Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4h4k_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 8.A OG1 VAL 161.A O no hydrogen 3.459 N/A LEU 9.A N VAL 161.A O no hydrogen 2.934 N/A LEU 10.A N ALA 92.A O no hydrogen 2.807 N/A ARG 11.A N THR 159.A O no hydrogen 2.694 N/A ILE 12.A N ALA 90.A O no hydrogen 2.735 N/A LYS 13.A N SER 157.A O no hydrogen 2.858 N/A ILE 14.A N ASN 88.A O no hydrogen 2.947 N/A VAL 15.A N THR 155.A O no hydrogen 3.065 N/A ILE 21.A N VAL 17.A O no hydrogen 3.202 N/A ALA 22.A N GLN 18.A O no hydrogen 2.726 N/A ASN 23.A N PRO 19.A O no hydrogen 3.287 N/A ASN 23.A N PHE 20.A O no hydrogen 3.190 N/A SER 24.A N ALA 22.A O no hydrogen 2.719 N/A SER 24.A OG ILE 21.A O no hydrogen 2.214 N/A ARG 25.A N ASP 29.A OD2 no hydrogen 3.077 N/A ARG 25.A NH1 GLU 251.A OE1 no hydrogen 2.398 N/A LYS 26.A N ASP 29.A OD2 no hydrogen 3.174 N/A LYS 26.A NZ SER 279.A OG no hydrogen 2.548 N/A LEU 30.A N LYS 26.A O no hydrogen 2.958 N/A TRP 31.A N GLN 27.A O no hydrogen 2.645 N/A TRP 31.A NE1 LEU 82.A O no hydrogen 3.115 N/A ALA 32.A N LEU 28.A O no hydrogen 2.894 N/A SER 33.A N ASP 29.A O no hydrogen 2.886 N/A SER 33.A OG ASP 29.A O no hydrogen 2.241 N/A SER 34.A N LEU 30.A O no hydrogen 3.239 N/A HIS 35.A N TRP 31.A O no hydrogen 2.791 N/A HIS 35.A ND1 TYR 263.A OH no hydrogen 2.608 N/A HIS 35.A NE2 ILE 81.A O no hydrogen 2.897 N/A LEU 36.A N ALA 32.A O no hydrogen 2.782 N/A LEU 37.A N SER 33.A O no hydrogen 3.221 N/A SER 38.A N SER 34.A O no hydrogen 3.319 N/A SER 38.A OG LEU 86.A O no hydrogen 2.423 N/A MET 39.A N HIS 35.A O no hydrogen 3.031 N/A LEU 40.A N LEU 36.A O no hydrogen 2.924 N/A MET 41.A N LEU 37.A O no hydrogen 3.248 N/A TYR 42.A N SER 38.A O no hydrogen 2.995 N/A LYS 43.A N MET 39.A O no hydrogen 2.850 N/A ALA 44.A N LEU 40.A O no hydrogen 2.877 N/A LEU 45.A N MET 41.A O no hydrogen 2.448 N/A GLU 46.A N TYR 42.A O no hydrogen 2.579 N/A VAL 49.A N LEU 45.A O no hydrogen 3.085 N/A ASP 50.A N GLU 46.A O no hydrogen 2.658 N/A LYS 51.A N VAL 47.A O no hydrogen 2.978 N/A PHE 52.A N ILE 48.A O no hydrogen 2.466 N/A GLY 53.A N ILE 48.A O no hydrogen 3.308 N/A GLU 55.A N GLU 55.A OE1 no hydrogen 2.597 N/A HIS 56.A N GLY 53.A O no hydrogen 3.386 N/A VAL 57.A N PRO 54.A O no hydrogen 2.534 N/A ILE 58.A N LEU 91.A O no hydrogen 3.070 N/A TYR 59.A N LEU 91.A O no hydrogen 3.309 N/A GLN 65.A N LEU 62.A O no hydrogen 2.805 N/A GLN 65.A NE2 SER 61.A O no hydrogen 2.076 N/A LEU 69.A N GLN 65.A O no hydrogen 2.841 N/A LYS 70.A N PRO 66.A O no hydrogen 2.566 N/A TYR 72.A N PHE 68.A O no hydrogen 3.035 N/A TYR 72.A OH ASP 50.A OD1 no hydrogen 2.120 N/A GLU 75.A N LEU 69.A O no hydrogen 2.749 N/A ILE 81.A N GLY 78.A O no hydrogen 2.802 N/A LEU 82.A N ASP 79.A O no hydrogen 3.115 N/A ALA 84.A N ILE 405.A O no hydrogen 2.935 N/A LEU 86.A N SER 38.A OG no hydrogen 3.078 N/A ASN 88.A ND2 ILE 14.A O no hydrogen 2.737 N/A ALA 90.A N ILE 12.A O no hydrogen 3.029 N/A LEU 91.A N TYR 59.A O no hydrogen 2.926 N/A ALA 92.A N LEU 10.A O no hydrogen 2.797 N/A ILE 93.A N HIS 56.A O no hydrogen 2.900 N/A VAL 94.A N THR 8.A O no hydrogen 2.758 N/A GLY 96.A N ASP 6.A O no hydrogen 3.289 N/A LYS 101.A NZ GLU 105.A OE1 no hydrogen 3.174 N/A ILE 102.A N GLU 98.A O no hydrogen 3.002 N/A GLU 103.A N ALA 99.A O no hydrogen 2.961 N/A GLU 104.A N GLU 100.A O no hydrogen 3.069 N/A GLU 105.A N LYS 101.A O no hydrogen 2.826 N/A ILE 106.A N ILE 102.A O no hydrogen 2.919 N/A LYS 107.A N GLU 103.A O no hydrogen 3.252 N/A LYS 107.A NZ GLU 211.A OE1 no hydrogen 2.850 N/A LYS 108.A N GLU 104.A O no hydrogen 3.030 N/A LYS 108.A NZ ASP 112.A OD2 no hydrogen 2.315 N/A ARG 109.A N GLU 105.A O no hydrogen 2.500 N/A ARG 109.A NH2 GLU 105.A OE2 no hydrogen 2.568 N/A ILE 110.A N ILE 106.A O no hydrogen 2.896 N/A ARG 111.A N LYS 107.A O no hydrogen 2.931 N/A ASP 112.A N LYS 108.A O no hydrogen 2.703 N/A PHE 113.A N ARG 109.A O no hydrogen 3.037 N/A LEU 114.A N ILE 110.A O no hydrogen 2.813 N/A LEU 115.A N ARG 111.A O no hydrogen 3.201 N/A GLN 116.A N ASP 112.A O no hydrogen 3.043 N/A LEU 117.A N PHE 113.A O no hydrogen 3.326 N/A TYR 118.A N LEU 114.A O no hydrogen 3.085 N/A TYR 118.A OH MET 141.A O no hydrogen 2.441 N/A ARG 119.A N LEU 115.A O no hydrogen 3.093 N/A GLU 120.A N GLN 116.A O no hydrogen 2.781 N/A ALA 121.A N LEU 117.A O no hydrogen 2.584 N/A VAL 122.A N TYR 118.A O no hydrogen 2.612 N/A ASP 123.A N ARG 119.A O no hydrogen 3.039 N/A TRP 124.A N GLU 120.A O no hydrogen 2.892 N/A ALA 125.A N ALA 121.A O no hydrogen 2.736 N/A VAL 126.A N VAL 122.A O no hydrogen 3.107 N/A GLU 127.A N ASP 123.A O no hydrogen 2.977 N/A ASN 128.A N TRP 124.A O no hydrogen 3.053 N/A ASN 128.A ND2 TRP 124.A O no hydrogen 3.549 N/A VAL 130.A N ALA 125.A O no hydrogen 2.830 N/A VAL 131.A N ALA 125.A O no hydrogen 3.294 N/A GLU 137.A N ASP 134.A O no hydrogen 2.786 N/A LYS 138.A N ARG 135.A O no hydrogen 3.128 N/A SER 140.A N GLU 137.A O no hydrogen 2.762 N/A MET 141.A N LYS 138.A O no hydrogen 2.779 N/A LEU 142.A N ASP 139.A O no hydrogen 3.223 N/A LYS 143.A NZ ASP 236.A OD2 no hydrogen 2.575 N/A TYR 146.A N LYS 143.A O no hydrogen 3.076 N/A TYR 146.A OH ASP 236.A OD1 no hydrogen 2.987 N/A LEU 147.A N LYS 143.A O no hydrogen 3.042 N/A LYS 148.A N GLU 144.A O no hydrogen 2.759 N/A LYS 148.A NZ GLU 217.A O no hydrogen 3.401 N/A VAL 150.A N TYR 146.A O no hydrogen 3.463 N/A ARG 151.A N LEU 147.A O no hydrogen 3.058 N/A ARG 151.A NH2 GLU 144.A OE2 no hydrogen 2.033 N/A GLU 152.A N LYS 148.A O no hydrogen 2.910 N/A TYR 153.A N ILE 149.A O no hydrogen 3.023 N/A THR 155.A N VAL 15.A O no hydrogen 2.864 N/A THR 155.A OG1 GLU 211.A O no hydrogen 3.365 N/A SER 157.A N LYS 13.A O no hydrogen 2.638 N/A SER 157.A OG GLU 211.A OE1 no hydrogen 3.178 N/A THR 159.A N ARG 11.A O no hydrogen 2.983 N/A VAL 161.A N LEU 9.A O no hydrogen 2.917 N/A SER 162.A OG SER 164.A O no hydrogen 2.376 N/A LEU 163.A N PRO 7.A O no hydrogen 3.229 N/A TYR 170.A N ASP 168.A OD1 no hydrogen 2.480 N/A VAL 172.A N ASP 168.A O no hydrogen 2.865 N/A THR 173.A N ILE 169.A O no hydrogen 3.022 N/A THR 173.A OG1 ILE 169.A O no hydrogen 2.658 N/A GLU 174.A N TYR 170.A O no hydrogen 3.257 N/A ASN 175.A N GLN 171.A O no hydrogen 3.242 N/A ASP 180.A N ASP 182.A OD2 no hydrogen 3.176 N/A TRP 186.A N ASP 182.A O no hydrogen 2.023 N/A LEU 187.A N ASP 182.A O no hydrogen 3.009 N/A LEU 187.A N VAL 183.A O no hydrogen 3.278 N/A LYS 188.A NZ GLU 167.A OE2 no hydrogen 3.198 N/A TYR 193.A OH HIS 379.A ND1 no hydrogen 2.822 N/A LEU 196.A N ILE 192.A O no hydrogen 2.833 N/A VAL 197.A N TYR 193.A O no hydrogen 2.920 N/A ILE 199.A N LEU 195.A O no hydrogen 3.304 N/A LEU 200.A N LEU 196.A O no hydrogen 3.239 N/A ASP 201.A N VAL 197.A O no hydrogen 3.105 N/A SER 202.A N LYS 198.A O no hydrogen 3.154 N/A LEU 203.A N ILE 199.A O no hydrogen 2.553 N/A GLY 204.A N LEU 200.A O no hydrogen 2.311 N/A GLU 205.A N ASP 201.A O no hydrogen 2.629 N/A ARG 206.A N LEU 203.A O no hydrogen 3.118 N/A LYS 207.A N LEU 203.A O no hydrogen 3.391 N/A LYS 207.A NZ ILE 158.A O no hydrogen 1.753 N/A VAL 208.A N GLY 204.A O no hydrogen 3.025 N/A THR 209.A N GLU 205.A O no hydrogen 3.446 N/A THR 209.A OG1 GLU 205.A O no hydrogen 2.408 N/A GLU 210.A N ARG 206.A O no hydrogen 3.432 N/A GLU 211.A N LYS 207.A O no hydrogen 2.903 N/A ARG 212.A N VAL 208.A O no hydrogen 2.889 N/A PHE 213.A N GLU 210.A O no hydrogen 3.161 N/A SER 216.A N GLU 152.A OE1 no hydrogen 2.738 N/A SER 216.A N GLU 152.A OE2 no hydrogen 3.299 N/A GLN 218.A NE2 ASN 230.A OD1 no hydrogen 3.193 N/A TRP 222.A N GLY 235.A O no hydrogen 3.432 N/A TRP 222.A NE1 TYR 238.A O no hydrogen 2.968 N/A LYS 223.A NZ GLY 221.A O no hydrogen 2.824 N/A CYS 224.A N ASN 230.A O no hydrogen 2.996 N/A HIS 225.A N PRO 252.A O no hydrogen 3.270 N/A LEU 231.A N GLN 218.A OE1 no hydrogen 3.077 N/A ALA 232.A N TRP 222.A O no hydrogen 2.525 N/A ILE 233.A N LEU 253.A O no hydrogen 3.190 N/A PHE 234.A N TYR 146.A OH no hydrogen 2.925 N/A GLY 235.A N ALA 232.A O no hydrogen 2.492 N/A ASP 236.A N ASP 236.A OD1 no hydrogen 2.367 N/A MET 237.A N PHE 234.A O no hydrogen 3.105 N/A TYR 238.A N PHE 234.A O no hydrogen 3.402 N/A ASN 242.A N ASP 239.A OD2 no hydrogen 3.488 N/A ASN 242.A ND2 ASP 239.A OD1 no hydrogen 2.849 N/A LEU 243.A N ASP 239.A O no hydrogen 2.969 N/A LYS 244.A N HIS 240.A O no hydrogen 2.811 N/A LYS 244.A NZ HIS 225.A NE2 no hydrogen 2.909 N/A SER 245.A N ASP 241.A O no hydrogen 3.121 N/A LEU 246.A N LEU 243.A O no hydrogen 3.116 N/A TRP 247.A N LYS 244.A O no hydrogen 3.294 N/A LEU 248.A N VAL 130.A O no hydrogen 3.221 N/A GLU 250.A N TRP 247.A O no hydrogen 3.181 N/A LEU 258.A N CYS 254.A O no hydrogen 2.858 N/A ILE 259.A N PRO 255.A O no hydrogen 2.799 N/A LYS 260.A NZ PHE 20.A O no hydrogen 2.892 N/A LYS 260.A NZ ASN 23.A O no hydrogen 2.680 N/A ARG 261.A N CYS 257.A O no hydrogen 3.173 N/A ARG 261.A NE ASP 29.A OD1 no hydrogen 2.758 N/A ARG 261.A NE ASP 29.A OD2 no hydrogen 3.442 N/A ARG 261.A NH2 ASP 29.A OD2 no hydrogen 3.121 N/A TYR 262.A N LEU 258.A O no hydrogen 2.998 N/A TYR 262.A OH GLU 120.A OE1 no hydrogen 3.031 N/A TYR 263.A N ILE 259.A O no hydrogen 2.711 N/A TYR 263.A OH HIS 35.A ND1 no hydrogen 2.608 N/A TRP 266.A N TYR 262.A O no hydrogen 3.195 N/A ILE 267.A N TYR 263.A O no hydrogen 3.152 N/A ARG 268.A N PRO 264.A O no hydrogen 3.289 N/A SER 269.A N VAL 265.A O no hydrogen 2.930 N/A SER 269.A OG VAL 265.A O no hydrogen 3.251 N/A LYS 270.A N TRP 266.A O no hydrogen 2.948 N/A THR 271.A N ILE 267.A O no hydrogen 2.401 N/A GLY 272.A N ARG 268.A O no hydrogen 2.159 N/A LYS 274.A NZ GLU 278.A OE2 no hydrogen 3.204 N/A GLU 278.A N ASP 282.A OD2 no hydrogen 3.248 N/A SER 279.A N ASP 282.A OD2 no hydrogen 3.086 N/A VAL 281.A N SER 279.A OG no hydrogen 3.142 N/A VAL 283.A N SER 279.A O no hydrogen 3.338 N/A ALA 284.A N VAL 280.A O no hydrogen 2.626 N/A LEU 285.A N VAL 281.A O no hydrogen 2.952 N/A LEU 286.A N VAL 283.A O no hydrogen 3.178 N/A TYR 287.A N ALA 284.A O no hydrogen 3.213 N/A TYR 287.A OH PRO 604.A O no hydrogen 1.823 N/A LYS 288.A N ASP 419.A OD2 no hydrogen 2.904 N/A LYS 288.A NZ TYR 287.A OH no hydrogen 3.410 N/A ASN 289.A N LEU 286.A O no hydrogen 2.672 N/A TRP 290.A N TYR 287.A O no hydrogen 3.174 N/A TRP 290.A NE1 GLY 355.A O no hydrogen 3.206 N/A ARG 291.A N LEU 285.A O no hydrogen 3.208 N/A ARG 291.A NH1 ASP 282.A OD1 no hydrogen 3.519 N/A ILE 293.A N ASN 289.A O no hydrogen 3.085 N/A PHE 294.A N TRP 290.A O no hydrogen 2.891 N/A ASP 295.A N ARG 291.A O no hydrogen 2.812 N/A GLU 296.A N LYS 292.A O no hydrogen 3.244 N/A LYS 297.A N ILE 293.A O no hydrogen 2.827 N/A TYR 298.A N PHE 294.A O no hydrogen 2.665 N/A GLY 299.A N PHE 294.A O no hydrogen 2.829 N/A LYS 300.A NZ LYS 297.A O no hydrogen 1.990 N/A LYS 300.A NZ ASP 301.A OD1 no hydrogen 3.208 N/A LEU 302.A N TYR 298.A O no hydrogen 2.992 N/A SER 304.A N ASP 301.A O no hydrogen 3.096 N/A SER 304.A OG ASP 301.A O no hydrogen 3.385 N/A ALA 306.A N LEU 302.A O no hydrogen 3.030 N/A ARG 307.A N VAL 303.A O no hydrogen 1.977 N/A ARG 307.A NH1 ASN 317.A OD1 no hydrogen 3.316 N/A GLU 308.A N SER 304.A O no hydrogen 2.333 N/A VAL 309.A N LYS 305.A O no hydrogen 3.036 N/A SER 310.A N ALA 306.A O no hydrogen 2.967 N/A ASP 312.A N ASP 312.A OD1 no hydrogen 2.454 N/A PHE 313.A N SER 310.A O no hydrogen 3.398 N/A MET 318.A N LYS 315.A O no hydrogen 3.061 N/A SER 322.A OG ASP 282.A OD1 no hydrogen 2.240 N/A LEU 324.A N ASP 321.A O no hydrogen 3.214 N/A TYR 325.A N SER 322.A O no hydrogen 2.888 N/A TYR 326.A N ASP 323.A O no hydrogen 3.178 N/A TYR 326.A OH PRO 358.A O no hydrogen 2.562 N/A SER 327.A N TYR 351.A OH no hydrogen 3.256 N/A SER 327.A OG TYR 351.A OH no hydrogen 2.864 N/A THR 329.A N TYR 326.A O no hydrogen 2.961 N/A THR 329.A OG1 ASP 323.A O no hydrogen 2.292 N/A THR 329.A OG1 TYR 326.A O no hydrogen 2.874 N/A TRP 330.A NE1 LEU 324.A O no hydrogen 2.810 N/A GLU 331.A N SER 327.A O no hydrogen 2.749 N/A SER 332.A N SER 328.A O no hydrogen 2.950 N/A SER 332.A N THR 329.A O no hydrogen 3.318 N/A GLU 338.A N GLU 338.A OE1 no hydrogen 2.833 N/A VAL 340.A N GLU 337.A O no hydrogen 3.315 N/A LYS 341.A N GLU 338.A O no hydrogen 3.336 N/A VAL 343.A N LYS 339.A O no hydrogen 3.390 N/A VAL 344.A N VAL 340.A O no hydrogen 3.045 N/A ASP 345.A N LYS 341.A O no hydrogen 2.824 N/A PHE 346.A N GLU 342.A O no hydrogen 2.137 N/A LEU 347.A N VAL 343.A O no hydrogen 2.320 N/A ASN 348.A N VAL 344.A O no hydrogen 2.721 N/A ASN 348.A ND2 VAL 344.A O no hydrogen 1.910 N/A ALA 349.A N ASP 345.A O no hydrogen 2.949 N/A ALA 350.A N PHE 346.A O no hydrogen 2.970 N/A TYR 351.A N LEU 347.A O no hydrogen 2.808 N/A TYR 351.A OH TYR 325.A O no hydrogen 2.637 N/A TYR 351.A OH SER 327.A OG no hydrogen 2.864 N/A LYS 352.A N ASN 348.A O no hydrogen 3.056 N/A ILE 354.A N ALA 350.A O no hydrogen 3.130 N/A GLY 355.A N TYR 351.A O no hydrogen 2.560 N/A LYS 359.A NZ SER 328.A OG no hydrogen 3.328 N/A TYR 361.A N VAL 454.A O no hydrogen 3.170 N/A ALA 362.A N LEU 416.A O no hydrogen 2.591 N/A ILE 363.A N LEU 452.A O no hydrogen 2.852 N/A LEU 364.A N ALA 414.A O no hydrogen 2.699 N/A VAL 365.A N GLY 450.A O no hydrogen 3.016 N/A MET 366.A N VAL 412.A O no hydrogen 2.987 N/A ASP 367.A N SER 448.A O no hydrogen 2.901 N/A GLY 368.A N ASP 367.A OD2 no hydrogen 2.922 N/A ASP 369.A N LYS 446.A O no hydrogen 3.216 N/A LYS 373.A NZ GLY 444.A O no hydrogen 3.309 N/A GLN 377.A N GLN 377.A OE1 no hydrogen 1.931 N/A HIS 379.A N THR 375.A O no hydrogen 2.899 N/A VAL 380.A N PRO 376.A O no hydrogen 2.952 N/A ALA 381.A N GLN 377.A O no hydrogen 3.140 N/A ILE 382.A N VAL 378.A O no hydrogen 3.402 N/A SER 383.A N HIS 379.A O no hydrogen 3.028 N/A SER 383.A OG ILE 58.A O no hydrogen 3.013 N/A SER 383.A OG HIS 379.A O no hydrogen 2.822 N/A GLN 384.A N VAL 380.A O no hydrogen 2.725 N/A ALA 385.A N ALA 381.A O no hydrogen 2.853 N/A LEU 386.A N ILE 382.A O no hydrogen 2.818 N/A ALA 387.A N SER 383.A O no hydrogen 2.781 N/A ASN 388.A N GLN 384.A O no hydrogen 2.810 N/A PHE 389.A N ALA 385.A O no hydrogen 2.784 N/A SER 390.A N LEU 386.A O no hydrogen 2.884 N/A SER 390.A OG LEU 386.A O no hydrogen 2.781 N/A SER 390.A OG ALA 387.A O no hydrogen 2.662 N/A ILE 391.A N ALA 387.A O no hydrogen 2.768 N/A ARG 392.A N ASN 388.A O no hydrogen 2.994 N/A ARG 392.A NH1 ASP 64.A OD2 no hydrogen 3.414 N/A GLU 393.A N ASN 388.A O no hydrogen 3.459 N/A VAL 394.A N PHE 389.A O no hydrogen 2.936 N/A SER 396.A N ARG 392.A O no hydrogen 2.976 N/A SER 396.A OG ARG 392.A O no hydrogen 3.251 N/A SER 396.A OG GLU 393.A O no hydrogen 2.512 N/A VAL 397.A N GLU 393.A O no hydrogen 3.311 N/A VAL 398.A N VAL 394.A O no hydrogen 2.985 N/A GLU 401.A N VAL 398.A O no hydrogen 2.781 N/A LEU 403.A N ILE 415.A O no hydrogen 2.830 N/A ILE 405.A N LEU 413.A O no hydrogen 3.117 N/A TYR 406.A N LEU 413.A O no hydrogen 3.146 N/A TYR 406.A OH ASP 411.A OD1 no hydrogen 3.236 N/A ALA 407.A N ALA 84.A O no hydrogen 2.935 N/A GLY 408.A N ASP 411.A O no hydrogen 3.294 N/A ASP 411.A N ASP 410.A OD1 no hydrogen 2.832 N/A VAL 412.A N MET 366.A O no hydrogen 2.638 N/A LEU 413.A N TYR 406.A O no hydrogen 2.924 N/A ALA 414.A N LEU 364.A O no hydrogen 2.789 N/A ILE 415.A N LEU 403.A O no hydrogen 2.806 N/A LEU 416.A N ALA 362.A O no hydrogen 2.823 N/A LYS 420.A N PRO 417.A O no hydrogen 3.101 N/A LYS 420.A NZ GLU 423.A OE1 no hydrogen 3.285 N/A ALA 421.A N VAL 418.A O no hydrogen 3.274 N/A VAL 424.A N LYS 420.A O no hydrogen 2.931 N/A ALA 425.A N ALA 421.A O no hydrogen 3.051 N/A TYR 426.A N LEU 422.A O no hydrogen 3.142 N/A TYR 426.A OH GLU 503.A OE1 no hydrogen 2.892 N/A TYR 426.A OH GLU 503.A OE2 no hydrogen 3.202 N/A LYS 427.A N GLU 423.A O no hydrogen 3.178 N/A LYS 427.A NZ GLU 423.A OE2 no hydrogen 3.259 N/A ILE 428.A N VAL 424.A O no hydrogen 2.904 N/A ARG 429.A N ALA 425.A O no hydrogen 2.860 N/A ARG 429.A NE ASP 482.A OD2 no hydrogen 2.784 N/A ARG 429.A NH2 ASP 482.A OD2 no hydrogen 2.297 N/A LYS 430.A N TYR 426.A O no hydrogen 2.828 N/A LYS 430.A NZ GLU 503.A OE2 no hydrogen 3.501 N/A GLU 431.A N LYS 427.A O no hydrogen 2.909 N/A PHE 432.A N ILE 428.A O no hydrogen 2.796 N/A GLY 433.A N ARG 429.A O no hydrogen 2.806 N/A LYS 434.A N LYS 430.A O no hydrogen 2.720 N/A SER 435.A N GLU 431.A O no hydrogen 2.898 N/A SER 435.A OG GLU 431.A O no hydrogen 2.628 N/A PHE 436.A N GLY 433.A O no hydrogen 3.173 N/A GLU 437.A N LYS 434.A O no hydrogen 2.558 N/A ASN 438.A N GLY 433.A O no hydrogen 3.344 N/A LYS 446.A NZ GLY 480.A O no hydrogen 3.165 N/A LEU 447.A N ASP 482.A OD2 no hydrogen 3.133 N/A SER 448.A N ASP 367.A O no hydrogen 3.058 N/A SER 448.A OG ASP 369.A OD2 no hydrogen 1.725 N/A ALA 449.A N THR 483.A O no hydrogen 2.971 N/A GLY 450.A N VAL 365.A O no hydrogen 2.665 N/A ILE 451.A N ALA 485.A O no hydrogen 2.827 N/A LEU 452.A N ILE 363.A O no hydrogen 3.077 N/A ILE 453.A N GLY 487.A O no hydrogen 2.836 N/A VAL 454.A N TYR 361.A O no hydrogen 3.025 N/A TYR 456.A N LYS 359.A O no hydrogen 2.926 N/A LYS 457.A N HIS 455.A ND1 no hydrogen 3.192 N/A HIS 458.A N HIS 455.A O no hydrogen 2.961 N/A HIS 458.A NE2 ASP 462.A OD2 no hydrogen 2.357 N/A ALA 463.A N PRO 459.A O no hydrogen 3.188 N/A LEU 464.A N LEU 460.A O no hydrogen 2.982 N/A GLU 465.A N TYR 461.A O no hydrogen 3.094 N/A LYS 466.A N ASP 462.A O no hydrogen 3.004 N/A LYS 466.A NZ ASP 462.A OD1 no hydrogen 3.062 N/A ALA 467.A N ALA 463.A O no hydrogen 2.923 N/A ARG 468.A N LEU 464.A O no hydrogen 3.018 N/A ASP 469.A N GLU 465.A O no hydrogen 2.961 N/A LEU 470.A N LYS 466.A O no hydrogen 2.825 N/A LEU 471.A N ALA 467.A O no hydrogen 3.229 N/A ASN 472.A N ARG 468.A O no hydrogen 2.870 N/A ASN 473.A N ASP 469.A O no hydrogen 2.695 N/A ASN 473.A ND2 ASP 469.A OD1 no hydrogen 2.650 N/A LYS 474.A N LEU 470.A O no hydrogen 3.229 N/A ALA 475.A N LEU 470.A O no hydrogen 2.884 N/A LYS 476.A N LEU 471.A O no hydrogen 3.027 N/A LYS 476.A NZ ASP 369.A OD2 no hydrogen 2.863 N/A ASN 477.A N LYS 474.A O no hydrogen 3.135 N/A ASN 477.A ND2 ASN 473.A O no hydrogen 2.138 N/A LYS 481.A N VAL 478.A O no hydrogen 2.994 N/A THR 483.A OG1 LYS 481.A O no hydrogen 2.880 N/A LEU 484.A N VAL 500.A O no hydrogen 2.888 N/A ALA 485.A N ALA 449.A O no hydrogen 3.032 N/A ILE 486.A N SER 498.A O no hydrogen 2.719 N/A GLY 487.A N ILE 451.A O no hydrogen 2.740 N/A LEU 488.A N TYR 496.A O no hydrogen 2.650 N/A LEU 489.A N ILE 453.A O no hydrogen 3.011 N/A LYS 490.A N SER 494.A O no hydrogen 2.998 N/A LYS 490.A NZ TYR 360.A OH no hydrogen 3.244 N/A LYS 490.A NZ ASP 599.A OD2 no hydrogen 3.083 N/A ARG 491.A N TYR 360.A OH no hydrogen 3.376 N/A SER 492.A OG SER 494.A OG no hydrogen 3.276 N/A GLY 493.A N LYS 490.A O no hydrogen 2.437 N/A SER 494.A N SER 492.A OG no hydrogen 3.247 N/A SER 494.A OG SER 492.A OG no hydrogen 3.276 N/A TYR 496.A N LEU 488.A O no hydrogen 2.827 N/A SER 498.A N ILE 486.A O no hydrogen 2.786 N/A SER 498.A OG GLY 589.A O no hydrogen 3.076 N/A VAL 500.A N LEU 484.A O no hydrogen 2.875 N/A GLY 501.A N HIS 577.A O no hydrogen 2.478 N/A TRP 502.A NE1 LEU 447.A O no hydrogen 2.687 N/A LEU 504.A N GLY 501.A O no hydrogen 3.393 N/A ILE 505.A N TRP 502.A O no hydrogen 3.294 N/A VAL 507.A N GLU 503.A O no hydrogen 2.814 N/A PHE 508.A N LEU 504.A O no hydrogen 2.819 N/A TYR 509.A N ILE 505.A O no hydrogen 2.884 N/A SER 511.A N PHE 508.A O no hydrogen 2.917 N/A SER 511.A OG PHE 508.A O no hydrogen 1.917 N/A GLU 512.A N GLU 570.A OE2 no hydrogen 2.223 N/A LEU 513.A N GLU 570.A OE1 no hydrogen 2.500 N/A ARG 514.A N SER 511.A OG no hydrogen 3.415 N/A LYS 515.A N SER 511.A O no hydrogen 3.160 N/A LYS 516.A N GLU 512.A O no hydrogen 2.840 N/A LYS 516.A NZ GLU 519.A OE2 no hydrogen 2.374 N/A LEU 517.A N LEU 513.A O no hydrogen 3.054 N/A LEU 518.A N ARG 514.A O no hydrogen 2.666 N/A GLU 519.A N LYS 515.A O no hydrogen 2.310 N/A GLU 520.A N LEU 517.A O no hydrogen 2.996 N/A LYS 521.A N GLU 520.A OE1 no hydrogen 1.995 N/A GLY 525.A N ILE 556.A O no hydrogen 3.405 N/A HIS 531.A N ARG 527.A O no hydrogen 2.720 N/A VAL 532.A N PHE 528.A O no hydrogen 3.117 N/A LEU 533.A N ILE 529.A O no hydrogen 2.926 N/A ARG 534.A N TYR 530.A O no hydrogen 2.882 N/A ARG 534.A NH1 ASP 537.A OD1 no hydrogen 2.364 N/A ARG 534.A NH1 ASP 537.A OD2 no hydrogen 2.065 N/A GLU 535.A N HIS 531.A O no hydrogen 3.202 N/A GLU 535.A N VAL 532.A O no hydrogen 3.117 N/A VAL 536.A N VAL 532.A O no hydrogen 3.211 N/A VAL 536.A N LEU 533.A O no hydrogen 3.158 N/A ASP 537.A N ARG 534.A O no hydrogen 3.309 N/A GLY 543.A N PRO 540.A O no hydrogen 2.750 N/A GLU 546.A N GLU 546.A OE1 no hydrogen 1.944 N/A MET 547.A N GLY 543.A O no hydrogen 3.252 N/A LEU 548.A N ILE 544.A O no hydrogen 2.916 N/A LYS 549.A N ASP 545.A O no hydrogen 2.692 N/A PHE 550.A N GLU 546.A O no hydrogen 2.438 N/A GLU 551.A N MET 547.A O no hydrogen 2.553 N/A VAL 552.A N LEU 548.A O no hydrogen 2.697 N/A ILE 553.A N LYS 549.A O no hydrogen 3.244 N/A ILE 553.A N PHE 550.A O no hydrogen 3.031 N/A ARG 554.A N PHE 550.A O no hydrogen 3.221 N/A HIS 555.A N GLU 551.A O no hydrogen 3.255 N/A HIS 555.A ND1 GLU 551.A O no hydrogen 2.466 N/A GLU 558.A N GLU 558.A OE1 no hydrogen 1.739 N/A LEU 563.A N GLU 559.A O no hydrogen 2.573 N/A ARG 564.A N THR 560.A O no hydrogen 3.014 N/A GLU 565.A N LYS 561.A O no hydrogen 3.292 N/A LYS 566.A N GLU 562.A O no hydrogen 3.249 N/A ILE 567.A N LEU 563.A O no hydrogen 2.974 N/A TYR 568.A N ARG 564.A O no hydrogen 2.773 N/A GLY 569.A N GLU 565.A O no hydrogen 2.653 N/A GLU 570.A N LYS 566.A O no hydrogen 2.440 N/A ILE 571.A N ILE 567.A O no hydrogen 2.730 N/A LYS 572.A N TYR 568.A O no hydrogen 3.007 N/A LYS 572.A NZ ASP 545.A OD1 no hydrogen 2.585 N/A ASP 573.A N GLY 569.A O no hydrogen 3.100 N/A LEU 574.A N GLU 570.A O no hydrogen 3.026 N/A LEU 575.A N ILE 571.A O no hydrogen 3.193 N/A GLU 576.A N ASP 573.A O no hydrogen 3.189 N/A HIS 577.A N LEU 574.A O no hydrogen 2.533 N/A VAL 578.A N LEU 575.A O no hydrogen 3.412 N/A ARG 579.A N LEU 499.A O no hydrogen 3.172 N/A ARG 579.A NE THR 483.A OG1 no hydrogen 3.060 N/A ARG 579.A NH2 LYS 481.A O no hydrogen 3.377 N/A ARG 579.A NH2 ASP 482.A O no hydrogen 3.260 N/A ASN 581.A N GLU 585.A OE1 no hydrogen 2.594 N/A GLU 585.A N ASN 582.A OD1 no hydrogen 2.707 N/A LYS 586.A N ASN 582.A O no hydrogen 3.006 N/A LYS 586.A NZ LEU 575.A O no hydrogen 3.317 N/A VAL 587.A N GLU 583.A O no hydrogen 3.081 N/A ARG 588.A N VAL 584.A O no hydrogen 3.324 N/A ARG 588.A NE VAL 536.A O no hydrogen 2.978 N/A ARG 588.A NH2 VAL 536.A O no hydrogen 2.633 N/A GLY 589.A N GLU 585.A O no hydrogen 3.134 N/A LEU 590.A N LYS 586.A O no hydrogen 2.821 N/A PHE 591.A N VAL 587.A O no hydrogen 2.854 N/A THR 592.A N ARG 588.A O no hydrogen 2.440 N/A THR 592.A OG1 ARG 588.A O no hydrogen 2.654 N/A PHE 593.A N GLY 589.A O no hydrogen 2.801 N/A LEU 594.A N LEU 590.A O no hydrogen 2.872 N/A LYS 595.A N PHE 591.A O no hydrogen 2.946 N/A ILE 596.A N THR 592.A O no hydrogen 3.019 N/A ILE 597.A N PHE 593.A O no hydrogen 3.150 N/A ASP 599.A N ILE 596.A O no hydrogen 3.321 N/A GLU 601.A N ASP 599.A OD1 no hydrogen 2.617 N/A VAL 602.A N ASP 599.A OD1 no hydrogen 3.308 N/A PHE 603.A N ASP 599.A O no hydrogen 2.735 N/A