Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5d4d_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N ARG 890.A O no hydrogen 3.217 N/A PHE 6.A N ILE 892.A O no hydrogen 2.930 N/A ARG 8.A N ASP 897.A OD1 no hydrogen 3.301 N/A ILE 9.A N ASP 897.A OD2 no hydrogen 2.946 N/A LEU 18.A N ASP 580.A OD2 no hydrogen 2.839 N/A GLU 20.A N PRO 17.A O no hydrogen 3.127 N/A GLN 22.A N THR 19.A O no hydrogen 2.874 N/A GLN 22.A NE2 ILE 130.A O no hydrogen 2.831 N/A GLN 22.A NE2 LYS 397.A O no hydrogen 2.937 N/A VAL 23.A N THR 19.A O no hydrogen 3.077 N/A GLU 24.A N GLU 20.A O no hydrogen 2.939 N/A SER 25.A OG THR 329.A OG1 no hydrogen 2.785 N/A TYR 26.A N GLN 22.A O no hydrogen 2.960 N/A TYR 26.A OH PRO 113.A O no hydrogen 2.446 N/A ARG 27.A N VAL 23.A O no hydrogen 2.966 N/A ARG 28.A N GLU 24.A O no hydrogen 2.920 N/A ALA 29.A N SER 25.A O no hydrogen 2.964 N/A LEU 30.A N TYR 26.A O no hydrogen 2.935 N/A GLN 31.A N ARG 27.A O no hydrogen 3.030 N/A GLN 31.A NE2 GLU 40.A O no hydrogen 3.438 N/A LYS 38.A N PRO 35.A O no hydrogen 2.614 N/A ARG 39.A NE GLN 31.A O no hydrogen 2.874 N/A ARG 39.A NH1 TYR 65.A O no hydrogen 2.913 N/A ARG 39.A NH2 GLN 31.A O no hydrogen 3.208 N/A GLU 40.A N GLN 31.A OE1 no hydrogen 2.996 N/A ILE 44.A N ALA 29.A O no hydrogen 3.185 N/A ALA 46.A N VAL 42.A O no hydrogen 3.148 N/A ALA 47.A N GLY 43.A O no hydrogen 3.025 N/A PHE 48.A N ILE 44.A O no hydrogen 2.952 N/A ARG 49.A N GLN 45.A O no hydrogen 2.911 N/A GLU 50.A N ALA 46.A O no hydrogen 2.902 N/A THR 51.A N ALA 47.A O no hydrogen 2.952 N/A THR 51.A OG1 ALA 47.A O no hydrogen 3.146 N/A PHE 52.A N PHE 48.A O no hydrogen 2.847 N/A ILE 54.A N LEU 60.A O no hydrogen 2.844 N/A VAL 59.A N ILE 95.A O no hydrogen 2.801 N/A LEU 60.A N ILE 54.A O no hydrogen 3.003 N/A ASP 61.A N GLN 93.A O no hydrogen 2.957 N/A LEU 63.A N ARG 91.A O no hydrogen 2.831 N/A TYR 65.A OH LEU 30.A O no hydrogen 2.475 N/A ARG 66.A N TYR 89.A O no hydrogen 2.909 N/A ARG 66.A NE GLU 106.A OE2 no hydrogen 2.692 N/A ARG 66.A NH2 GLU 106.A OE1 no hydrogen 3.085 N/A ARG 66.A NH2 GLU 106.A OE2 no hydrogen 3.373 N/A GLY 68.A N PRO 87.A O no hydrogen 2.843 N/A CYS 77.A N PRO 73.A O no hydrogen 2.991 N/A CYS 77.A SG PHE 72.A O no hydrogen 3.780 N/A CYS 77.A SG PRO 73.A O no hydrogen 3.378 N/A ARG 78.A N GLN 74.A O no hydrogen 2.925 N/A ARG 78.A NE ASP 127.A OD1 no hydrogen 2.840 N/A ARG 78.A NH2 ASP 127.A OD2 no hydrogen 3.129 N/A GLU 79.A N ASP 75.A O no hydrogen 2.926 N/A LYS 80.A N GLU 76.A O no hydrogen 3.030 N/A LYS 80.A NZ GLU 76.A OE2 no hydrogen 3.559 N/A LEU 82.A N CYS 77.A O no hydrogen 2.791 N/A TYR 84.A N ILE 122.A O no hydrogen 2.944 N/A ALA 86.A N ILE 112.A O no hydrogen 2.883 N/A LEU 88.A N GLY 110.A O no hydrogen 2.730 N/A TYR 89.A N ARG 66.A O no hydrogen 2.908 N/A ALA 90.A N VAL 107.A O no hydrogen 2.912 N/A ARG 91.A N GLU 64.A O no hydrogen 2.882 N/A LEU 92.A N ASP 105.A O no hydrogen 2.902 N/A GLN 93.A N ASP 61.A O no hydrogen 3.017 N/A GLN 93.A NE2 GLU 104.A OE2 no hydrogen 3.506 N/A LEU 94.A N LYS 103.A O no hydrogen 2.862 N/A ILE 95.A N VAL 59.A O no hydrogen 2.555 N/A HIS 96.A N LEU 101.A O no hydrogen 2.914 N/A GLY 100.A N HIS 96.A O no hydrogen 2.763 N/A LEU 101.A N HIS 96.A O no hydrogen 2.975 N/A LYS 103.A N LEU 94.A O no hydrogen 2.922 N/A ASP 105.A N LEU 92.A O no hydrogen 2.898 N/A VAL 107.A N ALA 90.A O no hydrogen 2.894 N/A LEU 109.A N LEU 88.A O no hydrogen 2.900 N/A ILE 112.A N ALA 86.A O no hydrogen 2.881 N/A LEU 114.A N TYR 84.A O no hydrogen 2.911 N/A THR 116.A N SER 120.A O no hydrogen 2.662 N/A THR 116.A OG1 ASP 118.A OD1 no hydrogen 2.958 N/A THR 116.A OG1 SER 120.A O no hydrogen 2.994 N/A THR 116.A OG1 SER 120.A OG no hydrogen 3.243 N/A GLY 119.A N THR 116.A O no hydrogen 3.404 N/A SER 120.A OG THR 116.A OG1 no hydrogen 3.243 N/A SER 120.A OG ASP 118.A OD2 no hydrogen 2.872 N/A PHE 121.A N ARG 128.A O no hydrogen 2.921 N/A ILE 123.A N ALA 126.A O no hydrogen 2.861 N/A ASN 124.A N THR 83.A OG1 no hydrogen 2.931 N/A ALA 126.A N ILE 123.A O no hydrogen 3.397 N/A ARG 128.A N PHE 121.A O no hydrogen 2.883 N/A ARG 128.A NH1 SER 382.A O no hydrogen 2.434 N/A ARG 128.A NH1 SER 382.A OG no hydrogen 3.054 N/A VAL 129.A N GLN 383.A O no hydrogen 2.879 N/A VAL 131.A N LEU 381.A O no hydrogen 2.954 N/A GLN 133.A N ARG 328.A O no hydrogen 2.929 N/A GLN 133.A NE2 LEU 403.A O no hydrogen 2.886 N/A GLN 133.A NE2 PRO 405.A O no hydrogen 3.208 N/A ILE 134.A N SER 401.A O no hydrogen 2.959 N/A HIS 135.A N ARG 326.A O no hydrogen 2.955 N/A SER 137.A N ASN 324.A O no hydrogen 2.782 N/A SER 137.A OG PRO 138.A O no hydrogen 2.686 N/A GLY 139.A N ILE 157.A O no hydrogen 2.817 N/A TYR 141.A N SER 155.A O no hydrogen 2.885 N/A TYR 141.A OH SER 137.A O no hydrogen 2.534 N/A PHE 142.A N ASP 317.A OD2 no hydrogen 3.268 N/A THR 143.A N ILE 153.A O no hydrogen 2.949 N/A ASP 145.A N ARG 151.A O no hydrogen 3.009 N/A ALA 147.A N ASP 145.A OD1 no hydrogen 2.997 N/A ARG 148.A NH2 VAL 170.A O no hydrogen 3.540 N/A ARG 151.A N ARG 148.A O no hydrogen 2.909 N/A ILE 153.A N THR 143.A O no hydrogen 2.872 N/A ALA 154.A N LEU 168.A O no hydrogen 2.907 N/A SER 155.A N TYR 141.A O no hydrogen 2.847 N/A SER 155.A OG ASP 167.A OD1 no hydrogen 3.072 N/A ILE 156.A N ILE 166.A O no hydrogen 2.919 N/A ILE 157.A N GLY 139.A O no hydrogen 2.897 N/A LEU 159.A N ASP 262.A O no hydrogen 3.032 N/A ARG 162.A N LEU 159.A O no hydrogen 2.975 N/A ARG 162.A NH1 GLU 50.A OE2 no hydrogen 3.286 N/A ILE 166.A N ILE 156.A O no hydrogen 3.185 N/A ASP 167.A N LYS 179.A O no hydrogen 3.011 N/A LEU 168.A N ALA 154.A O no hydrogen 2.855 N/A GLU 169.A N SER 177.A O no hydrogen 2.952 N/A GLU 171.A N VAL 175.A O no hydrogen 3.087 N/A GLY 174.A N GLU 171.A O no hydrogen 2.853 N/A VAL 175.A N ASN 173.A OD1 no hydrogen 2.917 N/A SER 177.A N GLU 169.A O no hydrogen 2.884 N/A SER 177.A OG GLU 171.A OE2 no hydrogen 2.532 N/A MET 178.A N PHE 185.A O no hydrogen 2.858 N/A LYS 179.A N ASP 167.A O no hydrogen 2.865 N/A VAL 180.A N ARG 183.A O no hydrogen 3.184 N/A ARG 183.A N VAL 180.A O no hydrogen 2.963 N/A PHE 185.A N MET 178.A O no hydrogen 2.949 N/A LEU 187.A N VAL 176.A O no hydrogen 3.019 N/A LEU 189.A N PRO 186.A O no hydrogen 3.223 N/A LEU 191.A N LEU 187.A O no hydrogen 2.936 N/A ARG 192.A N VAL 188.A O no hydrogen 2.880 N/A ARG 192.A NE MET 223.A O no hydrogen 2.998 N/A ARG 192.A NH2 TYR 196.A O no hydrogen 2.712 N/A VAL 193.A N LEU 189.A O no hydrogen 2.954 N/A LEU 194.A N LEU 190.A O no hydrogen 2.927 N/A GLY 195.A N ARG 192.A O no hydrogen 3.013 N/A TYR 196.A N LEU 191.A O no hydrogen 3.207 N/A TYR 196.A OH ASP 294.A OD1 no hydrogen 3.232 N/A LEU 201.A N ASP 197.A O no hydrogen 3.221 N/A ALA 202.A N GLN 198.A O no hydrogen 2.928 N/A ARG 203.A N GLU 199.A O no hydrogen 2.886 N/A ARG 203.A NH2 GLU 204.A OE2 no hydrogen 3.562 N/A GLU 204.A N THR 200.A O no hydrogen 2.943 N/A LEU 205.A N LEU 201.A O no hydrogen 2.890 N/A TYR 208.A N LEU 205.A O no hydrogen 3.458 N/A LEU 215.A N LEU 211.A O no hydrogen 3.005 N/A MET 216.A N GLN 213.A O no hydrogen 3.230 N/A SER 219.A OG ASP 217.A OD1 no hydrogen 2.678 N/A VAL 220.A N ASP 217.A OD1 no hydrogen 2.973 N/A PHE 221.A N ASP 217.A O no hydrogen 3.511 N/A ALA 222.A N GLU 218.A O no hydrogen 2.919 N/A MET 223.A N SER 219.A O no hydrogen 3.361 N/A ARG 224.A NH1 GLU 227.A OE2 no hydrogen 3.264 N/A GLU 226.A N GLU 226.A OE1 no hydrogen 2.740 N/A ALA 228.A N ARG 224.A O no hydrogen 2.950 N/A LEU 229.A N PRO 225.A O no hydrogen 2.899 N/A ILE 230.A N GLU 226.A O no hydrogen 2.958 N/A ARG 231.A N GLU 227.A O no hydrogen 2.909 N/A LEU 232.A N ALA 228.A O no hydrogen 2.905 N/A PHE 233.A N LEU 229.A O no hydrogen 2.927 N/A THR 234.A N ILE 230.A O no hydrogen 2.937 N/A THR 234.A OG1 ILE 230.A O no hydrogen 3.345 N/A THR 234.A OG1 ARG 231.A O no hydrogen 2.520 N/A LEU 235.A N ARG 231.A O no hydrogen 2.952 N/A LEU 236.A N LEU 232.A O no hydrogen 2.904 N/A ARG 237.A N PHE 233.A O no hydrogen 2.916 N/A ARG 237.A NH1 ASP 240.A OD2 no hydrogen 2.791 N/A LYS 243.A N PRO 241.A O no hydrogen 2.721 N/A ASP 245.A N ASP 245.A OD1 no hydrogen 2.562 N/A ALA 247.A N LYS 243.A O no hydrogen 3.191 N/A VAL 248.A N ARG 244.A O no hydrogen 2.894 N/A ALA 249.A N ASP 245.A O no hydrogen 2.935 N/A TYR 250.A N LYS 246.A O no hydrogen 2.952 N/A VAL 251.A N ALA 247.A O no hydrogen 2.925 N/A TYR 252.A N VAL 248.A O no hydrogen 2.915 N/A GLY 253.A N ALA 249.A O no hydrogen 2.931 N/A LEU 254.A N TYR 250.A O no hydrogen 2.876 N/A ILE 255.A N VAL 251.A O no hydrogen 2.897 N/A ALA 256.A N TYR 252.A O no hydrogen 2.793 N/A ASP 257.A N TYR 252.A O no hydrogen 2.575 N/A ARG 259.A N ASP 257.A OD1 no hydrogen 3.428 N/A ARG 260.A N ASP 257.A O no hydrogen 3.112 N/A TYR 261.A N ASP 257.A O no hydrogen 2.798 N/A ASP 262.A N ARG 162.A O no hydrogen 3.006 N/A LEU 263.A N ARG 282.A O no hydrogen 3.129 N/A ARG 268.A N GLY 264.A O no hydrogen 2.964 N/A ARG 268.A NH1 SER 280.A O no hydrogen 3.136 N/A TYR 269.A N GLU 265.A O no hydrogen 2.931 N/A LYS 270.A N ALA 266.A O no hydrogen 2.916 N/A LYS 270.A NZ TYR 141.A OH no hydrogen 3.541 N/A LYS 270.A NZ ASN 324.A OD1 no hydrogen 3.036 N/A ALA 271.A N GLY 267.A O no hydrogen 2.876 N/A GLU 272.A N ARG 268.A O no hydrogen 2.937 N/A GLU 273.A N TYR 269.A O no hydrogen 2.883 N/A LYS 274.A N LYS 270.A O no hydrogen 2.927 N/A LYS 274.A NZ TYR 303.A OH no hydrogen 3.202 N/A LYS 274.A NZ GLU 315.A O no hydrogen 3.031 N/A LYS 274.A NZ ASP 317.A OD1 no hydrogen 3.137 N/A LYS 274.A NZ ASP 317.A OD2 no hydrogen 2.961 N/A LEU 275.A N ALA 271.A O no hydrogen 2.932 N/A ILE 277.A N GLU 272.A O no hydrogen 3.123 N/A LEU 279.A N GLU 272.A OE2 no hydrogen 2.783 N/A SER 280.A N GLU 295.A OE1 no hydrogen 3.129 N/A SER 280.A OG GLU 295.A OE1 no hydrogen 3.158 N/A SER 280.A OG GLU 295.A OE2 no hydrogen 3.002 N/A ARG 282.A NE ASP 262.A OD1 no hydrogen 2.748 N/A ARG 282.A NH1 GLU 265.A OE1 no hydrogen 2.847 N/A ARG 282.A NH2 ASP 262.A OD2 no hydrogen 3.364 N/A THR 283.A OG1 ALA 256.A O no hydrogen 3.441 N/A THR 283.A OG1 ALA 285.A O no hydrogen 2.934 N/A ALA 285.A N ILE 255.A O no hydrogen 3.240 N/A ARG 286.A N LYS 293.A O no hydrogen 2.910 N/A GLU 288.A N GLU 291.A O no hydrogen 2.919 N/A GLU 291.A N GLU 288.A O no hydrogen 3.259 N/A LYS 293.A N ARG 286.A O no hydrogen 2.907 N/A GLU 295.A N LEU 284.A O no hydrogen 3.178 N/A VAL 296.A N LEU 284.A O no hydrogen 3.013 N/A LEU 298.A N ASP 294.A OD1 no hydrogen 3.148 N/A THR 300.A N VAL 296.A O no hydrogen 3.084 N/A THR 300.A OG1 VAL 296.A O no hydrogen 2.877 N/A LEU 301.A N PHE 297.A O no hydrogen 2.886 N/A ARG 302.A N LEU 298.A O no hydrogen 2.881 N/A ARG 302.A NH1 HIS 314.A NE2 no hydrogen 2.840 N/A TYR 303.A N PRO 299.A O no hydrogen 2.937 N/A LEU 304.A N THR 300.A O no hydrogen 2.890 N/A PHE 305.A N LEU 301.A O no hydrogen 2.928 N/A ALA 306.A N ARG 302.A O no hydrogen 2.926 N/A LEU 307.A N TYR 303.A O no hydrogen 2.887 N/A THR 308.A N LEU 304.A O no hydrogen 2.938 N/A THR 308.A OG1 LEU 304.A O no hydrogen 2.758 N/A ALA 309.A N PHE 305.A O no hydrogen 2.895 N/A GLY 310.A N LEU 307.A O no hydrogen 3.087 N/A VAL 311.A N ALA 306.A O no hydrogen 2.912 N/A HIS 314.A ND1 VAL 311.A O no hydrogen 3.124 N/A GLU 315.A N TYR 303.A OH no hydrogen 3.046 N/A ASP 317.A N PHE 142.A O no hydrogen 2.970 N/A ASP 320.A N ASP 318.A OD1 no hydrogen 3.134 N/A HIS 321.A N ASP 318.A O no hydrogen 3.453 N/A HIS 321.A NE2 ASP 482.A OD1 no hydrogen 3.177 N/A LEU 322.A N THR 423.A OG1 no hydrogen 3.002 N/A GLY 323.A N HIS 321.A ND1 no hydrogen 3.171 N/A ASN 324.A N HIS 321.A O no hydrogen 2.792 N/A ASN 324.A ND2 ASP 318.A O no hydrogen 2.406 N/A ARG 326.A N HIS 135.A O no hydrogen 2.887 N/A ARG 326.A NE LEU 454.A O no hydrogen 2.987 N/A ARG 326.A NH1 HIS 135.A NE2 no hydrogen 3.254 N/A ARG 326.A NH1 GLU 332.A OE1 no hydrogen 3.451 N/A ARG 326.A NH1 GLU 332.A OE2 no hydrogen 2.810 N/A ARG 326.A NH2 GLU 332.A OE1 no hydrogen 2.936 N/A ARG 326.A NH2 LEU 454.A O no hydrogen 3.177 N/A ILE 327.A N GLY 455.A O no hydrogen 2.634 N/A ARG 328.A N GLN 133.A O no hydrogen 2.823 N/A ARG 328.A NE GLU 332.A OE2 no hydrogen 3.110 N/A ARG 328.A NH1 GLN 133.A OE1 no hydrogen 3.421 N/A ARG 328.A NH2 ASP 336.A OD2 no hydrogen 3.166 N/A THR 329.A OG1 SER 25.A OG no hydrogen 2.785 N/A GLY 331.A N SER 25.A OG no hydrogen 2.856 N/A LEU 333.A N THR 329.A O no hydrogen 3.143 N/A MET 334.A N VAL 330.A O no hydrogen 2.880 N/A THR 335.A N GLY 331.A O no hydrogen 2.901 N/A THR 335.A OG1 GLY 331.A O no hydrogen 2.541 N/A ASP 336.A N GLU 332.A O no hydrogen 2.927 N/A GLN 337.A N LEU 333.A O no hydrogen 3.016 N/A GLN 337.A NE2 GLU 374.A OE2 no hydrogen 2.773 N/A PHE 338.A N MET 334.A O no hydrogen 2.861 N/A ARG 339.A N THR 335.A O no hydrogen 2.865 N/A VAL 340.A N ASP 336.A O no hydrogen 3.001 N/A GLY 341.A N GLN 337.A O no hydrogen 2.944 N/A LEU 342.A N PHE 338.A O no hydrogen 2.913 N/A ALA 343.A N ARG 339.A O no hydrogen 2.959 N/A ARG 344.A N VAL 340.A O no hydrogen 2.988 N/A LEU 345.A N GLY 341.A O no hydrogen 2.944 N/A ALA 346.A N LEU 342.A O no hydrogen 2.872 N/A ARG 347.A N ALA 343.A O no hydrogen 2.944 N/A GLY 348.A N ARG 344.A O no hydrogen 2.982 N/A VAL 349.A N LEU 345.A O no hydrogen 2.901 N/A ARG 350.A N ALA 346.A O no hydrogen 2.944 N/A GLU 351.A N ARG 347.A O no hydrogen 2.937 N/A ARG 352.A N GLY 348.A O no hydrogen 2.937 N/A ARG 352.A NE GLY 348.A O no hydrogen 3.300 N/A MET 353.A N VAL 349.A O no hydrogen 2.921 N/A MET 353.A N ARG 350.A O no hydrogen 3.179 N/A LYS 361.A NZ SER 356.A O no hydrogen 3.372 N/A LEU 362.A N THR 358.A O no hydrogen 3.281 N/A VAL 363.A N PRO 359.A O no hydrogen 3.104 N/A SER 365.A OG GLU 369.A OE1 no hydrogen 3.241 N/A ARG 366.A N ASN 364.A OD1 no hydrogen 2.905 N/A ARG 366.A NH1 GLU 369.A OE1 no hydrogen 2.646 N/A GLU 369.A N SER 365.A O no hydrogen 2.909 N/A ALA 370.A N ARG 366.A O no hydrogen 2.873 N/A ALA 371.A N PRO 367.A O no hydrogen 2.928 N/A ILE 372.A N LEU 368.A O no hydrogen 2.995 N/A ARG 373.A N GLU 369.A O no hydrogen 2.882 N/A GLU 374.A N ALA 370.A O no hydrogen 2.861 N/A PHE 375.A N ALA 371.A O no hydrogen 2.985 N/A PHE 376.A N ILE 372.A O no hydrogen 2.971 N/A SER 377.A N ARG 373.A O no hydrogen 2.849 N/A ARG 378.A N GLU 374.A O no hydrogen 2.908 N/A SER 379.A N PHE 375.A O no hydrogen 3.358 N/A LEU 381.A N SER 379.A OG no hydrogen 3.262 N/A SER 382.A OG PHE 376.A O no hydrogen 2.575 N/A GLN 383.A N VAL 129.A O no hydrogen 2.930 N/A LYS 385.A N ASP 127.A O no hydrogen 2.921 N/A LYS 385.A NZ ASP 118.A OD2 no hydrogen 3.133 N/A LYS 385.A NZ SER 120.A OG no hydrogen 3.379 N/A LYS 385.A NZ ASP 127.A OD2 no hydrogen 3.495 N/A ASP 386.A N HIS 396.A ND1 no hydrogen 2.905 N/A THR 388.A N ASP 386.A OD1 no hydrogen 3.191 N/A THR 388.A OG1 ASP 386.A OD1 no hydrogen 2.814 N/A ASN 389.A N SER 392.A OG no hydrogen 2.703 N/A ASN 389.A ND2 GLN 555.A O no hydrogen 2.976 N/A ASN 389.A ND2 ALA 558.A O no hydrogen 3.048 N/A SER 392.A N ASN 389.A OD1 no hydrogen 2.788 N/A SER 392.A OG ASN 389.A O no hydrogen 2.397 N/A SER 393.A OG ASP 386.A O no hydrogen 3.078 N/A LEU 394.A N PRO 390.A O no hydrogen 3.022 N/A ARG 395.A N LEU 391.A O no hydrogen 2.849 N/A HIS 396.A N SER 392.A O no hydrogen 2.922 N/A HIS 396.A NE2 GLN 383.A OE1 no hydrogen 2.800 N/A LYS 397.A N SER 393.A O no hydrogen 3.007 N/A LYS 397.A NZ ASP 118.A O no hydrogen 3.080 N/A LYS 397.A NZ ASP 118.A OD2 no hydrogen 2.815 N/A ARG 398.A N ARG 395.A O no hydrogen 3.145 N/A ARG 398.A NH1 LEU 445.A O no hydrogen 3.291 N/A ARG 398.A NH2 LEU 18.A O no hydrogen 2.668 N/A ARG 399.A N HIS 396.A O no hydrogen 3.180 N/A ILE 400.A N THR 443.A O no hydrogen 2.888 N/A SER 401.A N SER 132.A O no hydrogen 2.884 N/A ALA 402.A N LEU 441.A O no hydrogen 2.788 N/A LEU 403.A N SER 401.A OG no hydrogen 3.137 N/A LEU 408.A N ALA 402.A O no hydrogen 3.211 N/A ARG 412.A N THR 409.A O no hydrogen 3.115 N/A ARG 418.A NE ILE 439.A O no hydrogen 2.965 N/A ARG 418.A NH1 ALA 413.A O no hydrogen 2.759 N/A HIS 421.A ND1 THR 423.A OG1 no hydrogen 2.755 N/A HIS 421.A NE2 ASP 318.A OD2 no hydrogen 2.781 N/A ARG 422.A NH1 ASP 482.A OD2 no hydrogen 2.901 N/A ARG 422.A NH2 ASP 482.A OD1 no hydrogen 2.964 N/A ARG 422.A NH2 ASP 482.A OD2 no hydrogen 3.398 N/A THR 423.A N HIS 421.A ND1 no hydrogen 3.271 N/A THR 423.A OG1 HIS 421.A ND1 no hydrogen 2.755 N/A HIS 424.A N HIS 421.A O no hydrogen 2.937 N/A TYR 425.A N ARG 422.A O no hydrogen 3.482 N/A TYR 425.A OH GLN 488.A OE1 no hydrogen 3.425 N/A TYR 425.A OH ASP 523.A OD2 no hydrogen 2.420 N/A ARG 427.A N HIS 424.A O no hydrogen 2.788 N/A ARG 427.A NE ILE 457.A O no hydrogen 2.914 N/A ARG 427.A NH1 THR 423.A O no hydrogen 3.479 N/A ARG 427.A NH1 GLU 481.A OE2 no hydrogen 2.740 N/A ARG 427.A NH2 MET 476.A O no hydrogen 3.116 N/A ARG 427.A NH2 GLU 481.A OE2 no hydrogen 2.726 N/A ILE 428.A N HIS 424.A O no hydrogen 2.934 N/A CYS 429.A N SER 444.A O no hydrogen 2.889 N/A CYS 429.A SG SER 531.A OG no hydrogen 3.515 N/A CYS 429.A SG THR 534.A OG1 no hydrogen 3.451 N/A THR 433.A OG1 ILE 442.A O no hydrogen 3.106 N/A ILE 439.A N GLY 436.A O no hydrogen 2.811 N/A GLY 440.A N THR 433.A OG1 no hydrogen 2.814 N/A LEU 441.A N ASN 438.A O no hydrogen 2.943 N/A ILE 442.A N ASN 438.A O no hydrogen 3.447 N/A THR 443.A N ILE 400.A O no hydrogen 2.880 N/A THR 443.A OG1 ILE 400.A O no hydrogen 3.321 N/A SER 444.A OG ARG 398.A O no hydrogen 3.523 N/A SER 444.A OG GLU 432.A OE2 no hydrogen 3.091 N/A LEU 445.A N ARG 398.A O no hydrogen 3.116 N/A ALA 446.A N ARG 427.A O no hydrogen 2.863 N/A ALA 447.A N PHE 530.A O no hydrogen 2.889 N/A TYR 448.A OH ILE 13.A O no hydrogen 2.968 N/A ALA 449.A N ALA 446.A O no hydrogen 3.151 N/A ARG 450.A N ARG 458.A O no hydrogen 2.770 N/A ASP 452.A N PHE 456.A O no hydrogen 2.829 N/A LEU 454.A N ASP 452.A OD1 no hydrogen 2.789 N/A GLY 455.A N ASP 452.A O no hydrogen 2.991 N/A PHE 456.A N ASP 452.A OD1 no hydrogen 3.079 N/A ARG 458.A N ARG 450.A O no hydrogen 2.524 N/A ARG 458.A NE TYR 475.A O no hydrogen 2.915 N/A ARG 458.A NH1 ASP 452.A OD2 no hydrogen 2.878 N/A ARG 458.A NH2 TYR 475.A O no hydrogen 3.285 N/A THR 459.A N MET 476.A O no hydrogen 3.126 N/A TYR 461.A N VAL 474.A O no hydrogen 2.868 N/A TYR 461.A OH GLU 481.A OE2 no hydrogen 2.995 N/A ARG 462.A N MET 522.A O no hydrogen 2.860 N/A ARG 462.A NH1 THR 470.A O no hydrogen 3.342 N/A ARG 463.A N GLU 472.A O no hydrogen 2.938 N/A ARG 463.A NE GLU 472.A OE1 no hydrogen 3.143 N/A ARG 463.A NE GLU 472.A OE2 no hydrogen 2.950 N/A ARG 463.A NH2 GLU 472.A OE1 no hydrogen 2.571 N/A VAL 464.A N GLU 520.A O no hydrogen 2.759 N/A VAL 465.A N VAL 468.A O no hydrogen 2.888 N/A VAL 468.A N VAL 465.A O no hydrogen 3.070 N/A VAL 469.A N ASN 496.A O no hydrogen 2.579 N/A THR 470.A N ARG 463.A O no hydrogen 2.946 N/A THR 470.A OG1 ARG 463.A O no hydrogen 2.805 N/A GLU 472.A N THR 470.A OG1 no hydrogen 3.216 N/A VAL 474.A N TYR 461.A O no hydrogen 2.888 N/A TYR 475.A OH TYR 448.A O no hydrogen 3.412 N/A MET 476.A N THR 459.A O no hydrogen 2.981 N/A GLU 480.A N THR 477.A OG1 no hydrogen 3.401 N/A GLU 481.A N THR 477.A O no hydrogen 2.875 N/A ASP 482.A N ALA 478.A O no hydrogen 2.972 N/A ASP 482.A N THR 479.A O no hydrogen 3.238 N/A ARG 483.A N GLU 480.A O no hydrogen 3.112 N/A TYR 484.A N GLU 481.A O no hydrogen 3.348 N/A TYR 484.A OH GLU 480.A OE1 no hydrogen 3.400 N/A THR 485.A N GLU 520.A OE1 no hydrogen 3.174 N/A ILE 486.A N ARG 506.A O no hydrogen 2.958 N/A ALA 487.A N PHE 521.A O no hydrogen 2.769 N/A GLN 488.A N VAL 504.A O no hydrogen 2.971 N/A GLN 488.A NE2 TYR 425.A OH no hydrogen 3.422 N/A THR 491.A N GLN 488.A O no hydrogen 3.230 N/A THR 491.A OG1 GLN 488.A O no hydrogen 2.527 N/A GLU 494.A N ARG 497.A O no hydrogen 2.981 N/A ARG 497.A N GLU 494.A O no hydrogen 3.150 N/A ILE 498.A N GLY 467.A O no hydrogen 2.853 N/A ALA 499.A N PRO 492.A O no hydrogen 2.769 N/A VAL 503.A N VAL 514.A O no hydrogen 2.924 N/A ALA 505.A N VAL 512.A O no hydrogen 2.886 N/A ARG 506.A N ILE 486.A O no hydrogen 2.872 N/A ARG 506.A NH1 GLU 481.A OE1 no hydrogen 2.785 N/A ARG 506.A NH2 TYR 461.A OH no hydrogen 2.895 N/A ARG 506.A NH2 ASP 523.A OD1 no hydrogen 3.400 N/A ARG 507.A N GLU 510.A O no hydrogen 2.985 N/A ARG 507.A NE THR 485.A OG1 no hydrogen 2.790 N/A ARG 507.A NH2 GLU 518.A OE2 no hydrogen 2.883 N/A LYS 508.A NZ ASP 482.A O no hydrogen 3.148 N/A GLU 510.A N ARG 507.A O no hydrogen 3.004 N/A VAL 512.A N ALA 505.A O no hydrogen 2.899 N/A VAL 514.A N VAL 503.A O no hydrogen 2.926 N/A SER 515.A N GLU 518.A OE1 no hydrogen 3.190 N/A SER 515.A OG GLU 501.A OE2 no hydrogen 3.092 N/A SER 515.A OG GLU 517.A OE1 no hydrogen 3.149 N/A GLU 518.A N SER 515.A O no hydrogen 2.634 N/A GLU 520.A N THR 485.A O no hydrogen 3.187 N/A PHE 521.A N THR 485.A O no hydrogen 3.271 N/A MET 522.A N ARG 462.A O no hydrogen 2.917 N/A ASP 523.A N ALA 487.A O no hydrogen 2.959 N/A VAL 524.A N GLN 528.A OE1 no hydrogen 2.830 N/A SER 525.A N GLN 528.A OE1 no hydrogen 3.401 N/A SER 525.A OG GLU 11.A OE2 no hydrogen 2.892 N/A LYS 527.A N SER 525.A OG no hydrogen 3.188 N/A GLN 528.A NE2 PRO 460.A O no hydrogen 3.454 N/A VAL 529.A N PRO 526.A O no hydrogen 2.977 N/A PHE 530.A N LYS 527.A O no hydrogen 3.306 N/A SER 531.A OG GLU 432.A OE1 no hydrogen 3.218 N/A SER 531.A OG THR 534.A OG1 no hydrogen 2.673 N/A ASN 533.A ND2 SER 552.A O no hydrogen 3.531 N/A THR 534.A N SER 531.A OG no hydrogen 3.149 N/A THR 534.A OG1 SER 531.A OG no hydrogen 2.673 N/A THR 534.A OG1 SER 552.A OG no hydrogen 3.132 N/A ASN 535.A N SER 531.A O no hydrogen 3.165 N/A ASN 535.A ND2 LYS 527.A O no hydrogen 2.896 N/A ASN 535.A ND2 SER 531.A O no hydrogen 2.651 N/A LEU 536.A N ASN 533.A O no hydrogen 2.909 N/A ILE 537.A N THR 534.A O no hydrogen 3.399 N/A GLU 541.A N GLU 541.A OE2 no hydrogen 2.580 N/A HIS 542.A N PHE 539.A O no hydrogen 2.706 N/A ASP 543.A N LEU 540.A O no hydrogen 3.010 N/A ASP 544.A N MET 870.A O no hydrogen 2.985 N/A ASN 546.A N ASP 544.A OD2 no hydrogen 3.119 N/A ASN 546.A ND2 ASP 544.A OD2 no hydrogen 2.759 N/A ARG 547.A N ASP 544.A O no hydrogen 3.183 N/A ARG 547.A NH1 GLY 834.A O no hydrogen 2.963 N/A ALA 548.A N ASP 544.A O no hydrogen 3.052 N/A LEU 549.A N ALA 545.A O no hydrogen 2.893 N/A GLY 551.A N ARG 547.A O no hydrogen 2.935 N/A SER 552.A N ALA 548.A O no hydrogen 2.896 N/A SER 552.A OG THR 534.A OG1 no hydrogen 3.132 N/A ASN 553.A N LEU 549.A O no hydrogen 2.923 N/A ASN 553.A ND2 THR 433.A O no hydrogen 2.874 N/A MET 554.A N MET 550.A O no hydrogen 2.869 N/A GLN 555.A N GLY 551.A O no hydrogen 3.004 N/A GLN 555.A NE2 ASN 533.A O no hydrogen 3.116 N/A THR 556.A N ASN 553.A O no hydrogen 3.078 N/A THR 556.A OG1 ASN 553.A O no hydrogen 3.063 N/A GLN 557.A N MET 554.A O no hydrogen 2.875 N/A ALA 558.A N GLN 555.A O no hydrogen 3.305 N/A VAL 559.A N LYS 986.A O no hydrogen 2.919 N/A ILE 562.A N THR 691.A O no hydrogen 3.049 N/A ARG 563.A NH1 ARG 687.A O no hydrogen 2.842 N/A ALA 564.A N LEU 561.A O no hydrogen 3.402 N/A GLN 565.A N GLY 659.A O no hydrogen 2.896 N/A ALA 566.A N GLU 652.A OE1 no hydrogen 2.716 N/A VAL 568.A N ASN 661.A OD1 no hydrogen 3.115 N/A MET 570.A N TYR 891.A O no hydrogen 2.761 N/A THR 571.A N GLU 574.A OE1 no hydrogen 2.837 N/A THR 571.A OG1 ASN 535.A O no hydrogen 2.645 N/A THR 571.A OG1 GLU 574.A OE1 no hydrogen 3.273 N/A GLY 572.A N GLU 574.A OE2 no hydrogen 2.747 N/A GLU 574.A N GLU 574.A OE2 no hydrogen 2.628 N/A ARG 576.A NE ASP 580.A OD1 no hydrogen 3.034 N/A ARG 576.A NH1 LEU 15.A O no hydrogen 2.578 N/A ARG 576.A NH2 LEU 15.A O no hydrogen 2.762 N/A ARG 576.A NH2 PRO 16.A O no hydrogen 3.007 N/A ARG 576.A NH2 ASP 580.A OD1 no hydrogen 3.567 N/A ARG 576.A NH2 ASP 580.A OD2 no hydrogen 2.918 N/A VAL 577.A N LEU 573.A O no hydrogen 3.160 N/A ARG 579.A N GLU 575.A O no hydrogen 2.955 N/A ARG 579.A NH2 GLY 642.A O no hydrogen 2.582 N/A ASP 580.A N ARG 576.A O no hydrogen 2.885 N/A SER 581.A N VAL 577.A O no hydrogen 2.887 N/A SER 581.A OG VAL 577.A O no hydrogen 3.203 N/A SER 581.A OG VAL 578.A O no hydrogen 3.263 N/A LEU 582.A N ARG 579.A O no hydrogen 3.245 N/A ALA 583.A N VAL 578.A O no hydrogen 3.439 N/A ALA 583.A N SER 581.A OG no hydrogen 3.256 N/A LEU 585.A N ALA 646.A O no hydrogen 2.768 N/A ALA 587.A N ASP 643.A O no hydrogen 2.799 N/A GLU 588.A N TYR 605.A OH no hydrogen 3.037 N/A GLY 591.A N VAL 639.A O no hydrogen 2.813 N/A GLU 592.A N ARG 604.A O no hydrogen 2.837 N/A VAL 593.A N GLN 637.A O no hydrogen 2.782 N/A ALA 594.A N VAL 602.A O no hydrogen 2.780 N/A LYS 595.A N VAL 602.A O no hydrogen 2.907 N/A ASP 597.A N ARG 600.A O no hydrogen 2.697 N/A ARG 600.A NE ARG 600.A O no hydrogen 3.362 N/A ILE 601.A N TYR 613.A O no hydrogen 2.921 N/A VAL 602.A N LYS 595.A O no hydrogen 2.892 N/A VAL 603.A N VAL 611.A O no hydrogen 2.896 N/A ARG 604.A N GLU 592.A O no hydrogen 2.940 N/A TYR 605.A N ARG 609.A O no hydrogen 3.354 N/A TYR 605.A OH TYR 613.A OH no hydrogen 2.502 N/A GLU 606.A N ASP 590.A O no hydrogen 3.309 N/A GLY 608.A N TYR 605.A O no hydrogen 3.109 N/A ARG 609.A NH1 GLU 588.A OE2 no hydrogen 3.462 N/A VAL 611.A N VAL 603.A O no hydrogen 2.905 N/A TYR 613.A N ILE 601.A O no hydrogen 2.861 N/A TYR 613.A OH TYR 605.A OH no hydrogen 2.502 N/A LEU 615.A N ASN 599.A O no hydrogen 2.769 N/A ARG 616.A N GLN 629.A OE1 no hydrogen 2.654 N/A ARG 616.A NH2 ASP 75.A OD1 no hydrogen 3.284 N/A ARG 617.A NE GLY 598.A O no hydrogen 3.296 N/A ARG 617.A NH1 ASP 628.A OD2 no hydrogen 2.635 N/A TYR 619.A N LEU 627.A O no hydrogen 3.047 N/A ARG 620.A NE ILE 695.A O no hydrogen 2.766 N/A ARG 620.A NH1 GLU 696.A OE2 no hydrogen 3.212 N/A SER 621.A N THR 625.A O no hydrogen 3.061 N/A SER 621.A OG THR 625.A O no hydrogen 3.028 N/A SER 621.A OG THR 625.A OG1 no hydrogen 2.723 N/A ASN 622.A N GLU 387.A OE2 no hydrogen 2.805 N/A ASN 622.A ND2 ASP 127.A O no hydrogen 3.196 N/A ASN 622.A ND2 LYS 385.A O no hydrogen 2.747 N/A GLN 623.A N SER 621.A OG no hydrogen 3.320 N/A GLY 624.A N SER 621.A O no hydrogen 2.918 N/A THR 625.A N SER 621.A OG no hydrogen 3.183 N/A THR 625.A OG1 THR 388.A O no hydrogen 2.608 N/A THR 625.A OG1 SER 621.A OG no hydrogen 2.723 N/A ALA 626.A N ILE 693.A O no hydrogen 3.227 N/A LEU 627.A N TYR 619.A O no hydrogen 2.695 N/A GLN 629.A N ARG 616.A O no hydrogen 2.760 N/A GLN 629.A NE2 ALA 583.A O no hydrogen 3.589 N/A ARG 630.A N ASP 647.A O no hydrogen 2.753 N/A ARG 632.A N LEU 645.A O no hydrogen 2.880 N/A ARG 632.A NE ASP 647.A OD2 no hydrogen 2.917 N/A ARG 632.A NH1 PRO 631.A O no hydrogen 3.282 N/A VAL 634.A N GLN 637.A OE1 no hydrogen 3.146 N/A GLY 636.A N VAL 593.A O no hydrogen 2.716 N/A GLN 637.A N VAL 634.A O no hydrogen 3.091 N/A VAL 639.A N GLY 591.A O no hydrogen 2.926 N/A ARG 640.A N ASP 643.A OD1 no hydrogen 3.239 N/A LYS 641.A NZ GLU 588.A O no hydrogen 3.220 N/A GLY 642.A N ALA 587.A O no hydrogen 2.684 N/A ASP 643.A N ARG 640.A O no hydrogen 3.359 N/A LEU 645.A N LEU 585.A O no hydrogen 2.811 N/A ALA 646.A N LEU 585.A O no hydrogen 3.090 N/A ASP 647.A N ARG 630.A O no hydrogen 2.829 N/A SER 651.A OG ASP 647.A OD1 no hydrogen 2.734 N/A GLU 652.A N PHE 655.A O no hydrogen 2.899 N/A ASN 653.A N ASP 647.A OD2 no hydrogen 2.565 N/A GLY 654.A N ASP 647.A OD1 no hydrogen 2.726 N/A PHE 655.A N GLU 652.A O no hydrogen 3.014 N/A LEU 656.A N GLU 574.A O no hydrogen 2.976 N/A ALA 657.A N ALA 650.A O no hydrogen 2.802 N/A GLN 660.A N ILE 984.A O no hydrogen 2.907 N/A ASN 661.A N GLN 565.A OE1 no hydrogen 2.818 N/A ASN 661.A ND2 ALA 566.A O no hydrogen 2.664 N/A VAL 662.A N MET 982.A O no hydrogen 2.949 N/A LEU 663.A N ASP 858.A OD2 no hydrogen 3.045 N/A VAL 664.A N GLY 980.A O no hydrogen 2.805 N/A ALA 665.A N VAL 859.A O no hydrogen 2.945 N/A ILE 666.A N VAL 978.A O no hydrogen 2.927 N/A MET 667.A N LEU 861.A O no hydrogen 2.993 N/A PHE 669.A N ASN 673.A OD1 no hydrogen 3.062 N/A TYR 672.A N PHE 669.A O no hydrogen 2.769 N/A ASN 673.A ND2 MET 667.A O no hydrogen 2.906 N/A ASN 673.A ND2 ILE 860.A O no hydrogen 3.648 N/A PHE 674.A N GLY 671.A O no hydrogen 3.085 N/A ALA 677.A N PHE 674.A O no hydrogen 3.218 N/A ILE 678.A N VAL 838.A O no hydrogen 2.790 N/A ILE 680.A N LYS 841.A O no hydrogen 3.033 N/A SER 681.A N ASP 858.A O no hydrogen 2.713 N/A GLU 682.A N LEU 843.A O no hydrogen 2.642 N/A GLU 683.A N SER 681.A OG no hydrogen 3.195 N/A LEU 684.A N SER 681.A O no hydrogen 3.022 N/A LEU 685.A N GLU 682.A O no hydrogen 2.914 N/A LYS 686.A N GLU 682.A O no hydrogen 3.176 N/A LYS 686.A NZ GLU 683.A OE1 no hydrogen 2.997 N/A ARG 687.A N GLU 683.A O no hydrogen 3.010 N/A ARG 687.A NH1 ASP 858.A OD1 no hydrogen 3.163 N/A ARG 687.A NH2 ASP 858.A OD1 no hydrogen 3.119 N/A ARG 687.A NH2 ASP 858.A OD2 no hydrogen 3.071 N/A ASP 688.A N LEU 685.A O no hydrogen 3.016 N/A PHE 689.A N LEU 684.A O no hydrogen 2.950 N/A TYR 690.A N GLN 660.A OE1 no hydrogen 2.887 N/A TYR 690.A OH ILE 984.A O no hydrogen 2.643 N/A THR 691.A OG1 ASP 688.A OD2 no hydrogen 2.691 N/A SER 692.A N ARG 821.A O no hydrogen 2.953 N/A SER 692.A OG HIS 694.A NE2 no hydrogen 2.699 N/A HIS 694.A N GLN 819.A O no hydrogen 2.915 N/A HIS 694.A NE2 SER 692.A OG no hydrogen 2.699 N/A ILE 695.A N GLY 624.A O no hydrogen 3.007 N/A GLU 696.A N VAL 817.A O no hydrogen 2.909 N/A ARG 697.A N GLU 696.A OE2 no hydrogen 2.992 N/A TYR 698.A N VAL 815.A O no hydrogen 2.897 N/A TYR 698.A OH GLU 786.A OE1 no hydrogen 2.391 N/A ILE 700.A N VAL 813.A O no hydrogen 2.910 N/A ALA 702.A N GLU 811.A O no hydrogen 2.870 N/A ARG 703.A N GLU 710.A OE1 no hydrogen 3.100 N/A ASP 704.A N GLY 808.A O no hydrogen 2.799 N/A THR 705.A N GLY 708.A O no hydrogen 3.003 N/A THR 705.A OG1 GLY 708.A O no hydrogen 2.514 N/A LEU 707.A N THR 705.A OG1 no hydrogen 3.217 N/A GLY 708.A N THR 705.A OG1 no hydrogen 3.135 N/A GLU 710.A N ARG 703.A O no hydrogen 3.208 N/A ARG 711.A N THR 749.A O no hydrogen 3.220 N/A ARG 711.A NH1 PRO 709.A O no hydrogen 3.135 N/A ILE 712.A N GLU 811.A OE2 no hydrogen 3.002 N/A THR 713.A N GLY 747.A O no hydrogen 3.111 N/A ARG 714.A NE LEU 727.A O no hydrogen 3.132 N/A ARG 714.A NH1 GLU 721.A OE1 no hydrogen 3.434 N/A ARG 714.A NH2 GLU 721.A OE1 no hydrogen 3.231 N/A ARG 714.A NH2 GLU 721.A OE2 no hydrogen 3.165 N/A ASP 715.A N THR 713.A OG1 no hydrogen 2.776 N/A ALA 723.A N SER 720.A OG no hydrogen 3.012 N/A LEU 724.A N SER 720.A O no hydrogen 3.008 N/A LEU 727.A N LEU 724.A O no hydrogen 2.976 N/A ASP 728.A N VAL 732.A O no hydrogen 2.788 N/A GLU 730.A N ASP 728.A OD1 no hydrogen 3.056 N/A GLY 731.A N ASP 728.A O no hydrogen 3.012 N/A VAL 732.A N ASP 728.A OD1 no hydrogen 2.966 N/A VAL 733.A N LEU 745.A O no hydrogen 2.768 N/A ARG 734.A N ASP 726.A O no hydrogen 3.054 N/A ARG 734.A NE ASP 726.A OD1 no hydrogen 3.374 N/A ARG 734.A NH2 ASP 726.A OD1 no hydrogen 3.454 N/A GLY 736.A N VAL 790.A O no hydrogen 2.743 N/A ALA 737.A N ARG 734.A O no hydrogen 3.269 N/A VAL 739.A N GLY 788.A O no hydrogen 2.748 N/A LYS 740.A N ASP 743.A OD2 no hydrogen 2.474 N/A GLY 742.A N VAL 782.A O no hydrogen 3.021 N/A ASP 743.A N LYS 740.A O no hydrogen 2.916 N/A LEU 745.A N LEU 780.A O no hydrogen 2.963 N/A GLY 747.A N GLY 731.A O no hydrogen 2.754 N/A ARG 748.A N SER 779.A OG no hydrogen 2.955 N/A ARG 748.A NH1 GLU 701.A O no hydrogen 2.558 N/A ARG 748.A NH2 THR 778.A O no hydrogen 3.148 N/A THR 749.A N ARG 711.A O no hydrogen 3.163 N/A SER 750.A N LYS 776.A O no hydrogen 2.980 N/A SER 750.A OG GLU 710.A OE2 no hydrogen 2.977 N/A SER 750.A OG THR 778.A OG1 no hydrogen 2.963 N/A LYS 752.A N ASP 774.A O no hydrogen 2.788 N/A THR 758.A OG1 GLU 761.A OE1 no hydrogen 2.175 N/A GLU 760.A N GLU 760.A OE1 no hydrogen 2.558 N/A ARG 762.A N THR 758.A O no hydrogen 3.245 N/A LEU 763.A N PRO 759.A O no hydrogen 2.933 N/A LEU 764.A N GLU 760.A O no hydrogen 2.939 N/A ARG 765.A N GLU 761.A O no hydrogen 2.896 N/A ARG 765.A NH2 GLU 770.A O no hydrogen 3.116 N/A SER 766.A N ARG 762.A O no hydrogen 2.951 N/A SER 766.A OG ARG 762.A O no hydrogen 2.926 N/A ILE 767.A N LEU 763.A O no hydrogen 2.924 N/A PHE 768.A N LEU 764.A O no hydrogen 2.979 N/A GLY 769.A N ARG 765.A O no hydrogen 2.849 N/A ARG 773.A NH1 ASP 715.A OD1 no hydrogen 3.293 N/A LYS 776.A N SER 750.A O no hydrogen 2.882 N/A THR 778.A N ARG 748.A O no hydrogen 2.946 N/A THR 778.A OG1 ARG 748.A O no hydrogen 3.332 N/A THR 778.A OG1 SER 750.A OG no hydrogen 2.963 N/A SER 779.A N ASP 777.A OD1 no hydrogen 2.924 N/A SER 779.A OG ASP 777.A OD1 no hydrogen 2.803 N/A LEU 780.A N VAL 746.A O no hydrogen 3.094 N/A VAL 782.A N ASP 743.A O no hydrogen 2.902 N/A GLU 786.A N PRO 783.A O no hydrogen 3.188 N/A GLY 788.A N VAL 739.A O no hydrogen 3.073 N/A ILE 789.A N ALA 818.A O no hydrogen 2.798 N/A VAL 790.A N ALA 737.A O no hydrogen 2.884 N/A VAL 791.A N TYR 816.A O no hydrogen 3.073 N/A ARG 792.A NH1 GLU 79.A OE1 no hydrogen 3.300 N/A ARG 792.A NH2 GLU 79.A OE1 no hydrogen 2.871 N/A VAL 794.A N ARG 814.A O no hydrogen 2.898 N/A LEU 796.A N VAL 812.A O no hydrogen 2.900 N/A ARG 798.A NH1 ASP 704.A OD2 no hydrogen 2.741 N/A ARG 798.A NH2 ASP 704.A OD2 no hydrogen 3.087 N/A VAL 803.A N ASP 800.A O no hydrogen 3.244 N/A VAL 809.A N LYS 806.A O no hydrogen 3.118 N/A ARG 810.A N ALA 702.A O no hydrogen 2.812 N/A ARG 810.A NH2 ASP 704.A OD1 no hydrogen 2.442 N/A GLU 811.A N ALA 702.A O no hydrogen 2.966 N/A VAL 812.A N LEU 796.A O no hydrogen 2.883 N/A VAL 813.A N ILE 700.A O no hydrogen 2.910 N/A ARG 814.A N VAL 794.A O no hydrogen 2.917 N/A ARG 814.A NH1 GLU 699.A OE2 no hydrogen 2.871 N/A VAL 815.A N TYR 698.A O no hydrogen 2.869 N/A TYR 816.A N ARG 792.A O no hydrogen 2.873 N/A VAL 817.A N GLU 696.A O no hydrogen 2.904 N/A ALA 818.A N ILE 789.A O no hydrogen 2.781 N/A GLN 819.A N HIS 694.A O no hydrogen 2.873 N/A GLN 819.A NE2 GLY 787.A O no hydrogen 2.338 N/A ARG 821.A N SER 692.A O no hydrogen 2.851 N/A ARG 821.A NE GLN 819.A OE1 no hydrogen 2.936 N/A ARG 821.A NH1 ASP 993.A OD1 no hydrogen 3.426 N/A ARG 821.A NH1 ASP 993.A OD2 no hydrogen 2.909 N/A ARG 821.A NH2 GLN 819.A OE1 no hydrogen 2.658 N/A ARG 821.A NH2 ASP 993.A OD1 no hydrogen 3.019 N/A LYS 822.A NZ LEU 685.A O no hydrogen 3.256 N/A GLY 826.A N VAL 839.A O no hydrogen 2.955 N/A ASP 827.A N GLN 824.A O no hydrogen 3.132 N/A LEU 829.A N GLY 837.A O no hydrogen 2.841 N/A ALA 830.A N MET 985.A O no hydrogen 2.913 N/A ASN 831.A N ASN 835.A O no hydrogen 2.899 N/A ASN 831.A ND2 GLN 874.A OE1 no hydrogen 2.936 N/A ARG 832.A NH1 LEU 536.A O no hydrogen 3.504 N/A ARG 832.A NH1 VAL 569.A O no hydrogen 2.870 N/A ARG 832.A NH2 VAL 569.A O no hydrogen 2.886 N/A ARG 832.A NH2 GLU 877.A OE1 no hydrogen 3.182 N/A HIS 833.A N ASN 831.A OD1 no hydrogen 2.816 N/A HIS 833.A ND1 ASP 543.A OD1 no hydrogen 2.590 N/A HIS 833.A NE2 GLU 877.A OE2 no hydrogen 2.762 N/A GLY 834.A N ASN 831.A O no hydrogen 3.444 N/A ASN 835.A N ASN 831.A OD1 no hydrogen 3.108 N/A ASN 835.A ND2 GLN 874.A OE1 no hydrogen 2.917 N/A GLY 837.A N LEU 829.A O no hydrogen 2.906 N/A VAL 839.A N ASP 827.A O no hydrogen 3.095 N/A ALA 840.A N ILE 678.A O no hydrogen 2.910 N/A LEU 843.A N ILE 680.A O no hydrogen 2.964 N/A GLU 846.A N GLU 846.A OE1 no hydrogen 2.635 N/A ASP 847.A N PRO 844.A O no hydrogen 2.921 N/A MET 848.A N VAL 845.A O no hydrogen 3.276 N/A HIS 850.A N TYR 965.A O no hydrogen 3.001 N/A HIS 850.A ND1 LEU 851.A O no hydrogen 3.205 N/A LEU 851.A N THR 855.A O no hydrogen 2.803 N/A GLY 854.A N LEU 851.A O no hydrogen 2.882 N/A THR 855.A N ASP 853.A OD1 no hydrogen 3.272 N/A THR 855.A OG1 ASP 853.A OD1 no hydrogen 2.781 N/A VAL 857.A N PRO 849.A O no hydrogen 2.982 N/A ASP 858.A N LEU 663.A O no hydrogen 2.728 N/A VAL 859.A N LEU 663.A O no hydrogen 3.221 N/A ILE 860.A N VAL 679.A O no hydrogen 2.823 N/A LEU 861.A N ALA 665.A O no hydrogen 3.037 N/A ASN 862.A ND2 ASN 673.A O no hydrogen 3.454 N/A ASN 862.A ND2 ASN 673.A OD1 no hydrogen 3.084 N/A LEU 864.A N ASN 862.A OD1 no hydrogen 2.749 N/A GLY 865.A N ASN 862.A O no hydrogen 3.027 N/A VAL 866.A N PRO 863.A O no hydrogen 2.942 N/A ARG 869.A N VAL 866.A O no hydrogen 3.121 N/A ARG 869.A NH1 ASP 676.A OD1 no hydrogen 2.494 N/A ARG 869.A NH1 ASP 676.A OD2 no hydrogen 3.101 N/A ARG 869.A NH2 ASP 676.A OD2 no hydrogen 2.980 N/A ARG 869.A NH2 GLY 865.A O no hydrogen 3.079 N/A MET 870.A N VAL 866.A O no hydrogen 2.956 N/A ASN 871.A N ASN 871.A OD1 no hydrogen 2.524 N/A ASN 871.A ND2 HIS 833.A O no hydrogen 2.982 N/A LEU 872.A N HIS 542.A O no hydrogen 3.089 N/A GLY 873.A N ASP 543.A OD2 no hydrogen 2.669 N/A GLN 874.A NE2 ASN 871.A O no hydrogen 3.352 N/A ILE 875.A N LEU 872.A O no hydrogen 2.869 N/A LEU 876.A N LEU 872.A O no hydrogen 3.117 N/A GLU 877.A N GLY 873.A O no hydrogen 2.857 N/A THR 878.A N GLN 874.A O no hydrogen 2.918 N/A THR 878.A OG1 GLN 874.A O no hydrogen 2.286 N/A HIS 879.A N ILE 875.A O no hydrogen 2.973 N/A LEU 880.A N LEU 876.A O no hydrogen 2.980 N/A GLY 881.A N GLU 877.A O no hydrogen 2.896 N/A LEU 882.A N THR 878.A O no hydrogen 2.864 N/A ALA 883.A N HIS 879.A O no hydrogen 3.033 N/A GLY 884.A N LEU 880.A O no hydrogen 2.881 N/A TYR 885.A N LEU 882.A O no hydrogen 2.829 N/A PHE 886.A N LEU 882.A O no hydrogen 3.100 N/A LEU 887.A N ALA 883.A O no hydrogen 3.089 N/A GLN 889.A N GLY 884.A O no hydrogen 2.984 N/A GLN 889.A NE2 TYR 891.A OH no hydrogen 2.934 N/A ARG 890.A N GLU 2.A O no hydrogen 3.188 N/A ARG 890.A NH1 GLU 652.A OE1 no hydrogen 2.939 N/A ARG 890.A NH2 GLU 652.A OE1 no hydrogen 3.009 N/A ARG 890.A NH2 GLU 652.A OE2 no hydrogen 3.422 N/A TYR 891.A N VAL 568.A O no hydrogen 2.612 N/A ILE 892.A N LYS 4.A O no hydrogen 2.933 N/A SER 893.A N MET 570.A O no hydrogen 2.662 N/A PHE 896.A N GLU 541.A OE2 no hydrogen 2.966 N/A ALA 899.A N SER 893.A OG no hydrogen 3.206 N/A LYS 900.A N GLU 903.A OE2 no hydrogen 3.136 N/A ILE 904.A N LYS 900.A O no hydrogen 3.226 N/A LYS 905.A N GLU 901.A O no hydrogen 2.832 N/A LYS 905.A NZ LEU 958.A O no hydrogen 3.449 N/A GLU 906.A N PRO 902.A O no hydrogen 2.923 N/A LEU 907.A N GLU 903.A O no hydrogen 2.988 N/A LEU 908.A N ILE 904.A O no hydrogen 2.863 N/A ALA 909.A N LYS 905.A O no hydrogen 2.872 N/A GLN 910.A N GLU 906.A O no hydrogen 3.014 N/A ALA 911.A N LEU 907.A O no hydrogen 2.923 N/A PHE 912.A N LEU 908.A O no hydrogen 2.838 N/A GLU 913.A N ALA 909.A O no hydrogen 3.053 N/A TYR 915.A N ALA 911.A O no hydrogen 2.918 N/A PHE 916.A N PHE 912.A O no hydrogen 2.873 N/A GLY 917.A N GLU 913.A O no hydrogen 2.933 N/A ARG 919.A NH1 GLU 930.A OE1 no hydrogen 3.289 N/A ARG 919.A NH1 GLU 930.A OE2 no hydrogen 3.145 N/A ARG 919.A NH2 GLU 930.A OE1 no hydrogen 2.801 N/A ARG 919.A NH2 GLU 930.A OE2 no hydrogen 2.883 N/A LYS 920.A N PHE 916.A O no hydrogen 2.959 N/A GLY 921.A N GLY 917.A O no hydrogen 2.918 N/A GLU 922.A N LYS 918.A O no hydrogen 3.069 N/A PHE 924.A N ARG 919.A O no hydrogen 3.269 N/A ASP 927.A N GLU 930.A OE1 no hydrogen 2.956 N/A ARG 929.A N ASP 927.A OD1 no hydrogen 2.787 N/A ARG 929.A NE GLY 970.A O no hydrogen 3.043 N/A ARG 929.A NH1 ASP 927.A OD1 no hydrogen 3.156 N/A ARG 929.A NH2 GLY 970.A O no hydrogen 3.480 N/A VAL 931.A N ASP 927.A O no hydrogen 3.044 N/A GLU 932.A N LYS 928.A O no hydrogen 3.018 N/A VAL 933.A N ARG 929.A O no hydrogen 2.945 N/A LEU 934.A N GLU 930.A O no hydrogen 2.892 N/A ARG 935.A N VAL 931.A O no hydrogen 2.931 N/A ARG 936.A N GLU 932.A O no hydrogen 3.018 N/A ALA 937.A N VAL 933.A O no hydrogen 2.850 N/A GLU 938.A N LEU 934.A O no hydrogen 2.889 N/A LYS 939.A N ARG 935.A O no hydrogen 2.999 N/A LEU 940.A N ARG 936.A O no hydrogen 2.887 N/A LEU 940.A N ALA 937.A O no hydrogen 2.974 N/A GLY 941.A N GLU 938.A O no hydrogen 3.109 N/A LEU 942.A N ALA 937.A O no hydrogen 2.900 N/A THR 944.A N GLU 955.A OE1 no hydrogen 2.960 N/A THR 944.A OG1 GLU 955.A OE1 no hydrogen 3.449 N/A THR 944.A OG1 GLU 955.A OE2 no hydrogen 3.266 N/A THR 948.A N GLU 951.A OE1 no hydrogen 3.001 N/A GLU 951.A N THR 948.A OG1 no hydrogen 2.999 N/A GLN 952.A N THR 948.A O no hydrogen 3.072 N/A GLN 952.A NE2 THR 944.A O no hydrogen 2.796 N/A LEU 953.A N PRO 949.A O no hydrogen 2.869 N/A LYS 954.A N GLU 950.A O no hydrogen 2.936 N/A LYS 954.A NZ GLU 913.A OE2 no hydrogen 3.189 N/A GLU 955.A N GLU 951.A O no hydrogen 2.910 N/A LEU 956.A N GLN 952.A O no hydrogen 2.908 N/A PHE 957.A N LEU 953.A O no hydrogen 2.876 N/A LEU 958.A N LYS 954.A O no hydrogen 2.904 N/A GLN 959.A N LEU 956.A O no hydrogen 2.889 N/A GLN 959.A NE2 LEU 942.A O no hydrogen 2.703 N/A GLN 959.A NE2 GLU 955.A O no hydrogen 2.920 N/A GLY 960.A N PHE 957.A O no hydrogen 2.721 N/A LYS 961.A N LEU 956.A O no hydrogen 2.963 N/A VAL 962.A N ILE 977.A O no hydrogen 2.754 N/A TYR 965.A N HIS 850.A O no hydrogen 2.931 N/A ASP 966.A N GLU 971.A O no hydrogen 2.998 N/A ARG 968.A N ASP 966.A OD1 no hydrogen 3.011 N/A ARG 968.A NH1 ASP 966.A OD1 no hydrogen 3.009 N/A THR 969.A N ASP 966.A O no hydrogen 3.299 N/A GLY 970.A N ASP 966.A O no hydrogen 2.737 N/A GLU 971.A N THR 969.A OG1 no hydrogen 3.291 N/A ILE 973.A N LEU 964.A O no hydrogen 2.784 N/A ILE 977.A N VAL 962.A O no hydrogen 2.864 N/A GLY 980.A N VAL 664.A O no hydrogen 3.007 N/A MET 982.A N VAL 662.A O no hydrogen 2.880 N/A PHE 983.A N GLU 877.A OE1 no hydrogen 2.679 N/A ILE 984.A N GLN 660.A O no hydrogen 2.917 N/A MET 985.A N ALA 830.A O no hydrogen 2.816 N/A LYS 986.A NZ TYR 690.A O no hydrogen 3.225 N/A LYS 986.A NZ SER 692.A OG no hydrogen 2.960 N/A LEU 987.A N LYS 828.A O no hydrogen 2.714 N/A TYR 988.A OH GLN 623.A O no hydrogen 3.204 N/A HIS 989.A NE2 GLN 557.A OE1 no hydrogen 3.109 N/A VAL 991.A N ASP 827.A OD2 no hydrogen 3.373 N/A ASP 993.A N MET 990.A O no hydrogen 2.910 N/A LYS 994.A N VAL 991.A O no hydrogen 3.242 N/A LYS 994.A NZ HIS 989.A ND1 no hydrogen 3.196 N/A MET 995.A N VAL 991.A O no hydrogen 2.982 N/A HIS 996.A NE2 GLY 1018.A O no hydrogen 2.874 N/A ARG 998.A NH1 PRO 1002.A O no hydrogen 3.061 N/A ARG 998.A NH1 PHE 1017.A O no hydrogen 2.879 N/A ARG 998.A NH2 PRO 1002.A O no hydrogen 3.251 N/A SER 1004.A N GLN 1009.A O no hydrogen 2.672 N/A SER 1004.A OG THR 1007.A OG1 no hydrogen 3.037 N/A THR 1007.A OG1 SER 1004.A OG no hydrogen 3.037 N/A GLN 1008.A N SER 1004.A O no hydrogen 3.061 N/A GLN 1008.A NE2 LEU 1005.A O no hydrogen 2.846 N/A GLN 1009.A NE2 ASP 1048.A OD2 no hydrogen 3.251 N/A LEU 1011.A N PRO 1002.A O no hydrogen 3.192 N/A LYS 1014.A NZ ASP 993.A O no hydrogen 3.195 N/A GLN 1016.A N GLY 1013.A O no hydrogen 3.241 N/A GLN 1016.A NE2 GLY 1012.A O no hydrogen 3.098 N/A PHE 1017.A N LYS 1014.A O no hydrogen 3.093 N/A GLY 1018.A N GLY 1013.A O no hydrogen 2.911 N/A GLY 1019.A N LEU 1011.A O no hydrogen 2.773 N/A GLY 1023.A N GLU 1026.A OE2 no hydrogen 2.672 N/A VAL 1027.A N GLY 1023.A O no hydrogen 2.977 N/A TRP 1028.A N GLU 1024.A O no hydrogen 2.894 N/A ALA 1029.A N MET 1025.A O no hydrogen 2.989 N/A LEU 1030.A N GLU 1026.A O no hydrogen 2.953 N/A GLU 1031.A N VAL 1027.A O no hydrogen 2.892 N/A ALA 1032.A N TRP 1028.A O no hydrogen 2.892 N/A TYR 1033.A N ALA 1029.A O no hydrogen 3.022 N/A GLY 1034.A N GLU 1031.A O no hydrogen 2.838 N/A ALA 1035.A N LEU 1030.A O no hydrogen 2.986 N/A LEU 1039.A N ALA 1035.A O no hydrogen 3.342 N/A GLN 1040.A N ALA 1036.A O no hydrogen 2.914 N/A GLU 1041.A N HIS 1037.A O no hydrogen 2.907 N/A MET 1042.A N THR 1038.A O no hydrogen 3.022 N/A LEU 1043.A N LEU 1039.A O no hydrogen 2.931 N/A THR 1044.A N GLU 1041.A O no hydrogen 3.270 N/A THR 1044.A OG1 GLN 1040.A O no hydrogen 2.208 N/A LYS 1046.A N GLU 1041.A O no hydrogen 2.855 N/A SER 1047.A N THR 1044.A O no hydrogen 3.044 N/A SER 1047.A OG ASP 1048.A OD1 no hydrogen 3.500 N/A ASP 1049.A N THR 1044.A O no hydrogen 3.085 N/A GLY 1052.A N ASP 1049.A OD1 no hydrogen 2.862 N/A ARG 1053.A N ASP 1049.A O no hydrogen 2.833 N/A ARG 1053.A NH1 GLN 1008.A O no hydrogen 2.982 N/A ARG 1053.A NH1 SER 1047.A O no hydrogen 2.576 N/A ARG 1053.A NH2 GLN 1008.A OE1 no hydrogen 3.446 N/A ASN 1054.A N ILE 1050.A O no hydrogen 3.012 N/A ALA 1055.A N GLU 1051.A O no hydrogen 2.892 N/A ALA 1056.A N GLY 1052.A O no hydrogen 2.886 N/A TYR 1057.A N ARG 1053.A O no hydrogen 2.963 N/A GLU 1058.A N ASN 1054.A O no hydrogen 3.009 N/A ALA 1059.A N ALA 1055.A O no hydrogen 2.879 N/A ILE 1060.A N ALA 1056.A O no hydrogen 2.915 N/A ILE 1061.A N TYR 1057.A O no hydrogen 3.005 N/A LYS 1062.A N GLU 1058.A O no hydrogen 3.064 N/A LYS 1062.A NZ GLU 1058.A OE2 no hydrogen 2.790 N/A GLY 1063.A N ILE 1060.A O no hydrogen 3.200 N/A SER 1070.A N ASP 1049.A OD2 no hydrogen 2.758 N/A SER 1070.A OG ASP 1049.A OD1 no hydrogen 3.181 N/A SER 1070.A OG ASP 1049.A OD2 no hydrogen 3.159 N/A GLU 1073.A N ASP 1048.A O no hydrogen 2.964 N/A SER 1074.A N ASP 1048.A OD2 no hydrogen 2.881 N/A SER 1074.A OG THR 1007.A O no hydrogen 3.157 N/A SER 1074.A OG ASP 1048.A OD2 no hydrogen 3.014 N/A PHE 1075.A N PRO 1072.A O no hydrogen 3.034 N/A ARG 1076.A NE ILE 1101.A O no hydrogen 2.753 N/A ARG 1076.A NH1 GLU 1073.A OE1 no hydrogen 2.658 N/A ARG 1076.A NH2 ILE 1101.A O no hydrogen 3.440 N/A VAL 1077.A N GLU 1073.A O no hydrogen 2.933 N/A LEU 1078.A N SER 1074.A O no hydrogen 2.926 N/A VAL 1079.A N PHE 1075.A O no hydrogen 2.902 N/A LYS 1080.A N ARG 1076.A O no hydrogen 2.940 N/A LYS 1080.A NZ GLN 1083.A OE1 no hydrogen 2.513 N/A GLU 1081.A N VAL 1077.A O no hydrogen 2.875 N/A LEU 1082.A N LEU 1078.A O no hydrogen 2.889 N/A GLN 1083.A N VAL 1079.A O no hydrogen 2.898 N/A ALA 1084.A N LYS 1080.A O no hydrogen 2.952 N/A LEU 1085.A N GLU 1081.A O no hydrogen 3.168 N/A LEU 1085.A N LEU 1082.A O no hydrogen 3.079 N/A ALA 1086.A N GLN 1083.A O no hydrogen 2.888 N/A LEU 1087.A N LEU 1082.A O no hydrogen 3.018 N/A ASP 1093.A N ASN 1097.A O no hydrogen 2.956 N/A GLU 1094.A N GLU 1094.A OE1 no hydrogen 2.766 N/A LYS 1095.A N ASP 1093.A OD1 no hydrogen 3.143 N/A ASP 1096.A N ASP 1093.A O no hydrogen 2.763 N/A ASN 1097.A N ASP 1093.A OD1 no hydrogen 2.973 N/A VAL 1099.A N THR 1091.A O no hydrogen 2.830 N/A PHE 1102.A N ASP 1100.A OD1 no hydrogen 2.879 N/A GLY 1104.A N ASP 1100.A OD2 no hydrogen 2.430 N/A LEU 1105.A N PHE 1102.A O no hydrogen 3.186 N/A SER 1107.A N GLY 1104.A O no hydrogen 3.244 N/A SER 1107.A OG GLY 1104.A O no hydrogen 3.348 N/A