Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4l44_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 10.A N ARG 7.A O no hydrogen 2.982 N/A CYS 10.A SG THR 32.A OG1 no hydrogen 3.359 N/A PHE 11.A N PRO 8.A O no hydrogen 3.249 N/A GLU 12.A N ARG 29.A O no hydrogen 2.972 N/A LEU 14.A N GLN 27.A O no hydrogen 2.833 N/A ARG 15.A N GLN 27.A O no hydrogen 3.351 N/A ARG 15.A NE GLN 27.A OE1 no hydrogen 3.246 N/A LEU 17.A N VAL 25.A O no hydrogen 2.827 N/A GLY 18.A N VAL 25.A O no hydrogen 3.342 N/A GLY 20.A N GLY 23.A O no hydrogen 2.651 N/A TYR 22.A OH ASP 56.A OD2 no hydrogen 2.685 N/A LYS 24.A N VAL 44.A O no hydrogen 3.091 N/A VAL 25.A N GLY 18.A O no hydrogen 2.738 N/A PHE 26.A N MET 42.A O no hydrogen 2.824 N/A GLN 27.A N ARG 15.A O no hydrogen 2.712 N/A VAL 28.A N PHE 40.A O no hydrogen 2.783 N/A ARG 29.A N GLU 12.A O no hydrogen 3.020 N/A ARG 29.A NE GLU 292.A OE2 no hydrogen 3.342 N/A ARG 29.A NH1 GLU 12.A OE2 no hydrogen 2.721 N/A ARG 29.A NH2 GLU 292.A OE2 no hydrogen 3.120 N/A LYS 30.A N LYS 38.A O no hydrogen 2.827 N/A LYS 30.A NZ GLU 4.A OE1 no hydrogen 3.245 N/A LYS 30.A NZ GLU 4.A OE2 no hydrogen 3.303 N/A LYS 30.A NZ THR 32.A O no hydrogen 2.781 N/A VAL 31.A N CYS 10.A O no hydrogen 2.804 N/A THR 32.A OG1 GLU 4.A OE1 no hydrogen 3.317 N/A THR 36.A N GLY 33.A O no hydrogen 3.462 N/A THR 36.A OG1 GLY 33.A O no hydrogen 2.436 N/A GLY 37.A N LYS 30.A O no hydrogen 2.653 N/A LYS 38.A N ASN 35.A O no hydrogen 2.969 N/A PHE 40.A N VAL 28.A O no hydrogen 2.881 N/A ALA 41.A N LEU 92.A O no hydrogen 2.858 N/A MET 42.A N PHE 26.A O no hydrogen 2.717 N/A LYS 43.A N LEU 90.A O no hydrogen 2.754 N/A LYS 43.A NZ GLU 63.A OE2 no hydrogen 2.827 N/A LYS 43.A NZ ASP 156.A OD1 no hydrogen 3.492 N/A VAL 44.A N LYS 24.A O no hydrogen 2.807 N/A LEU 45.A N LEU 88.A O no hydrogen 2.830 N/A LYS 46.A N TYR 22.A O no hydrogen 2.456 N/A LYS 47.A N GLY 86.A O no hydrogen 3.134 N/A LYS 47.A NZ GLN 83.A OE1 no hydrogen 2.776 N/A LYS 47.A NZ GLY 85.A O no hydrogen 2.673 N/A ASN 53.A N ILE 50.A O no hydrogen 3.156 N/A ASP 56.A N ASN 53.A OD1 no hydrogen 3.100 N/A THR 57.A N ASN 53.A O no hydrogen 3.246 N/A THR 57.A OG1 ILE 50.A O no hydrogen 3.062 N/A THR 57.A OG1 ASN 53.A O no hydrogen 2.570 N/A THR 57.A OG1 ALA 54.A O no hydrogen 3.463 N/A ALA 58.A N ALA 54.A O no hydrogen 2.763 N/A HIS 59.A N LYS 55.A O no hydrogen 3.147 N/A THR 60.A N ASP 56.A O no hydrogen 3.039 N/A THR 60.A OG1 ASP 56.A O no hydrogen 2.716 N/A LYS 61.A N THR 57.A O no hydrogen 2.985 N/A LYS 61.A NZ VAL 311.A O no hydrogen 2.711 N/A ALA 62.A N ALA 58.A O no hydrogen 2.860 N/A GLU 63.A N HIS 59.A O no hydrogen 2.855 N/A ARG 64.A N THR 60.A O no hydrogen 3.173 N/A ARG 64.A NE ARG 64.A O no hydrogen 2.739 N/A ARG 64.A NH1 PHE 315.A O no hydrogen 2.489 N/A ASN 65.A N LYS 61.A O no hydrogen 2.921 N/A ILE 66.A N ALA 62.A O no hydrogen 2.669 N/A LEU 67.A N GLU 63.A O no hydrogen 2.846 N/A GLU 68.A N ASN 65.A O no hydrogen 3.285 N/A GLU 69.A N ASN 65.A O no hydrogen 3.052 N/A VAL 70.A N ILE 66.A O no hydrogen 2.761 N/A LYS 71.A NZ GLU 68.A O no hydrogen 2.996 N/A LYS 71.A NZ TYR 317.A OH no hydrogen 2.494 N/A PHE 74.A N HIS 72.A ND1 no hydrogen 3.116 N/A ILE 75.A N HIS 72.A O no hydrogen 2.909 N/A VAL 76.A N LEU 154.A O no hydrogen 2.944 N/A ASP 77.A N GLU 93.A OE1 no hydrogen 2.887 N/A ILE 79.A N ILE 91.A O no hydrogen 2.744 N/A TYR 80.A N ILE 91.A O no hydrogen 3.084 N/A ALA 81.A N TYR 317.A O no hydrogen 3.004 N/A PHE 82.A N TYR 89.A O no hydrogen 2.989 N/A GLN 83.A NE2 PHE 312.A O no hydrogen 2.578 N/A THR 84.A N LYS 87.A O no hydrogen 2.808 N/A LYS 87.A N THR 84.A O no hydrogen 2.894 N/A LYS 87.A NZ GLN 303.A OE1 no hydrogen 3.359 N/A LEU 88.A N LEU 45.A O no hydrogen 3.004 N/A TYR 89.A N PHE 82.A O no hydrogen 2.767 N/A TYR 89.A OH THR 304.A O no hydrogen 2.470 N/A LEU 90.A N LYS 43.A O no hydrogen 2.884 N/A ILE 91.A N TYR 80.A O no hydrogen 2.609 N/A LEU 92.A N ALA 41.A O no hydrogen 2.793 N/A GLU 93.A N ASP 77.A O no hydrogen 3.048 N/A TYR 94.A OH ASP 293.A O no hydrogen 2.514 N/A GLY 97.A N LEU 146.A O no hydrogen 2.902 N/A GLY 98.A N LEU 95.A O no hydrogen 3.363 N/A LEU 100.A N ILE 144.A O no hydrogen 2.915 N/A GLN 103.A N LEU 100.A O no hydrogen 3.044 N/A LEU 104.A N PHE 101.A O no hydrogen 3.087 N/A ARG 106.A NE GLN 103.A OE1 no hydrogen 2.828 N/A ARG 106.A NH2 GLN 103.A OE1 no hydrogen 2.690 N/A GLU 107.A N GLN 103.A O no hydrogen 2.722 N/A PHE 110.A N MET 201.A O no hydrogen 3.047 N/A THR 114.A OG1 ASP 113.A OD1 no hydrogen 3.318 N/A ALA 115.A N MET 111.A O no hydrogen 2.782 N/A CYS 116.A N GLU 112.A O no hydrogen 2.654 N/A CYS 116.A SG PHE 266.A O no hydrogen 3.483 N/A TYR 118.A N THR 114.A O no hydrogen 3.387 N/A TYR 118.A OH GLY 150.A O no hydrogen 3.283 N/A LEU 119.A N ALA 115.A O no hydrogen 2.848 N/A ALA 120.A N CYS 116.A O no hydrogen 2.858 N/A GLU 121.A N PHE 117.A O no hydrogen 3.148 N/A ILE 122.A N TYR 118.A O no hydrogen 2.956 N/A SER 123.A N LEU 119.A O no hydrogen 2.844 N/A SER 123.A OG ALA 120.A O no hydrogen 2.755 N/A MET 124.A N ALA 120.A O no hydrogen 3.115 N/A ALA 125.A N GLU 121.A O no hydrogen 3.308 N/A LEU 126.A N ILE 122.A O no hydrogen 2.913 N/A GLY 127.A N SER 123.A O no hydrogen 2.937 N/A HIS 128.A N MET 124.A O no hydrogen 3.212 N/A LEU 129.A N ALA 125.A O no hydrogen 3.130 N/A HIS 130.A N LEU 126.A O no hydrogen 3.045 N/A HIS 130.A ND1 ASP 257.A OD2 no hydrogen 3.051 N/A HIS 130.A NE2 ASP 190.A OD2 no hydrogen 2.839 N/A GLN 131.A N GLY 127.A O no hydrogen 3.127 N/A GLN 131.A NE2 GLY 127.A O no hydrogen 3.056 N/A LYS 132.A N HIS 128.A O no hydrogen 3.207 N/A LYS 132.A N LEU 129.A O no hydrogen 3.036 N/A GLY 133.A N HIS 130.A O no hydrogen 3.232 N/A ILE 134.A N LEU 129.A O no hydrogen 2.742 N/A TYR 136.A OH THR 155.A O no hydrogen 2.301 N/A ARG 137.A N ASP 190.A OD1 no hydrogen 3.158 N/A ASP 138.A N TYR 136.A O no hydrogen 3.146 N/A LYS 140.A N ASN 143.A OD1 no hydrogen 2.823 N/A ASN 143.A N LYS 140.A O no hydrogen 2.941 N/A ILE 144.A N PRO 141.A O no hydrogen 3.302 N/A MET 145.A N LYS 153.A O no hydrogen 3.046 N/A ASN 147.A N HIS 151.A O no hydrogen 2.958 N/A ASN 147.A ND2 GLN 149.A OE1 no hydrogen 3.497 N/A GLN 149.A N ASN 147.A OD1 no hydrogen 3.235 N/A GLY 150.A N ASN 147.A O no hydrogen 3.045 N/A HIS 151.A N ASN 147.A OD1 no hydrogen 2.780 N/A HIS 151.A NE2 VAL 280.A O no hydrogen 3.079 N/A VAL 152.A N GLU 121.A OE1 no hydrogen 2.803 N/A LYS 153.A N MET 145.A O no hydrogen 2.917 N/A LYS 153.A NZ PRO 73.A O no hydrogen 3.186 N/A LYS 153.A NZ ILE 75.A O no hydrogen 2.772 N/A LYS 153.A NZ GLU 93.A OE1 no hydrogen 2.855 N/A LEU 154.A N PHE 74.A O no hydrogen 2.843 N/A THR 155.A N ASN 143.A O no hydrogen 3.223 N/A THR 155.A OG1 ASN 143.A O no hydrogen 2.854 N/A CYS 160.A SG HIS 166.A ND1 no hydrogen 3.897 N/A LYS 161.A NZ ASP 156.A OD2 no hydrogen 2.861 N/A HIS 166.A NE2 ASP 56.A OD1 no hydrogen 2.784 N/A CYS 169.A N HIS 166.A O no hydrogen 3.063 N/A CYS 169.A SG HIS 166.A ND1 no hydrogen 3.003 N/A CYS 169.A SG HIS 166.A O no hydrogen 2.902 N/A THR 171.A N CYS 169.A O no hydrogen 3.284 N/A MET 175.A N ILE 172.A O no hydrogen 3.120 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.944 N/A ILE 179.A N ALA 176.A O no hydrogen 3.103 N/A LEU 180.A N ALA 176.A O no hydrogen 3.227 N/A MET 181.A N PRO 177.A O no hydrogen 3.118 N/A ARG 182.A N ILE 179.A O no hydrogen 3.366 N/A SER 183.A N GLU 178.A O no hydrogen 3.221 N/A ARG 187.A NH1 GLY 252.A O no hydrogen 2.890 N/A ARG 187.A NH1 GLY 254.A O no hydrogen 2.850 N/A ARG 187.A NH1 ASP 257.A OD1 no hydrogen 2.782 N/A ARG 187.A NH2 ALA 253.A O no hydrogen 2.831 N/A ARG 187.A NH2 GLY 254.A O no hydrogen 2.913 N/A VAL 189.A N ASN 186.A O no hydrogen 3.086 N/A ASP 190.A N ARG 187.A O no hydrogen 3.001 N/A TRP 191.A N ALA 188.A O no hydrogen 3.052 N/A TRP 191.A NE1 ASP 257.A OD1 no hydrogen 2.989 N/A TRP 192.A N ALA 188.A O no hydrogen 3.117 N/A SER 193.A N VAL 189.A O no hydrogen 3.075 N/A SER 193.A OG TYR 174.A O no hydrogen 3.424 N/A SER 193.A OG VAL 189.A O no hydrogen 3.260 N/A LEU 194.A N ASP 190.A O no hydrogen 3.115 N/A GLY 195.A N TRP 191.A O no hydrogen 3.079 N/A ALA 196.A N TRP 192.A O no hydrogen 2.855 N/A LEU 197.A N SER 193.A O no hydrogen 2.825 N/A MET 198.A N LEU 194.A O no hydrogen 2.869 N/A TYR 199.A N GLY 195.A O no hydrogen 2.896 N/A TYR 199.A OH ASN 226.A O no hydrogen 2.643 N/A ASP 200.A N ALA 196.A O no hydrogen 3.062 N/A MET 201.A N LEU 197.A O no hydrogen 2.967 N/A LEU 202.A N MET 198.A O no hydrogen 2.966 N/A THR 203.A OG1 TYR 199.A O no hydrogen 2.532 N/A GLY 204.A N ASP 200.A O no hydrogen 2.722 N/A ALA 205.A N THR 203.A OG1 no hydrogen 3.366 N/A ARG 213.A NH2 PHE 168.A O no hydrogen 2.616 N/A LYS 215.A N ASN 212.A OD1 no hydrogen 3.361 N/A THR 216.A OG1 ASN 212.A O no hydrogen 2.488 N/A ILE 217.A N ARG 213.A O no hydrogen 3.062 N/A ASP 218.A N LYS 214.A O no hydrogen 3.106 N/A LYS 219.A N LYS 215.A O no hydrogen 2.919 N/A ILE 220.A N THR 216.A O no hydrogen 3.113 N/A LEU 221.A N ILE 217.A O no hydrogen 2.955 N/A LYS 222.A N ASP 218.A O no hydrogen 2.805 N/A CYS 223.A N LYS 219.A O no hydrogen 3.268 N/A CYS 223.A SG LEU 243.A O no hydrogen 3.720 N/A TYR 230.A OH LEU 202.A O no hydrogen 2.655 N/A LEU 231.A N PRO 228.A O no hydrogen 3.507 N/A THR 232.A N GLU 112.A OE2 no hydrogen 2.652 N/A THR 232.A OG1 GLU 112.A OE1 no hydrogen 2.458 N/A THR 232.A OG1 GLU 112.A OE2 no hydrogen 3.112 N/A THR 232.A OG1 GLU 234.A OE1 no hydrogen 3.334 N/A GLN 233.A NE2 GLU 234.A OE2 no hydrogen 3.328 N/A ARG 236.A N THR 232.A O no hydrogen 3.086 N/A ASP 237.A N GLN 233.A O no hydrogen 3.103 N/A LEU 238.A N GLU 234.A O no hydrogen 3.076 N/A LEU 239.A N ALA 235.A O no hydrogen 3.205 N/A LYS 240.A N ARG 236.A O no hydrogen 3.275 N/A LYS 241.A N ASP 237.A O no hydrogen 3.098 N/A LYS 241.A NZ ASP 237.A OD1 no hydrogen 3.519 N/A LYS 241.A NZ ASP 237.A OD2 no hydrogen 2.849 N/A LEU 242.A N LEU 238.A O no hydrogen 2.761 N/A LEU 243.A N LEU 239.A O no hydrogen 2.832 N/A ARG 245.A NH2 GLU 178.A OE1 no hydrogen 3.463 N/A SER 249.A N ASN 246.A O no hydrogen 3.243 N/A ARG 250.A N ALA 247.A O no hydrogen 3.321 N/A ARG 250.A NE LYS 244.A O no hydrogen 3.221 N/A ARG 250.A NH1 GLU 178.A OE2 no hydrogen 2.686 N/A ARG 250.A NH1 ALA 188.A O no hydrogen 3.093 N/A ARG 250.A NH2 GLU 178.A OE1 no hydrogen 2.973 N/A ARG 250.A NH2 LYS 244.A O no hydrogen 2.778 N/A LEU 251.A N LYS 241.A O no hydrogen 2.792 N/A GLY 252.A N GLU 260.A OE1 no hydrogen 3.050 N/A ASP 257.A N GLY 254.A O no hydrogen 3.123 N/A VAL 261.A N ASP 257.A O no hydrogen 3.224 N/A GLN 262.A N ALA 258.A O no hydrogen 2.616 N/A GLN 262.A NE2 SER 123.A OG no hydrogen 3.081 N/A ALA 263.A N GLU 260.A O no hydrogen 3.186 N/A HIS 264.A N VAL 261.A O no hydrogen 3.070 N/A HIS 264.A NE2 ASP 237.A OD2 no hydrogen 3.007 N/A PHE 266.A N HIS 264.A ND1 no hydrogen 3.109 N/A PHE 267.A N HIS 264.A O no hydrogen 2.860 N/A ARG 268.A N PRO 265.A O no hydrogen 3.005 N/A ARG 268.A NE PRO 265.A O no hydrogen 2.676 N/A ILE 270.A N PHE 267.A O no hydrogen 2.988 N/A GLU 274.A N ASN 271.A OD1 no hydrogen 2.883 N/A LEU 275.A N ASN 271.A O no hydrogen 2.949 N/A LEU 276.A N TRP 272.A O no hydrogen 2.991 N/A ALA 277.A N GLU 273.A O no hydrogen 3.186 N/A ARG 278.A N LEU 275.A O no hydrogen 2.901 N/A LYS 279.A N GLU 274.A O no hydrogen 3.015 N/A PHE 284.A N TYR 118.A OH no hydrogen 3.234 N/A GLU 292.A N GLU 292.A OE1 no hydrogen 2.718 N/A SER 295.A OG VAL 294.A O no hydrogen 2.841 N/A SER 298.A OG ASP 297.A OD1 no hydrogen 3.323 N/A THR 304.A OG1 PRO 8.A O no hydrogen 2.738 N/A THR 304.A OG1 PHE 11.A O no hydrogen 3.472 N/A ALA 308.A N GLU 306.A O no hydrogen 2.778 N/A TYR 317.A N ALA 81.A O no hydrogen 2.745 N/A ALA 319.A N ILE 79.A O no hydrogen 2.832 N/A