Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8k2l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 6.A N ARG 45.A O no hydrogen 2.933 N/A THR 7.A OG1 ALA 157.A O no hydrogen 3.528 N/A THR 7.A OG1 GLU 158.A OE2 no hydrogen 2.606 N/A ARG 8.A N ALA 43.A O no hydrogen 2.899 N/A ARG 8.A NH1 LEU 22.A O no hydrogen 2.964 N/A ARG 8.A NH1 ASP 24.A O no hydrogen 2.816 N/A CYS 9.A SG VAL 27.A O no hydrogen 3.375 N/A CYS 9.A SG GLN 41.A O no hydrogen 3.967 N/A LEU 10.A N GLN 41.A O no hydrogen 2.815 N/A SER 12.A OG GLU 498.A OE1 no hydrogen 2.481 N/A SER 12.A OG GLU 498.A OE2 no hydrogen 3.072 N/A LEU 13.A N SER 11.A OG no hydrogen 2.989 N/A SER 14.A N SER 11.A O no hydrogen 3.433 N/A SER 14.A OG ASP 24.A OD2 no hydrogen 2.615 N/A LYS 15.A NZ PHE 420.A O no hydrogen 3.459 N/A LYS 15.A NZ PHE 421.A O no hydrogen 2.988 N/A LYS 15.A NZ LEU 423.A O no hydrogen 3.008 N/A VAL 27.A N CYS 9.A O no hydrogen 2.807 N/A ASN 28.A ND2 GLU 158.A OE1 no hydrogen 3.205 N/A ASN 28.A ND2 LYS 159.A O no hydrogen 2.719 N/A GLY 30.A N ALA 161.A O no hydrogen 3.220 N/A SER 31.A OG GLU 547.A OE1 no hydrogen 2.474 N/A ALA 32.A N GLU 163.A O no hydrogen 2.987 N/A MET 33.A N GLU 36.A OE1 no hydrogen 2.955 N/A TRP 34.A N GLN 167.A O no hydrogen 3.004 N/A LYS 35.A N PRO 123.A O no hydrogen 3.006 N/A LYS 35.A NZ GLU 168.A OE1 no hydrogen 3.281 N/A GLU 36.A N MET 33.A O no hydrogen 3.171 N/A VAL 37.A N GLN 501.A OE1 no hydrogen 2.842 N/A PHE 38.A N VAL 120.A O no hydrogen 2.885 N/A PHE 40.A N VAL 118.A O no hydrogen 3.018 N/A GLN 41.A N LEU 10.A O no hydrogen 3.041 N/A GLN 41.A NE2 SER 11.A O no hydrogen 2.969 N/A GLN 41.A NE2 SER 14.A O no hydrogen 2.865 N/A VAL 42.A N VAL 116.A O no hydrogen 2.840 N/A ALA 43.A N ARG 8.A O no hydrogen 2.847 N/A TYR 44.A N ARG 114.A O no hydrogen 2.849 N/A TYR 44.A OH HIS 107.A O no hydrogen 2.896 N/A ARG 45.A N GLU 6.A O no hydrogen 2.928 N/A ARG 45.A NE GLU 6.A OE2 no hydrogen 2.892 N/A ARG 45.A NH1 GLU 21.A OE1 no hydrogen 3.292 N/A ARG 45.A NH2 GLU 6.A OE2 no hydrogen 2.880 N/A SER 46.A OG ASP 4.A O no hydrogen 2.670 N/A GLN 48.A N SER 46.A OG no hydrogen 3.110 N/A ILE 50.A N ALA 108.A O no hydrogen 2.973 N/A SER 52.A N HIS 107.A ND1 no hydrogen 3.120 N/A LEU 53.A N VAL 106.A O no hydrogen 2.908 N/A LYS 54.A N GLU 148.A O no hydrogen 2.879 N/A SER 56.A N CYS 146.A O no hydrogen 3.082 N/A GLU 58.A N ASP 144.A O no hydrogen 2.860 N/A SER 59.A N GLU 62.A OE2 no hydrogen 3.159 N/A SER 59.A OG PRO 142.A O no hydrogen 2.835 N/A LEU 61.A N SER 59.A OG no hydrogen 2.922 N/A GLU 62.A N SER 59.A O no hydrogen 3.095 N/A TYR 64.A N LEU 61.A O no hydrogen 2.783 N/A LEU 65.A N GLU 62.A O no hydrogen 3.214 N/A ALA 66.A N THR 119.A O no hydrogen 2.830 N/A ARG 68.A N TRP 117.A O no hydrogen 2.876 N/A ARG 68.A NH1 ASP 489.A OD2 no hydrogen 2.848 N/A ARG 68.A NH2 THR 119.A OG1 no hydrogen 2.938 N/A ALA 69.A N TYR 100.A O no hydrogen 2.850 N/A VAL 70.A N SER 115.A O no hydrogen 2.933 N/A GLY 71.A N PRO 98.A O no hydrogen 2.810 N/A SER 73.A N TYR 95.A O no hydrogen 2.787 N/A SER 73.A OG TYR 481.A OH no hydrogen 2.877 N/A SER 75.A N GLY 93.A O no hydrogen 2.926 N/A SER 75.A OG SER 474.A OG no hydrogen 2.707 N/A GLU 76.A N ASP 467.A OD2 no hydrogen 3.001 N/A LEU 77.A N ASP 467.A OD2 no hydrogen 2.835 N/A GLY 86.A N ASP 84.A OD1 no hydrogen 2.822 N/A TYR 87.A N ASP 84.A O no hydrogen 3.334 N/A TYR 87.A OH ASP 413.A O no hydrogen 2.649 N/A ILE 88.A N SER 422.A O no hydrogen 2.823 N/A ARG 89.A NH1 ASP 19.A OD1 no hydrogen 3.163 N/A ARG 89.A NH1 ASP 19.A OD2 no hydrogen 2.813 N/A ARG 89.A NH2 ASP 19.A OD1 no hydrogen 2.989 N/A GLY 93.A N SER 75.A O no hydrogen 3.092 N/A TYR 95.A N SER 73.A O no hydrogen 2.919 N/A TYR 95.A OH ALA 91.A O no hydrogen 2.647 N/A ASP 97.A N GLY 71.A O no hydrogen 3.024 N/A LEU 99.A N ASP 489.A O no hydrogen 2.892 N/A TYR 100.A N ALA 69.A O no hydrogen 2.881 N/A ASP 104.A N PRO 101.A O no hydrogen 2.995 N/A GLY 105.A N LEU 102.A O no hydrogen 2.742 N/A ALA 108.A N ILE 50.A O no hydrogen 2.869 N/A ASN 111.A N SER 46.A O no hydrogen 2.832 N/A GLN 112.A N VAL 109.A O no hydrogen 3.031 N/A ARG 114.A N TYR 44.A O no hydrogen 2.943 N/A ARG 114.A NE GLN 112.A OE1 no hydrogen 3.000 N/A ARG 114.A NH1 GLN 112.A OE1 no hydrogen 2.787 N/A SER 115.A OG GLN 41.A OE1 no hydrogen 2.759 N/A SER 115.A OG VAL 42.A O no hydrogen 3.439 N/A VAL 116.A N VAL 42.A O no hydrogen 3.021 N/A TRP 117.A N ARG 68.A O no hydrogen 2.739 N/A VAL 118.A N PHE 40.A O no hydrogen 2.730 N/A THR 119.A N ALA 66.A O no hydrogen 2.957 N/A VAL 120.A N PHE 38.A O no hydrogen 2.828 N/A SER 121.A N TYR 64.A O no hydrogen 2.868 N/A LEU 122.A N GLU 36.A O no hydrogen 3.017 N/A SER 124.A OG SER 126.A OG no hydrogen 3.159 N/A SER 124.A OG GLU 127.A OE1 no hydrogen 3.530 N/A SER 126.A OG SER 124.A OG no hydrogen 3.159 N/A GLU 127.A N SER 124.A O no hydrogen 3.193 N/A GLU 127.A N SER 124.A OG no hydrogen 3.366 N/A PHE 128.A N MET 125.A O no hydrogen 3.251 N/A ILE 129.A N TYR 64.A OH no hydrogen 2.823 N/A GLY 135.A N ASP 133.A OD1 no hydrogen 2.649 N/A ALA 136.A N ASP 133.A O no hydrogen 2.869 N/A SER 138.A OG GLU 163.A OE2 no hydrogen 2.577 N/A VAL 139.A N ILE 164.A O no hydrogen 2.958 N/A PHE 141.A N LEU 162.A O no hydrogen 2.841 N/A ILE 143.A N PHE 160.A O no hydrogen 2.689 N/A ASP 144.A N GLU 58.A O no hydrogen 3.063 N/A LEU 145.A N GLU 158.A O no hydrogen 2.795 N/A CYS 146.A N SER 56.A O no hydrogen 2.807 N/A CYS 146.A SG GLU 148.A OE2 no hydrogen 3.801 N/A PHE 147.A N GLY 156.A O no hydrogen 2.892 N/A GLU 148.A N LYS 54.A O no hydrogen 2.936 N/A ASP 149.A N ASN 153.A O no hydrogen 3.022 N/A LYS 151.A N ASP 149.A OD1 no hydrogen 2.972 N/A LYS 151.A NZ ASP 149.A OD2 no hydrogen 3.057 N/A GLY 152.A N ASP 149.A O no hydrogen 3.322 N/A ASN 153.A N ASP 149.A OD1 no hydrogen 2.954 N/A LEU 155.A N PHE 147.A O no hydrogen 2.736 N/A GLY 156.A N PHE 147.A O no hydrogen 3.212 N/A GLU 158.A N LEU 145.A O no hydrogen 2.987 N/A PHE 160.A N ILE 143.A O no hydrogen 2.851 N/A ALA 161.A N ASN 28.A O no hydrogen 3.008 N/A LEU 162.A N PHE 141.A O no hydrogen 3.074 N/A GLU 163.A N GLY 30.A O no hydrogen 2.927 N/A ILE 164.A N VAL 139.A O no hydrogen 2.782 N/A ILE 165.A N ALA 32.A O no hydrogen 2.860 N/A PHE 166.A N GLU 137.A O no hydrogen 2.914 N/A GLN 167.A N ILE 165.A O no hydrogen 2.803 N/A GLN 167.A NE2 ILE 553.A O no hydrogen 2.806 N/A LEU 169.A N TRP 34.A O no hydrogen 2.921 N/A GLN 172.A NE2 LEU 174.A O no hydrogen 2.961 N/A GLN 172.A NE2 GLY 213.A O no hydrogen 2.992 N/A LEU 175.A N GLN 441.A O no hydrogen 2.962 N/A HIS 176.A N ASN 215.A OD1 no hydrogen 2.884 N/A HIS 176.A ND1 GLY 213.A O no hydrogen 2.882 N/A HIS 176.A NE2 GLU 178.A OE2 no hydrogen 2.570 N/A THR 177.A N PHE 443.A O no hydrogen 3.096 N/A THR 177.A OG1 MET 216.A O no hydrogen 3.391 N/A THR 177.A OG1 GLU 273.A OE1 no hydrogen 2.617 N/A TRP 179.A N HIS 445.A O no hydrogen 2.774 N/A TRP 179.A NE1 GLU 273.A OE2 no hydrogen 2.958 N/A HIS 181.A N ASN 449.A OD1 no hydrogen 2.870 N/A HIS 181.A NE2 TRP 446.A O no hydrogen 2.796 N/A CYS 184.A SG ASP 183.A OD1 no hydrogen 3.736 N/A ALA 186.A N SER 182.A O no hydrogen 3.105 N/A THR 187.A N ASP 183.A O no hydrogen 2.995 N/A THR 187.A OG1 ASP 183.A O no hydrogen 3.245 N/A THR 187.A OG1 TYR 452.A OH no hydrogen 2.977 N/A GLN 188.A N CYS 184.A O no hydrogen 3.124 N/A TYR 189.A N ILE 185.A O no hydrogen 3.061 N/A TYR 189.A OH TYR 205.A OH no hydrogen 2.671 N/A TYR 189.A OH GLY 483.A O no hydrogen 2.645 N/A VAL 191.A N ALA 186.A O no hydrogen 2.954 N/A PHE 194.A N HIS 198.A ND1 no hydrogen 2.948 N/A SER 195.A N GLU 192.A O no hydrogen 3.144 N/A SER 195.A OG GLU 192.A O no hydrogen 2.603 N/A HIS 198.A N SER 195.A OG no hydrogen 3.289 N/A HIS 198.A NE2 SER 182.A O no hydrogen 2.791 N/A TRP 199.A N SER 195.A O no hydrogen 2.990 N/A LYS 200.A N GLU 196.A O no hydrogen 3.103 N/A LEU 201.A N ALA 197.A O no hydrogen 3.231 N/A ILE 202.A N HIS 198.A O no hydrogen 2.866 N/A GLU 203.A N TRP 199.A O no hydrogen 2.988 N/A SER 204.A N LYS 200.A O no hydrogen 3.205 N/A SER 204.A OG LYS 200.A O no hydrogen 3.368 N/A TYR 205.A N LEU 201.A O no hydrogen 2.978 N/A TYR 205.A OH TYR 189.A OH no hydrogen 2.671 N/A VAL 206.A N ILE 202.A O no hydrogen 2.864 N/A HIS 207.A N GLU 203.A O no hydrogen 3.032 N/A ASN 208.A N SER 204.A O no hydrogen 3.242 N/A ASN 208.A ND2 ASP 489.A OD1 no hydrogen 2.854 N/A ALA 209.A N TYR 205.A O no hydrogen 3.025 N/A VAL 210.A N VAL 206.A O no hydrogen 2.829 N/A ASN 211.A N HIS 207.A O no hydrogen 2.991 N/A ASN 211.A ND2 HIS 207.A NE2 no hydrogen 3.173 N/A HIS 212.A N ASN 208.A O no hydrogen 3.136 N/A HIS 212.A N ALA 209.A O no hydrogen 2.963 N/A HIS 212.A ND1 ASN 208.A O no hydrogen 2.782 N/A HIS 212.A NE2 GLU 494.A OE2 no hydrogen 2.618 N/A GLY 213.A N VAL 210.A O no hydrogen 3.017 N/A VAL 214.A N ALA 209.A O no hydrogen 2.980 N/A ASN 215.A N HIS 176.A O no hydrogen 3.037 N/A ASN 215.A ND2 LEU 174.A O no hydrogen 2.787 N/A MET 216.A N HIS 176.A O no hydrogen 3.282 N/A LEU 217.A N PHE 271.A O no hydrogen 3.055 N/A THR 219.A N GLU 273.A O no hydrogen 2.859 N/A THR 219.A OG1 LEU 217.A O no hydrogen 2.899 N/A LEU 221.A N THR 219.A O no hydrogen 3.116 N/A LEU 221.A N SER 275.A OG no hydrogen 3.160 N/A LEU 226.A N PRO 224.A O no hydrogen 3.036 N/A ASP 227.A N GLN 280.A OE1 no hydrogen 2.971 N/A THR 228.A OG1 LEU 226.A O no hydrogen 2.897 N/A GLY 232.A N TYR 229.A O no hydrogen 2.878 N/A ARG 234.A NE ASP 183.A OD2 no hydrogen 2.813 N/A ARG 234.A NH1 LEU 226.A O no hydrogen 2.984 N/A ARG 234.A NH2 HIS 181.A ND1 no hydrogen 2.995 N/A ARG 234.A NH2 ASP 183.A OD1 no hydrogen 3.033 N/A ARG 234.A NH2 ASP 183.A OD2 no hydrogen 3.283 N/A VAL 237.A N THR 223.A OG1 no hydrogen 2.935 N/A GLN 238.A NE2 ILE 240.A O no hydrogen 2.912 N/A GLN 238.A NE2 ILE 290.A O no hydrogen 2.800 N/A LEU 239.A N PRO 220.A O no hydrogen 2.975 N/A ILE 240.A N LEU 221.A O no hydrogen 3.183 N/A ASP 241.A N LYS 253.A O no hydrogen 3.218 N/A GLU 243.A N ARG 251.A O no hydrogen 2.925 N/A ILE 244.A N LYS 292.A O no hydrogen 2.971 N/A THR 245.A N GLU 249.A O no hydrogen 2.891 N/A THR 245.A OG1 GLU 249.A O no hydrogen 3.293 N/A GLU 249.A N GLY 246.A O no hydrogen 2.960 N/A TYR 250.A N GLN 318.A OE1 no hydrogen 3.165 N/A ARG 251.A N GLU 243.A O no hydrogen 2.850 N/A LYS 253.A N ASP 241.A O no hydrogen 2.885 N/A GLU 258.A N PHE 254.A O no hydrogen 2.897 N/A ARG 259.A N ASP 255.A O no hydrogen 3.038 N/A ARG 259.A NH1 GLU 196.A OE2 no hydrogen 2.815 N/A ARG 259.A NH2 GLU 196.A OE1 no hydrogen 2.917 N/A ARG 259.A NH2 GLU 196.A OE2 no hydrogen 3.529 N/A TRP 260.A N ARG 256.A O no hydrogen 3.041 N/A TRP 260.A NE1 THR 219.A OG1 no hydrogen 3.039 N/A VAL 261.A N LEU 257.A O no hydrogen 2.905 N/A GLU 262.A N GLU 258.A O no hydrogen 2.941 N/A MET 263.A N ARG 259.A O no hydrogen 2.893 N/A CYS 264.A N TRP 260.A O no hydrogen 2.983 N/A CYS 264.A SG TRP 260.A O no hydrogen 3.523 N/A GLN 265.A N VAL 261.A O no hydrogen 2.901 N/A ARG 266.A N GLU 262.A O no hydrogen 2.962 N/A ARG 266.A NH2 GLU 203.A OE1 no hydrogen 3.133 N/A ARG 266.A NH2 GLU 203.A OE2 no hydrogen 2.627 N/A LEU 267.A N MET 263.A O no hydrogen 2.991 N/A LEU 267.A N CYS 264.A O no hydrogen 3.254 N/A GLY 268.A N CYS 264.A O no hydrogen 3.044 N/A ILE 269.A N CYS 264.A O no hydrogen 2.933 N/A GLN 270.A N ASN 215.A O no hydrogen 2.797 N/A GLN 270.A NE2 GLU 171.A OE2 no hydrogen 3.331 N/A PHE 271.A N ASN 215.A O no hydrogen 2.968 N/A ILE 272.A N LYS 335.A O no hydrogen 2.840 N/A GLU 273.A N LEU 217.A O no hydrogen 2.991 N/A PHE 274.A N PHE 337.A O no hydrogen 2.811 N/A SER 275.A N THR 219.A O no hydrogen 2.964 N/A SER 275.A OG THR 219.A O no hydrogen 3.254 N/A SER 275.A OG PHE 222.A O no hydrogen 3.411 N/A HIS 276.A N HIS 276.A ND1 no hydrogen 2.726 N/A HIS 276.A NE2 ASP 342.A OD2 no hydrogen 2.816 N/A THR 279.A N TYR 285.A O no hydrogen 2.986 N/A THR 279.A OG1 TYR 285.A O no hydrogen 3.316 N/A ALA 283.A N THR 279.A O no hydrogen 3.072 N/A LYS 284.A NZ HIS 348.A ND1 no hydrogen 3.261 N/A LYS 284.A NZ SER 351.A OG no hydrogen 3.144 N/A TYR 285.A N THR 279.A OG1 no hydrogen 2.945 N/A ALA 286.A N THR 305.A O no hydrogen 3.354 N/A LYS 288.A NZ GLU 233.A OE1 no hydrogen 2.898 N/A LYS 288.A NZ ARG 234.A O no hydrogen 2.728 N/A LYS 288.A NZ THR 236.A OG1 no hydrogen 2.830 N/A ILE 289.A N PHE 301.A O no hydrogen 3.146 N/A ILE 290.A N GLN 238.A OE1 no hydrogen 3.016 N/A ALA 291.A N LYS 298.A O no hydrogen 2.904 N/A LYS 292.A N VAL 242.A O no hydrogen 2.933 N/A LYS 293.A N GLU 296.A O no hydrogen 3.017 N/A GLU 296.A N LYS 293.A O no hydrogen 3.372 N/A LYS 298.A N ALA 291.A O no hydrogen 2.746 N/A ARG 299.A NH1 ASP 304.A OD1 no hydrogen 2.893 N/A ARG 299.A NH2 ASP 304.A OD1 no hydrogen 3.502 N/A ARG 299.A NH2 ASP 304.A OD2 no hydrogen 2.889 N/A ILE 300.A N ILE 289.A O no hydrogen 2.854 N/A PHE 301.A N ILE 289.A O no hydrogen 3.492 N/A GLY 302.A N THR 305.A OG1 no hydrogen 2.993 N/A TRP 303.A NE1 GLY 232.A O no hydrogen 2.952 N/A THR 305.A N GLY 302.A O no hydrogen 3.220 N/A THR 305.A OG1 GLY 302.A O no hydrogen 3.076 N/A ALA 307.A N LYS 284.A O no hydrogen 2.841 N/A GLY 309.A N GLU 306.A O no hydrogen 2.976 N/A TYR 312.A OH LEU 277.A O no hydrogen 2.613 N/A SER 313.A N GLY 309.A O no hydrogen 3.192 N/A LEU 314.A N GLU 310.A O no hydrogen 2.832 N/A PHE 315.A N SER 311.A O no hydrogen 3.053 N/A LEU 316.A N TYR 312.A O no hydrogen 2.966 N/A ASP 317.A N SER 313.A O no hydrogen 2.922 N/A GLN 318.A N LEU 314.A O no hydrogen 3.181 N/A GLN 318.A N PHE 315.A O no hydrogen 3.140 N/A GLN 318.A NE2 ASN 248.A O no hydrogen 2.828 N/A GLN 318.A NE2 LEU 314.A O no hydrogen 3.294 N/A PHE 319.A N PHE 315.A O no hydrogen 2.811 N/A LEU 320.A N LEU 316.A O no hydrogen 2.931 N/A GLN 322.A NE2 GLN 318.A O no hydrogen 3.305 N/A LEU 323.A N PHE 319.A O no hydrogen 2.945 N/A VAL 324.A N LEU 320.A O no hydrogen 2.958 N/A HIS 325.A N PRO 321.A O no hydrogen 2.993 N/A PHE 326.A N GLN 322.A O no hydrogen 3.122 N/A ILE 327.A N LEU 323.A O no hydrogen 2.863 N/A ARG 328.A N VAL 324.A O no hydrogen 3.004 N/A ASN 329.A N HIS 325.A O no hydrogen 2.974 N/A HIS 330.A N PHE 326.A O no hydrogen 2.960 N/A HIS 330.A N ILE 327.A O no hydrogen 3.214 N/A HIS 330.A ND1 PHE 326.A O no hydrogen 2.855 N/A HIS 330.A NE2 GLU 258.A OE2 no hydrogen 2.584 N/A HIS 331.A N ARG 328.A O no hydrogen 3.311 N/A LEU 332.A N ILE 327.A O no hydrogen 2.979 N/A LYS 335.A N LEU 332.A O no hydrogen 2.830 N/A LYS 335.A NZ GLN 270.A O no hydrogen 3.143 N/A PHE 337.A N ILE 272.A O no hydrogen 2.939 N/A PHE 338.A N SER 367.A O no hydrogen 3.023 N/A HIS 339.A NE2 GLU 273.A OE2 no hydrogen 2.573 N/A VAL 340.A N ASP 370.A OD1 no hydrogen 2.926 N/A SER 341.A N ASP 370.A OD1 no hydrogen 2.995 N/A SER 341.A OG THR 279.A O no hydrogen 2.542 N/A GLU 343.A N ALA 371.A O no hydrogen 2.670 N/A HIS 348.A N GLY 345.A O no hydrogen 2.839 N/A ALA 349.A N MET 346.A O no hydrogen 3.104 N/A SER 351.A OG GLY 282.A O no hydrogen 2.628 N/A SER 351.A OG HIS 348.A O no hydrogen 3.242 N/A TYR 352.A N HIS 348.A O no hydrogen 2.974 N/A TYR 352.A OH ASP 370.A OD2 no hydrogen 2.620 N/A ARG 353.A N ALA 349.A O no hydrogen 2.915 N/A ARG 353.A NE GLU 350.A OE1 no hydrogen 3.288 N/A ARG 353.A NH2 GLU 350.A OE1 no hydrogen 3.552 N/A ARG 353.A NH2 GLU 350.A OE2 no hydrogen 2.869 N/A GLN 354.A N GLU 350.A O no hydrogen 3.088 N/A ALA 355.A N SER 351.A O no hydrogen 3.058 N/A SER 356.A N TYR 352.A O no hydrogen 2.846 N/A ASP 357.A N ARG 353.A O no hydrogen 2.932 N/A ILE 358.A N GLN 354.A O no hydrogen 3.388 N/A LEU 359.A N ALA 355.A O no hydrogen 3.340 N/A ASN 360.A N SER 356.A O no hydrogen 2.894 N/A LYS 361.A N ASP 357.A O no hydrogen 3.276 N/A LYS 361.A N ILE 358.A O no hydrogen 3.224 N/A LYS 361.A NZ ASP 317.A OD1 no hydrogen 2.642 N/A LYS 361.A NZ ASP 317.A OD2 no hydrogen 3.239 N/A HIS 362.A N LEU 359.A O no hydrogen 3.016 N/A HIS 362.A NE2 ASP 317.A OD1 no hydrogen 2.782 N/A LEU 363.A N LEU 359.A O no hydrogen 2.841 N/A PHE 366.A N LEU 363.A O no hydrogen 2.979 N/A ILE 368.A N GLN 384.A OE1 no hydrogen 2.929 N/A LEU 369.A N PHE 338.A O no hydrogen 2.839 N/A ASP 370.A N ILE 385.A O no hydrogen 2.969 N/A ALA 371.A N ASP 342.A OD1 no hydrogen 2.976 N/A LEU 372.A N VAL 387.A O no hydrogen 3.036 N/A SER 373.A N GLU 343.A OE1 no hydrogen 2.913 N/A SER 373.A OG GLU 343.A OE2 no hydrogen 2.559 N/A SER 373.A OG SER 389.A OG no hydrogen 3.205 N/A ASP 376.A N ASP 374.A OD1 no hydrogen 2.925 N/A PHE 377.A N ASP 374.A OD1 no hydrogen 3.436 N/A TYR 378.A N ASP 374.A O no hydrogen 3.024 N/A GLU 379.A N TYR 375.A O no hydrogen 2.866 N/A LYS 380.A N PHE 377.A O no hydrogen 3.108 N/A GLY 381.A N TYR 378.A O no hydrogen 2.990 N/A GLN 384.A NE2 PHE 366.A O no hydrogen 3.170 N/A ILE 385.A N ILE 368.A O no hydrogen 3.040 N/A VAL 387.A N ASP 370.A O no hydrogen 2.782 N/A SER 389.A N SER 373.A OG no hydrogen 2.914 N/A SER 389.A OG SER 373.A OG no hydrogen 3.205 N/A SER 389.A OG ASP 391.A OD1 no hydrogen 2.623 N/A ASN 390.A N TYR 407.A O no hydrogen 2.923 N/A ASN 390.A ND2 SER 417.A O no hydrogen 3.097 N/A GLN 392.A N SER 389.A O no hydrogen 2.857 N/A GLU 394.A N GLU 394.A OE1 no hydrogen 3.026 N/A ILE 397.A N ILE 393.A O no hydrogen 3.072 N/A GLU 398.A N GLU 394.A O no hydrogen 2.894 N/A HIS 399.A N PRO 395.A O no hydrogen 3.003 N/A HIS 399.A ND1 PRO 395.A O no hydrogen 2.801 N/A GLY 400.A N ILE 397.A O no hydrogen 2.992 N/A VAL 401.A N PHE 396.A O no hydrogen 3.068 N/A THR 406.A N GLY 442.A O no hydrogen 3.039 N/A THR 406.A OG1 PRO 388.A O no hydrogen 2.832 N/A TYR 407.A N PRO 388.A O no hydrogen 3.397 N/A TYR 407.A OH GLU 343.A OE2 no hydrogen 2.586 N/A CYS 409.A N GLN 412.A OE1 no hydrogen 2.863 N/A CYS 409.A SG GLN 412.A OE1 no hydrogen 3.255 N/A GLN 412.A N CYS 409.A O no hydrogen 3.115 N/A GLN 412.A NE2 ASP 391.A OD1 no hydrogen 3.180 N/A GLN 412.A NE2 ASP 391.A OD2 no hydrogen 3.511 N/A HIS 414.A ND1 HIS 415.A NE2 no hydrogen 3.015 N/A HIS 415.A N ASP 84.A OD2 no hydrogen 2.946 N/A VAL 416.A N HIS 414.A O no hydrogen 2.772 N/A SER 417.A OG ARG 427.A O no hydrogen 2.677 N/A SER 417.A OG ASN 428.A O no hydrogen 3.179 N/A ASN 418.A ND2 CYS 409.A O no hydrogen 2.944 N/A ASN 418.A ND2 GLN 412.A O no hydrogen 2.874 N/A ARG 419.A N ASN 418.A OD1 no hydrogen 2.770 N/A ARG 419.A NE TYR 408.A OH no hydrogen 2.964 N/A ARG 419.A NH1 GLU 178.A OE1 no hydrogen 2.823 N/A ARG 419.A NH2 GLU 178.A OE1 no hydrogen 3.473 N/A ARG 419.A NH2 GLU 178.A OE2 no hydrogen 3.038 N/A ARG 419.A NH2 TYR 408.A OH no hydrogen 3.420 N/A PHE 421.A N SER 474.A O no hydrogen 2.881 N/A SER 422.A OG PRO 78.A O no hydrogen 2.787 N/A LEU 423.A N PHE 420.A O no hydrogen 3.196 N/A SER 424.A OG ASP 537.A OD1 no hydrogen 2.590 N/A SER 424.A OG ASP 537.A OD2 no hydrogen 3.389 N/A ARG 427.A N SER 424.A OG no hydrogen 3.169 N/A ARG 427.A NE VAL 416.A O no hydrogen 3.015 N/A ARG 427.A NH1 ASP 84.A OD1 no hydrogen 2.950 N/A ARG 427.A NH1 ASP 84.A OD2 no hydrogen 3.488 N/A ARG 427.A NH2 ASP 84.A OD2 no hydrogen 2.814 N/A ASN 428.A N SER 424.A O no hydrogen 3.347 N/A ASN 428.A N SER 425.A O no hydrogen 3.123 N/A ASN 428.A ND2 ARG 492.A O no hydrogen 3.032 N/A ARG 429.A N SER 425.A O no hydrogen 3.015 N/A ARG 429.A NE ASP 502.A OD2 no hydrogen 2.833 N/A ARG 429.A NH2 ASP 502.A OD1 no hydrogen 3.021 N/A VAL 430.A N PRO 426.A O no hydrogen 3.033 N/A LEU 431.A N ASN 428.A O no hydrogen 3.306 N/A GLY 432.A N ARG 429.A O no hydrogen 3.183 N/A GLN 434.A N VAL 430.A O no hydrogen 3.235 N/A GLN 434.A NE2 THR 531.A O no hydrogen 2.834 N/A GLN 434.A NE2 PHE 532.A O no hydrogen 3.345 N/A LEU 435.A N LEU 431.A O no hydrogen 2.864 N/A TYR 436.A N GLY 432.A O no hydrogen 3.014 N/A TYR 436.A OH GLU 510.A OE1 no hydrogen 2.565 N/A LYS 437.A N ALA 433.A O no hydrogen 2.964 N/A LYS 437.A NZ GLU 523.A OE2 no hydrogen 2.566 N/A LYS 437.A NZ GLU 529.A OE2 no hydrogen 2.953 N/A LYS 437.A NZ LEU 530.A O no hydrogen 2.714 N/A PHE 438.A N GLN 434.A O no hydrogen 3.098 N/A GLY 439.A N TYR 436.A O no hydrogen 3.225 N/A VAL 440.A N LEU 435.A O no hydrogen 3.084 N/A GLN 441.A N LEU 404.A O no hydrogen 2.685 N/A PHE 443.A N LEU 175.A O no hydrogen 2.888 N/A LEU 444.A N THR 406.A O no hydrogen 3.103 N/A HIS 445.A N THR 177.A O no hydrogen 3.005 N/A TRP 446.A NE1 ASP 476.A OD1 no hydrogen 3.044 N/A GLY 447.A N HIS 445.A ND1 no hydrogen 2.861 N/A PHE 448.A N TRP 179.A O no hydrogen 3.201 N/A ASN 449.A ND2 HIS 181.A O no hydrogen 3.003 N/A PHE 450.A N PRO 477.A O no hydrogen 3.101 N/A TRP 451.A NE1 VAL 480.A O no hydrogen 3.168 N/A TYR 452.A OH THR 187.A OG1 no hydrogen 2.977 N/A SER 453.A N LYS 458.A O no hydrogen 2.850 N/A SER 453.A OG LYS 458.A O no hydrogen 3.473 N/A GLN 454.A N ALA 468.A O no hydrogen 3.326 N/A SER 456.A N SER 453.A O no hydrogen 2.913 N/A SER 456.A OG ASP 227.A O no hydrogen 2.658 N/A LYS 458.A N SER 453.A OG no hydrogen 2.967 N/A ILE 460.A N TRP 451.A O no hydrogen 3.035 N/A PHE 463.A N ASP 461.A OD1 no hydrogen 3.124 N/A LYS 464.A N ASP 461.A O no hydrogen 2.799 N/A LYS 464.A NZ ASP 461.A OD2 no hydrogen 3.088 N/A VAL 465.A N ASP 461.A O no hydrogen 2.800 N/A THR 466.A OG1 PRO 74.A O no hydrogen 2.724 N/A THR 466.A OG1 SER 474.A OG no hydrogen 2.745 N/A CYS 470.A N ASP 467.A OD1 no hydrogen 2.944 N/A ALA 471.A N ASP 467.A O no hydrogen 2.979 N/A PHE 472.A N ASP 467.A O no hydrogen 3.011 N/A SER 474.A N LEU 77.A O no hydrogen 3.114 N/A SER 474.A OG SER 75.A OG no hydrogen 2.707 N/A SER 474.A OG THR 466.A OG1 no hydrogen 2.745 N/A GLY 475.A N THR 466.A O no hydrogen 3.413 N/A ASP 476.A N PRO 473.A O no hydrogen 3.112 N/A VAL 479.A N PHE 448.A O no hydrogen 3.013 N/A VAL 480.A N PHE 448.A O no hydrogen 3.415 N/A TYR 481.A N LEU 488.A O no hydrogen 2.871 N/A TYR 481.A OH SER 73.A OG no hydrogen 2.877 N/A TYR 481.A OH ASP 97.A OD2 no hydrogen 2.569 N/A LEU 488.A N TYR 481.A O no hydrogen 2.834 N/A SER 490.A N VAL 479.A O no hydrogen 3.313 N/A SER 490.A OG VAL 479.A O no hydrogen 2.803 N/A ILE 491.A N ASP 97.A O no hydrogen 2.807 N/A ARG 492.A NE ASP 97.A OD1 no hydrogen 2.668 N/A ARG 492.A NE ASP 97.A OD2 no hydrogen 3.533 N/A ARG 492.A NH1 ARG 419.A O no hydrogen 3.114 N/A ARG 492.A NH2 ASP 97.A OD2 no hydrogen 3.154 N/A ARG 492.A NH2 PHE 478.A O no hydrogen 2.919 N/A TRP 493.A N SER 490.A OG no hydrogen 3.127 N/A TRP 493.A NE1 ASN 208.A OD1 no hydrogen 2.906 N/A GLU 494.A N SER 490.A O no hydrogen 3.306 N/A VAL 495.A N ILE 491.A O no hydrogen 2.911 N/A PHE 496.A N ARG 492.A O no hydrogen 2.809 N/A ARG 497.A N TRP 493.A O no hydrogen 3.146 N/A ARG 497.A NH1 ASN 211.A O no hydrogen 2.923 N/A ARG 497.A NH2 GLU 494.A OE1 no hydrogen 2.841 N/A GLU 498.A N GLU 494.A O no hydrogen 3.158 N/A GLY 499.A N VAL 495.A O no hydrogen 3.198 N/A LEU 500.A N PHE 496.A O no hydrogen 3.230 N/A GLN 501.A N ARG 497.A O no hydrogen 2.846 N/A GLN 501.A NE2 VAL 37.A O no hydrogen 2.857 N/A ASP 502.A N GLU 498.A O no hydrogen 2.948 N/A LEU 503.A N GLY 499.A O no hydrogen 3.035 N/A ARG 504.A N LEU 500.A O no hydrogen 3.034 N/A ARG 504.A NE PRO 170.A O no hydrogen 2.798 N/A ARG 504.A NH2 LEU 169.A O no hydrogen 3.371 N/A ARG 504.A NH2 PRO 170.A O no hydrogen 3.290 N/A ALA 505.A N GLN 501.A O no hydrogen 2.912 N/A LEU 506.A N ASP 502.A O no hydrogen 2.859 N/A LYS 507.A N LEU 503.A O no hydrogen 2.976 N/A LYS 507.A NZ THR 173.A OG1 no hydrogen 2.995 N/A LEU 508.A N ARG 504.A O no hydrogen 3.045 N/A LEU 509.A N ALA 505.A O no hydrogen 2.989 N/A GLU 510.A N LEU 506.A O no hydrogen 2.893 N/A ALA 511.A N LYS 507.A O no hydrogen 2.895 N/A LEU 512.A N LEU 509.A O no hydrogen 3.102 N/A ALA 513.A N LEU 509.A O no hydrogen 2.751 N/A GLY 514.A N GLU 510.A O no hydrogen 2.838 N/A ARG 515.A NH1 GLU 510.A OE1 no hydrogen 2.725 N/A ARG 515.A NH2 TYR 436.A O no hydrogen 2.932 N/A THR 518.A N GLY 514.A O no hydrogen 3.206 N/A THR 518.A OG1 GLY 514.A O no hydrogen 2.899 N/A LEU 519.A N ARG 515.A O no hydrogen 2.915 N/A ALA 520.A N GLU 516.A O no hydrogen 3.085 N/A LEU 521.A N LYS 517.A O no hydrogen 2.964 N/A LEU 522.A N THR 518.A O no hydrogen 3.044 N/A GLU 523.A N LEU 519.A O no hydrogen 3.071 N/A GLN 524.A N LEU 521.A O no hydrogen 3.326 N/A LEU 526.A N GLU 523.A O no hydrogen 3.108 N/A LEU 530.A N GLU 523.A OE2 no hydrogen 3.153 N/A THR 531.A N SER 534.A O no hydrogen 3.088 N/A LYS 533.A N THR 531.A OG1 no hydrogen 3.133 N/A LYS 533.A NZ ASP 391.A O no hydrogen 3.156 N/A SER 534.A N THR 531.A OG1 no hydrogen 2.925 N/A TRP 541.A N ASP 538.A OD1 no hydrogen 2.806 N/A LEU 542.A N ASP 538.A O no hydrogen 3.167 N/A LEU 543.A N ILE 539.A O no hydrogen 3.010 N/A SER 544.A N GLU 540.A O no hydrogen 2.932 N/A SER 544.A OG GLU 540.A O no hydrogen 2.823 N/A SER 544.A OG TRP 541.A O no hydrogen 3.275 N/A THR 545.A N TRP 541.A O no hydrogen 2.873 N/A THR 545.A OG1 TRP 541.A O no hydrogen 2.751 N/A ARG 546.A N LEU 542.A O no hydrogen 3.016 N/A ARG 546.A NE ASN 550.A OD1 no hydrogen 2.990 N/A ARG 546.A NH1 GLU 36.A OE2 no hydrogen 3.236 N/A ARG 546.A NH1 ASP 502.A OD1 no hydrogen 2.786 N/A ARG 546.A NH2 GLU 36.A OE1 no hydrogen 2.841 N/A ARG 546.A NH2 GLU 36.A OE2 no hydrogen 3.290 N/A ARG 546.A NH2 ASN 550.A OD1 no hydrogen 3.167 N/A GLU 547.A N LEU 543.A O no hydrogen 2.935 N/A LYS 548.A N SER 544.A O no hydrogen 2.948 N/A LYS 548.A NZ GLN 524.A OE1 no hydrogen 2.746 N/A ILE 549.A N THR 545.A O no hydrogen 3.076 N/A ASN 550.A N ARG 546.A O no hydrogen 2.925 N/A ASN 550.A ND2 SER 31.A OG no hydrogen 3.075 N/A ARG 551.A N GLU 547.A O no hydrogen 2.992 N/A ALA 552.A N LYS 548.A O no hydrogen 2.954 N/A ILE 553.A N ILE 549.A O no hydrogen 2.924 N/A LYS 554.A N ASN 550.A O no hydrogen 2.955 N/A LYS 554.A NZ GLU 163.A OE2 no hydrogen 3.107 N/A ASP 555.A N ARG 551.A O no hydrogen 2.915 N/A ALA 556.A N ILE 553.A O no hydrogen 3.293 N/A