Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n2c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A N TYR 22.A OH no hydrogen 3.242 N/A ARG 3.A N TYR 22.A O no hydrogen 2.896 N/A ARG 3.A NH1 VAL 16.A O no hydrogen 2.707 N/A VAL 5.A N TRP 24.A O no hydrogen 2.880 N/A LEU 7.A N ASP 26.A O no hydrogen 3.385 N/A SER 11.A N GLN 8.A O no hydrogen 3.086 N/A VAL 13.A N GLY 108.A O no hydrogen 2.891 N/A ALA 15.A N PHE 110.A O no hydrogen 2.890 N/A TYR 17.A N THR 112.A O no hydrogen 2.877 N/A LEU 19.A N ILE 114.A O no hydrogen 3.030 N/A THR 21.A N VAL 18.A O no hydrogen 3.303 N/A THR 21.A OG1 VAL 18.A O no hydrogen 2.465 N/A TYR 22.A N ARG 1.A O no hydrogen 3.142 N/A LEU 23.A N VAL 77.A O no hydrogen 2.906 N/A TRP 24.A N ARG 3.A O no hydrogen 2.898 N/A THR 25.A N LEU 75.A O no hydrogen 2.897 N/A ASP 26.A N VAL 5.A O no hydrogen 2.958 N/A TYR 28.A N ASP 26.A OD1 no hydrogen 2.999 N/A SER 29.A OG ASP 26.A OD2 no hydrogen 2.587 N/A ALA 31.A N TYR 28.A O no hydrogen 3.235 N/A ALA 35.A N PRO 32.A O no hydrogen 3.361 N/A THR 37.A N TYR 96.A O no hydrogen 2.962 N/A THR 37.A OG1 TYR 96.A O no hydrogen 3.023 N/A PHE 38.A N TRP 67.A O no hydrogen 2.937 N/A SER 39.A N ASN 94.A O no hydrogen 2.905 N/A SER 39.A OG TYR 96.A OH no hydrogen 3.033 N/A LYS 41.A N THR 92.A O no hydrogen 2.898 N/A HIS 42.A N THR 61.A O no hydrogen 2.778 N/A HIS 42.A ND1 SER 43.A O no hydrogen 2.501 N/A HIS 42.A NE2 VAL 59.A O no hydrogen 3.039 N/A SER 43.A N LYS 90.A O no hydrogen 2.921 N/A SER 43.A OG SER 88.A O no hydrogen 3.119 N/A TRP 47.A N THR 78.A O no hydrogen 2.863 N/A GLU 49.A N ARG 76.A O no hydrogen 2.899 N/A VAL 50.A N GLU 57.A O no hydrogen 2.895 N/A VAL 51.A N THR 74.A O no hydrogen 2.901 N/A ARG 52.A N GLU 55.A O no hydrogen 3.089 N/A GLU 55.A N ARG 52.A O no hydrogen 3.195 N/A GLU 57.A N VAL 50.A O no hydrogen 2.901 N/A VAL 59.A N VAL 48.A O no hydrogen 2.916 N/A GLY 63.A N LEU 40.A O no hydrogen 3.192 N/A TRP 67.A N PHE 38.A O no hydrogen 2.892 N/A LEU 69.A N GLN 36.A O no hydrogen 3.212 N/A SER 72.A N SER 70.A OG no hydrogen 3.192 N/A THR 74.A N VAL 51.A O no hydrogen 2.899 N/A THR 74.A OG1 THR 25.A O no hydrogen 2.421 N/A THR 74.A OG1 LEU 75.A O no hydrogen 3.466 N/A LEU 75.A N THR 25.A O no hydrogen 2.910 N/A ARG 76.A N GLU 49.A O no hydrogen 2.888 N/A VAL 77.A N LEU 23.A O no hydrogen 2.883 N/A THR 78.A N TRP 47.A O no hydrogen 2.931 N/A MET 79.A N TYR 17.A OH no hydrogen 3.017 N/A SER 83.A N ALA 113.A O no hydrogen 2.665 N/A SER 83.A OG ASP 89.A OD2 no hydrogen 3.001 N/A VAL 91.A N LEU 109.A O no hydrogen 2.919 N/A THR 92.A N LYS 41.A O no hydrogen 2.866 N/A VAL 93.A N ALA 107.A O no hydrogen 2.876 N/A ASN 94.A N SER 39.A O no hydrogen 2.876 N/A TYR 95.A N ASP 105.A O no hydrogen 3.188 N/A TYR 95.A OH VAL 27.A O no hydrogen 2.915 N/A TYR 96.A N THR 37.A O no hydrogen 2.893 N/A TYR 96.A OH SER 39.A OG no hydrogen 3.033 N/A GLY 100.A N ASP 97.A O no hydrogen 3.318 N/A ILE 104.A N TYR 95.A O no hydrogen 3.001 N/A GLN 106.A N ASP 105.A OD1 no hydrogen 2.923 N/A ALA 107.A N VAL 93.A O no hydrogen 2.925 N/A LEU 109.A N VAL 91.A O no hydrogen 2.868 N/A PHE 110.A N VAL 13.A O no hydrogen 2.902 N/A LEU 111.A N ASP 89.A O no hydrogen 2.811 N/A THR 112.A N ALA 15.A O no hydrogen 2.930 N/A THR 112.A OG1 ALA 86.A O no hydrogen 2.311 N/A ALA 113.A N SER 83.A OG no hydrogen 2.592 N/A ILE 114.A N TYR 17.A O no hydrogen 2.894 N/A GLU 115.A N LYS 187.A O no hydrogen 2.865 N/A SER 117.A N ARG 185.A O no hydrogen 2.938 N/A SER 117.A OG ASP 119.A OD1 no hydrogen 3.106 N/A SER 117.A OG ASP 119.A OD2 no hydrogen 2.839 N/A LEU 118.A N ASP 286.A OD2 no hydrogen 2.882 N/A ASP 119.A N ILE 183.A O no hydrogen 2.878 N/A ALA 122.A N GLU 129.A OE1 no hydrogen 2.416 N/A ASP 123.A N GLU 129.A OE1 no hydrogen 3.102 N/A ARG 124.A N ASP 121.A OD1 no hydrogen 2.811 N/A ARG 124.A NE GLY 146.A O no hydrogen 2.931 N/A ARG 124.A NH2 THR 139.A O no hydrogen 3.036 N/A ASP 125.A N ASP 123.A OD2 no hydrogen 3.326 N/A GLY 126.A N ASP 121.A OD2 no hydrogen 3.450 N/A VAL 127.A N ASP 125.A OD1 no hydrogen 2.945 N/A ASN 131.A N ASP 119.A OD1 no hydrogen 2.947 N/A ASN 132.A ND2 GLN 145.A OE1 no hydrogen 2.664 N/A LYS 134.A N ASN 132.A OD1 no hydrogen 2.947 N/A LYS 135.A N ASN 132.A O no hydrogen 3.127 N/A LYS 135.A NZ LEU 118.A O no hydrogen 2.454 N/A LYS 135.A NZ ASP 119.A OD1 no hydrogen 3.464 N/A LYS 135.A NZ ASN 131.A OD1 no hydrogen 3.096 N/A LYS 135.A NZ ASP 286.A OD2 no hydrogen 2.540 N/A SER 137.A N LYS 134.A O no hydrogen 3.030 N/A SER 137.A OG LYS 134.A O no hydrogen 3.091 N/A TRP 138.A NE1 ALA 147.A O no hydrogen 2.939 N/A THR 139.A N GLN 145.A O no hydrogen 3.104 N/A THR 139.A OG1 GLN 145.A O no hydrogen 2.800 N/A GLY 141.A N TRP 641.A O no hydrogen 3.305 N/A GLY 144.A N GLY 141.A O no hydrogen 2.954 N/A GLN 145.A N THR 139.A OG1 no hydrogen 2.406 N/A GLY 146.A N ALA 122.A O no hydrogen 2.766 N/A LEU 149.A N ARG 291.A O no hydrogen 2.872 N/A ASN 152.A N GLY 252.A O no hydrogen 3.148 N/A ASN 152.A ND2 ASP 175.A OD1 no hydrogen 2.796 N/A ASN 152.A ND2 GLU 251.A OE2 no hydrogen 3.175 N/A CYS 153.A SG VAL 151.A O no hydrogen 3.694 N/A ARG 155.A N GLY 371.A O no hydrogen 3.283 N/A ARG 155.A NH1 LEU 160.A O no hydrogen 3.151 N/A ARG 155.A NH2 VAL 366.A O no hydrogen 3.562 N/A ARG 155.A NH2 LEU 370.A O no hydrogen 2.359 N/A GLU 156.A N ASP 164.A OD1 no hydrogen 3.019 N/A GLU 156.A N ASP 164.A OD2 no hydrogen 3.413 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.865 N/A ASP 164.A N ASP 154.A O no hydrogen 2.603 N/A CYS 165.A N ASN 152.A O no hydrogen 3.304 N/A CYS 165.A SG ASN 152.A O no hydrogen 3.133 N/A CYS 165.A SG LEU 253.A O no hydrogen 3.326 N/A ARG 166.A N GLU 163.A O no hydrogen 3.075 N/A GLU 174.A N SER 172.A OG no hydrogen 3.359 N/A LYS 177.A N GLU 174.A O no hydrogen 2.936 N/A ASP 178.A N ASP 175.A O no hydrogen 2.938 N/A MET 179.A N LEU 176.A O no hydrogen 3.127 N/A SER 180.A N VAL 250.A O no hydrogen 2.908 N/A SER 180.A OG ILE 148.A O no hydrogen 2.772 N/A MET 182.A N PHE 248.A O no hydrogen 2.903 N/A ILE 183.A N ASP 119.A O no hydrogen 2.885 N/A LEU 184.A N LEU 246.A O no hydrogen 2.906 N/A ARG 185.A N SER 117.A O no hydrogen 2.893 N/A ARG 185.A NH2 VAL 128.A O no hydrogen 2.799 N/A THR 186.A N ALA 244.A O no hydrogen 2.889 N/A LYS 187.A N GLU 115.A O no hydrogen 2.943 N/A GLY 188.A N GLY 242.A O no hydrogen 3.369 N/A GLU 197.A N LEU 271.A O no hydrogen 2.939 N/A VAL 199.A N SER 269.A O no hydrogen 2.905 N/A LEU 200.A N HIS 235.A O no hydrogen 2.916 N/A TYR 201.A N HIS 267.A O no hydrogen 2.880 N/A ILE 202.A N LEU 233.A O no hydrogen 2.933 N/A ASP 206.A N SER 203.A O no hydrogen 3.246 N/A SER 207.A N MET 204.A O no hydrogen 3.255 N/A SER 207.A OG SER 203.A O no hydrogen 3.376 N/A SER 207.A OG MET 204.A O no hydrogen 2.643 N/A LYS 209.A N ASP 206.A O no hydrogen 3.112 N/A LYS 209.A NZ SER 205.A O no hydrogen 2.659 N/A LYS 209.A NZ ASP 208.A OD1 no hydrogen 2.450 N/A LYS 209.A NZ ASP 208.A OD2 no hydrogen 3.309 N/A VAL 210.A N ASP 206.A O no hydrogen 3.205 N/A GLY 211.A N GLU 251.A O no hydrogen 2.916 N/A VAL 212.A N LEU 228.A O no hydrogen 2.846 N/A PHE 213.A N PHE 249.A O no hydrogen 2.880 N/A TYR 214.A N ILE 225.A O no hydrogen 2.970 N/A GLU 216.A N ARG 223.A O no hydrogen 2.905 N/A GLN 222.A N ALA 219.A O no hydrogen 2.835 N/A ARG 223.A N GLU 216.A O no hydrogen 2.906 N/A ILE 225.A N TYR 214.A O no hydrogen 2.889 N/A ILE 227.A N VAL 212.A O no hydrogen 2.767 N/A LEU 228.A N VAL 212.A O no hydrogen 2.990 N/A GLY 229.A N LYS 232.A O no hydrogen 3.226 N/A ARG 230.A NH1 CYS 165.A O no hydrogen 2.987 N/A ARG 230.A NH1 ASP 167.A O no hydrogen 3.428 N/A ARG 230.A NH1 GLU 168.A OE1 no hydrogen 3.460 N/A ARG 230.A NH2 CYS 165.A O no hydrogen 2.756 N/A ARG 231.A NH1 GLU 168.A OE2 no hydrogen 3.063 N/A LYS 232.A N GLY 229.A O no hydrogen 3.144 N/A LYS 232.A NZ ILE 227.A O no hydrogen 3.390 N/A LYS 232.A NZ HIS 235.A ND1 no hydrogen 3.042 N/A HIS 235.A N LEU 200.A O no hydrogen 2.881 N/A VAL 237.A N ILE 198.A O no hydrogen 2.884 N/A TYR 239.A OH PRO 189.A O no hydrogen 2.940 N/A GLY 242.A N GLY 188.A O no hydrogen 2.921 N/A ALA 244.A N THR 186.A O no hydrogen 2.910 N/A LEU 246.A N LEU 184.A O no hydrogen 2.899 N/A PHE 248.A N MET 182.A O no hydrogen 2.884 N/A PHE 249.A N PHE 213.A O no hydrogen 2.914 N/A VAL 250.A N SER 180.A O no hydrogen 2.887 N/A GLU 251.A N GLY 211.A O no hydrogen 2.890 N/A GLY 252.A N LEU 150.A O no hydrogen 2.994 N/A LEU 253.A N LYS 209.A O no hydrogen 2.736 N/A CYS 254.A SG PHE 255.A O no hydrogen 3.162 N/A ASP 257.A N PHE 260.A O no hydrogen 3.211 N/A GLU 258.A N ASP 257.A OD1 no hydrogen 2.501 N/A PHE 260.A N ASP 257.A O no hydrogen 3.096 N/A VAL 264.A N PHE 290.A O no hydrogen 2.802 N/A ILE 266.A N VAL 288.A O no hydrogen 3.180 N/A HIS 267.A N TYR 201.A O no hydrogen 2.929 N/A HIS 267.A ND1 THR 287.A OG1 no hydrogen 3.129 N/A VAL 268.A N ASP 286.A O no hydrogen 2.957 N/A SER 269.A N VAL 199.A O no hydrogen 2.900 N/A SER 269.A OG PHE 284.A O no hydrogen 2.841 N/A SER 269.A OG THR 285.A OG1 no hydrogen 3.167 N/A LEU 270.A N PHE 284.A O no hydrogen 2.802 N/A LEU 271.A N GLU 197.A O no hydrogen 2.864 N/A GLU 272.A N THR 281.A O no hydrogen 2.902 N/A TYR 273.A N GLY 195.A O no hydrogen 2.537 N/A ILE 278.A N ALA 275.A O no hydrogen 3.188 N/A THR 281.A N GLU 272.A O no hydrogen 2.933 N/A ILE 283.A N THR 281.A O no hydrogen 2.783 N/A THR 285.A OG1 SER 269.A OG no hydrogen 3.167 N/A ASP 286.A N VAL 268.A O no hydrogen 2.919 N/A THR 287.A OG1 HIS 267.A ND1 no hydrogen 3.129 N/A VAL 288.A N ILE 266.A O no hydrogen 3.178 N/A ILE 289.A N LYS 135.A O no hydrogen 2.775 N/A PHE 290.A N VAL 264.A O no hydrogen 2.869 N/A ARG 291.A N ALA 147.A O no hydrogen 2.856 N/A ILE 292.A N GLY 262.A O no hydrogen 2.666 N/A ALA 293.A N LEU 149.A O no hydrogen 2.840 N/A TRP 295.A N GLN 438.A OE1 no hydrogen 2.751 N/A TRP 295.A NE1 VAL 351.A O no hydrogen 3.116 N/A ILE 296.A N TYR 341.A O no hydrogen 3.203 N/A MET 297.A N GLN 441.A OE1 no hydrogen 3.010 N/A ASN 300.A ND2 PHE 462.A O no hydrogen 3.547 N/A VAL 305.A N ARG 632.A O no hydrogen 2.897 N/A SER 306.A N ARG 632.A O no hydrogen 3.316 N/A VAL 307.A N GLU 318.A O no hydrogen 3.176 N/A PHE 308.A N ASN 630.A O no hydrogen 2.741 N/A VAL 309.A N LYS 320.A O no hydrogen 3.212 N/A CYS 310.A SG ASP 330.A O no hydrogen 3.373 N/A CYS 311.A N ASN 327.A OD1 no hydrogen 3.150 N/A ASN 316.A ND2 ASN 316.A O no hydrogen 2.475 N/A LYS 320.A N VAL 307.A O no hydrogen 2.831 N/A CYS 322.A N VAL 309.A O no hydrogen 2.800 N/A LEU 326.A N PHE 323.A O no hydrogen 2.817 N/A ASN 327.A N PHE 323.A O no hydrogen 3.345 N/A ARG 328.A N GLN 324.A O no hydrogen 2.899 N/A ASP 330.A N ASN 327.A O no hydrogen 2.898 N/A GLN 334.A NE2 HIS 626.A O no hydrogen 2.983 N/A GLN 334.A NE2 THR 629.A O no hydrogen 2.643 N/A ILE 337.A N GLN 334.A O no hydrogen 3.400 N/A GLU 338.A N LEU 353.A O no hydrogen 2.947 N/A GLY 340.A N VAL 351.A O no hydrogen 2.932 N/A TYR 341.A N ILE 296.A O no hydrogen 3.035 N/A ILE 342.A N PHE 349.A O no hydrogen 2.941 N/A ALA 344.A N LYS 347.A O no hydrogen 2.511 N/A LYS 347.A N ALA 344.A O no hydrogen 3.284 N/A LYS 347.A NZ PRO 345.A O no hydrogen 2.939 N/A PHE 349.A N ILE 342.A O no hydrogen 2.921 N/A VAL 351.A N GLY 340.A O no hydrogen 2.880 N/A VAL 352.A N GLY 375.A O no hydrogen 2.749 N/A LEU 353.A N GLU 338.A O no hydrogen 2.864 N/A ASP 354.A N VAL 377.A O no hydrogen 2.913 N/A SER 355.A N GLU 336.A O no hydrogen 2.914 N/A SER 355.A OG ASP 390.A O no hydrogen 2.749 N/A ARG 357.A N SER 355.A OG no hydrogen 3.237 N/A ARG 357.A NH1 ASP 330.A OD2 no hydrogen 3.258 N/A ARG 357.A NH2 ASP 330.A OD2 no hydrogen 3.475 N/A GLY 359.A N GLU 336.A OE1 no hydrogen 3.316 N/A ASN 360.A N ASP 330.A OD1 no hydrogen 2.734 N/A ASN 360.A ND2 ARG 328.A O no hydrogen 2.872 N/A LYS 362.A N GLY 359.A O no hydrogen 2.747 N/A PHE 364.A N LEU 361.A O no hydrogen 2.603 N/A LYS 367.A N PHE 364.A O no hydrogen 3.174 N/A LEU 369.A N PRO 365.A O no hydrogen 2.080 N/A LEU 370.A N PRO 365.A O no hydrogen 3.219 N/A ASP 373.A N ASP 154.A OD2 no hydrogen 3.373 N/A PHE 374.A N GLY 371.A O no hydrogen 3.121 N/A GLY 375.A N PRO 350.A O no hydrogen 2.568 N/A TYR 376.A N CYS 153.A O no hydrogen 3.076 N/A TYR 376.A OH ASP 354.A OD2 no hydrogen 2.979 N/A VAL 377.A N VAL 352.A O no hydrogen 2.863 N/A THR 378.A OG1 TYR 376.A OH no hydrogen 2.708 N/A ARG 379.A NE THR 378.A O no hydrogen 2.721 N/A THR 387.A N ASP 390.A OD1 no hydrogen 2.772 N/A SER 388.A OG VAL 453.A O no hydrogen 2.663 N/A LEU 389.A N THR 387.A OG1 no hydrogen 3.027 N/A ASP 390.A N THR 387.A O no hydrogen 3.353 N/A SER 391.A OG SER 388.A O no hydrogen 3.077 N/A PHE 392.A N ASP 335.A O no hydrogen 2.778 N/A ASN 394.A N SER 391.A O no hydrogen 3.119 N/A ASN 394.A ND2 LEU 389.A O no hydrogen 2.694 N/A ASN 394.A ND2 GLY 416.A O no hydrogen 3.345 N/A GLU 396.A N LEU 414.A O no hydrogen 2.933 N/A SER 398.A N ARG 412.A O no hydrogen 2.768 N/A SER 398.A OG PRO 399.A O no hydrogen 3.030 N/A SER 398.A OG ARG 412.A O no hydrogen 3.431 N/A VAL 401.A N TYR 408.A O no hydrogen 2.952 N/A VAL 403.A N LYS 406.A O no hydrogen 2.925 N/A ASN 404.A ND2 ASN 404.A O no hydrogen 2.691 N/A LYS 406.A N VAL 403.A O no hydrogen 3.090 N/A TYR 408.A N VAL 401.A O no hydrogen 2.858 N/A GLY 411.A N TYR 408.A O no hydrogen 3.319 N/A ARG 412.A N SER 398.A OG no hydrogen 2.709 N/A ARG 412.A NE ALA 442.A O no hydrogen 2.886 N/A ARG 412.A NH1 GLU 542.A O no hydrogen 3.117 N/A ARG 412.A NH1 GLU 542.A OE1 no hydrogen 3.048 N/A ARG 412.A NH2 ALA 442.A O no hydrogen 3.242 N/A ILE 413.A N GLN 441.A O no hydrogen 3.194 N/A LEU 414.A N GLU 396.A O no hydrogen 2.877 N/A ILE 415.A N VAL 444.A O no hydrogen 2.932 N/A GLY 416.A N ASN 394.A OD1 no hydrogen 2.893 N/A SER 417.A OG SER 418.A O no hydrogen 3.255 N/A SER 417.A OG GLU 445.A OE2 no hydrogen 3.327 N/A SER 418.A N SER 417.A OG no hydrogen 2.598 N/A SER 418.A OG SER 422.A OG no hydrogen 3.368 N/A SER 418.A OG ARG 425.A O no hydrogen 2.788 N/A SER 422.A N PHE 419.A O no hydrogen 3.005 N/A SER 422.A OG PHE 419.A O no hydrogen 2.473 N/A GLY 424.A N SER 422.A OG no hydrogen 3.052 N/A ARG 425.A N ASP 449.A OD2 no hydrogen 3.115 N/A ARG 425.A NE ASP 449.A OD1 no hydrogen 2.967 N/A ARG 425.A NH1 THR 452.A O no hydrogen 3.137 N/A ARG 425.A NH2 ASP 449.A OD1 no hydrogen 3.281 N/A ARG 425.A NH2 THR 452.A O no hydrogen 2.933 N/A ARG 426.A NE GLU 445.A OE2 no hydrogen 3.274 N/A ARG 426.A NH2 GLU 445.A OE1 no hydrogen 2.937 N/A THR 428.A N ASP 390.A OD2 no hydrogen 2.458 N/A THR 428.A OG1 ASP 390.A OD2 no hydrogen 2.672 N/A LYS 429.A N GLU 384.A OE1 no hydrogen 2.795 N/A LYS 429.A NZ ASP 433.A OD2 no hydrogen 2.396 N/A ARG 432.A N THR 428.A O no hydrogen 3.225 N/A ARG 432.A NE MET 427.A O no hydrogen 2.701 N/A ARG 432.A NH2 MET 427.A O no hydrogen 3.020 N/A ASP 433.A N LYS 429.A O no hydrogen 2.886 N/A PHE 434.A N VAL 430.A O no hydrogen 2.921 N/A LEU 435.A N VAL 431.A O no hydrogen 2.908 N/A LYS 436.A N ARG 432.A O no hydrogen 2.901 N/A ALA 437.A N ASP 433.A O no hydrogen 2.894 N/A GLN 438.A N PHE 434.A O no hydrogen 2.935 N/A GLN 438.A N LEU 435.A O no hydrogen 3.266 N/A GLN 438.A NE2 PRO 256.A O no hydrogen 2.640 N/A GLN 438.A NE2 PHE 434.A O no hydrogen 3.093 N/A GLN 439.A N LEU 435.A O no hydrogen 3.460 N/A VAL 440.A N GLN 438.A O no hydrogen 2.733 N/A GLN 441.A NE2 MET 297.A O no hydrogen 2.959 N/A GLN 441.A NE2 LEU 410.A O no hydrogen 2.498 N/A VAL 444.A N ILE 413.A O no hydrogen 2.645 N/A LEU 446.A N ILE 415.A O no hydrogen 2.897 N/A TYR 447.A N ASN 535.A OD1 no hydrogen 2.712 N/A SER 448.A N SER 417.A O no hydrogen 3.049 N/A SER 448.A OG ASN 394.A OD1 no hydrogen 3.476 N/A SER 448.A OG GLY 454.A O no hydrogen 2.743 N/A LEU 451.A N SER 448.A O no hydrogen 3.072 N/A THR 452.A N ALA 565.A O no hydrogen 2.876 N/A THR 452.A OG1 ALA 565.A O no hydrogen 2.855 N/A HIS 455.A N GLU 458.A OE1 no hydrogen 2.853 N/A HIS 455.A NE2 SER 388.A O no hydrogen 2.841 N/A ASP 457.A N GLY 393.A O no hydrogen 3.258 N/A PHE 459.A N VAL 456.A O no hydrogen 3.290 N/A SER 461.A N LEU 474.A O no hydrogen 2.921 N/A VAL 463.A N PHE 471.A O no hydrogen 3.120 N/A GLY 467.A N ILE 465.A O no hydrogen 2.415 N/A LEU 472.A N LYS 470.A O no hydrogen 2.403 N/A LEU 474.A N SER 461.A O no hydrogen 2.862 N/A MET 475.A N ILE 551.A O no hydrogen 2.865 N/A ALA 476.A N PHE 459.A O no hydrogen 3.026 N/A SER 477.A N LEU 553.A O no hydrogen 2.607 N/A SER 477.A OG GLN 529.A OE1 no hydrogen 3.344 N/A THR 478.A N GLN 529.A OE1 no hydrogen 3.088 N/A THR 478.A OG1 ASN 525.A O no hydrogen 2.738 N/A THR 478.A OG1 GLN 529.A OE1 no hydrogen 3.316 N/A SER 479.A N GLN 529.A OE1 no hydrogen 3.462 N/A SER 479.A OG.A SER 477.A OG no hydrogen 2.417 N/A SER 479.A OG.A GLN 529.A OE1 no hydrogen 3.520 N/A SER 479.A OG.B SER 477.A OG no hydrogen 2.406 N/A SER 479.A OG.B GLN 529.A OE1 no hydrogen 3.551 N/A ALA 480.A N SER 477.A OG no hydrogen 3.057 N/A TYR 482.A N THR 478.A O no hydrogen 2.916 N/A LYS 483.A N SER 479.A O no hydrogen 2.896 N/A LYS 483.A NZ GLU 487.A OE2 no hydrogen 3.460 N/A LEU 484.A N ALA 480.A O no hydrogen 2.900 N/A PHE 485.A N CYS 481.A O no hydrogen 2.905 N/A ARG 486.A N TYR 482.A O no hydrogen 2.902 N/A GLU 487.A N LYS 483.A O no hydrogen 2.912 N/A LYS 488.A N LEU 484.A O no hydrogen 2.906 N/A GLN 489.A N PHE 485.A O no hydrogen 2.890 N/A GLN 489.A NE2 ASN 513.A OD1 no hydrogen 3.039 N/A LYS 490.A N ARG 486.A O no hydrogen 2.914 N/A ASP 491.A N LYS 488.A O no hydrogen 3.124 N/A GLY 492.A N GLN 489.A O no hydrogen 3.024 N/A HIS 493.A N LYS 488.A O no hydrogen 2.864 N/A ALA 496.A N HIS 493.A O no hydrogen 2.694 N/A MET 498.A N ILE 510.A O no hydrogen 3.045 N/A PHE 499.A N PHE 588.A O no hydrogen 2.736 N/A LYS 500.A NZ ILE 497.A O no hydrogen 2.756 N/A ILE 512.A N ALA 496.A O no hydrogen 3.241 N/A ASN 513.A N GLY 494.A O no hydrogen 2.737 N/A LYS 514.A N THR 511.A OG1 no hydrogen 3.256 N/A ILE 515.A N THR 511.A O no hydrogen 2.844 N/A LEU 516.A N ILE 512.A O no hydrogen 2.895 N/A SER 517.A N.A ASN 513.A O no hydrogen 2.701 N/A SER 517.A N.B ASN 513.A O no hydrogen 2.699 N/A SER 517.A OG.A ASN 513.A O no hydrogen 2.772 N/A SER 517.A OG.B ASN 513.A O no hydrogen 2.814 N/A SER 520.A OG GLU 524.A OE2 no hydrogen 3.162 N/A LEU 521.A N ASN 518.A OD1 no hydrogen 3.289 N/A VAL 522.A N ASN 518.A O no hydrogen 3.366 N/A GLN 523.A N GLU 519.A O no hydrogen 2.927 N/A GLU 524.A N SER 520.A O no hydrogen 2.906 N/A ASN 525.A N LEU 521.A O no hydrogen 2.905 N/A ASN 525.A ND2 LEU 521.A O no hydrogen 2.557 N/A ASN 525.A ND2 PHE 557.A O no hydrogen 2.983 N/A LEU 526.A N VAL 522.A O no hydrogen 2.905 N/A TYR 527.A N GLN 523.A O no hydrogen 2.941 N/A PHE 528.A N GLU 524.A O no hydrogen 2.887 N/A GLN 529.A N ASN 525.A O no hydrogen 2.895 N/A GLN 529.A NE2 ASP 533.A OD1 no hydrogen 2.855 N/A GLN 529.A NE2 ASP 533.A OD2 no hydrogen 3.394 N/A ARG 530.A N LEU 526.A O no hydrogen 2.926 N/A CYS 531.A N TYR 527.A O no hydrogen 2.926 N/A CYS 531.A SG TYR 527.A O no hydrogen 3.255 N/A LEU 532.A N PHE 528.A O no hydrogen 2.896 N/A ASP 533.A N GLN 529.A O no hydrogen 2.898 N/A TRP 534.A N ARG 530.A O no hydrogen 2.929 N/A ASN 535.A ND2 TYR 447.A O no hydrogen 3.270 N/A ASN 535.A ND2 CYS 531.A O no hydrogen 2.404 N/A ARG 536.A N LEU 532.A O no hydrogen 2.897 N/A ARG 536.A NE GLU 547.A OE1 no hydrogen 3.549 N/A ARG 536.A NE GLU 547.A OE2 no hydrogen 2.853 N/A ARG 536.A NH1 ASP 552.A OD1 no hydrogen 2.380 N/A ARG 536.A NH2 GLU 547.A OE2 no hydrogen 2.436 N/A ARG 536.A NH2 ASP 552.A OD2 no hydrogen 3.019 N/A ASP 537.A N ASP 533.A O no hydrogen 2.908 N/A ILE 538.A N TRP 534.A O no hydrogen 2.938 N/A LEU 539.A N ASN 535.A O no hydrogen 2.876 N/A LYS 540.A N ARG 536.A O no hydrogen 2.915 N/A LYS 540.A NZ GLU 547.A OE1 no hydrogen 3.413 N/A LYS 541.A N ASP 537.A O no hydrogen 2.918 N/A LYS 541.A NZ GLU 542.A OE2 no hydrogen 3.392 N/A GLU 542.A N ILE 538.A O no hydrogen 2.881 N/A LEU 543.A N LEU 539.A O no hydrogen 2.874 N/A GLY 544.A N LYS 541.A O no hydrogen 3.408 N/A LEU 545.A N LYS 540.A O no hydrogen 3.020 N/A THR 546.A N ASP 549.A OD2 no hydrogen 3.256 N/A THR 546.A OG1 ASP 549.A OD2 no hydrogen 3.068 N/A ASP 549.A N THR 546.A O no hydrogen 3.306 N/A ILE 551.A N LEU 473.A O no hydrogen 2.905 N/A LEU 553.A N MET 475.A O no hydrogen 2.639 N/A ALA 555.A N SER 477.A O no hydrogen 2.704 N/A PHE 557.A N ASN 525.A OD1 no hydrogen 2.779 N/A LYS 558.A N ARG 566.A O no hydrogen 2.865 N/A LYS 558.A NZ MET 559.A O no hydrogen 2.807 N/A MET 559.A N GLU 524.A OE1 no hydrogen 2.870 N/A ASP 560.A N ARG 564.A O no hydrogen 2.894 N/A ASP 562.A N ASP 560.A OD1 no hydrogen 3.296 N/A HIS 563.A N ASP 560.A O no hydrogen 3.063 N/A ARG 564.A N ASP 560.A OD1 no hydrogen 2.687 N/A ARG 564.A NE ASP 449.A O no hydrogen 2.925 N/A ALA 565.A N TRP 450.A O no hydrogen 2.827 N/A ARG 566.A N LYS 558.A O no hydrogen 2.912 N/A PHE 568.A N LEU 556.A O no hydrogen 2.794 N/A ASN 571.A ND2 GLU 458.A O no hydrogen 2.540 N/A ASN 574.A ND2 GLU 624.A OE1 no hydrogen 3.188 N/A LEU 582.A N GLU 612.A O no hydrogen 2.786 N/A GLY 583.A N ILE 576.A O no hydrogen 2.932 N/A LYS 586.A N ILE 616.A O no hydrogen 2.620 N/A LYS 586.A NZ GLU 599.A OE2 no hydrogen 3.159 N/A VAL 592.A N GLU 595.A O no hydrogen 2.617 N/A GLU 595.A N VAL 592.A O no hydrogen 2.763 N/A CYS 597.A N PRO 590.A O no hydrogen 3.203 N/A MET 600.A N CYS 596.A O no hydrogen 3.212 N/A HIS 601.A N CYS 597.A O no hydrogen 2.899 N/A VAL 602.A N LEU 598.A O no hydrogen 2.912 N/A ARG 603.A N GLU 599.A O no hydrogen 2.903 N/A ARG 603.A NH1 GLU 607.A OE2 no hydrogen 2.334 N/A GLY 604.A N MET 600.A O no hydrogen 2.896 N/A LEU 605.A N HIS 601.A O no hydrogen 2.910 N/A LEU 606.A N VAL 602.A O no hydrogen 2.901 N/A GLU 607.A N ARG 603.A O no hydrogen 2.731 N/A LEU 609.A N LEU 606.A O no hydrogen 2.775 N/A THR 614.A N LEU 582.A O no hydrogen 3.018 N/A ILE 616.A N ILE 584.A O no hydrogen 3.036 N/A HIS 619.A ND1 GLU 624.A OE2 no hydrogen 2.671 N/A HIS 626.A N GLU 624.A O no hydrogen 2.428 N/A HIS 626.A ND1 MET 575.A O no hydrogen 3.076 N/A HIS 626.A NE2 GLU 396.A OE2 no hydrogen 2.953 N/A THR 629.A N HIS 626.A O no hydrogen 3.195 N/A THR 629.A OG1 VAL 625.A O no hydrogen 2.302 N/A ASN 630.A N PHE 308.A O no hydrogen 3.050 N/A ARG 632.A N SER 306.A O no hydrogen 2.657 N/A ARG 633.A NH2 VAL 577.A O no hydrogen 2.633 N/A LYS 634.A N PRO 303.A O no hydrogen 2.772 N/A LYS 639.A NZ THR 637.A O no hydrogen 2.834 N/A TRP 640.A NE1 GLU 343.A O no hydrogen 3.045 N/A HIS 642.A N LYS 639.A O no hydrogen 3.027 N/A MET 643.A N TRP 640.A O no hydrogen 3.167 N/A