Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qf1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 2.A N GLU 23.A OE1 no hydrogen 3.259 N/A SER 3.A N ASP 1.A OD1 no hydrogen 3.067 N/A SER 3.A OG ASP 1.A OD1 no hydrogen 2.588 N/A LYS 5.A N PHE 2.A O no hydrogen 2.928 N/A VAL 6.A N SER 3.A O no hydrogen 3.246 N/A ILE 7.A N ILE 34.A O no hydrogen 2.776 N/A GLN 8.A NE2 ILE 36.A O no hydrogen 3.349 N/A GLN 8.A NE2 GLU 43.A OE1 no hydrogen 2.497 N/A ASP 12.A N SER 10.A OG no hydrogen 3.095 N/A SER 13.A OG SER 10.A O no hydrogen 2.885 N/A LEU 14.A N LEU 11.A O no hydrogen 3.216 N/A ARG 19.A N PRO 15.A O no hydrogen 2.985 N/A ARG 19.A NE GLU 23.A OE2 no hydrogen 2.672 N/A ARG 19.A NH1 ASP 12.A OD1 no hydrogen 2.849 N/A ARG 19.A NH2 GLU 23.A OE1 no hydrogen 3.111 N/A ARG 19.A NH2 GLU 23.A OE2 no hydrogen 3.396 N/A LYS 20.A N GLN 16.A O no hydrogen 3.088 N/A LYS 20.A NZ GLN 16.A OE1 no hydrogen 3.548 N/A LYS 20.A NZ GLU 17.A OE1.B no hydrogen 3.244 N/A LYS 20.A NZ GLU 17.A OE2.B no hydrogen 3.436 N/A PHE 21.A N GLU 17.A O no hydrogen 3.257 N/A VAL 22.A N VAL 18.A O no hydrogen 3.004 N/A GLU 23.A N ARG 19.A O no hydrogen 2.857 N/A GLY 24.A N LYS 20.A O no hydrogen 2.845 N/A ASN 25.A N PHE 21.A O no hydrogen 3.203 N/A ASN 25.A ND2 PHE 21.A O no hydrogen 3.141 N/A ALA 26.A N VAL 22.A O no hydrogen 2.805 N/A GLN 27.A N GLU 23.A O no hydrogen 2.913 N/A LEU 28.A N GLY 24.A O no hydrogen 3.237 N/A CYS 29.A N ASN 25.A O no hydrogen 2.789 N/A CYS 29.A SG PHE 121.A O no hydrogen 4.025 N/A GLN 30.A N ALA 26.A O no hydrogen 2.868 N/A GLN 30.A NE2.B GLN 27.A O no hydrogen 2.670 N/A GLU 32.A N ARG 128.A O no hydrogen 2.735 N/A TYR 33.A N ARG 128.A O no hydrogen 3.470 N/A ILE 34.A N LYS 5.A O no hydrogen 2.870 N/A HIS 35.A N MET 130.A O no hydrogen 2.946 N/A HIS 35.A NE2 GLU 43.A OE1 no hydrogen 2.958 N/A ILE 36.A N GLN 8.A O no hydrogen 2.906 N/A CYS 37.A N VAL 132.A O no hydrogen 2.899 N/A CYS 37.A SG VAL 132.A O no hydrogen 3.425 N/A ASP 38.A N GLU 43.A OE1 no hydrogen 2.918 N/A GLY 39.A N GLU 43.A OE2 no hydrogen 2.797 N/A SER 40.A N ASP 38.A OD1 no hydrogen 2.792 N/A SER 40.A OG ASP 38.A OD1 no hydrogen 2.816 N/A SER 40.A OG ASP 38.A OD2 no hydrogen 3.421 N/A GLU 43.A N SER 40.A OG no hydrogen 3.165 N/A TYR 44.A N SER 40.A O no hydrogen 3.161 N/A GLY 45.A N GLU 41.A O no hydrogen 2.988 N/A ARG 46.A N GLU 42.A O no hydrogen 3.101 N/A LEU 47.A N GLU 43.A O no hydrogen 3.057 N/A LEU 48.A N TYR 44.A O no hydrogen 3.029 N/A ALA 49.A N GLY 45.A O no hydrogen 2.977 N/A HIS 50.A N ARG 46.A O no hydrogen 2.848 N/A MET 51.A N LEU 47.A O no hydrogen 3.049 N/A GLN 52.A N LEU 48.A O no hydrogen 2.918 N/A GLU 53.A N ALA 49.A O no hydrogen 3.164 N/A GLU 54.A N HIS 50.A O no hydrogen 3.280 N/A GLU 54.A N MET 51.A O no hydrogen 3.289 N/A GLY 55.A N GLN 52.A O no hydrogen 3.394 N/A VAL 56.A N MET 51.A O no hydrogen 2.832 N/A ILE 57.A N MET 51.A O no hydrogen 3.407 N/A ARG 58.A N LEU 68.A O no hydrogen 2.874 N/A ARG 58.A NE GLU 353.A OE1 no hydrogen 3.221 N/A ARG 58.A NH2 GLU 353.A OE1 no hydrogen 3.508 N/A ARG 58.A NH2 GLU 353.A OE2 no hydrogen 3.117 N/A LEU 60.A N CYS 66.A O no hydrogen 2.917 N/A LYS 62.A N GLY 357.A O no hydrogen 3.337 N/A TYR 63.A N LEU 60.A O no hydrogen 3.358 N/A ASN 65.A ND2 ASN 345.A OD1 no hydrogen 3.067 N/A CYS 66.A SG ASP 64.A O no hydrogen 3.797 N/A CYS 66.A SG ILE 342.A O no hydrogen 3.950 N/A CYS 66.A SG GLN 343.A O no hydrogen 3.727 N/A TRP 67.A N THR 346.A O no hydrogen 3.031 N/A TRP 67.A NE1 ASN 65.A OD1 no hydrogen 2.868 N/A LEU 68.A N ARG 58.A O no hydrogen 2.805 N/A ALA 69.A N PHE 348.A O no hydrogen 2.843 N/A THR 71.A N ASN 350.A OD1 no hydrogen 2.873 N/A THR 71.A OG1 ASP 72.A O no hydrogen 3.087 N/A THR 71.A OG1 ASP 75.A O no hydrogen 3.106 N/A ARG 74.A N ASP 72.A OD1 no hydrogen 3.017 N/A ARG 74.A NE ASP 72.A OD1 no hydrogen 3.150 N/A ARG 74.A NE ASP 72.A OD2 no hydrogen 3.287 N/A ARG 74.A NH2 ASP 72.A OD2 no hydrogen 2.795 N/A ASP 75.A N ASP 72.A O no hydrogen 2.830 N/A ARG 78.A NH1 GLU 80.A OE2 no hydrogen 3.299 N/A LYS 82.A N ILE 79.A O.A no hydrogen 3.231 N/A LYS 82.A N ILE 79.A O.B no hydrogen 3.208 N/A THR 83.A N GLU 80.A O no hydrogen 3.074 N/A THR 83.A OG1 ILE 79.A O.A no hydrogen 2.624 N/A THR 83.A OG1 ILE 79.A O.B no hydrogen 2.595 N/A VAL 84.A N ILE 210.A O.A no hydrogen 2.839 N/A VAL 84.A N ILE 210.A O.B no hydrogen 3.007 N/A ILE 85.A N ARG 106.A O no hydrogen 2.927 N/A ILE 86.A N HIS 212.A O no hydrogen 2.859 N/A THR 87.A OG1 GLU 89.A O no hydrogen 2.697 N/A THR 87.A OG1 THR 93.A OG1 no hydrogen 2.822 N/A ARG 91.A NE.A ASP 587.A OD1 no hydrogen 3.302 N/A ARG 91.A NH1.B ASP 587.A OD2 no hydrogen 3.150 N/A ARG 91.A NH2.A ASP 587.A OD1 no hydrogen 2.786 N/A ASP 92.A N GLU 89.A O no hydrogen 3.211 N/A THR 93.A N GLN 90.A O no hydrogen 2.951 N/A THR 93.A OG1 THR 87.A OG1 no hydrogen 2.822 N/A VAL 94.A N GLN 90.A O no hydrogen 3.045 N/A LYS 98.A N ASP 582.A O no hydrogen 2.866 N/A SER 99.A N ASP 582.A OD2 no hydrogen 3.016 N/A GLY 100.A N ASP 582.A OD2 no hydrogen 3.344 N/A GLN 103.A N GLN 583.A OE1 no hydrogen 2.675 N/A LEU 104.A N SER 102.A OG no hydrogen 3.030 N/A TRP 107.A NE1 THR 87.A O no hydrogen 2.910 N/A MET 108.A N ILE 85.A O no hydrogen 3.078 N/A SER 109.A OG GLU 111.A OE1 no hydrogen 3.266 N/A ASP 112.A N SER 109.A OG no hydrogen 3.087 N/A PHE 113.A N SER 109.A O no hydrogen 2.926 N/A GLU 114.A N GLU 110.A O no hydrogen 3.008 N/A LYS 115.A N GLU 111.A O no hydrogen 3.309 N/A ALA 116.A N ASP 112.A O no hydrogen 3.024 N/A PHE 117.A N PHE 113.A O no hydrogen 2.735 N/A ASN 118.A N GLU 114.A O no hydrogen 3.053 N/A ALA 119.A N LYS 115.A O no hydrogen 3.132 N/A ALA 119.A N ALA 116.A O no hydrogen 3.209 N/A ARG 120.A N PHE 117.A O no hydrogen 3.061 N/A ARG 120.A NE LEU 207.A O no hydrogen 2.757 N/A ARG 120.A NH1 ALA 116.A O no hydrogen 2.793 N/A ARG 120.A NH2 LEU 207.A O no hydrogen 3.561 N/A PHE 121.A N PHE 117.A O no hydrogen 2.956 N/A GLY 123.A N LEU 28.A O no hydrogen 2.889 N/A CYS 124.A N PHE 121.A O no hydrogen 2.921 N/A CYS 124.A SG PHE 121.A O no hydrogen 3.137 N/A CYS 124.A SG SER 186.A OG no hydrogen 3.279 N/A MET 125.A N CYS 29.A O no hydrogen 2.833 N/A LYS 126.A N GLY 123.A O no hydrogen 3.119 N/A ARG 128.A N MET 125.A O no hydrogen 2.865 N/A ARG 128.A NE CYS 189.A O no hydrogen 2.930 N/A ARG 128.A NH2 CYS 189.A O no hydrogen 2.832 N/A MET 130.A N TYR 33.A O no hydrogen 2.771 N/A TYR 131.A N THR 152.A O no hydrogen 2.727 N/A VAL 132.A N HIS 35.A O no hydrogen 2.820 N/A ILE 133.A N GLU 150.A O no hydrogen 2.746 N/A PHE 135.A N GLY 148.A O no hydrogen 2.998 N/A SER 136.A N ARG 166.A O no hydrogen 2.838 N/A SER 136.A OG GLY 138.A O no hydrogen 3.034 N/A MET 137.A N LYS 146.A O no hydrogen 2.691 N/A GLY 138.A N PRO 319.A O no hydrogen 2.731 N/A SER 142.A N PRO 139.A O no hydrogen 2.750 N/A SER 142.A OG PRO 414.A O no hydrogen 2.645 N/A LEU 144.A N SER 142.A OG no hydrogen 3.076 N/A ALA 145.A N SER 142.A O no hydrogen 3.304 N/A LYS 146.A N MET 137.A O no hydrogen 3.015 N/A LYS 146.A NZ GLU 249.A OE1 no hydrogen 2.920 N/A GLY 148.A N PHE 135.A O no hydrogen 2.801 N/A ILE 149.A N ILE 181.A O no hydrogen 3.016 N/A GLU 150.A N ILE 133.A O no hydrogen 2.925 N/A LEU 151.A N CYS 183.A O no hydrogen 2.790 N/A THR 152.A N TYR 131.A O no hydrogen 3.030 N/A SER 154.A N THR 152.A OG1 no hydrogen 3.042 N/A TYR 156.A OH THR 349.A OG1 no hydrogen 2.604 N/A VAL 157.A N SER 154.A OG no hydrogen 3.151 N/A VAL 158.A N SER 154.A O no hydrogen 3.200 N/A ALA 159.A N PRO 155.A O no hydrogen 2.992 N/A SER 160.A N TYR 156.A O no hydrogen 3.136 N/A SER 160.A OG TYR 156.A O no hydrogen 3.033 N/A MET 161.A N VAL 157.A O no hydrogen 2.807 N/A ARG 162.A N VAL 158.A O no hydrogen 3.054 N/A ARG 162.A NE GLY 39.A O no hydrogen 3.056 N/A ARG 162.A NH2 GLY 39.A O no hydrogen 3.078 N/A ARG 162.A NH2 GLU 41.A OE1.A no hydrogen 2.822 N/A ILE 163.A N SER 160.A O no hydrogen 3.202 N/A MET 164.A N SER 160.A O no hydrogen 2.880 N/A THR 165.A N MET 161.A O no hydrogen 2.946 N/A THR 165.A OG1 MET 161.A O no hydrogen 2.570 N/A ARG 166.A N SER 136.A O no hydrogen 3.432 N/A ARG 166.A NH1 GLU 320.A O no hydrogen 3.082 N/A ARG 166.A NH2 GLU 412.A OE1 no hydrogen 2.935 N/A GLY 168.A N PRO 134.A O no hydrogen 2.925 N/A THR 169.A N ASP 38.A O no hydrogen 3.084 N/A VAL 171.A N GLY 168.A O no hydrogen 3.138 N/A GLU 173.A N THR 169.A O no hydrogen 3.127 N/A ALA 174.A N SER 170.A O no hydrogen 3.133 N/A LEU 175.A N VAL 171.A O no hydrogen 2.856 N/A GLY 176.A N LEU 172.A O no hydrogen 3.281 N/A GLY 178.A N LEU 175.A O no hydrogen 2.989 N/A ILE 181.A N ILE 147.A O no hydrogen 2.925 N/A LYS 182.A N ARG 217.A O no hydrogen 2.948 N/A LYS 182.A NZ.A ARG 216.A O no hydrogen 2.777 N/A CYS 183.A N ILE 149.A O no hydrogen 2.928 N/A CYS 183.A SG ILE 181.A O no hydrogen 3.837 N/A LEU 184.A N ILE 219.A O no hydrogen 2.875 N/A HIS 185.A N LEU 151.A O no hydrogen 2.804 N/A SER 186.A N SER 221.A O no hydrogen 3.101 N/A SER 186.A OG ASP 153.A OD2 no hydrogen 2.898 N/A VAL 187.A N ASP 153.A OD1 no hydrogen 3.048 N/A GLY 188.A N SER 186.A OG no hydrogen 3.072 N/A CYS 189.A SG VAL 187.A O no hydrogen 3.918 N/A CYS 189.A SG CYS 203.A O no hydrogen 3.188 N/A LEU 191.A N LYS 126.A O no hydrogen 2.802 N/A ASN 199.A ND2 THR 71.A O no hydrogen 3.141 N/A TRP 201.A N VAL 198.A O no hydrogen 2.887 N/A TRP 201.A NE1 ASP 75.A OD2 no hydrogen 2.816 N/A CYS 203.A SG ASP 72.A OD2 no hydrogen 3.563 N/A CYS 203.A SG TRP 201.A O no hydrogen 3.827 N/A ASN 204.A N GLY 223.A O no hydrogen 2.672 N/A ASN 204.A ND2 GLY 188.A O no hydrogen 3.096 N/A LEU 207.A N ASN 204.A O no hydrogen 3.251 N/A THR 208.A N PRO 205.A O no hydrogen 3.160 N/A THR 208.A OG1 ASN 204.A O no hydrogen 2.960 N/A THR 208.A OG1 PRO 205.A O no hydrogen 3.299 N/A LEU 209.A N PHE 222.A O no hydrogen 2.910 N/A ILE 210.A N.A LYS 82.A O no hydrogen 2.860 N/A ILE 210.A N.B LYS 82.A O no hydrogen 2.853 N/A ALA 211.A N ILE 220.A O no hydrogen 2.773 N/A HIS 212.A N VAL 84.A O no hydrogen 2.974 N/A HIS 212.A ND1 VAL 84.A O no hydrogen 2.814 N/A LEU 213.A N GLU 218.A O no hydrogen 2.806 N/A ARG 216.A N LEU 213.A O no hydrogen 2.990 N/A ARG 216.A NE GLU 218.A OE2 no hydrogen 3.454 N/A ARG 217.A N PRO 214.A O no hydrogen 3.239 N/A ARG 217.A NH1 GLU 248.A OE2 no hydrogen 3.072 N/A ARG 217.A NH2 PRO 214.A O no hydrogen 3.082 N/A ARG 217.A NH2 GLU 248.A OE1 no hydrogen 3.161 N/A GLU 218.A N LEU 213.A O no hydrogen 3.245 N/A ILE 219.A N LYS 182.A O no hydrogen 2.800 N/A ILE 220.A N ALA 211.A O no hydrogen 2.875 N/A SER 221.A N LEU 184.A O no hydrogen 2.831 N/A SER 221.A OG ASN 229.A O no hydrogen 2.530 N/A PHE 222.A N LEU 209.A O no hydrogen 2.875 N/A GLY 223.A N SER 186.A O no hydrogen 2.957 N/A SER 224.A OG ASP 75.A OD1 no hydrogen 2.583 N/A SER 224.A OG ASP 75.A OD2 no hydrogen 3.524 N/A GLY 225.A N ASP 75.A OD2 no hydrogen 2.783 N/A TYR 226.A N SER 224.A OG no hydrogen 3.054 N/A TYR 226.A OH ASN 394.A O no hydrogen 2.775 N/A ASN 229.A N TYR 226.A O no hydrogen 2.845 N/A ASN 229.A ND2 ALA 77.A O no hydrogen 2.945 N/A ASN 229.A ND2 SER 224.A OG no hydrogen 2.917 N/A SER 230.A N GLY 227.A O no hydrogen 3.087 N/A SER 230.A OG GLY 225.A O no hydrogen 2.829 N/A SER 230.A OG GLY 227.A O no hydrogen 3.534 N/A LEU 231.A N GLY 227.A O no hydrogen 2.748 N/A LEU 232.A N GLU 150.A OE1 no hydrogen 3.143 N/A LYS 234.A N LEU 231.A O no hydrogen 3.169 N/A LYS 234.A NZ ASP 302.A OD2 no hydrogen 2.588 N/A LYS 234.A NZ GLU 320.A OE1 no hydrogen 3.445 N/A LYS 234.A NZ GLU 320.A OE2 no hydrogen 3.251 N/A LYS 235.A NZ ASP 302.A OD1 no hydrogen 3.311 N/A LYS 235.A NZ ASP 302.A OD2 no hydrogen 2.938 N/A CYS 236.A SG HIS 212.A NE2 no hydrogen 3.354 N/A CYS 236.A SG GLY 228.A O no hydrogen 3.716 N/A PHE 237.A N LEU 232.A O no hydrogen 2.982 N/A ALA 238.A N GLY 233.A O no hydrogen 2.902 N/A LEU 239.A N LYS 235.A O no hydrogen 3.127 N/A ARG 240.A N LYS 235.A O no hydrogen 3.037 N/A ARG 240.A NE PRO 468.A O no hydrogen 3.118 N/A ARG 240.A NH1 HIS 212.A NE2 no hydrogen 3.062 N/A ARG 240.A NH2 PRO 468.A O no hydrogen 3.059 N/A ILE 241.A N CYS 236.A O no hydrogen 2.869 N/A ALA 242.A N PHE 237.A O no hydrogen 2.782 N/A SER 243.A N LEU 239.A O no hydrogen 2.741 N/A SER 243.A OG LEU 239.A O no hydrogen 2.808 N/A SER 243.A OG ARG 240.A O no hydrogen 3.089 N/A ARG 244.A N ILE 241.A O no hydrogen 3.043 N/A ARG 244.A NH1 GLU 248.A OE1 no hydrogen 2.619 N/A ARG 244.A NH2 ASP 215.A OD2 no hydrogen 2.526 N/A LEU 245.A N ILE 241.A O no hydrogen 3.107 N/A ALA 246.A N ALA 242.A O no hydrogen 2.868 N/A LYS 247.A N SER 243.A O no hydrogen 3.079 N/A GLU 248.A N ARG 244.A O no hydrogen 2.995 N/A GLU 249.A N LEU 245.A O no hydrogen 2.839 N/A GLY 250.A N ALA 246.A O no hydrogen 2.790 N/A TRP 251.A N ALA 246.A O no hydrogen 2.990 N/A TRP 251.A NE1 GLU 249.A OE1 no hydrogen 2.800 N/A LEU 252.A N MET 306.A O no hydrogen 2.747 N/A GLU 254.A N ALA 304.A O no hydrogen 2.877 N/A HIS 255.A ND1 ALA 465.A O no hydrogen 2.733 N/A HIS 255.A NE2 ASP 302.A OD1 no hydrogen 3.125 N/A LEU 257.A N ALA 273.A O no hydrogen 2.838 N/A ILE 258.A N GLY 300.A O no hydrogen 2.971 N/A LEU 259.A N LEU 271.A O no hydrogen 2.889 N/A GLY 260.A N GLU 297.A O no hydrogen 2.772 N/A ILE 261.A N LYS 269.A O no hydrogen 2.732 N/A THR 262.A N LYS 295.A O no hydrogen 2.920 N/A ASN 263.A N LYS 267.A O no hydrogen 2.854 N/A GLU 265.A N ASN 263.A OD1 no hydrogen 2.992 N/A GLY 266.A N ASN 263.A O no hydrogen 3.086 N/A LYS 267.A N ASN 263.A OD1 no hydrogen 2.874 N/A LYS 268.A NZ TYR 270.A OH no hydrogen 3.182 N/A LYS 268.A NZ GLU 297.A OE1 no hydrogen 3.018 N/A LYS 268.A NZ ASP 408.A OD1 no hydrogen 2.755 N/A LYS 269.A N ILE 261.A O no hydrogen 2.843 N/A LYS 269.A NZ GLU 420.A OE1 no hydrogen 2.852 N/A TYR 270.A OH ASP 408.A OD1 no hydrogen 3.360 N/A TYR 270.A OH ASP 408.A OD2 no hydrogen 2.719 N/A LEU 271.A N LEU 259.A O no hydrogen 2.845 N/A ALA 272.A N GLY 421.A O no hydrogen 3.038 N/A ALA 273.A N LEU 257.A O no hydrogen 3.052 N/A ALA 274.A N ILE 423.A O no hydrogen 2.784 N/A LYS 281.A NZ HIS 255.A NE2 no hydrogen 3.215 N/A LYS 281.A NZ PHE 275.A O no hydrogen 3.070 N/A THR 282.A OG1 ASP 301.A OD2 no hydrogen 3.135 N/A LEU 284.A N GLY 280.A O no hydrogen 3.372 N/A ALA 285.A N LYS 281.A O no hydrogen 2.870 N/A MET 286.A N THR 282.A O no hydrogen 3.001 N/A MET 287.A N LEU 284.A O no hydrogen 3.473 N/A THR 290.A OG1 GLY 515.A O no hydrogen 3.426 N/A THR 290.A OG1 GLU 516.A OE1 no hydrogen 2.738 N/A TRP 294.A N LEU 291.A O no hydrogen 3.397 N/A LYS 295.A N THR 262.A O no hydrogen 3.051 N/A GLU 297.A N GLY 260.A O no hydrogen 2.804 N/A CYS 298.A N ILE 406.A O no hydrogen 2.952 N/A VAL 299.A N ILE 258.A O no hydrogen 2.981 N/A GLY 300.A N ILE 258.A O no hydrogen 3.181 N/A ALA 304.A N GLU 254.A O no hydrogen 3.007 N/A TRP 305.A N ILE 317.A O no hydrogen 3.036 N/A TRP 305.A NE1 ALA 238.A O no hydrogen 2.833 N/A MET 306.A N LEU 252.A O no hydrogen 2.865 N/A LYS 307.A N ARG 315.A O no hydrogen 2.824 N/A ASP 309.A N ASN 313.A O no hydrogen 2.731 N/A GLY 312.A N ASP 309.A O no hydrogen 2.936 N/A ASN 313.A N ASP 309.A OD1 no hydrogen 2.788 N/A ARG 315.A N LYS 307.A O no hydrogen 2.937 N/A ARG 315.A NE ASP 309.A OD2 no hydrogen 3.287 N/A ARG 315.A NH1 GLY 416.A O no hydrogen 3.111 N/A ALA 316.A N VAL 417.A O no hydrogen 2.921 N/A ILE 317.A N TRP 305.A O no hydrogen 2.940 N/A ASN 318.A ND2 VAL 299.A O no hydrogen 2.940 N/A GLU 320.A N ASN 318.A OD1 no hydrogen 3.063 N/A ASN 321.A N MET 164.A O no hydrogen 2.880 N/A PHE 323.A N THR 399.A O no hydrogen 2.770 N/A GLY 325.A N PHE 397.A O no hydrogen 3.112 N/A ALA 327.A N SER 395.A O no hydrogen 2.971 N/A GLY 329.A N GLU 362.A O no hydrogen 2.797 N/A THR 330.A N ALA 327.A O no hydrogen 3.091 N/A THR 330.A OG1 VAL 326.A O no hydrogen 3.186 N/A THR 330.A OG1 ALA 327.A O no hydrogen 2.857 N/A SER 331.A N THR 334.A OG1 no hydrogen 2.933 N/A SER 331.A OG THR 334.A OG1 no hydrogen 3.088 N/A THR 334.A N SER 331.A OG no hydrogen 2.994 N/A THR 334.A OG1 GLY 329.A O no hydrogen 2.890 N/A THR 334.A OG1 SER 331.A O no hydrogen 3.552 N/A THR 334.A OG1 SER 331.A OG no hydrogen 3.088 N/A ASN 335.A N SER 331.A O no hydrogen 2.813 N/A ASN 337.A ND2 MET 286.A O no hydrogen 2.785 N/A ASN 337.A ND2 ASN 288.A OD1.B no hydrogen 2.802 N/A ALA 338.A N ASN 335.A O no hydrogen 3.226 N/A ALA 338.A N ASN 335.A OD1 no hydrogen 3.233 N/A ILE 339.A N ASN 335.A O no hydrogen 3.298 N/A LYS 340.A N PRO 336.A O no hydrogen 3.113 N/A THR 341.A N ASN 337.A O no hydrogen 3.031 N/A THR 341.A OG1 ASN 337.A O no hydrogen 2.704 N/A ILE 342.A N ALA 338.A O no hydrogen 3.051 N/A ILE 342.A N ILE 339.A O no hydrogen 3.278 N/A ASN 345.A N ASP 64.A O no hydrogen 2.969 N/A ASN 345.A ND2 GLN 403.A OE1 no hydrogen 2.888 N/A THR 346.A OG1 LYS 344.A O no hydrogen 2.739 N/A THR 346.A OG1 THR 399.A OG1.A no hydrogen 3.083 N/A ILE 347.A N CYS 398.A O no hydrogen 3.059 N/A PHE 348.A N TRP 67.A O no hydrogen 2.777 N/A THR 349.A N ARG 396.A O no hydrogen 2.968 N/A THR 349.A OG1 TYR 156.A OH no hydrogen 2.604 N/A ASN 350.A N ALA 69.A O no hydrogen 2.837 N/A ASN 350.A ND2 THR 71.A OG1 no hydrogen 2.933 N/A ALA 352.A N TYR 360.A O no hydrogen 2.915 N/A GLU 353.A N THR 375.A O no hydrogen 2.800 N/A THR 354.A N GLY 358.A O no hydrogen 2.832 N/A SER 355.A N THR 373.A O no hydrogen 2.924 N/A SER 355.A OG THR 373.A O no hydrogen 3.459 N/A GLY 357.A N THR 354.A O no hydrogen 2.875 N/A GLY 358.A N THR 354.A OG1 no hydrogen 2.960 N/A VAL 359.A N TYR 63.A OH no hydrogen 2.767 N/A TYR 360.A N ALA 352.A O no hydrogen 2.908 N/A TYR 360.A OH GLU 366.A O no hydrogen 3.162 N/A TRP 361.A NE1 THR 330.A O no hydrogen 2.840 N/A GLU 362.A N GLU 362.A OE2 no hydrogen 2.861 N/A ILE 364.A N TRP 361.A O no hydrogen 3.283 N/A VAL 372.A N ALA 369.A O no hydrogen 3.167 N/A THR 373.A N SER 355.A OG no hydrogen 2.975 N/A THR 375.A N GLU 353.A O no hydrogen 2.760 N/A SER 376.A N LYS 380.A O no hydrogen 2.739 N/A SER 376.A OG LYS 380.A O no hydrogen 3.420 N/A TRP 377.A N CYS 390.A O no hydrogen 2.780 N/A LYS 378.A N SER 376.A OG no hydrogen 3.197 N/A ASN 379.A N SER 376.A O no hydrogen 3.131 N/A TRP 382.A N ILE 374.A O no hydrogen 2.859 N/A TRP 382.A NE1 GLU 388.A O no hydrogen 2.611 N/A ASP 386.A N ARG 383.A O no hydrogen 3.019 N/A CYS 390.A N GLU 362.A OE1 no hydrogen 2.988 N/A CYS 390.A SG GLU 362.A OE1 no hydrogen 3.464 N/A CYS 390.A SG GLU 362.A OE2 no hydrogen 3.500 N/A ALA 391.A N GLU 362.A OE2 no hydrogen 3.225 N/A HIS 392.A N ASN 350.A O no hydrogen 3.066 N/A ASN 394.A N HIS 392.A ND1 no hydrogen 2.987 N/A ASN 394.A ND2 VAL 76.A O no hydrogen 3.141 N/A SER 395.A N HIS 392.A O no hydrogen 2.866 N/A SER 395.A OG HIS 392.A O no hydrogen 2.793 N/A ARG 396.A N THR 349.A O no hydrogen 2.957 N/A ARG 396.A NE ASN 394.A O no hydrogen 3.342 N/A ARG 396.A NH1 PHE 324.A O no hydrogen 3.498 N/A PHE 397.A N GLY 325.A O no hydrogen 3.068 N/A CYS 398.A N ILE 347.A O no hydrogen 2.787 N/A CYS 398.A SG SER 160.A O no hydrogen 3.948 N/A THR 399.A N PHE 323.A O no hydrogen 2.938 N/A THR 399.A OG1.A THR 341.A O no hydrogen 3.191 N/A THR 399.A OG1.A THR 346.A OG1 no hydrogen 3.083 N/A ALA 401.A N ASN 321.A O no hydrogen 3.140 N/A GLN 403.A N PRO 400.A O no hydrogen 3.184 N/A GLN 403.A NE2 THR 341.A O no hydrogen 2.720 N/A GLN 403.A NE2 LYS 344.A O no hydrogen 2.945 N/A CYS 404.A N ALA 401.A O no hydrogen 3.155 N/A ILE 407.A N CYS 404.A O no hydrogen 3.037 N/A ASP 408.A N CYS 298.A O no hydrogen 2.747 N/A ALA 410.A N ASP 408.A OD2 no hydrogen 2.922 N/A TRP 411.A N ASP 408.A O no hydrogen 3.064 N/A SER 413.A N ALA 410.A O no hydrogen 3.085 N/A SER 413.A OG.B ALA 410.A O no hydrogen 3.565 N/A GLU 415.A N GLU 415.A OE1 no hydrogen 2.695 N/A GLY 416.A N SER 413.A O no hydrogen 3.027 N/A VAL 417.A N ALA 316.A O no hydrogen 2.782 N/A ILE 419.A N LEU 314.A O no hydrogen 2.770 N/A GLU 420.A N TYR 270.A O no hydrogen 2.972 N/A ILE 422.A N LYS 494.A O no hydrogen 2.795 N/A ILE 423.A N ALA 272.A O no hydrogen 2.771 N/A PHE 424.A N PHE 496.A O no hydrogen 2.856 N/A ARG 427.A N SER 453.A OG.B no hydrogen 2.811 N/A ARG 428.A N ASN 499.A OD1 no hydrogen 3.251 N/A ARG 428.A NH1 GLU 572.A OE2 no hydrogen 2.929 N/A ARG 428.A NH2 GLU 572.A OE1 no hydrogen 2.892 N/A LEU 434.A N LEU 561.A O no hydrogen 3.280 N/A TYR 436.A N HIS 497.A O no hydrogen 2.935 N/A GLU 437.A N TYR 541.A O no hydrogen 2.731 N/A ALA 438.A N ILE 495.A O no hydrogen 2.752 N/A LEU 439.A N HIS 443.A ND1 no hydrogen 2.781 N/A SER 440.A OG GLN 442.A OE1 no hydrogen 3.467 N/A TRP 441.A NE1 TRP 481.A O no hydrogen 2.968 N/A HIS 443.A N SER 440.A OG no hydrogen 3.164 N/A GLY 444.A N SER 440.A O no hydrogen 2.859 N/A VAL 445.A N TRP 441.A O no hydrogen 2.891 N/A PHE 446.A N GLN 442.A O no hydrogen 3.091 N/A VAL 447.A N HIS 443.A O no hydrogen 2.849 N/A GLY 448.A N GLY 444.A O no hydrogen 3.084 N/A ALA 449.A N VAL 445.A O no hydrogen 2.953 N/A ALA 450.A N PHE 446.A O no hydrogen 2.848 N/A ALA 450.A N VAL 447.A O no hydrogen 3.203 N/A MET 451.A N GLY 448.A O no hydrogen 3.419 N/A ARG 452.A NH1 GLU 572.A OE2 no hydrogen 3.252 N/A SER 453.A N MET 460.A O no hydrogen 2.993 N/A GLU 454.A N ARG 427.A O no hydrogen 2.882 N/A ALA 455.A N VAL 458.A O no hydrogen 2.729 N/A LYS 457.A N ALA 455.A O no hydrogen 3.182 N/A VAL 458.A N ALA 455.A O no hydrogen 3.243 N/A MET 460.A N SER 453.A O no hydrogen 3.206 N/A HIS 461.A NE2 GLU 575.A OE1 no hydrogen 2.552 N/A ASP 462.A N MET 451.A O no hydrogen 2.981 N/A PHE 464.A N GLY 448.A O no hydrogen 2.940 N/A ALA 465.A N ASP 462.A O no hydrogen 3.013 N/A MET 466.A N PRO 463.A O no hydrogen 2.863 N/A ARG 467.A N ASP 462.A OD1 no hydrogen 3.002 N/A ARG 467.A NH1 GLN 103.A O no hydrogen 2.782 N/A ARG 467.A NH2 GLU 80.A OE1 no hydrogen 2.427 N/A PHE 469.A N MET 466.A O no hydrogen 2.758 N/A PHE 470.A N MET 466.A O no hydrogen 3.053 N/A GLY 471.A N SER 243.A OG no hydrogen 3.085 N/A ASN 473.A N ASP 92.A O no hydrogen 3.031 N/A ASN 473.A ND2 ARG 91.A O no hydrogen 2.707 N/A ASN 473.A ND2 ASP 587.A OD2 no hydrogen 2.794 N/A LYS 476.A N ASN 473.A OD1 no hydrogen 3.121 N/A TYR 477.A N ASN 473.A O no hydrogen 3.003 N/A TYR 477.A OH GLU 254.A OE1 no hydrogen 2.484 N/A TYR 477.A OH GLU 254.A OE2 no hydrogen 3.282 N/A LEU 478.A N PHE 474.A O no hydrogen 2.923 N/A ALA 479.A N GLY 475.A O no hydrogen 3.023 N/A HIS 480.A N LYS 476.A O no hydrogen 2.797 N/A HIS 480.A NE2 TRP 251.A O no hydrogen 2.751 N/A TRP 481.A N TYR 477.A O no hydrogen 2.951 N/A TRP 481.A NE1 GLU 254.A OE2 no hydrogen 2.932 N/A LEU 482.A N LEU 478.A O no hydrogen 2.907 N/A SER 483.A N ALA 479.A O no hydrogen 2.969 N/A SER 483.A OG HIS 480.A O no hydrogen 2.667 N/A MET 484.A N TRP 481.A O no hydrogen 3.231 N/A ALA 485.A N LEU 482.A O no hydrogen 3.198 N/A HIS 486.A N SER 483.A O no hydrogen 2.985 N/A ARG 487.A N MET 484.A O no hydrogen 3.282 N/A ARG 487.A NH1.A PRO 488.A O no hydrogen 3.108 N/A ARG 487.A NH2.A ASP 309.A O no hydrogen 2.698 N/A ARG 487.A NH2.B GLY 250.A O no hydrogen 2.787 N/A ALA 490.A N ARG 487.A O no hydrogen 3.388 N/A LYS 491.A N GLY 312.A O no hydrogen 2.758 N/A LYS 494.A N GLU 420.A O no hydrogen 3.311 N/A LYS 494.A NZ GLU 437.A OE2 no hydrogen 2.613 N/A PHE 496.A N ILE 422.A O no hydrogen 2.930 N/A HIS 497.A N TYR 436.A O no hydrogen 2.816 N/A VAL 498.A N PHE 424.A O no hydrogen 2.791 N/A ASN 499.A N LEU 434.A O no hydrogen 2.817 N/A ASN 499.A ND2 ARG 428.A O no hydrogen 2.725 N/A ASN 499.A ND2 VAL 432.A O no hydrogen 2.930 N/A PHE 501.A N ASN 499.A OD1 no hydrogen 3.039 N/A ARG 502.A NH1 LEU 561.A O no hydrogen 3.176 N/A ARG 502.A NH1 GLY 563.A O no hydrogen 2.875 N/A ARG 502.A NH2 GLY 563.A O no hydrogen 2.972 N/A LYS 503.A N PRO 429.A O no hydrogen 2.817 N/A LYS 503.A NZ GLY 507.A O no hydrogen 3.220 N/A ASP 504.A N LYS 508.A O no hydrogen 2.954 N/A ASN 506.A N ASP 504.A OD2 no hydrogen 3.410 N/A LYS 508.A N ASP 504.A OD2 no hydrogen 2.774 N/A LYS 508.A NZ PHE 509.A O no hydrogen 2.910 N/A LEU 510.A N ARG 502.A O no hydrogen 2.904 N/A TRP 511.A NE1 ASN 517.A OD1 no hydrogen 2.686 N/A GLU 516.A N GLY 513.A O no hydrogen 2.850 N/A ASN 517.A N PHE 514.A O no hydrogen 2.992 N/A SER 518.A N GLY 515.A O no hydrogen 3.221 N/A SER 518.A OG GLY 515.A O no hydrogen 2.861 N/A ARG 519.A N GLU 516.A O no hydrogen 3.118 N/A ARG 519.A NE GLU 516.A OE1 no hydrogen 2.892 N/A ARG 519.A NH1 ASN 549.A O no hydrogen 2.935 N/A ARG 519.A NH1 LYS 551.A O no hydrogen 2.823 N/A ARG 519.A NH2 GLU 516.A OE1 no hydrogen 3.151 N/A ARG 519.A NH2 LYS 551.A O no hydrogen 2.918 N/A LEU 521.A N ASN 517.A O no hydrogen 3.008 N/A GLU 522.A N SER 518.A O no hydrogen 2.851 N/A TRP 523.A N ARG 519.A O no hydrogen 3.383 N/A TRP 523.A NE1 SER 533.A O no hydrogen 3.055 N/A MET 524.A N VAL 520.A O no hydrogen 3.129 N/A PHE 525.A N LEU 521.A O no hydrogen 2.864 N/A GLY 526.A N GLU 522.A O no hydrogen 3.036 N/A ARG 527.A N TRP 523.A O no hydrogen 2.990 N/A ARG 527.A NE GLU 437.A OE1 no hydrogen 2.686 N/A ARG 527.A NH1 GLU 531.A O no hydrogen 3.027 N/A ARG 527.A NH2 GLU 437.A OE1 no hydrogen 3.472 N/A ARG 527.A NH2 GLU 437.A OE2 no hydrogen 3.100 N/A ILE 528.A N MET 524.A O no hydrogen 2.888 N/A GLU 529.A N PHE 525.A O no hydrogen 3.081 N/A GLY 530.A N ARG 527.A O no hydrogen 3.034 N/A GLU 531.A N GLY 526.A O no hydrogen 2.832 N/A LYS 535.A N VAL 542.A O no hydrogen 2.803 N/A THR 537.A N GLY 540.A O no hydrogen 2.964 N/A THR 537.A OG1 GLY 540.A O no hydrogen 2.523 N/A ILE 539.A N THR 537.A OG1 no hydrogen 3.361 N/A GLY 540.A N THR 537.A O no hydrogen 3.235 N/A TYR 541.A N GLU 437.A O no hydrogen 2.936 N/A VAL 542.A N LYS 535.A O no hydrogen 2.909 N/A LYS 544.A N SER 533.A O no hydrogen 2.990 N/A LYS 544.A NZ ASP 532.A O no hydrogen 2.875 N/A LYS 544.A NZ ASP 532.A OD2 no hydrogen 3.287 N/A ALA 547.A N LYS 544.A O no hydrogen 3.052 N/A LEU 553.A N LEU 550.A O no hydrogen 3.162 N/A ASN 557.A ND2 GLU 560.A OE1.A no hydrogen 2.889 N/A GLU 560.A N ASN 557.A OD1 no hydrogen 3.409 N/A LEU 561.A N ASN 557.A O no hydrogen 3.022 N/A PHE 562.A N VAL 558.A O no hydrogen 2.954 N/A GLY 563.A N GLU 560.A O no hydrogen 3.373 N/A SER 565.A OG GLU 567.A OE1 no hydrogen 3.354 N/A LYS 566.A NZ SER 604.A O no hydrogen 3.234 N/A LYS 566.A NZ MET 606.A O no hydrogen 3.337 N/A PHE 568.A N SER 565.A OG no hydrogen 3.065 N/A TRP 569.A N SER 565.A O no hydrogen 3.009 N/A TRP 569.A NE1 GLY 431.A O no hydrogen 3.172 N/A GLU 570.A N LYS 566.A O no hydrogen 2.806 N/A LYS 571.A N GLU 567.A O no hydrogen 3.443 N/A GLU 572.A N PHE 568.A O no hydrogen 2.934 N/A VAL 573.A N TRP 569.A O no hydrogen 3.006 N/A GLU 574.A N GLU 570.A O no hydrogen 3.126 N/A GLU 575.A N LYS 571.A O no hydrogen 2.979 N/A ILE 576.A N GLU 572.A O no hydrogen 3.003 N/A ASP 577.A N VAL 573.A O no hydrogen 3.047 N/A LYS 578.A N GLU 574.A O no hydrogen 3.135 N/A TYR 579.A N GLU 575.A O no hydrogen 3.047 N/A LEU 580.A N ILE 576.A O no hydrogen 2.871 N/A GLU 581.A N ASP 577.A O no hydrogen 2.920 N/A ASP 582.A N LYS 578.A O no hydrogen 3.029 N/A GLN 583.A N TYR 579.A O no hydrogen 2.865 N/A GLN 583.A NE2 GLN 101.A O no hydrogen 3.054 N/A GLN 583.A NE2 ASP 582.A OD1 no hydrogen 3.121 N/A VAL 584.A N LEU 580.A O no hydrogen 2.880 N/A ASN 585.A N LEU 580.A O no hydrogen 3.117 N/A ASN 585.A ND2 ILE 96.A O no hydrogen 2.920 N/A ASP 587.A N VAL 584.A O no hydrogen 3.102 N/A LEU 588.A N ASN 585.A O no hydrogen 3.362 N/A ILE 592.A N PRO 589.A O no hydrogen 3.017 N/A GLU 593.A N PRO 589.A O no hydrogen 3.273 N/A ARG 594.A N TYR 590.A O no hydrogen 2.794 N/A GLU 595.A N GLU 591.A O no hydrogen 2.877 N/A LEU 596.A N ILE 592.A O no hydrogen 2.960 N/A ARG 597.A N GLU 593.A O no hydrogen 2.923 N/A ALA 598.A N ARG 594.A O no hydrogen 2.899 N/A LEU 599.A N GLU 595.A O no hydrogen 2.913 N/A LYS 600.A N LEU 596.A O no hydrogen 2.999 N/A GLN 601.A N ARG 597.A O no hydrogen 2.915 N/A ARG 602.A N ALA 598.A O no hydrogen 2.890 N/A ARG 602.A NE PRO 538.A O no hydrogen 2.658 N/A ARG 602.A NH2 PRO 538.A O no hydrogen 3.151 N/A ILE 603.A N LEU 599.A O no hydrogen 2.990 N/A SER 604.A N LYS 600.A O no hydrogen 2.989 N/A SER 604.A OG GLN 601.A O no hydrogen 2.758 N/A GLN 605.A N ARG 602.A O no hydrogen 3.326 N/A GLN 605.A NE2 SER 604.A OG no hydrogen 3.236 N/A MET 606.A N ILE 603.A O no hydrogen 3.245 N/A