Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xlp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N GLN 6.A OE1 no hydrogen 2.836 N/A GLN 6.A N THR 3.A OG1 no hydrogen 3.232 N/A ARG 7.A N THR 3.A O no hydrogen 2.915 N/A TYR 8.A N HIS 4.A O no hydrogen 3.027 N/A TYR 8.A OH PHE 78.A O no hydrogen 2.911 N/A ARG 9.A N ARG 5.A O no hydrogen 3.051 N/A GLU 10.A N GLN 6.A O no hydrogen 3.038 N/A LYS 11.A N ARG 7.A O no hydrogen 2.951 N/A LYS 11.A NZ GLY 81.A O no hydrogen 2.686 N/A VAL 12.A N TYR 8.A O no hydrogen 2.916 N/A SER 13.A N ARG 9.A O no hydrogen 2.978 N/A GLN 14.A N GLU 10.A O no hydrogen 2.973 N/A MET 15.A N LYS 11.A O no hydrogen 2.904 N/A VAL 16.A N VAL 12.A O no hydrogen 2.886 N/A SER 17.A N SER 13.A O no hydrogen 3.148 N/A SER 17.A OG SER 13.A O no hydrogen 3.302 N/A TRP 18.A N GLN 14.A O no hydrogen 2.923 N/A TRP 18.A NE1 ALA 153.A O no hydrogen 3.285 N/A GLY 19.A N MET 15.A O no hydrogen 2.898 N/A HIS 20.A N VAL 16.A O no hydrogen 3.087 N/A TRP 21.A N SER 17.A O no hydrogen 3.352 N/A PHE 22.A N TRP 18.A O no hydrogen 2.876 N/A ALA 23.A N GLY 19.A O no hydrogen 2.827 N/A LEU 24.A N HIS 20.A O no hydrogen 2.950 N/A PHE 25.A N TRP 21.A O no hydrogen 2.883 N/A ASN 26.A N PHE 22.A O no hydrogen 2.986 N/A ASN 26.A ND2 PHE 22.A O no hydrogen 2.949 N/A ASN 26.A ND2 GLU 149.A OE1 no hydrogen 3.229 N/A ILE 27.A N ALA 23.A O no hydrogen 2.844 N/A LEU 28.A N LEU 24.A O no hydrogen 3.208 N/A LEU 29.A N PHE 25.A O no hydrogen 2.903 N/A SER 30.A N ASN 26.A O no hydrogen 2.849 N/A SER 30.A OG ILE 27.A O no hydrogen 2.798 N/A LEU 31.A N ILE 27.A O no hydrogen 2.994 N/A VAL 32.A N LEU 28.A O no hydrogen 3.081 N/A ILE 33.A N LEU 29.A O no hydrogen 3.043 N/A GLY 34.A N SER 30.A O no hydrogen 2.660 N/A SER 35.A N LEU 31.A O no hydrogen 2.831 N/A SER 35.A OG VAL 32.A O no hydrogen 2.730 N/A ARG 36.A N ILE 33.A O no hydrogen 3.229 N/A ARG 36.A NH2 GLU 106.A OE2 no hydrogen 2.649 N/A ARG 36.A NH2 THR 109.A OG1 no hydrogen 3.082 N/A TYR 37.A N GLY 34.A O no hydrogen 3.081 N/A TYR 37.A OH ASP 104.A OD1 no hydrogen 2.524 N/A LEU 38.A N SER 35.A O no hydrogen 2.980 N/A PHE 39.A N SER 35.A O no hydrogen 3.082 N/A ILE 40.A N ARG 36.A O no hydrogen 2.943 N/A ALA 41.A N TYR 37.A O no hydrogen 2.885 N/A THR 46.A OG1 TYR 196.A OH no hydrogen 2.823 N/A GLY 49.A N THR 46.A OG1 no hydrogen 3.085 N/A ARG 50.A N THR 46.A O no hydrogen 2.952 N/A ILE 51.A N LEU 47.A O no hydrogen 2.952 N/A TYR 52.A N ALA 48.A O no hydrogen 3.045 N/A TYR 52.A OH SER 184.A O no hydrogen 2.853 N/A SER 53.A N GLY 49.A O no hydrogen 2.998 N/A SER 53.A OG GLY 49.A O no hydrogen 3.234 N/A TYR 54.A N ARG 50.A O no hydrogen 3.200 N/A VAL 55.A N ILE 51.A O no hydrogen 2.880 N/A SER 56.A N TYR 52.A O no hydrogen 2.833 N/A SER 56.A OG TYR 52.A O no hydrogen 2.647 N/A SER 56.A OG SER 53.A O no hydrogen 3.396 N/A ILE 57.A N SER 53.A O no hydrogen 3.319 N/A ILE 58.A N TYR 54.A O no hydrogen 3.087 N/A GLY 59.A N VAL 55.A O no hydrogen 2.867 N/A HIS 60.A N SER 56.A O no hydrogen 2.811 N/A HIS 60.A NE2 PRO 207.A O no hydrogen 2.676 N/A PHE 61.A N ILE 57.A O no hydrogen 2.980 N/A SER 62.A N ILE 58.A O no hydrogen 3.048 N/A SER 62.A OG ILE 58.A O no hydrogen 2.694 N/A PHE 63.A N GLY 59.A O no hydrogen 3.032 N/A LEU 64.A N HIS 60.A O no hydrogen 2.922 N/A VAL 65.A N PHE 61.A O no hydrogen 2.862 N/A PHE 66.A N SER 62.A O no hydrogen 2.964 N/A ALA 67.A N PHE 63.A O no hydrogen 2.822 N/A THR 68.A N LEU 64.A O no hydrogen 3.099 N/A THR 68.A OG1 LEU 64.A O no hydrogen 2.837 N/A TYR 69.A N VAL 65.A O no hydrogen 3.009 N/A LEU 70.A N PHE 66.A O no hydrogen 2.906 N/A LEU 71.A N ALA 67.A O no hydrogen 2.928 N/A ILE 72.A N THR 68.A O no hydrogen 2.989 N/A PHE 74.A N TYR 69.A O no hydrogen 2.679 N/A LEU 76.A N ILE 72.A O no hydrogen 3.301 N/A THR 77.A N LEU 73.A O no hydrogen 3.123 N/A THR 77.A N PHE 74.A O no hydrogen 3.240 N/A THR 77.A OG1 LEU 73.A O no hydrogen 2.702 N/A PHE 78.A N PRO 75.A O no hydrogen 3.059 N/A ILE 79.A N LEU 76.A O no hydrogen 3.043 N/A VAL 80.A N LEU 76.A O no hydrogen 2.948 N/A LEU 85.A N SER 82.A OG no hydrogen 3.117 N/A MET 86.A N SER 82.A O no hydrogen 2.882 N/A ARG 87.A N GLN 83.A O no hydrogen 2.952 N/A ARG 87.A NE GLN 83.A OE1 no hydrogen 2.831 N/A ARG 87.A NH1 GLN 83.A OE1 no hydrogen 3.049 N/A ARG 87.A NH2 ALA 153.A O no hydrogen 3.417 N/A PHE 88.A N ARG 84.A O no hydrogen 2.934 N/A LEU 89.A N LEU 85.A O no hydrogen 2.761 N/A SER 90.A N MET 86.A O no hydrogen 2.953 N/A SER 90.A OG MET 86.A O no hydrogen 2.880 N/A VAL 91.A N ARG 87.A O no hydrogen 2.897 N/A ILE 92.A N PHE 88.A O no hydrogen 2.890 N/A LEU 93.A N LEU 89.A O no hydrogen 2.976 N/A ALA 94.A N SER 90.A O no hydrogen 2.951 N/A THR 95.A N VAL 91.A O no hydrogen 2.899 N/A THR 95.A OG1 VAL 91.A O no hydrogen 2.834 N/A ALA 96.A N ILE 92.A O no hydrogen 2.956 N/A GLY 97.A N LEU 93.A O no hydrogen 2.845 N/A MET 98.A N ALA 94.A O no hydrogen 2.790 N/A THR 99.A N THR 95.A O no hydrogen 2.902 N/A THR 99.A OG1 THR 95.A O no hydrogen 2.686 N/A LEU 100.A N ALA 96.A O no hydrogen 2.931 N/A LEU 101.A N GLY 97.A O no hydrogen 2.973 N/A LEU 102.A N MET 98.A O no hydrogen 2.856 N/A ILE 103.A N THR 99.A O no hydrogen 2.820 N/A ASP 104.A N LEU 100.A O no hydrogen 2.889 N/A SER 105.A N LEU 101.A O no hydrogen 2.891 N/A SER 105.A OG LEU 101.A O no hydrogen 3.507 N/A SER 105.A OG LEU 102.A O no hydrogen 2.729 N/A GLU 106.A N LEU 102.A O no hydrogen 3.056 N/A VAL 107.A N ILE 103.A O no hydrogen 2.916 N/A PHE 108.A N ASP 104.A O no hydrogen 2.871 N/A THR 109.A N SER 105.A O no hydrogen 2.937 N/A THR 109.A OG1 SER 105.A O no hydrogen 2.720 N/A ARG 110.A N GLU 106.A O no hydrogen 3.134 N/A ARG 110.A NH2 GLU 130.A OE1 no hydrogen 2.853 N/A PHE 111.A N VAL 107.A O no hydrogen 2.931 N/A HIS 112.A N PHE 108.A O no hydrogen 2.817 N/A HIS 114.A ND1 ASP 104.A OD1 no hydrogen 2.743 N/A HIS 114.A NE2 ALA 204.A O no hydrogen 2.703 N/A LEU 115.A N ASP 104.A OD2 no hydrogen 2.832 N/A VAL 119.A N ASN 116.A OD1 no hydrogen 2.720 N/A TRP 120.A N ASN 116.A O no hydrogen 2.870 N/A GLN 121.A N ILE 118.A O no hydrogen 3.103 N/A LEU 122.A N VAL 119.A O no hydrogen 2.902 N/A VAL 123.A N VAL 119.A O no hydrogen 3.259 N/A ASN 125.A N LEU 122.A O no hydrogen 3.144 N/A ASP 127.A N ASN 125.A OD1 no hydrogen 3.202 N/A GLU 130.A N ASP 127.A O no hydrogen 3.076 N/A MET 131.A N GLU 128.A O no hydrogen 3.082 N/A ASP 134.A N GLU 130.A O no hydrogen 3.007 N/A TRP 135.A N MET 131.A O no hydrogen 2.644 N/A GLN 136.A N ALA 132.A O no hydrogen 3.257 N/A LEU 137.A N ARG 133.A O no hydrogen 3.107 N/A MET 138.A N ASP 134.A O no hydrogen 2.904 N/A PHE 139.A N TRP 135.A O no hydrogen 2.860 N/A ILE 140.A N GLN 136.A O no hydrogen 2.893 N/A SER 141.A N GLN 136.A O no hydrogen 2.757 N/A SER 141.A OG GLN 136.A O no hydrogen 3.408 N/A VAL 142.A N LEU 137.A O no hydrogen 2.852 N/A VAL 144.A N ILE 140.A O no hydrogen 2.937 N/A ILE 145.A N SER 141.A O no hydrogen 2.965 N/A LEU 146.A N VAL 142.A O no hydrogen 2.872 N/A LEU 147.A N PRO 143.A O no hydrogen 2.844 N/A LEU 148.A N VAL 144.A O no hydrogen 2.954 N/A GLU 149.A N ILE 145.A O no hydrogen 2.881 N/A LEU 150.A N LEU 146.A O no hydrogen 2.859 N/A VAL 151.A N LEU 147.A O no hydrogen 2.859 N/A PHE 152.A N LEU 148.A O no hydrogen 3.045 N/A ALA 153.A N GLU 149.A O no hydrogen 2.883 N/A THR 154.A N LEU 150.A O no hydrogen 3.021 N/A TRP 155.A N VAL 151.A O no hydrogen 2.996 N/A SER 156.A N PHE 152.A O no hydrogen 2.775 N/A SER 156.A OG PHE 152.A O no hydrogen 2.774 N/A SER 156.A OG ALA 153.A O no hydrogen 3.276 N/A TRP 157.A N ALA 153.A O no hydrogen 3.243 N/A GLN 158.A N THR 154.A O no hydrogen 2.955 N/A LYS 159.A N TRP 155.A O no hydrogen 2.945 N/A LEU 160.A N TRP 157.A O no hydrogen 3.052 N/A LEU 163.A N LYS 159.A O no hydrogen 2.902 N/A THR 164.A N LEU 160.A O no hydrogen 2.783 N/A THR 164.A OG1 LEU 160.A O no hydrogen 2.841 N/A ARG 165.A N ARG 161.A O no hydrogen 3.026 N/A ARG 166.A N SER 162.A O no hydrogen 3.180 N/A ARG 166.A N LEU 163.A O no hydrogen 3.140 N/A ARG 166.A NH1 SER 162.A O no hydrogen 2.923 N/A ARG 167.A N THR 164.A O no hydrogen 3.129 N/A ARG 167.A NE THR 164.A O no hydrogen 3.136 N/A PHE 169.A N ARG 166.A O no hydrogen 2.999 N/A ALA 170.A N ARG 167.A O no hydrogen 3.423 N/A ALA 174.A N ALA 170.A O no hydrogen 3.130 N/A ALA 175.A N ARG 171.A O no hydrogen 2.955 N/A PHE 176.A N PRO 172.A O no hydrogen 2.955 N/A LEU 177.A N LEU 173.A O no hydrogen 2.940 N/A PHE 178.A N ALA 174.A O no hydrogen 3.105 N/A ILE 179.A N ALA 175.A O no hydrogen 2.877 N/A ALA 180.A N PHE 176.A O no hydrogen 2.752 N/A PHE 181.A N LEU 177.A O no hydrogen 3.055 N/A ILE 182.A N PHE 178.A O no hydrogen 3.030 N/A ALA 183.A N ILE 179.A O no hydrogen 2.719 N/A SER 184.A N ALA 180.A O no hydrogen 3.020 N/A SER 184.A OG ALA 180.A O no hydrogen 3.540 N/A SER 184.A OG PHE 181.A O no hydrogen 2.930 N/A HIS 185.A N ILE 182.A O no hydrogen 3.098 N/A VAL 186.A N ILE 182.A O no hydrogen 3.026 N/A VAL 187.A N ALA 183.A O no hydrogen 2.811 N/A TYR 188.A N SER 184.A O no hydrogen 3.313 N/A TYR 188.A OH THR 200.A O no hydrogen 3.324 N/A ILE 189.A N HIS 185.A O no hydrogen 2.971 N/A TRP 190.A N VAL 186.A O no hydrogen 3.173 N/A ALA 191.A N VAL 187.A O no hydrogen 2.786 N/A ASP 192.A N TYR 188.A O no hydrogen 2.749 N/A ALA 193.A N ILE 189.A O no hydrogen 3.080 N/A ASN 194.A N TRP 190.A O no hydrogen 3.054 N/A ASN 194.A N ALA 191.A O no hydrogen 3.204 N/A ASN 194.A ND2 TRP 190.A O no hydrogen 2.940 N/A PHE 195.A N ASP 192.A O no hydrogen 3.476 N/A TYR 196.A N ALA 191.A O no hydrogen 2.992 N/A TYR 196.A OH THR 46.A OG1 no hydrogen 2.823 N/A ARG 197.A NH1 ASN 238.A O no hydrogen 2.849 N/A ARG 197.A NH2 GLY 237.A O no hydrogen 2.802 N/A ILE 199.A N TYR 196.A O no hydrogen 3.096 N/A THR 200.A N TYR 196.A O no hydrogen 3.029 N/A THR 200.A OG1 TYR 196.A O no hydrogen 3.380 N/A THR 200.A OG1 PRO 239.A O no hydrogen 2.534 N/A MET 201.A N ARG 197.A O no hydrogen 2.857 N/A GLN 202.A N ILE 199.A O no hydrogen 2.922 N/A GLN 202.A NE2 GLY 49.A O no hydrogen 3.124 N/A GLN 202.A NE2 PRO 198.A O no hydrogen 2.899 N/A ARG 203.A N THR 200.A O no hydrogen 3.183 N/A ARG 203.A NH1 PRO 211.A O no hydrogen 3.012 N/A ASN 205.A N GLN 202.A O no hydrogen 2.895 N/A MET 212.A N HIS 185.A ND1 no hydrogen 2.958 N/A ARG 215.A NE ASP 192.A OD1 no hydrogen 3.458 N/A ARG 215.A NE ASP 192.A OD2 no hydrogen 2.858 N/A ARG 215.A NH1 ASP 192.A OD1 no hydrogen 2.824 N/A LEU 218.A N ALA 214.A O no hydrogen 2.848 N/A GLU 219.A N ARG 215.A O no hydrogen 2.924 N/A LYS 220.A N ARG 216.A O no hydrogen 2.988 N/A HIS 221.A N PHE 217.A O no hydrogen 3.263 N/A HIS 221.A N LEU 218.A O no hydrogen 3.152 N/A GLY 222.A N GLU 219.A O no hydrogen 3.082 N/A LEU 223.A N LEU 218.A O no hydrogen 2.887 N/A GLU 228.A N ASP 225.A OD1 no hydrogen 2.815 N/A TYR 229.A N ASP 225.A O no hydrogen 2.859 N/A TYR 229.A OH ASP 192.A O no hydrogen 2.786 N/A GLN 230.A N ALA 226.A O no hydrogen 2.777 N/A ARG 231.A N GLN 227.A O no hydrogen 2.816 N/A ARG 231.A NH1 GLU 235.A OE1 no hydrogen 3.127 N/A ARG 232.A N GLU 228.A O no hydrogen 3.117 N/A ARG 232.A NE GLN 236.A OE1 no hydrogen 2.949 N/A LEU 233.A N TYR 229.A O no hydrogen 2.954 N/A ILE 234.A N GLN 230.A O no hydrogen 3.014 N/A GLU 235.A N ARG 231.A O no hydrogen 2.912 N/A GLN 236.A N ARG 232.A O no hydrogen 2.842 N/A GLY 237.A N LEU 233.A O no hydrogen 3.035 N/A ASN 238.A N ASP 319.A OD2 no hydrogen 2.438 N/A ASP 240.A N ASP 240.A OD2 no hydrogen 2.671 N/A ALA 241.A N ASN 238.A O no hydrogen 2.979 N/A GLN 245.A N PHE 583.A O no hydrogen 2.716 N/A GLN 245.A NE2 PRO 247.A O no hydrogen 2.858 N/A TYR 246.A OH TYR 311.A O no hydrogen 2.576 N/A LEU 248.A N GLU 511.A O no hydrogen 2.813 N/A SER 249.A OG GLU 511.A OE2 no hydrogen 3.477 N/A ARG 252.A N THR 507.A OG1 no hydrogen 2.813 N/A ARG 254.A N HIS 504.A O no hydrogen 2.936 N/A GLY 257.A N ASP 255.A OD1 no hydrogen 2.782 N/A THR 258.A N LEU 502.A O no hydrogen 3.205 N/A THR 258.A OG1 GLN 260.A OE1 no hydrogen 2.903 N/A GLN 260.A N THR 258.A OG1 no hydrogen 3.249 N/A GLN 260.A NE2 ASN 442.A OD1 no hydrogen 3.372 N/A VAL 262.A N TRP 393.A O no hydrogen 3.098 N/A LEU 263.A N VAL 444.A O no hydrogen 2.746 N/A LEU 264.A N SER 395.A O no hydrogen 2.703 N/A ILE 265.A N ILE 446.A O no hydrogen 2.748 N/A THR 266.A N VAL 397.A O no hydrogen 2.934 N/A VAL 267.A N THR 448.A O no hydrogen 3.106 N/A ASP 268.A N PHE 399.A O no hydrogen 2.981 N/A LEU 270.A N ARG 451.A O no hydrogen 3.081 N/A ASN 271.A N TYR 416.A OH no hydrogen 2.578 N/A ASN 271.A ND2 SER 273.A OG no hydrogen 3.243 N/A ASN 271.A ND2 ILE 453.A O no hydrogen 2.935 N/A SER 273.A OG ASN 271.A OD1 no hydrogen 3.083 N/A SER 273.A OG GLU 459.A OE2 no hydrogen 3.128 N/A ARG 274.A N ASN 271.A OD1 no hydrogen 2.776 N/A PHE 275.A N TYR 272.A O no hydrogen 3.118 N/A GLN 278.A N ARG 274.A O no hydrogen 3.031 N/A MET 279.A N PHE 275.A O no hydrogen 2.903 N/A ALA 281.A N ASP 424.A OD2 no hydrogen 2.799 N/A LEU 282.A N ASP 424.A OD1 no hydrogen 2.646 N/A ALA 283.A N MET 279.A O no hydrogen 2.897 N/A GLY 284.A N PRO 280.A O no hydrogen 2.858 N/A PHE 285.A N ALA 281.A O no hydrogen 2.950 N/A ALA 286.A N LEU 282.A O no hydrogen 2.809 N/A GLU 287.A N ALA 283.A O no hydrogen 2.982 N/A GLN 288.A N GLY 284.A O no hydrogen 3.273 N/A ASN 289.A N ALA 286.A O no hydrogen 3.066 N/A ASN 289.A ND2 PHE 285.A O no hydrogen 2.869 N/A ILE 290.A N ILE 475.A O no hydrogen 3.029 N/A SER 291.A N GLN 483.A O no hydrogen 3.115 N/A PHE 292.A N LEU 473.A O no hydrogen 2.965 N/A THR 293.A N ILE 485.A O no hydrogen 2.978 N/A THR 293.A OG1 ILE 485.A O no hydrogen 3.447 N/A HIS 295.A ND1 THR 489.A OG1 no hydrogen 2.734 N/A HIS 295.A NE2 HIS 491.A ND1 no hydrogen 2.937 N/A MET 296.A N THR 489.A O no hydrogen 2.772 N/A SER 297.A N LEU 469.A O no hydrogen 2.822 N/A SER 297.A OG GLY 299.A O no hydrogen 3.130 N/A SER 297.A OG GLY 450.A O no hydrogen 2.658 N/A GLY 299.A N SER 297.A OG no hydrogen 3.151 N/A ASN 300.A ND2 ASP 463.A O no hydrogen 3.137 N/A THR 302.A OG1 ASP 268.A O no hydrogen 2.868 N/A GLY 305.A N THR 301.A O no hydrogen 3.008 N/A ILE 306.A N THR 302.A O no hydrogen 2.895 N/A PHE 307.A N ASP 303.A O no hydrogen 3.021 N/A GLY 308.A N ASN 304.A O no hydrogen 3.147 N/A LEU 309.A N GLY 305.A O no hydrogen 3.104 N/A PHE 310.A N ILE 306.A O no hydrogen 3.138 N/A TYR 311.A N PHE 307.A O no hydrogen 2.802 N/A TYR 311.A OH THR 326.A O no hydrogen 2.788 N/A GLY 312.A N GLY 308.A O no hydrogen 2.886 N/A SER 314.A N GLN 514.A OE1 no hydrogen 2.841 N/A SER 314.A OG SER 316.A OG no hydrogen 3.041 N/A SER 314.A OG GLU 580.A OE1 no hydrogen 3.123 N/A SER 314.A OG GLU 580.A OE2 no hydrogen 3.106 N/A SER 316.A N SER 314.A OG no hydrogen 3.329 N/A SER 316.A OG SER 314.A OG no hydrogen 3.041 N/A SER 316.A OG GLU 580.A OE1 no hydrogen 2.685 N/A TYR 317.A N SER 314.A O no hydrogen 2.957 N/A TYR 317.A OH ASP 579.A O no hydrogen 3.049 N/A MET 318.A N PRO 315.A O no hydrogen 2.953 N/A ILE 321.A N TYR 317.A O no hydrogen 2.886 N/A LEU 322.A N MET 318.A O no hydrogen 2.724 N/A SER 323.A N ASP 319.A O no hydrogen 3.019 N/A SER 323.A OG ASP 319.A O no hydrogen 3.480 N/A SER 323.A OG GLY 320.A O no hydrogen 3.026 N/A THR 324.A N ILE 321.A O no hydrogen 3.313 N/A THR 324.A OG1 GLY 320.A O no hydrogen 2.985 N/A THR 324.A OG1 ILE 321.A O no hydrogen 3.263 N/A THR 324.A OG1 THR 326.A OG1 no hydrogen 2.510 N/A ARG 325.A N LEU 322.A O no hydrogen 3.285 N/A THR 326.A N ILE 321.A O no hydrogen 3.263 N/A THR 326.A OG1 THR 324.A OG1 no hydrogen 2.510 N/A ALA 329.A N TYR 246.A OH no hydrogen 2.961 N/A THR 332.A N ALA 328.A O no hydrogen 2.922 N/A THR 332.A OG1 ALA 328.A O no hydrogen 3.016 N/A ALA 333.A N ALA 329.A O no hydrogen 2.949 N/A LEU 334.A N LEU 330.A O no hydrogen 2.914 N/A ASN 335.A N ILE 331.A O no hydrogen 2.857 N/A GLN 336.A N THR 332.A O no hydrogen 2.898 N/A GLN 337.A N ALA 333.A O no hydrogen 2.902 N/A GLN 337.A NE2 ASP 255.A O no hydrogen 2.879 N/A GLN 337.A NE2 LEU 503.A O no hydrogen 2.782 N/A GLY 338.A N ASN 335.A O no hydrogen 3.119 N/A TYR 339.A N LEU 334.A O no hydrogen 2.988 N/A TYR 339.A OH GLN 260.A O no hydrogen 2.564 N/A GLN 340.A N ARG 392.A O no hydrogen 2.824 N/A GLY 342.A N PHE 394.A O no hydrogen 3.037 N/A LEU 343.A N SER 363.A O no hydrogen 2.861 N/A PHE 344.A N TRP 396.A O no hydrogen 2.817 N/A SER 345.A OG SER 351.A OG no hydrogen 2.945 N/A SER 346.A N SER 398.A O no hydrogen 2.957 N/A SER 346.A OG ASP 372.A OD1 no hydrogen 2.521 N/A SER 346.A OG THR 375.A OG1 no hydrogen 2.783 N/A SER 346.A OG SER 398.A O no hydrogen 3.429 N/A ASP 347.A N SER 345.A OG no hydrogen 3.075 N/A GLY 348.A N SER 345.A OG no hydrogen 3.398 N/A THR 350.A N ASP 347.A O no hydrogen 3.206 N/A THR 350.A OG1 ASP 347.A O no hydrogen 2.936 N/A SER 351.A N GLY 348.A O no hydrogen 3.304 N/A SER 351.A OG SER 345.A OG no hydrogen 2.945 N/A TYR 354.A N SER 351.A O no hydrogen 2.996 N/A ARG 355.A NE GLU 235.A OE2 no hydrogen 3.490 N/A GLN 356.A NE2 ILE 234.A O no hydrogen 3.240 N/A ALA 357.A N TYR 354.A O no hydrogen 3.073 N/A PHE 362.A N LEU 359.A O no hydrogen 3.266 N/A SER 363.A N LEU 341.A O no hydrogen 2.955 N/A ARG 368.A N SER 366.A OG no hydrogen 2.979 N/A THR 369.A OG1 ASP 347.A O no hydrogen 3.483 N/A GLN 370.A N SER 346.A O no hydrogen 3.017 N/A GLN 370.A NE2 THR 375.A OG1 no hydrogen 3.035 N/A GLN 370.A NE2 GLN 378.A OE1 no hydrogen 2.932 N/A GLN 374.A N SER 371.A OG no hydrogen 3.328 N/A THR 375.A N SER 371.A O no hydrogen 3.056 N/A THR 375.A OG1 SER 346.A OG no hydrogen 2.783 N/A THR 375.A OG1 SER 371.A O no hydrogen 3.029 N/A ALA 376.A N ASP 372.A O no hydrogen 2.950 N/A THR 377.A N GLU 373.A O no hydrogen 2.906 N/A THR 377.A OG1 GLU 373.A O no hydrogen 2.922 N/A GLN 378.A N GLN 374.A O no hydrogen 2.973 N/A GLN 378.A NE2 GLN 370.A OE1 no hydrogen 3.120 N/A GLN 378.A NE2 GLN 374.A OE1 no hydrogen 3.014 N/A TRP 379.A N THR 375.A O no hydrogen 3.216 N/A TRP 379.A NE1 SER 395.A OG no hydrogen 2.623 N/A ILE 380.A N ALA 376.A O no hydrogen 2.946 N/A ASN 381.A N THR 377.A O no hydrogen 2.879 N/A TRP 382.A N GLN 378.A O no hydrogen 2.938 N/A LEU 383.A N TRP 379.A O no hydrogen 2.767 N/A GLY 384.A N ILE 380.A O no hydrogen 3.041 N/A ARG 385.A N ASN 381.A O no hydrogen 2.901 N/A TYR 386.A N TRP 382.A O no hydrogen 3.070 N/A ARG 392.A NH1 MET 256.A O no hydrogen 2.679 N/A ARG 392.A NH1 GLN 337.A O no hydrogen 2.883 N/A ARG 392.A NH2 MET 256.A O no hydrogen 3.020 N/A TRP 393.A N ASN 261.A OD1 no hydrogen 3.016 N/A PHE 394.A N GLN 340.A O no hydrogen 2.824 N/A SER 395.A N VAL 262.A O no hydrogen 2.757 N/A TRP 396.A N GLY 342.A O no hydrogen 2.807 N/A TRP 396.A NE1 THR 266.A OG1 no hydrogen 2.783 N/A VAL 397.A N LEU 264.A O no hydrogen 2.731 N/A SER 398.A N PHE 344.A O no hydrogen 2.745 N/A PHE 399.A N THR 266.A O no hydrogen 2.818 N/A ASN 400.A N ASP 372.A OD1 no hydrogen 2.961 N/A ASN 400.A ND2 ASP 347.A OD1 no hydrogen 2.779 N/A THR 402.A OG1 GLY 269.A O no hydrogen 2.519 N/A ASN 403.A N ASN 400.A O no hydrogen 3.035 N/A ASN 403.A ND2 ASP 268.A OD1 no hydrogen 3.057 N/A PHE 412.A N ASN 408.A O no hydrogen 2.648 N/A ALA 413.A N GLN 409.A O no hydrogen 3.301 N/A ARG 414.A N GLN 410.A O no hydrogen 3.399 N/A LYS 415.A N ALA 411.A O no hydrogen 2.917 N/A TYR 416.A N PHE 412.A O no hydrogen 2.765 N/A SER 417.A N ALA 413.A O no hydrogen 2.902 N/A ARG 418.A N ARG 414.A O no hydrogen 3.246 N/A ALA 419.A N LYS 415.A O no hydrogen 2.795 N/A ALA 420.A N TYR 416.A O no hydrogen 2.702 N/A GLY 421.A N SER 417.A O no hydrogen 3.179 N/A ASN 422.A N ARG 418.A O no hydrogen 3.159 N/A VAL 423.A N ALA 419.A O no hydrogen 3.000 N/A ASP 424.A N ALA 420.A O no hydrogen 2.955 N/A ASP 425.A N GLY 421.A O no hydrogen 2.949 N/A GLN 426.A N ASN 422.A O no hydrogen 3.270 N/A ILE 427.A N VAL 423.A O no hydrogen 2.905 N/A ASN 428.A N ASP 424.A O no hydrogen 2.948 N/A ARG 429.A N ASP 425.A O no hydrogen 3.096 N/A ARG 429.A NH1 GLU 373.A O no hydrogen 3.381 N/A ARG 429.A NH1 THR 377.A OG1 no hydrogen 3.085 N/A ARG 429.A NH1 GLN 426.A OE1 no hydrogen 2.986 N/A ARG 429.A NH2 THR 377.A OG1 no hydrogen 2.986 N/A VAL 430.A N GLN 426.A O no hydrogen 3.111 N/A LEU 431.A N ILE 427.A O no hydrogen 2.877 N/A ASN 432.A N ASN 428.A O no hydrogen 2.812 N/A ALA 433.A N ARG 429.A O no hydrogen 2.990 N/A LEU 434.A N VAL 430.A O no hydrogen 2.982 N/A ARG 435.A N LEU 431.A O no hydrogen 2.817 N/A ASP 436.A N ASN 432.A O no hydrogen 2.763 N/A SER 437.A N ALA 433.A O no hydrogen 2.881 N/A SER 437.A OG ALA 433.A O no hydrogen 3.537 N/A SER 437.A OG LEU 434.A O no hydrogen 2.714 N/A GLY 438.A N ARG 435.A O no hydrogen 3.245 N/A LYS 439.A N SER 437.A OG no hydrogen 3.269 N/A ASN 442.A N LYS 439.A O no hydrogen 3.343 N/A THR 443.A N LEU 440.A O no hydrogen 3.405 N/A THR 443.A OG1 LYS 439.A O no hydrogen 2.471 N/A VAL 444.A N ASN 261.A O no hydrogen 2.841 N/A VAL 445.A N HIS 476.A O no hydrogen 2.846 N/A ILE 446.A N LEU 263.A O no hydrogen 2.860 N/A ILE 447.A N VAL 474.A O no hydrogen 2.789 N/A THR 448.A N ILE 265.A O no hydrogen 3.022 N/A THR 448.A OG1 PRO 472.A O no hydrogen 2.742 N/A ALA 449.A N THR 448.A OG1 no hydrogen 2.747 N/A GLY 450.A N VAL 267.A O no hydrogen 2.930 N/A ARG 451.A NH1 THR 302.A OG1 no hydrogen 2.924 N/A ARG 451.A NH1 ASN 403.A OD1 no hydrogen 3.084 N/A ARG 451.A NH2 ASN 403.A OD1 no hydrogen 3.120 N/A GLY 452.A N HIS 468.A O no hydrogen 2.847 N/A ILE 453.A N LEU 270.A O no hydrogen 3.032 N/A LEU 455.A N GLU 459.A OE1 no hydrogen 2.638 N/A SER 456.A N GLU 459.A OE1 no hydrogen 2.884 N/A GLU 459.A N SER 456.A O no hydrogen 3.214 N/A GLU 459.A N SER 456.A OG no hydrogen 3.235 N/A GLU 460.A N GLU 457.A O no hydrogen 3.058 N/A THR 461.A OG1 GLY 560.A O no hydrogen 2.658 N/A SER 465.A OG GLU 459.A O no hydrogen 2.622 N/A HIS 468.A N SER 465.A O no hydrogen 3.009 N/A HIS 468.A N SER 465.A OG no hydrogen 3.377 N/A LEU 469.A N SER 465.A O no hydrogen 2.938 N/A LEU 469.A N HIS 466.A O no hydrogen 3.193 N/A GLN 470.A N HIS 466.A O no hydrogen 2.598 N/A VAL 471.A N HIS 295.A O no hydrogen 3.019 N/A VAL 474.A N ILE 447.A O no hydrogen 2.835 N/A ILE 475.A N ILE 290.A O no hydrogen 2.789 N/A HIS 476.A N VAL 445.A O no hydrogen 2.711 N/A HIS 476.A ND1 ASN 289.A OD1 no hydrogen 2.590 N/A HIS 476.A NE2 LEU 440.A O no hydrogen 3.056 N/A THR 480.A N TRP 477.A O no hydrogen 2.932 N/A THR 480.A OG1 TRP 477.A O no hydrogen 3.557 N/A GLN 483.A N ASN 289.A O no hydrogen 2.951 N/A GLN 483.A NE2 PRO 481.A O no hydrogen 3.288 N/A ILE 485.A N SER 291.A O no hydrogen 3.027 N/A THR 489.A N ARG 294.A O no hydrogen 3.065 N/A THR 489.A OG1 HIS 295.A ND1 no hydrogen 2.734 N/A ASP 490.A N ASP 493.A OD2 no hydrogen 3.006 N/A HIS 491.A ND1 HIS 295.A NE2 no hydrogen 2.937 N/A HIS 491.A NE2 ALA 449.A O no hydrogen 2.843 N/A THR 492.A OG1 ASP 490.A OD2 no hydrogen 2.655 N/A ASP 493.A N ASP 490.A O no hydrogen 2.932 N/A ASP 493.A N ASP 490.A OD2 no hydrogen 3.090 N/A LEU 494.A N ASP 490.A O no hydrogen 3.346 N/A MET 495.A N HIS 491.A O no hydrogen 2.997 N/A THR 496.A N THR 492.A O no hydrogen 3.078 N/A THR 496.A OG1 THR 492.A O no hydrogen 3.093 N/A THR 496.A OG1 SER 513.A OG no hydrogen 2.716 N/A THR 497.A N ASP 493.A O no hydrogen 2.954 N/A THR 497.A OG1 ASP 493.A O no hydrogen 2.967 N/A THR 497.A OG1 ASP 517.A OD2 no hydrogen 3.403 N/A LEU 498.A N LEU 494.A O no hydrogen 3.080 N/A MET 499.A N MET 495.A O no hydrogen 3.006 N/A GLN 500.A N THR 496.A O no hydrogen 2.955 N/A ARG 501.A N THR 497.A O no hydrogen 2.804 N/A ARG 501.A NE ASP 517.A OD1 no hydrogen 2.618 N/A ARG 501.A NE ASP 517.A OD2 no hydrogen 3.165 N/A LEU 502.A N LEU 498.A O no hydrogen 3.105 N/A LEU 503.A N LEU 498.A O no hydrogen 3.035 N/A HIS 504.A N GLN 500.A O no hydrogen 3.156 N/A HIS 504.A ND1 ASP 255.A OD1 no hydrogen 2.505 N/A VAL 505.A N MET 499.A O no hydrogen 2.888 N/A SER 506.A N ARG 252.A O no hydrogen 2.833 N/A THR 507.A OG1 GLU 250.A O no hydrogen 3.249 N/A GLU 511.A N PRO 508.A O no hydrogen 2.920 N/A TYR 512.A N ALA 509.A O no hydrogen 3.071 N/A SER 513.A N ALA 509.A O no hydrogen 2.894 N/A SER 513.A OG THR 496.A OG1 no hydrogen 2.716 N/A SER 513.A OG ALA 509.A O no hydrogen 3.267 N/A GLN 514.A N GLY 312.A O no hydrogen 2.798 N/A GLY 515.A N SER 513.A OG no hydrogen 3.221 N/A GLN 516.A N ASP 493.A OD1 no hydrogen 2.714 N/A GLN 516.A NE2 GLN 522.A O no hydrogen 2.830 N/A LEU 518.A N THR 497.A OG1 no hydrogen 2.712 N/A PHE 519.A N ASP 517.A OD2 no hydrogen 2.855 N/A ASN 520.A N ASP 517.A O no hydrogen 3.234 N/A GLN 522.A N ASN 520.A OD1 no hydrogen 2.917 N/A ARG 523.A NH1 ASP 517.A O no hydrogen 2.650 N/A ARG 523.A NH1 ASN 520.A O no hydrogen 2.926 N/A ARG 523.A NH2 GLN 516.A O no hydrogen 3.371 N/A ARG 524.A N GLN 516.A OE1 no hydrogen 2.795 N/A ARG 524.A NH1 GLY 515.A O no hydrogen 2.968 N/A VAL 528.A N THR 539.A O no hydrogen 3.120 N/A ALA 530.A N ALA 537.A O no hydrogen 2.864 N/A ALA 531.A N SER 298.A O no hydrogen 3.123 N/A ASP 532.A N THR 535.A O no hydrogen 2.974 N/A ASP 534.A N ASP 532.A OD1 no hydrogen 3.015 N/A THR 535.A OG1 ASP 532.A OD1 no hydrogen 3.103 N/A THR 535.A OG1 ASP 534.A OD1 no hydrogen 3.131 N/A LEU 536.A N LEU 547.A O no hydrogen 2.785 N/A ALA 537.A N ALA 530.A O no hydrogen 2.685 N/A ILE 538.A N LEU 545.A O no hydrogen 2.687 N/A THR 539.A N VAL 528.A O no hydrogen 2.877 N/A THR 540.A N LYS 543.A O no hydrogen 2.841 N/A THR 540.A OG1 LYS 543.A O no hydrogen 2.908 N/A LYS 542.A N THR 540.A OG1 no hydrogen 3.198 N/A LYS 543.A N THR 540.A OG1 no hydrogen 2.869 N/A THR 544.A N TYR 556.A O no hydrogen 2.809 N/A LEU 545.A N ILE 538.A O no hydrogen 2.763 N/A VAL 546.A N ARG 554.A O no hydrogen 2.898 N/A LEU 547.A N LEU 536.A O no hydrogen 2.883 N/A ASN 548.A N LYS 552.A O no hydrogen 3.274 N/A ASN 549.A N ASP 534.A O no hydrogen 3.106 N/A ASN 549.A ND2 ASN 533.A O no hydrogen 3.608 N/A GLY 551.A N ASN 548.A O no hydrogen 3.064 N/A LYS 552.A N ASN 548.A OD1 no hydrogen 2.836 N/A ARG 554.A N VAL 546.A O no hydrogen 2.952 N/A THR 555.A OG1 ASP 565.A OD1 no hydrogen 2.890 N/A TYR 556.A N THR 544.A O no hydrogen 2.896 N/A ASN 557.A N GLU 561.A O no hydrogen 3.066 N/A GLY 560.A N ASN 557.A O no hydrogen 3.032 N/A GLU 561.A N ASN 557.A OD1 no hydrogen 2.753 N/A VAL 563.A N THR 555.A O no hydrogen 2.995 N/A LEU 573.A N GLN 569.A O no hydrogen 2.911 N/A LEU 574.A N LEU 570.A O no hydrogen 2.656 N/A GLN 575.A N SER 571.A O no hydrogen 3.154 N/A GLN 575.A NE2 ASP 579.A OD2 no hydrogen 3.236 N/A VAL 576.A N LEU 572.A O no hydrogen 2.903 N/A LEU 577.A N LEU 573.A O no hydrogen 2.962 N/A THR 578.A N LEU 574.A O no hydrogen 2.931 N/A THR 578.A OG1 LEU 574.A O no hydrogen 2.595 N/A ASP 579.A N GLN 575.A O no hydrogen 2.923 N/A GLU 580.A N VAL 576.A O no hydrogen 2.902 N/A LYS 581.A N THR 578.A O no hydrogen 3.225 N/A ARG 582.A N ASP 579.A O no hydrogen 3.403 N/A ARG 582.A NH1 SER 510.A O no hydrogen 2.846 N/A ARG 582.A NH1 SER 513.A O no hydrogen 2.736 N/A ARG 582.A NH2 ASP 579.A OD1 no hydrogen 2.883 N/A PHE 583.A N TYR 317.A OH no hydrogen 3.179 N/A ILE 584.A N LYS 581.A O no hydrogen 2.933 N/A ALA 585.A N SER 243.A O no hydrogen 3.186 N/A