Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mx9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N GLN 89.A OE1 no hydrogen 2.945 N/A TYR 4.A OH ILE 61.A O no hydrogen 2.753 N/A LEU 9.A N ASN 5.A O no hydrogen 3.030 N/A LEU 10.A N LYS 6.A O no hydrogen 2.899 N/A TYR 11.A N GLU 7.A O no hydrogen 3.311 N/A TYR 11.A OH ASP 163.A OD2 no hydrogen 2.683 N/A LEU 12.A N PHE 8.A O no hydrogen 3.079 N/A ALA 13.A N LEU 9.A O no hydrogen 3.023 N/A GLY 14.A N LEU 10.A O no hydrogen 3.391 N/A PHE 15.A N TYR 11.A O no hydrogen 3.023 N/A VAL 16.A N LEU 12.A O no hydrogen 2.819 N/A ASP 17.A N ALA 13.A O no hydrogen 2.915 N/A GLY 18.A N GLY 14.A O no hydrogen 2.844 N/A ASP 19.A N PHE 15.A O no hydrogen 2.617 N/A GLY 20.A N VAL 16.A O no hydrogen 2.867 N/A SER 21.A N TYR 43.A O no hydrogen 2.829 N/A ILE 23.A N THR 41.A O no hydrogen 3.009 N/A GLN 25.A N ARG 39.A O no hydrogen 2.787 N/A ASN 27.A N ARG 37.A O no hydrogen 2.570 N/A ASN 29.A N LYS 35.A O no hydrogen 2.818 N/A SER 31.A N ASN 29.A OD1 no hydrogen 3.257 N/A SER 32.A OG HIS 36.A O no hydrogen 3.355 N/A LYS 33.A NZ LYS 115.A O no hydrogen 2.682 N/A LYS 35.A N SER 32.A O no hydrogen 2.865 N/A ARG 37.A N ASN 27.A O no hydrogen 2.676 N/A ARG 39.A N GLN 25.A O no hydrogen 2.868 N/A THR 41.A N ILE 23.A O no hydrogen 3.036 N/A PHE 42.A N LEU 77.A O no hydrogen 2.958 N/A TYR 43.A N SER 21.A O no hydrogen 2.858 N/A VAL 44.A N TYR 75.A O no hydrogen 2.922 N/A GLN 46.A N SER 73.A O no hydrogen 2.888 N/A GLN 46.A NE2 ASP 19.A OD2 no hydrogen 2.741 N/A GLN 46.A NE2 THR 45.A O no hydrogen 2.872 N/A LYS 47.A NZ GLN 49.A OE1 no hydrogen 3.391 N/A LYS 47.A NZ ASP 282.A OD1 no hydrogen 3.121 N/A THR 48.A N SER 71.A O no hydrogen 2.771 N/A THR 48.A OG1 ASP 68.A OD2 no hydrogen 3.131 N/A THR 48.A OG1 GLY 70.A O no hydrogen 3.322 N/A THR 48.A OG1 SER 73.A OG no hydrogen 2.899 N/A ARG 50.A N LYS 47.A O no hydrogen 2.782 N/A ARG 50.A NE GLN 46.A OE1 no hydrogen 2.924 N/A ARG 50.A NH1 ASP 282.A OD1 no hydrogen 3.310 N/A ARG 50.A NH1 ASP 282.A OD2 no hydrogen 3.306 N/A ARG 50.A NH2 GLN 46.A OE1 no hydrogen 3.453 N/A ARG 50.A NH2 ASP 282.A OD2 no hydrogen 3.174 N/A ARG 51.A N THR 48.A O no hydrogen 2.993 N/A ARG 51.A NE ASP 68.A OD1 no hydrogen 3.254 N/A ARG 51.A NH1 ASP 55.A OD2 no hydrogen 3.016 N/A ARG 51.A NH2 ASP 68.A OD1 no hydrogen 3.474 N/A PHE 53.A N ARG 50.A O no hydrogen 3.127 N/A ASP 55.A N ARG 51.A O no hydrogen 2.750 N/A LYS 56.A N TRP 52.A O no hydrogen 2.729 N/A LEU 57.A N PHE 53.A O no hydrogen 3.179 N/A VAL 58.A N LEU 54.A O no hydrogen 3.365 N/A ASP 59.A N LYS 56.A O no hydrogen 2.775 N/A GLU 60.A N LYS 56.A O no hydrogen 2.911 N/A ILE 61.A N LEU 57.A O no hydrogen 2.712 N/A GLY 62.A N VAL 58.A O no hydrogen 2.907 N/A TYR 65.A N VAL 76.A O no hydrogen 3.021 N/A ARG 67.A N GLN 74.A O no hydrogen 2.885 N/A ARG 67.A NE GLN 74.A OE1 no hydrogen 2.830 N/A ARG 67.A NH2 GLN 74.A OE1 no hydrogen 2.892 N/A SER 69.A N VAL 72.A O no hydrogen 2.778 N/A SER 69.A OG ASP 68.A O no hydrogen 3.006 N/A SER 73.A N GLN 46.A O no hydrogen 2.763 N/A SER 73.A OG THR 48.A OG1 no hydrogen 2.899 N/A GLN 74.A N ARG 67.A O no hydrogen 2.960 N/A GLN 74.A NE2 THR 45.A OG1 no hydrogen 3.124 N/A TYR 75.A N VAL 44.A O no hydrogen 2.741 N/A TYR 75.A OH VAL 63.A O no hydrogen 2.440 N/A VAL 76.A N TYR 65.A O no hydrogen 2.830 N/A LEU 77.A N PHE 42.A O no hydrogen 2.931 N/A LEU 83.A N GLU 79.A O no hydrogen 2.973 N/A HIS 84.A N ILE 80.A O no hydrogen 3.034 N/A HIS 84.A NE2 GLU 109.A OE2 no hydrogen 2.827 N/A ASN 85.A N LYS 81.A O no hydrogen 2.986 N/A ASN 85.A ND2 THR 2.A O no hydrogen 3.139 N/A PHE 86.A N PRO 82.A O no hydrogen 2.850 N/A LEU 87.A N LEU 83.A O no hydrogen 2.926 N/A THR 88.A N HIS 84.A O no hydrogen 2.888 N/A THR 88.A OG1 HIS 84.A O no hydrogen 2.877 N/A GLN 89.A NE2 THR 2.A O no hydrogen 2.967 N/A GLN 89.A NE2 ASN 85.A O no hydrogen 2.957 N/A GLN 89.A NE2 ASN 85.A OD1 no hydrogen 2.990 N/A LEU 90.A N PHE 86.A O no hydrogen 2.976 N/A LEU 90.A N LEU 87.A O no hydrogen 3.235 N/A GLN 91.A N LEU 87.A O no hydrogen 3.044 N/A GLN 91.A NE2 THR 88.A O no hydrogen 3.657 N/A PHE 93.A N LEU 90.A O no hydrogen 2.968 N/A LEU 94.A N GLN 91.A O no hydrogen 3.215 N/A LYS 95.A N ASP 17.A OD2 no hydrogen 2.877 N/A LEU 96.A N ASP 17.A OD1 no hydrogen 3.285 N/A LEU 96.A N ASP 17.A OD2 no hydrogen 3.214 N/A LYS 97.A N ASP 17.A OD1 no hydrogen 3.034 N/A GLN 98.A NE2 GLN 91.A O no hydrogen 2.744 N/A GLN 98.A NE2 GLN 91.A OE1 no hydrogen 3.516 N/A GLN 100.A N GLN 100.A OE1 no hydrogen 2.784 N/A GLN 100.A NE2 ASN 135.A OD1 no hydrogen 2.795 N/A ALA 101.A N LYS 97.A O no hydrogen 3.091 N/A ASN 102.A N GLN 98.A O no hydrogen 3.070 N/A LEU 103.A N LYS 99.A O no hydrogen 2.994 N/A VAL 104.A N GLN 100.A O no hydrogen 2.899 N/A LEU 105.A N ALA 101.A O no hydrogen 2.976 N/A LYS 106.A N ASN 102.A O no hydrogen 2.963 N/A ILE 107.A N LEU 103.A O no hydrogen 2.927 N/A ILE 108.A N VAL 104.A O no hydrogen 3.170 N/A GLU 109.A N LEU 105.A O no hydrogen 3.188 N/A GLN 110.A N LYS 106.A O no hydrogen 2.971 N/A SER 113.A OG GLN 110.A OE1 no hydrogen 3.424 N/A ALA 114.A N GLN 110.A O no hydrogen 3.035 N/A LYS 115.A N LEU 111.A O no hydrogen 3.096 N/A GLU 116.A N SER 113.A O no hydrogen 2.938 N/A ASP 119.A N SER 117.A OG no hydrogen 3.278 N/A PHE 121.A N SER 117.A O no hydrogen 3.186 N/A LEU 122.A N PRO 118.A O no hydrogen 3.296 N/A GLU 123.A N ASP 119.A O no hydrogen 3.302 N/A VAL 124.A N LYS 120.A O no hydrogen 3.198 N/A CYS 125.A N PHE 121.A O no hydrogen 3.001 N/A CYS 125.A SG PHE 121.A O no hydrogen 3.511 N/A THR 126.A N LEU 122.A O no hydrogen 3.188 N/A THR 126.A N GLU 123.A O no hydrogen 2.867 N/A THR 126.A OG1 GLU 123.A O no hydrogen 2.613 N/A TRP 127.A N VAL 124.A O no hydrogen 2.928 N/A VAL 128.A N VAL 124.A O no hydrogen 3.402 N/A ASP 129.A N CYS 125.A O no hydrogen 3.151 N/A GLN 130.A N THR 126.A O no hydrogen 3.315 N/A GLN 130.A NE2 THR 126.A O no hydrogen 3.242 N/A ILE 131.A N TRP 127.A O no hydrogen 2.946 N/A ALA 132.A N VAL 128.A O no hydrogen 3.030 N/A ALA 133.A N ASP 129.A O no hydrogen 2.916 N/A LEU 134.A N GLN 130.A O no hydrogen 2.958 N/A ASN 135.A N ILE 131.A O no hydrogen 3.014 N/A ASN 135.A ND2 ILE 22.A O no hydrogen 2.871 N/A SER 137.A N ASN 135.A O no hydrogen 2.723 N/A ARG 140.A NH1 ASP 129.A OD1 no hydrogen 3.325 N/A ARG 140.A NH2 ASP 129.A OD1 no hydrogen 2.787 N/A THR 143.A N THR 146.A OG1 no hydrogen 3.409 N/A SER 144.A N ASP 129.A OD1 no hydrogen 3.284 N/A SER 144.A OG ASP 129.A OD2 no hydrogen 2.488 N/A VAL 147.A N THR 143.A O no hydrogen 3.069 N/A ARG 148.A N SER 144.A O no hydrogen 3.153 N/A ARG 148.A N GLU 145.A O no hydrogen 3.140 N/A ARG 148.A NH1 GLU 145.A OE1 no hydrogen 2.971 N/A LYS 152.A NZ GLU 7.A OE2 no hydrogen 2.973 N/A PHE 154.A N SER 150.A O no hydrogen 3.224 N/A LEU 155.A N ASN 151.A O no hydrogen 3.215 N/A LEU 156.A N LYS 152.A O no hydrogen 3.013 N/A TYR 157.A N GLU 153.A O no hydrogen 3.296 N/A TYR 157.A OH ASP 17.A OD2 no hydrogen 2.532 N/A LEU 158.A N PHE 154.A O no hydrogen 2.718 N/A ALA 159.A N LEU 155.A O no hydrogen 2.939 N/A GLY 160.A N LEU 156.A O no hydrogen 3.317 N/A GLY 160.A N TYR 157.A O no hydrogen 3.042 N/A PHE 161.A N TYR 157.A O no hydrogen 3.138 N/A VAL 162.A N LEU 158.A O no hydrogen 2.922 N/A ASP 163.A N ALA 159.A O no hydrogen 2.827 N/A SER 164.A N GLY 160.A O no hydrogen 3.096 N/A SER 164.A OG GLY 160.A O no hydrogen 2.789 N/A SER 164.A OG PHE 161.A O no hydrogen 2.910 N/A ASP 165.A N PHE 161.A O no hydrogen 2.791 N/A GLY 166.A N VAL 162.A O no hydrogen 2.979 N/A SER 167.A N ALA 189.A O no hydrogen 2.912 N/A ILE 169.A N THR 187.A O no hydrogen 2.880 N/A GLN 171.A N SER 185.A O no hydrogen 2.608 N/A LYS 173.A N GLN 183.A O no hydrogen 2.716 N/A ARG 175.A N LYS 181.A O no hydrogen 2.637 N/A ASN 178.A N ARG 175.A O no hydrogen 3.301 N/A LYS 181.A N ASN 178.A O no hydrogen 2.710 N/A HIS 182.A ND1 PHE 180.A O no hydrogen 3.252 N/A GLN 183.A N LYS 173.A O no hydrogen 2.666 N/A GLN 183.A NE2 ASN 178.A OD1 no hydrogen 3.424 N/A SER 185.A N GLN 171.A O no hydrogen 2.737 N/A THR 187.A N ILE 169.A O no hydrogen 2.848 N/A THR 187.A OG1 SER 224.A OG no hydrogen 3.125 N/A PHE 188.A N LEU 223.A O no hydrogen 2.868 N/A ALA 189.A N SER 167.A O no hydrogen 2.945 N/A VAL 190.A N TYR 221.A O no hydrogen 2.882 N/A THR 191.A N ASP 165.A O no hydrogen 3.322 N/A THR 191.A OG1 ASP 220.A OD1 no hydrogen 3.081 N/A GLN 192.A N SER 219.A O no hydrogen 2.893 N/A GLN 192.A NE2 ASP 165.A OD2 no hydrogen 3.115 N/A GLN 192.A NE2 THR 191.A O no hydrogen 2.863 N/A LYS 193.A NZ ASP 136.A OD1 no hydrogen 3.367 N/A THR 194.A N SER 217.A O no hydrogen 2.922 N/A THR 194.A OG1 SER 219.A OG no hydrogen 2.969 N/A ARG 196.A N LYS 193.A O no hydrogen 2.936 N/A ARG 196.A NE GLN 192.A OE1 no hydrogen 2.623 N/A ARG 196.A NH1 ASP 136.A OD1 no hydrogen 3.105 N/A ARG 196.A NH2 ASP 136.A OD2 no hydrogen 2.888 N/A ARG 196.A NH2 GLN 192.A OE1 no hydrogen 3.549 N/A ARG 197.A N THR 194.A O no hydrogen 3.086 N/A ARG 197.A NE ASP 214.A OD1 no hydrogen 3.056 N/A ARG 197.A NE ASP 214.A OD2 no hydrogen 3.451 N/A ARG 197.A NH1 ASP 201.A OD2 no hydrogen 3.203 N/A PHE 199.A N ARG 196.A O no hydrogen 2.982 N/A ASP 201.A N ARG 197.A O no hydrogen 2.856 N/A LYS 202.A N TRP 198.A O no hydrogen 3.248 N/A LEU 203.A N PHE 199.A O no hydrogen 3.256 N/A VAL 204.A N LEU 200.A O no hydrogen 3.434 N/A ASP 205.A N ASP 201.A O no hydrogen 3.317 N/A GLU 206.A N LYS 202.A O no hydrogen 2.917 N/A ILE 207.A N LEU 203.A O no hydrogen 2.647 N/A GLY 208.A N VAL 204.A O no hydrogen 3.073 N/A TYR 211.A N ARG 222.A O no hydrogen 3.245 N/A TYR 213.A N ASP 220.A O no hydrogen 2.794 N/A SER 215.A N VAL 218.A O no hydrogen 2.896 N/A VAL 218.A N SER 215.A O no hydrogen 3.077 N/A SER 219.A N GLN 192.A O no hydrogen 2.912 N/A SER 219.A OG THR 194.A OG1 no hydrogen 2.969 N/A SER 219.A OG ASP 214.A OD1 no hydrogen 2.759 N/A ASP 220.A N TYR 213.A O no hydrogen 2.790 N/A TYR 221.A N VAL 190.A O no hydrogen 2.763 N/A TYR 221.A OH VAL 209.A O no hydrogen 2.321 N/A ARG 222.A N TYR 211.A O no hydrogen 2.968 N/A ARG 222.A NE ASP 220.A OD2 no hydrogen 3.110 N/A ARG 222.A NH2 ASP 220.A OD2 no hydrogen 3.081 N/A LEU 223.A N PHE 188.A O no hydrogen 2.818 N/A SER 224.A OG LEU 186.A O no hydrogen 3.078 N/A SER 224.A OG THR 187.A OG1 no hydrogen 3.125 N/A LEU 229.A N GLU 225.A O no hydrogen 2.994 N/A HIS 230.A N ILE 226.A O no hydrogen 3.291 N/A HIS 230.A NE2 GLU 255.A OE2 no hydrogen 3.194 N/A ASN 231.A N LYS 227.A O no hydrogen 2.902 N/A PHE 232.A N PRO 228.A O no hydrogen 2.829 N/A LEU 233.A N LEU 229.A O no hydrogen 2.863 N/A THR 234.A N HIS 230.A O no hydrogen 3.087 N/A THR 234.A OG1 HIS 230.A O no hydrogen 2.599 N/A GLN 235.A N ASN 231.A O no hydrogen 3.245 N/A LEU 236.A N PHE 232.A O no hydrogen 2.884 N/A GLN 237.A N LEU 233.A O no hydrogen 2.939 N/A PHE 239.A N LEU 236.A O no hydrogen 3.217 N/A LEU 240.A N GLN 237.A O no hydrogen 3.444 N/A LYS 241.A N ASP 163.A OD2 no hydrogen 2.611 N/A LEU 242.A N ASP 163.A OD1 no hydrogen 3.130 N/A LEU 242.A N ASP 163.A OD2 no hydrogen 3.008 N/A LYS 243.A N ASP 163.A OD1 no hydrogen 2.971 N/A GLN 244.A NE2 GLN 237.A O no hydrogen 2.434 N/A GLN 246.A N GLN 246.A OE1 no hydrogen 2.850 N/A GLN 246.A NE2 ASN 281.A OD1 no hydrogen 3.043 N/A ALA 247.A N LYS 243.A O no hydrogen 3.082 N/A ASN 248.A N GLN 244.A O no hydrogen 3.103 N/A LEU 249.A N LYS 245.A O no hydrogen 2.921 N/A VAL 250.A N GLN 246.A O no hydrogen 2.947 N/A LEU 251.A N ALA 247.A O no hydrogen 3.146 N/A LYS 252.A N ASN 248.A O no hydrogen 2.771 N/A ILE 253.A N LEU 249.A O no hydrogen 3.071 N/A ILE 254.A N VAL 250.A O no hydrogen 3.026 N/A GLU 255.A N LEU 251.A O no hydrogen 3.024 N/A GLN 256.A N ILE 253.A O no hydrogen 2.877 N/A LEU 257.A N ILE 254.A O no hydrogen 3.495 N/A ALA 260.A N LEU 257.A O no hydrogen 2.826 N/A LYS 261.A N LEU 257.A O no hydrogen 2.934 N/A PHE 267.A N SER 263.A O no hydrogen 3.080 N/A LEU 268.A N PRO 264.A O no hydrogen 3.341 N/A GLU 269.A N ASP 265.A O no hydrogen 2.958 N/A VAL 270.A N LYS 266.A O no hydrogen 2.918 N/A CYS 271.A N PHE 267.A O no hydrogen 3.101 N/A CYS 271.A SG PHE 267.A O no hydrogen 3.287 N/A THR 272.A N GLU 269.A O no hydrogen 3.116 N/A THR 272.A OG1 GLU 269.A O no hydrogen 2.563 N/A VAL 274.A N VAL 270.A O no hydrogen 3.233 N/A ASP 275.A N CYS 271.A O no hydrogen 3.083 N/A GLN 276.A N THR 272.A O no hydrogen 3.153 N/A ILE 277.A N TRP 273.A O no hydrogen 3.097 N/A ALA 278.A N VAL 274.A O no hydrogen 3.177 N/A ALA 279.A N ASP 275.A O no hydrogen 2.971 N/A LEU 280.A N GLN 276.A O no hydrogen 2.931 N/A ASN 281.A N ILE 277.A O no hydrogen 2.954 N/A ASN 281.A ND2 ILE 168.A O no hydrogen 3.060 N/A ARG 286.A NH1 ASP 275.A OD1 no hydrogen 3.397 N/A ARG 286.A NH2 ASP 275.A OD1 no hydrogen 2.670 N/A THR 289.A N THR 292.A OG1 no hydrogen 3.215 N/A SER 290.A N ASP 275.A OD1 no hydrogen 3.242 N/A SER 290.A OG ASP 275.A OD2 no hydrogen 2.404 N/A VAL 293.A N THR 289.A O no hydrogen 3.171 N/A ARG 294.A N GLU 291.A O no hydrogen 2.888 N/A ALA 295.A N THR 292.A O no hydrogen 2.807 N/A VAL 296.A N VAL 293.A O no hydrogen 2.990 N/A ASP 298.A N ALA 295.A O no hydrogen 2.954 N/A