Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ag6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N SER 84.A OG no hydrogen 3.329 N/A THR 2.A N SER 84.A OG no hydrogen 3.304 N/A THR 2.A OG1 SER 84.A OG no hydrogen 3.193 N/A THR 2.A OG1 ALA 88.A O no hydrogen 2.692 N/A LYS 3.A N ASP 89.A O no hydrogen 2.923 N/A ILE 5.A N VAL 91.A O no hydrogen 2.889 N/A VAL 8.A N ASP 98.A OD2 no hydrogen 2.819 N/A GLU 10.A N THR 7.A OG1 no hydrogen 3.081 N/A MET 11.A N THR 7.A O no hydrogen 2.942 N/A GLN 12.A N VAL 8.A O no hydrogen 2.816 N/A HIS 13.A N LYS 9.A O no hydrogen 3.082 N/A ILE 14.A N GLU 10.A O no hydrogen 2.970 N/A VAL 15.A N MET 11.A O no hydrogen 2.963 N/A LYS 16.A N GLN 12.A O no hydrogen 2.842 N/A ALA 17.A N HIS 13.A O no hydrogen 3.120 N/A ALA 18.A N ILE 14.A O no hydrogen 2.888 N/A LYS 19.A N VAL 15.A O no hydrogen 2.920 N/A LYS 19.A NZ MET 141.A O no hydrogen 2.916 N/A ARG 20.A N LYS 16.A O no hydrogen 3.060 N/A SER 21.A N ALA 17.A O no hydrogen 3.203 N/A SER 21.A N ALA 18.A O no hydrogen 3.120 N/A SER 21.A OG ALA 17.A O no hydrogen 3.272 N/A SER 21.A OG ALA 18.A O no hydrogen 2.897 N/A SER 21.A OG THR 23.A OG1 no hydrogen 2.879 N/A GLY 22.A N LYS 19.A O no hydrogen 3.027 N/A THR 23.A N ALA 18.A O no hydrogen 2.960 N/A THR 23.A OG1 ALA 18.A O no hydrogen 2.985 N/A THR 23.A OG1 SER 21.A OG no hydrogen 2.879 N/A THR 24.A N ASP 50.A OD1 no hydrogen 2.852 N/A ILE 25.A N ASP 143.A OD1 no hydrogen 2.620 N/A GLY 26.A N ILE 51.A O no hydrogen 2.978 N/A PHE 27.A N TYR 144.A O no hydrogen 2.867 N/A ILE 28.A N ILE 53.A O no hydrogen 2.915 N/A THR 30.A N SER 55.A O no hydrogen 2.921 N/A THR 30.A OG1 SER 55.A O no hydrogen 2.815 N/A GLY 32.A N THR 30.A OG1 no hydrogen 3.104 N/A ALA 33.A N ASP 79.A OD2 no hydrogen 2.820 N/A LEU 34.A N ASP 79.A OD1 no hydrogen 2.896 N/A HIS 35.A N HIS 38.A ND1 no hydrogen 3.057 N/A LEU 39.A N HIS 35.A O no hydrogen 3.036 N/A THR 40.A N ASP 36.A O no hydrogen 2.870 N/A THR 40.A OG1 ASP 36.A O no hydrogen 2.745 N/A VAL 42.A N HIS 38.A O no hydrogen 3.084 N/A ARG 43.A N LEU 39.A O no hydrogen 2.806 N/A ARG 43.A NH1 ASP 36.A OD2 no hydrogen 2.799 N/A ARG 43.A NH2 ASP 36.A OD2 no hydrogen 3.012 N/A GLU 44.A N THR 40.A O no hydrogen 3.159 N/A SER 45.A N MET 41.A O no hydrogen 3.086 N/A SER 45.A OG ASN 49.A OD1 no hydrogen 3.146 N/A SER 45.A OG THR 52.A OG1 no hydrogen 2.781 N/A VAL 46.A N VAL 42.A O no hydrogen 2.874 N/A SER 47.A N ARG 43.A O no hydrogen 3.087 N/A SER 47.A N GLU 44.A O no hydrogen 3.277 N/A SER 47.A OG GLU 44.A O no hydrogen 2.696 N/A THR 48.A N SER 45.A O no hydrogen 3.008 N/A THR 48.A OG1 SER 45.A O no hydrogen 3.246 N/A THR 48.A OG1 ASN 49.A OD1 no hydrogen 2.785 N/A THR 48.A OG1 TYR 146.A OH no hydrogen 3.301 N/A ASN 49.A N SER 45.A O no hydrogen 2.796 N/A ASP 50.A N THR 24.A OG1 no hydrogen 2.906 N/A ILE 51.A N THR 24.A O no hydrogen 3.237 N/A THR 52.A N ASP 89.A OD2 no hydrogen 2.795 N/A THR 52.A OG1 SER 45.A OG no hydrogen 2.781 N/A ILE 53.A N GLY 26.A O no hydrogen 2.918 N/A VAL 54.A N ILE 90.A O no hydrogen 2.874 N/A SER 55.A N ILE 28.A O no hydrogen 3.175 N/A VAL 56.A N PHE 92.A O no hydrogen 2.801 N/A PHE 57.A N THR 30.A O no hydrogen 3.047 N/A ASN 59.A ND2 GLN 62.A OE1 no hydrogen 3.027 N/A ASN 59.A ND2 GLY 128.A O no hydrogen 2.940 N/A LEU 61.A N ASN 59.A OD1 no hydrogen 3.313 N/A GLN 62.A N ASN 59.A O no hydrogen 3.129 N/A PHE 63.A N PRO 60.A O no hydrogen 3.271 N/A GLY 64.A N GLU 67.A OE1 no hydrogen 2.741 N/A GLU 67.A N GLY 64.A O no hydrogen 3.147 N/A ALA 71.A N ASP 68.A O no hydrogen 3.144 N/A TYR 72.A N ASP 68.A O no hydrogen 2.970 N/A ARG 74.A NH1 PHE 69.A O no hydrogen 2.823 N/A ARG 74.A NH2 PHE 69.A O no hydrogen 3.126 N/A ASP 79.A N GLN 75.A O no hydrogen 2.986 N/A LEU 80.A N ILE 76.A O no hydrogen 2.754 N/A GLU 81.A N ASP 77.A O no hydrogen 3.177 N/A LEU 82.A N LYS 78.A O no hydrogen 3.075 N/A VAL 83.A N ASP 79.A O no hydrogen 3.022 N/A SER 84.A N LEU 80.A O no hydrogen 2.895 N/A SER 84.A OG THR 2.A OG1 no hydrogen 3.193 N/A SER 84.A OG LEU 80.A O no hydrogen 2.692 N/A GLU 85.A N GLU 81.A O no hydrogen 3.064 N/A VAL 86.A N VAL 83.A O no hydrogen 3.149 N/A GLY 87.A N SER 84.A O no hydrogen 3.098 N/A ALA 88.A N VAL 83.A O no hydrogen 3.179 N/A ASP 89.A N THR 52.A O no hydrogen 3.113 N/A ILE 90.A N THR 52.A O no hydrogen 3.220 N/A VAL 91.A N LYS 3.A O no hydrogen 2.832 N/A PHE 92.A N VAL 54.A O no hydrogen 2.795 N/A HIS 93.A N ILE 5.A O no hydrogen 2.919 N/A HIS 93.A ND1 VAL 56.A O no hydrogen 3.262 N/A ASP 98.A N ALA 95.A O no hydrogen 3.130 N/A MET 99.A N ALA 95.A O no hydrogen 3.264 N/A TYR 100.A N VAL 96.A O no hydrogen 2.912 N/A TYR 100.A OH ASN 59.A OD1 no hydrogen 2.780 N/A VAL 110.A N ASP 127.A OD1 no hydrogen 2.740 N/A ALA 114.A N GLY 111.A O no hydrogen 2.957 N/A ASP 115.A N PRO 112.A O no hydrogen 2.941 N/A GLU 118.A N GLN 153.A OE1 no hydrogen 2.965 N/A GLY 119.A N VAL 116.A O no hydrogen 2.847 N/A ALA 120.A N VAL 116.A O no hydrogen 3.428 N/A ALA 120.A N LEU 117.A O no hydrogen 3.059 N/A LYS 121.A N LEU 117.A O no hydrogen 3.037 N/A LYS 121.A NZ GLU 241.A OE2 no hydrogen 2.770 N/A ARG 122.A N GLU 118.A O no hydrogen 2.806 N/A ARG 122.A NE GLU 67.A OE2 no hydrogen 2.813 N/A ARG 122.A NH1 GLU 67.A OE1 no hydrogen 2.943 N/A ARG 122.A NH1 GLU 67.A OE2 no hydrogen 3.311 N/A HIS 125.A N ARG 122.A O no hydrogen 3.020 N/A HIS 125.A ND1 GLN 62.A O no hydrogen 2.830 N/A GLY 128.A N GLY 124.A O no hydrogen 2.998 N/A VAL 129.A N HIS 125.A O no hydrogen 2.943 N/A VAL 130.A N PHE 126.A O no hydrogen 2.804 N/A THR 131.A N ASP 127.A O no hydrogen 2.943 N/A THR 131.A OG1 ASP 127.A O no hydrogen 2.727 N/A VAL 132.A N GLY 128.A O no hydrogen 3.101 N/A VAL 133.A N VAL 129.A O no hydrogen 2.896 N/A ASN 134.A N VAL 130.A O no hydrogen 2.882 N/A LYS 135.A N THR 131.A O no hydrogen 3.287 N/A LYS 135.A NZ MET 99.A O no hydrogen 2.686 N/A LEU 136.A N VAL 132.A O no hydrogen 2.848 N/A PHE 137.A N VAL 133.A O no hydrogen 2.812 N/A ASN 138.A N ASN 134.A O no hydrogen 3.108 N/A ILE 139.A N LYS 135.A O no hydrogen 2.860 N/A VAL 140.A N LEU 136.A O no hydrogen 2.785 N/A MET 141.A N PHE 137.A O no hydrogen 2.811 N/A ASP 143.A N ILE 25.A O no hydrogen 2.761 N/A TYR 144.A N ILE 25.A O no hydrogen 3.202 N/A ALA 145.A N GLU 170.A O no hydrogen 2.998 N/A TYR 146.A N PHE 27.A O no hydrogen 2.872 N/A TYR 146.A OH ASN 49.A OD1 no hydrogen 3.215 N/A PHE 147.A N ILE 172.A O no hydrogen 2.976 N/A LYS 149.A N ILE 174.A O no hydrogen 2.804 N/A ASP 151.A N GLY 148.A O no hydrogen 3.318 N/A GLN 153.A NE2 LEU 113.A O no hydrogen 2.810 N/A GLN 153.A NE2 VAL 116.A O no hydrogen 2.893 N/A LEU 155.A N ASP 151.A O no hydrogen 2.953 N/A ALA 156.A N ALA 152.A O no hydrogen 3.088 N/A ILE 157.A N GLN 153.A O no hydrogen 3.032 N/A VAL 158.A N GLN 154.A O no hydrogen 2.819 N/A GLU 159.A N LEU 155.A O no hydrogen 2.987 N/A GLN 160.A N ALA 156.A O no hydrogen 3.032 N/A GLN 160.A NE2 ASP 164.A OD1 no hydrogen 3.043 N/A GLN 160.A NE2 ASP 164.A OD2 no hydrogen 3.280 N/A MET 161.A N ILE 157.A O no hydrogen 2.945 N/A VAL 162.A N VAL 158.A O no hydrogen 2.873 N/A LYS 163.A N GLU 159.A O no hydrogen 3.002 N/A ASP 164.A N GLN 160.A O no hydrogen 2.880 N/A PHE 165.A N MET 161.A O no hydrogen 2.903 N/A ASN 166.A N LYS 163.A O no hydrogen 3.212 N/A HIS 167.A N VAL 162.A O no hydrogen 3.113 N/A HIS 167.A NE2 ASN 134.A OD1 no hydrogen 2.887 N/A GLU 170.A N ASP 143.A O no hydrogen 2.919 N/A ILE 172.A N ALA 145.A O no hydrogen 2.876 N/A ILE 174.A N PHE 147.A O no hydrogen 2.823 N/A ARG 178.A NH1 GLY 182.A O no hydrogen 2.987 N/A ARG 178.A NH1 ASP 276.A OD2 no hydrogen 2.901 N/A ARG 178.A NH2 ASP 276.A OD1 no hydrogen 2.970 N/A GLU 179.A N LEU 183.A O no hydrogen 2.727 N/A GLY 182.A N GLU 179.A O no hydrogen 2.892 N/A LEU 183.A N ASP 181.A OD1 no hydrogen 3.180 N/A LYS 185.A N VAL 177.A O no hydrogen 2.983 N/A LYS 185.A NZ GLU 179.A OE1 no hydrogen 3.138 N/A LYS 185.A NZ GLU 179.A OE2 no hydrogen 2.912 N/A SER 187.A OG GLY 32.A O no hydrogen 3.220 N/A SER 187.A OG ALA 33.A O no hydrogen 2.501 N/A ARG 188.A N SER 186.A OG no hydrogen 3.208 N/A ARG 188.A NE ASP 68.A OD2 no hydrogen 2.800 N/A ARG 188.A NH1 ASP 68.A OD1 no hydrogen 2.939 N/A ARG 188.A NH1 ASP 68.A OD2 no hydrogen 3.410 N/A ASN 189.A N SER 186.A O no hydrogen 3.091 N/A ASN 189.A ND2 ALA 184.A O no hydrogen 3.114 N/A TYR 191.A N ARG 188.A O no hydrogen 3.001 N/A TYR 191.A OH ASP 68.A OD2 no hydrogen 2.757 N/A LEU 192.A N ASN 189.A O no hydrogen 2.965 N/A THR 193.A N GLU 196.A OE1 no hydrogen 3.139 N/A GLU 196.A N THR 193.A OG1 no hydrogen 3.087 N/A ARG 197.A N THR 193.A O no hydrogen 2.834 N/A ARG 197.A NH1 ASP 181.A OD1 no hydrogen 3.480 N/A ARG 197.A NH1 ASP 181.A OD2 no hydrogen 3.290 N/A ARG 197.A NH2 ASP 181.A OD2 no hydrogen 2.836 N/A ARG 197.A NH2 ARG 197.A O no hydrogen 2.929 N/A GLU 199.A N GLN 195.A O no hydrogen 3.135 N/A ALA 200.A N GLU 196.A O no hydrogen 2.684 N/A VAL 201.A N GLN 198.A O no hydrogen 3.337 N/A HIS 202.A N GLU 199.A O no hydrogen 3.054 N/A HIS 202.A ND1 TYR 231.A OH no hydrogen 2.867 N/A LEU 203.A N ALA 200.A O no hydrogen 3.267 N/A SER 204.A OG VAL 201.A O no hydrogen 2.798 N/A LYS 205.A N VAL 201.A O no hydrogen 3.253 N/A SER 206.A N HIS 202.A O no hydrogen 2.770 N/A SER 206.A OG HIS 202.A O no hydrogen 3.404 N/A SER 206.A OG LEU 203.A O no hydrogen 2.689 N/A LEU 207.A N LEU 203.A O no hydrogen 3.192 N/A LEU 207.A N SER 204.A O no hydrogen 3.068 N/A LEU 208.A N SER 204.A O no hydrogen 3.008 N/A LEU 209.A N LYS 205.A O no hydrogen 3.080 N/A ALA 210.A N SER 206.A O no hydrogen 2.902 N/A GLN 211.A N LEU 207.A O no hydrogen 2.808 N/A ALA 212.A N LEU 208.A O no hydrogen 2.969 N/A LEU 213.A N LEU 209.A O no hydrogen 2.917 N/A TYR 214.A N ALA 210.A O no hydrogen 2.953 N/A GLN 215.A N GLN 211.A O no hydrogen 2.755 N/A ASP 216.A N ALA 212.A O no hydrogen 2.995 N/A GLY 217.A N TYR 214.A O no hydrogen 2.985 N/A GLU 218.A N LEU 213.A O no hydrogen 3.060 N/A ARG 219.A NH1 TYR 214.A O no hydrogen 2.775 N/A ARG 219.A NH1 GLU 218.A O no hydrogen 2.940 N/A GLN 220.A N GLU 218.A OE1 no hydrogen 2.975 N/A GLN 220.A NE2 GLU 256.A OE2 no hydrogen 3.052 N/A SER 221.A N HIS 255.A O no hydrogen 2.895 N/A SER 221.A OG GLN 254.A O no hydrogen 2.630 N/A ILE 224.A N GLN 220.A O no hydrogen 3.361 N/A ILE 225.A N SER 221.A O no hydrogen 2.851 N/A ASP 226.A N LYS 222.A O no hydrogen 2.891 N/A ARG 227.A N VAL 223.A O no hydrogen 3.055 N/A VAL 228.A N ILE 224.A O no hydrogen 2.866 N/A THR 229.A N ILE 225.A O no hydrogen 2.812 N/A THR 229.A OG1 ILE 225.A O no hydrogen 2.720 N/A GLU 230.A N ASP 226.A O no hydrogen 2.882 N/A TYR 231.A N ARG 227.A O no hydrogen 3.049 N/A TYR 231.A OH HIS 202.A ND1 no hydrogen 2.867 N/A LEU 232.A N VAL 228.A O no hydrogen 2.968 N/A GLU 233.A N THR 229.A O no hydrogen 2.843 N/A SER 234.A N GLU 230.A O no hydrogen 3.097 N/A SER 234.A N TYR 231.A O no hydrogen 3.222 N/A SER 234.A OG GLU 230.A O no hydrogen 2.986 N/A SER 234.A OG TYR 231.A O no hydrogen 2.728 N/A SER 234.A OG HIS 235.A ND1 no hydrogen 2.887 N/A HIS 235.A N LEU 232.A O no hydrogen 3.032 N/A HIS 235.A ND1 TYR 231.A O no hydrogen 2.675 N/A ILE 236.A N LEU 232.A O no hydrogen 2.858 N/A SER 237.A N GLU 199.A OE2 no hydrogen 2.953 N/A SER 237.A OG GLU 199.A OE2 no hydrogen 2.999 N/A SER 237.A OG GLU 238.A OE1 no hydrogen 3.502 N/A GLU 241.A N ALA 266.A O no hydrogen 2.783 N/A GLU 242.A N ALA 266.A O no hydrogen 3.076 N/A ALA 244.A N SER 264.A O no hydrogen 3.060 N/A TYR 246.A N PHE 262.A O no hydrogen 3.325 N/A SER 247.A N VAL 252.A O no hydrogen 2.838 N/A SER 247.A OG VAL 252.A O no hydrogen 3.355 N/A TYR 248.A N ARG 260.A O no hydrogen 3.151 N/A TYR 248.A OH ALA 152.A O no hydrogen 2.701 N/A LEU 251.A N SER 247.A O no hydrogen 2.935 N/A VAL 252.A N SER 247.A OG no hydrogen 2.861 N/A GLN 254.A N VAL 245.A O no hydrogen 2.960 N/A GLN 254.A NE2 VAL 252.A O no hydrogen 2.885 N/A ILE 257.A N ARG 219.A O no hydrogen 2.823 N/A ARG 260.A NH2 GLY 281.A O no hydrogen 2.785 N/A ILE 261.A N ILE 280.A O no hydrogen 2.758 N/A PHE 262.A N TYR 246.A O no hydrogen 2.934 N/A ILE 263.A N ILE 278.A O no hydrogen 2.893 N/A SER 264.A N ALA 244.A O no hydrogen 3.020 N/A LEU 265.A N ASP 276.A O no hydrogen 2.829 N/A ALA 266.A N GLU 242.A O no hydrogen 3.090 N/A VAL 267.A N LEU 274.A O no hydrogen 2.833 N/A LYS 268.A N ARG 239.A O no hydrogen 3.103 N/A PHE 269.A N ALA 272.A O no hydrogen 2.704 N/A SER 270.A N GLU 196.A OE2 no hydrogen 2.872 N/A SER 270.A OG GLU 196.A OE1 no hydrogen 3.113 N/A SER 270.A OG GLU 196.A OE2 no hydrogen 2.617 N/A ARG 273.A NE GLU 241.A OE1 no hydrogen 3.466 N/A ARG 273.A NE GLU 241.A OE2 no hydrogen 2.853 N/A ARG 273.A NH1 GLU 118.A OE1 no hydrogen 2.809 N/A ARG 273.A NH2 GLU 118.A OE1 no hydrogen 3.399 N/A ARG 273.A NH2 GLU 118.A OE2 no hydrogen 2.847 N/A ARG 273.A NH2 GLU 241.A OE2 no hydrogen 3.133 N/A LEU 274.A N VAL 267.A O no hydrogen 2.897 N/A ASP 276.A N LEU 265.A O no hydrogen 3.266 N/A ASN 277.A N ASP 276.A OD1 no hydrogen 2.641 N/A ASN 277.A ND2 LYS 149.A O no hydrogen 3.073 N/A ILE 278.A N ILE 263.A O no hydrogen 3.070 N/A ILE 280.A N ILE 261.A O no hydrogen 2.870 N/A