Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4m54_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 3.A N LEU 307.A O no hydrogen 2.790 N/A LEU 4.A N ILE 103.A O no hydrogen 3.104 N/A TYR 5.A N THR 305.A O no hydrogen 2.618 N/A LEU 6.A N VAL 105.A O no hydrogen 3.015 N/A ASN 7.A N ASP 10.A OD2 no hydrogen 3.344 N/A ARG 8.A NH1 GLU 86.A OE2 no hydrogen 2.777 N/A ASP 10.A N ASN 7.A OD1 no hydrogen 2.718 N/A ILE 11.A N ASN 7.A O no hydrogen 2.951 N/A GLU 12.A N ARG 8.A O no hydrogen 3.028 N/A GLN 13.A N SER 9.A O no hydrogen 3.005 N/A ALA 14.A N ASP 10.A O no hydrogen 2.948 N/A GLY 15.A N GLU 12.A O no hydrogen 2.872 N/A GLY 16.A N ILE 11.A O no hydrogen 2.692 N/A SER 19.A N GLU 153.A OE1 no hydrogen 2.944 N/A SER 19.A OG GLU 153.A OE1 no hydrogen 2.663 N/A GLN 20.A N HIS 18.A ND1 no hydrogen 3.119 N/A GLN 20.A NE2 ASP 24.A OD1 no hydrogen 3.090 N/A TYR 22.A N SER 19.A O no hydrogen 2.957 N/A TYR 22.A OH GLY 16.A O no hydrogen 2.694 N/A VAL 23.A N SER 19.A O no hydrogen 2.930 N/A ASP 24.A N GLN 20.A O no hydrogen 2.931 N/A ALA 25.A N VAL 21.A O no hydrogen 3.077 N/A LEU 26.A N TYR 22.A O no hydrogen 2.860 N/A THR 27.A N VAL 23.A O no hydrogen 3.041 N/A THR 27.A OG1 VAL 23.A O no hydrogen 2.362 N/A GLU 28.A N ASP 24.A O no hydrogen 3.387 N/A ALA 29.A N ALA 25.A O no hydrogen 3.024 N/A LEU 30.A N LEU 26.A O no hydrogen 2.546 N/A THR 31.A N THR 27.A O no hydrogen 3.166 N/A THR 31.A OG1 THR 27.A O no hydrogen 2.476 N/A ALA 32.A N GLU 28.A O no hydrogen 3.016 N/A HIS 33.A N ALA 29.A O no hydrogen 2.846 N/A HIS 33.A NE2 ASP 248.A OD2 no hydrogen 2.643 N/A ALA 34.A N LEU 30.A O no hydrogen 3.086 N/A HIS 35.A N THR 31.A O no hydrogen 3.163 N/A HIS 35.A ND1 THR 31.A O no hydrogen 3.126 N/A ASN 36.A N HIS 33.A O no hydrogen 3.111 N/A ASP 37.A N ALA 32.A O no hydrogen 2.872 N/A VAL 39.A N HIS 60.A O no hydrogen 2.835 N/A LEU 46.A N ILE 54.A O no hydrogen 2.828 N/A ARG 47.A NH1 ILE 50.A O no hydrogen 3.110 N/A ARG 47.A NH2 ILE 50.A O no hydrogen 3.292 N/A ALA 51.A N HIS 49.A ND1 no hydrogen 2.917 N/A ASP 52.A N HIS 49.A O no hydrogen 3.293 N/A ARG 53.A N SER 75.A O no hydrogen 3.085 N/A ARG 53.A NH1 ILE 50.A O no hydrogen 3.203 N/A ILE 54.A N LEU 46.A O no hydrogen 3.041 N/A ILE 55.A N ILE 73.A O no hydrogen 2.856 N/A ALA 56.A N PRO 44.A O no hydrogen 3.270 N/A MET 57.A N LYS 71.A O no hydrogen 2.870 N/A SER 59.A N GLY 69.A O no hydrogen 2.926 N/A HIS 60.A N VAL 39.A O no hydrogen 2.764 N/A HIS 60.A ND1 SER 68.A OG no hydrogen 2.787 N/A ILE 61.A N ILE 67.A O no hydrogen 2.832 N/A GLY 62.A N ASP 37.A O no hydrogen 2.967 N/A ILE 67.A N ILE 61.A O no hydrogen 3.051 N/A SER 68.A N ASN 95.A O no hydrogen 3.149 N/A SER 68.A OG HIS 60.A ND1 no hydrogen 2.787 N/A GLY 69.A N SER 59.A O no hydrogen 3.097 N/A ILE 70.A N ILE 93.A O no hydrogen 3.066 N/A LYS 71.A N MET 57.A O no hydrogen 2.957 N/A LYS 71.A NZ SER 112.A OG no hydrogen 2.957 N/A LYS 71.A NZ ASP 287.A OD1 no hydrogen 2.677 N/A TRP 72.A N VAL 91.A O no hydrogen 2.952 N/A ILE 73.A N ILE 55.A O no hydrogen 3.200 N/A GLY 74.A N SER 89.A O no hydrogen 2.692 N/A SER 75.A OG ALA 51.A O no hydrogen 2.541 N/A LYS 76.A N ARG 87.A O no hydrogen 3.133 N/A HIS 77.A N ASP 52.A OD1 no hydrogen 3.005 N/A HIS 77.A ND1 ASP 52.A OD1 no hydrogen 2.771 N/A ASN 79.A N LYS 76.A O no hydrogen 3.107 N/A ASN 79.A ND2 GLU 86.A O no hydrogen 3.337 N/A ASN 79.A ND2 ARG 87.A O no hydrogen 3.246 N/A LYS 82.A N ASP 78.A O no hydrogen 2.785 N/A ARG 83.A N ASN 79.A O no hydrogen 3.161 N/A MET 85.A N ASN 79.A O no hydrogen 2.932 N/A ARG 87.A NH1 SER 75.A OG no hydrogen 2.794 N/A SER 89.A N GLY 74.A O no hydrogen 3.074 N/A VAL 91.A N TRP 72.A O no hydrogen 3.261 N/A ILE 92.A N MET 106.A O no hydrogen 2.427 N/A ILE 93.A N ILE 70.A O no hydrogen 3.074 N/A LEU 94.A N ALA 104.A O no hydrogen 2.989 N/A ASN 95.A N SER 68.A O no hydrogen 2.772 N/A ASN 95.A ND2 ASN 100.A O no hydrogen 3.053 N/A ASP 96.A N TYR 101.A O no hydrogen 2.993 N/A GLU 98.A N ASP 96.A OD1 no hydrogen 3.320 N/A THR 99.A N ASP 96.A O no hydrogen 3.105 N/A THR 99.A OG1 ASP 96.A OD2 no hydrogen 3.363 N/A ASN 100.A N ASP 96.A O no hydrogen 2.512 N/A TYR 101.A N THR 99.A OG1 no hydrogen 3.172 N/A TYR 101.A OH TYR 310.A OH no hydrogen 3.146 N/A ILE 103.A N LEU 94.A O no hydrogen 2.866 N/A VAL 105.A N LEU 4.A O no hydrogen 3.056 N/A MET 106.A N ILE 92.A O no hydrogen 2.686 N/A GLU 107.A N LEU 6.A O no hydrogen 3.083 N/A ALA 108.A N GLY 90.A O no hydrogen 2.892 N/A SER 109.A N GLU 107.A OE2 no hydrogen 3.055 N/A SER 109.A OG GLU 107.A OE1 no hydrogen 3.415 N/A SER 109.A OG GLU 107.A OE2 no hydrogen 2.354 N/A SER 112.A N ALA 108.A O no hydrogen 2.710 N/A SER 113.A N SER 109.A O no hydrogen 3.016 N/A SER 113.A OG SER 109.A O no hydrogen 3.265 N/A SER 113.A OG LEU 110.A O no hydrogen 2.880 N/A MET 114.A N LEU 110.A O no hydrogen 2.982 N/A ARG 115.A N ILE 111.A O no hydrogen 2.936 N/A ARG 115.A NE ASP 287.A OD1 no hydrogen 2.500 N/A ARG 115.A NH2 ASP 287.A OD1 no hydrogen 2.999 N/A ARG 115.A NH2 ASP 287.A OD2 no hydrogen 2.887 N/A THR 116.A N SER 112.A O no hydrogen 3.190 N/A THR 116.A OG1 SER 112.A O no hydrogen 2.620 N/A ALA 117.A N SER 113.A O no hydrogen 3.185 N/A ALA 118.A N MET 114.A O no hydrogen 3.004 N/A VAL 119.A N ARG 115.A O no hydrogen 2.931 N/A SER 120.A N THR 116.A O no hydrogen 3.397 N/A SER 120.A OG GLN 147.A OE1 no hydrogen 2.866 N/A SER 120.A OG SER 226.A OG no hydrogen 2.855 N/A VAL 121.A N ALA 117.A O no hydrogen 3.039 N/A ILE 122.A N ALA 118.A O no hydrogen 2.951 N/A ALA 123.A N VAL 119.A O no hydrogen 2.999 N/A ALA 124.A N SER 120.A O no hydrogen 2.888 N/A LYS 125.A N VAL 121.A O no hydrogen 3.029 N/A LYS 125.A N ILE 122.A O no hydrogen 3.218 N/A HIS 126.A N ALA 123.A O no hydrogen 3.183 N/A HIS 126.A ND1 ILE 122.A O no hydrogen 3.171 N/A LEU 127.A N ALA 123.A O no hydrogen 2.692 N/A ALA 128.A N ALA 124.A O no hydrogen 2.970 N/A LYS 129.A NZ GLU 201.A OE2 no hydrogen 3.453 N/A LYS 130.A NZ LYS 125.A O no hydrogen 3.569 N/A LYS 133.A N GLU 201.A OE1 no hydrogen 2.505 N/A ASP 134.A N GLU 201.A OE1 no hydrogen 2.811 N/A LEU 135.A N ARG 160.A O no hydrogen 2.874 N/A THR 136.A N VAL 202.A O no hydrogen 2.684 N/A THR 136.A OG1 ALA 196.A O no hydrogen 2.639 N/A ILE 137.A N PHE 162.A O no hydrogen 2.916 N/A ILE 138.A N ILE 204.A O no hydrogen 2.964 N/A GLY 139.A N TYR 164.A O no hydrogen 2.943 N/A CYS 140.A N ASP 165.A OD2 no hydrogen 2.768 N/A ASP 145.A N GLY 141.A O no hydrogen 3.133 N/A LYS 146.A N LEU 142.A O no hydrogen 3.203 N/A LYS 146.A NZ ASN 17.A OD1 no hydrogen 2.646 N/A LYS 146.A NZ GLN 149.A OE1 no hydrogen 2.951 N/A GLN 147.A N ILE 143.A O no hydrogen 2.857 N/A GLN 147.A NE2 THR 116.A O no hydrogen 3.197 N/A LEU 148.A N GLY 144.A O no hydrogen 3.056 N/A GLN 149.A N ASP 145.A O no hydrogen 3.002 N/A GLN 149.A NE2 ASN 17.A O no hydrogen 2.926 N/A GLN 149.A NE2 GLU 153.A OE2 no hydrogen 2.906 N/A SER 150.A N LYS 146.A O no hydrogen 3.051 N/A SER 150.A OG LYS 146.A O no hydrogen 2.980 N/A MET 151.A N GLN 147.A O no hydrogen 3.159 N/A LEU 152.A N LEU 148.A O no hydrogen 3.084 N/A GLU 153.A N GLN 149.A O no hydrogen 3.084 N/A GLN 154.A N SER 150.A O no hydrogen 3.023 N/A GLN 154.A NE2 SER 19.A OG no hydrogen 2.945 N/A GLN 154.A NE2 GLN 20.A OE1 no hydrogen 2.861 N/A PHE 155.A N MET 151.A O no hydrogen 2.849 N/A HIS 157.A ND1 PHE 132.A O no hydrogen 2.553 N/A ILE 158.A N PHE 155.A O no hydrogen 3.417 N/A GLU 159.A N LYS 133.A O no hydrogen 2.827 N/A ARG 160.A N LYS 133.A O no hydrogen 3.014 N/A ARG 160.A NE ASP 134.A OD1 no hydrogen 2.935 N/A ARG 160.A NH2 ASP 134.A OD2 no hydrogen 3.021 N/A VAL 161.A N ASN 186.A O no hydrogen 3.162 N/A PHE 162.A N LEU 135.A O no hydrogen 2.716 N/A VAL 163.A N ILE 188.A O no hydrogen 3.059 N/A TYR 164.A N ILE 137.A O no hydrogen 3.085 N/A PHE 167.A N ASP 165.A OD1 no hydrogen 2.928 N/A CYS 171.A N PHE 167.A O no hydrogen 3.306 N/A CYS 171.A SG VAL 163.A O no hydrogen 3.652 N/A ALA 172.A N SER 168.A O no hydrogen 2.970 N/A ARG 173.A N GLU 169.A O no hydrogen 3.038 N/A PHE 174.A N ALA 170.A O no hydrogen 3.252 N/A VAL 175.A N CYS 171.A O no hydrogen 3.032 N/A ASP 176.A N ALA 172.A O no hydrogen 3.137 N/A ARG 177.A N ARG 173.A O no hydrogen 3.094 N/A TRP 178.A N PHE 174.A O no hydrogen 3.236 N/A TRP 178.A NE1 ASP 145.A OD1 no hydrogen 2.867 N/A GLN 179.A N VAL 175.A O no hydrogen 2.887 N/A GLN 179.A NE2 GLN 179.A O no hydrogen 3.265 N/A GLN 179.A NE2 ILE 185.A O no hydrogen 2.668 N/A GLN 180.A N ASP 176.A O no hydrogen 3.372 N/A GLN 180.A N ARG 177.A O no hydrogen 3.243 N/A GLN 181.A N ARG 177.A O no hydrogen 3.151 N/A ARG 182.A N TRP 178.A O no hydrogen 2.897 N/A ARG 182.A NE GLU 184.A OE2 no hydrogen 2.845 N/A ARG 182.A NH1 GLU 184.A OE2 no hydrogen 2.687 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.511 N/A ILE 185.A N ARG 182.A O no hydrogen 3.297 N/A ASN 186.A N GLU 159.A O no hydrogen 3.381 N/A PHE 187.A N GLN 179.A OE1 no hydrogen 3.149 N/A ILE 188.A N VAL 161.A O no hydrogen 2.985 N/A THR 190.A N VAL 163.A O no hydrogen 3.075 N/A THR 190.A OG1 VAL 163.A O no hydrogen 3.226 N/A THR 190.A OG1 ASN 192.A O no hydrogen 3.049 N/A GLU 195.A N ASN 192.A OD1 no hydrogen 2.617 N/A ALA 196.A N ASN 192.A O no hydrogen 3.477 N/A VAL 197.A N ALA 193.A O no hydrogen 2.923 N/A SER 198.A N LYS 194.A O no hydrogen 2.958 N/A SER 198.A OG LYS 194.A O no hydrogen 2.578 N/A SER 198.A OG GLU 195.A O no hydrogen 3.321 N/A ASN 199.A N ALA 196.A O no hydrogen 3.331 N/A ASN 199.A ND2 GLU 195.A O no hydrogen 2.278 N/A GLY 200.A N VAL 197.A O no hydrogen 3.146 N/A GLU 201.A N ASP 134.A O no hydrogen 2.937 N/A VAL 202.A N ASP 134.A O no hydrogen 3.215 N/A VAL 203.A N PHE 224.A O no hydrogen 2.905 N/A ILE 204.A N THR 136.A O no hydrogen 2.756 N/A THR 205.A N SER 226.A O no hydrogen 3.383 N/A THR 205.A OG1 ASN 227.A OD1 no hydrogen 2.754 N/A THR 205.A OG1 SER 229.A OG no hydrogen 3.209 N/A CYS 206.A N ILE 138.A O no hydrogen 2.596 N/A THR 207.A N SER 229.A OG no hydrogen 3.164 N/A THR 207.A OG1 ASP 232.A OD1 no hydrogen 3.455 N/A THR 207.A OG1 ASP 232.A OD2 no hydrogen 2.615 N/A THR 209.A N THR 207.A OG1 no hydrogen 3.202 N/A THR 209.A OG1 GLN 211.A O no hydrogen 3.154 N/A GLN 211.A N THR 209.A OG1 no hydrogen 3.396 N/A TYR 213.A N ASP 232.A O no hydrogen 2.943 N/A TYR 213.A OH ASP 232.A OD2 no hydrogen 2.618 N/A ILE 214.A N ASP 232.A O no hydrogen 3.046 N/A TYR 216.A N GLU 236.A OE1 no hydrogen 2.936 N/A TRP 218.A N GLU 215.A O no hydrogen 3.241 N/A LEU 219.A N TYR 216.A O no hydrogen 3.088 N/A GLN 220.A NE2 SER 198.A O no hydrogen 2.792 N/A GLY 222.A N ASP 273.A O no hydrogen 2.992 N/A ALA 223.A N GLN 220.A O no hydrogen 3.352 N/A PHE 224.A N GLU 201.A O no hydrogen 2.883 N/A ILE 225.A N ILE 276.A O no hydrogen 2.901 N/A SER 226.A N VAL 203.A O no hydrogen 2.852 N/A SER 226.A OG SER 120.A OG no hydrogen 2.855 N/A ASN 227.A N LEU 278.A O no hydrogen 2.849 N/A ASN 227.A ND2 ILE 230.A O no hydrogen 2.603 N/A ASN 227.A ND2 ASN 279.A OD1 no hydrogen 3.352 N/A ILE 228.A N SER 226.A O no hydrogen 2.780 N/A SER 229.A N THR 205.A O no hydrogen 2.929 N/A SER 229.A OG THR 205.A OG1 no hydrogen 3.209 N/A SER 229.A OG ASP 232.A OD1 no hydrogen 2.322 N/A ILE 230.A N ASN 227.A O no hydrogen 3.180 N/A MET 231.A N SER 229.A O no hydrogen 2.559 N/A HIS 234.A N ILE 214.A O no hydrogen 3.215 N/A VAL 237.A N HIS 234.A O no hydrogen 3.068 N/A ILE 239.A N LYS 235.A O no hydrogen 3.293 N/A ILE 239.A N GLU 236.A O no hydrogen 3.161 N/A LYS 240.A N GLU 236.A O no hydrogen 2.721 N/A LYS 240.A NZ GLU 236.A OE2 no hydrogen 2.790 N/A ALA 241.A N VAL 237.A O no hydrogen 2.811 N/A ASP 242.A N ILE 275.A O no hydrogen 2.976 N/A LYS 243.A NZ GLY 268.A O no hydrogen 2.736 N/A LYS 243.A NZ GLU 270.A OE1 no hydrogen 2.709 N/A LYS 243.A NZ GLU 274.A OE1 no hydrogen 2.854 N/A LYS 243.A NZ GLU 274.A OE2 no hydrogen 3.003 N/A VAL 245.A N LEU 277.A O no hydrogen 2.773 N/A VAL 246.A N ALA 256.A O no hydrogen 3.279 N/A ASP 248.A N ASP 247.A OD1 no hydrogen 2.719 N/A TRP 249.A N GLU 257.A OE2 no hydrogen 2.844 N/A SER 250.A OG ASP 248.A OD1 no hydrogen 2.837 N/A GLN 251.A N ASP 248.A OD1 no hydrogen 3.132 N/A CYS 252.A N TRP 249.A O no hydrogen 2.594 N/A CYS 252.A SG ASP 247.A OD1 no hydrogen 3.740 N/A CYS 252.A SG ASP 248.A O no hydrogen 3.199 N/A CYS 252.A SG ASN 279.A O no hydrogen 3.716 N/A HIS 255.A N VAL 244.A O no hydrogen 2.951 N/A HIS 255.A NE2 PRO 267.A O no hydrogen 2.646 N/A GLU 257.A N GLN 260.A OE1 no hydrogen 3.090 N/A LEU 258.A N VAL 246.A O no hydrogen 2.775 N/A GLN 260.A N GLU 257.A O no hydrogen 2.931 N/A LEU 261.A N LEU 258.A O no hydrogen 3.092 N/A THR 263.A OG1 GLY 259.A O no hydrogen 3.323 N/A THR 263.A OG1 GLN 260.A O no hydrogen 3.272 N/A THR 263.A OG1 ASP 265.A OD2 no hydrogen 2.913 N/A ILE 266.A N GLN 260.A O no hydrogen 3.185 N/A ARG 269.A N HIS 126.A O no hydrogen 2.765 N/A ARG 269.A NE LEU 127.A O no hydrogen 2.479 N/A ARG 269.A NH1 ASP 271.A O no hydrogen 2.993 N/A ARG 269.A NH1 GLU 274.A O no hydrogen 2.525 N/A ARG 269.A NH2 LEU 127.A O no hydrogen 2.997 N/A ARG 269.A NH2 ALA 223.A O no hydrogen 2.978 N/A ARG 269.A NH2 GLU 274.A O no hydrogen 2.789 N/A GLU 270.A N GLU 274.A OE1 no hydrogen 2.968 N/A ASP 273.A N ASP 271.A OD1 no hydrogen 3.035 N/A GLU 274.A N ASP 271.A O no hydrogen 3.440 N/A ILE 275.A N ASP 242.A OD2 no hydrogen 2.625 N/A ILE 276.A N ALA 223.A O no hydrogen 2.974 N/A LEU 277.A N LYS 243.A O no hydrogen 2.931 N/A LEU 278.A N ILE 225.A O no hydrogen 2.833 N/A ASN 279.A N VAL 245.A O no hydrogen 2.642 N/A MET 281.A N ASP 247.A OD1 no hydrogen 3.072 N/A GLY 282.A N ASP 247.A OD2 no hydrogen 2.704 N/A MET 283.A N GLU 286.A OE1 no hydrogen 3.207 N/A ILE 285.A N GLN 40.A OE1 no hydrogen 3.027 N/A GLU 286.A N MET 283.A O no hydrogen 3.088 N/A ILE 288.A N ALA 284.A O no hydrogen 2.946 N/A SER 289.A N ILE 285.A O no hydrogen 3.129 N/A SER 289.A OG ILE 285.A O no hydrogen 2.744 N/A SER 289.A OG GLU 286.A O no hydrogen 3.338 N/A SER 290.A N GLU 286.A O no hydrogen 3.271 N/A SER 290.A OG GLU 286.A O no hydrogen 2.774 N/A ALA 291.A N ASP 287.A O no hydrogen 2.862 N/A TYR 292.A N ILE 288.A O no hydrogen 2.911 N/A PHE 293.A N SER 289.A O no hydrogen 2.994 N/A ILE 294.A N SER 290.A O no hydrogen 3.026 N/A TYR 295.A N ALA 291.A O no hydrogen 2.745 N/A GLN 296.A N TYR 292.A O no hydrogen 3.175 N/A GLN 297.A N PHE 293.A O no hydrogen 3.391 N/A ALA 298.A N ILE 294.A O no hydrogen 2.923 N/A GLN 299.A N TYR 295.A O no hydrogen 3.088 N/A GLN 299.A NE2 TYR 295.A OH no hydrogen 3.119 N/A GLN 300.A N GLN 296.A O no hydrogen 3.120 N/A GLN 301.A N GLN 297.A O no hydrogen 2.932 N/A ILE 303.A N ALA 298.A O no hydrogen 2.637 N/A THR 305.A N TYR 5.A O no hydrogen 2.896 N/A LEU 307.A N MET 3.A O no hydrogen 2.629 N/A LEU 309.A N ARG 1.A O no hydrogen 2.786 N/A