 183.A O no hydrogen 3.181 N/A VAL 188.A N ARG 184.A O no hydrogen 3.012 N/A TRP 189.A N GLN 185.A O no hydrogen 3.237 N/A SER 190.A N SER 186.A O no hydrogen 3.051 N/A SER 190.A OG TRP 171.A O no hydrogen 2.787 N/A SER 190.A OG SER 186.A O no hydrogen 3.118 N/A PHE 191.A N ASP 187.A O no hydrogen 2.919 N/A GLY 192.A N VAL 188.A O no hydrogen 3.054 N/A VAL 193.A N TRP 189.A O no hydrogen 3.378 N/A VAL 194.A N SER 190.A O no hydrogen 2.982 N/A LEU 195.A N PHE 191.A O no hydrogen 2.926 N/A TYR 196.A N GLY 192.A O no hydrogen 3.101 N/A TYR 196.A OH CYS 206.A O no hydrogen 2.581 N/A GLU 197.A N VAL 193.A O no hydrogen 2.876 N/A LEU 198.A N VAL 194.A O no hydrogen 2.893 N/A PHE 199.A N LEU 195.A O no hydrogen 2.937 N/A THR 200.A N GLU 197.A O no hydrogen 3.252 N/A THR 200.A OG1 TYR 196.A O no hydrogen 3.118 N/A THR 200.A OG1 GLU 197.A O no hydrogen 2.995 N/A TYR 201.A N LEU 198.A O no hydrogen 2.925 N/A TYR 201.A OH LEU 103.A O no hydrogen 2.673 N/A CYS 202.A N GLU 197.A O no hydrogen 2.787 N/A CYS 202.A SG GLU 197.A O no hydrogen 3.885 N/A CYS 202.A SG GLU 197.A OE2 no hydrogen 3.792 N/A ASP 203.A N THR 200.A O no hydrogen 3.094 N/A SER 205.A N ASP 203.A OD1 no hydrogen 2.914 N/A SER 205.A OG ASP 203.A OD1 no hydrogen 2.729 N/A SER 207.A N LYS 204.A O no hydrogen 3.404 N/A SER 207.A OG LYS 204.A O no hydrogen 2.923 N/A SER 207.A OG SER 209.A OG no hydrogen 3.000 N/A SER 209.A OG SER 207.A OG no hydrogen 3.000 N/A ALA 210.A N SER 207.A OG no hydrogen 3.131 N/A GLU 211.A N SER 207.A O no hydrogen 2.845 N/A PHE 212.A N PRO 208.A O no hydrogen 2.855 N/A LEU 213.A N SER 209.A O no hydrogen 2.816 N/A ARG 214.A N ALA 210.A O no hydrogen 3.142 N/A ARG 214.A NE GLU 211.A OE1 no hydrogen 3.314 N/A ARG 214.A NE GLU 211.A OE2 no hydrogen 3.174 N/A ARG 214.A NH2 GLU 211.A OE2 no hydrogen 2.703 N/A MET 215.A N GLU 211.A O no hydrogen 3.129 N/A MET 216.A N PHE 212.A O no hydrogen 2.785 N/A GLY 217.A N LEU 213.A O no hydrogen 3.077 N/A ARG 227.A N PRO 223.A O no hydrogen 3.068 N/A LEU 228.A N ALA 224.A O no hydrogen 2.864 N/A LEU 229.A N LEU 225.A O no hydrogen 2.986 N/A GLU 230.A N SER 226.A O no hydrogen 2.778 N/A LEU 231.A N ARG 227.A O no hydrogen 2.878 N/A LEU 232.A N LEU 228.A O no hydrogen 2.813 N/A GLU 233.A N LEU 229.A O no hydrogen 2.796 N/A GLU 234.A N GLU 230.A O no hydrogen 3.061 N/A GLY 235.A N LEU 232.A O no hydrogen 3.049 N/A GLN 236.A N LEU 231.A O no hydrogen 3.045 N/A GLN 236.A NE2 GLU 234.A OE1 no hydrogen 3.562 N/A ARG 237.A NE TRP 256.A O no hydrogen 3.132 N/A ARG 237.A NH1 LEU 232.A O no hydrogen 2.859 N/A ARG 237.A NH1 GLN 236.A O no hydrogen 2.948 N/A ARG 237.A NH2 TRP 256.A O no hydrogen 2.777 N/A CYS 244.A N PRO 241.A O no hydrogen 3.231 N/A CYS 244.A SG PRO 245.A O no hydrogen 3.493 N/A VAL 248.A N PRO 245.A O no hydrogen 3.095 N/A HIS 249.A N PRO 245.A O no hydrogen 3.318 N/A GLU 250.A N ALA 246.A O no hydrogen 2.942 N/A LEU 251.A N GLU 247.A O no hydrogen 2.995 N/A MET 252.A N VAL 248.A O no hydrogen 3.008 N/A LYS 253.A N HIS 249.A O no hydrogen 3.029 N/A LYS 253.A NZ GLU 250.A OE1 no hydrogen 3.235 N/A LYS 253.A NZ GLU 250.A OE2 no hydrogen 3.472 N/A LEU 254.A N GLU 250.A O no hydrogen 3.079 N/A CYS 255.A N LEU 251.A O no hydrogen 3.079 N/A CYS 255.A SG LEU 251.A O no hydrogen 3.353 N/A TRP 256.A N MET 252.A O no hydrogen 3.018 N/A TRP 256.A N LYS 253.A O no hydrogen 3.086 N/A ALA 257.A N LEU 254.A O no hydrogen 3.083 N/A ASP 262.A N SER 259.A O no hydrogen 3.089 N/A ARG 263.A N PRO 260.A O no hydrogen 3.153 N/A ARG 263.A NE ALA 257.A O no hydrogen 3.020 N/A ARG 263.A NH1 GLU 175.A OE1 no hydrogen 3.514 N/A ARG 263.A NH1 GLU 175.A OE2 no hydrogen 2.789 N/A ARG 263.A NH1 GLN 185.A O no hydrogen 2.881 N/A ARG 263.A NH2 GLU 175.A OE1 no hydrogen 2.715 N/A ARG 263.A NH2 ALA 257.A O no hydrogen 3.564 N/A ARG 263.A NH2 PRO 258.A O no hydrogen 3.362 N/A SER 265.A OG SER 267.A OG no hydrogen 2.708 N/A SER 267.A OG SER 265.A OG no hydrogen 2.708 N/A ALA 268.A N SER 265.A OG no hydrogen 2.802 N/A LEU 269.A N SER 265.A O no hydrogen 2.860 N/A GLY 270.A N PHE 266.A O no hydrogen 3.005 N/A LEU 273.A N LEU 269.A O no hydrogen 2.955 N/A ASP 274.A N GLY 270.A O no hydrogen 2.989 N/A MET 275.A N PRO 271.A O no hydrogen 2.798 N/A LEU 276.A N GLN 272.A O no hydrogen 3.286 N/A TRP 277.A N LEU 273.A O no hydrogen 3.172 N/A