Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qvr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A NE1 GLU 92.A OE2 no hydrogen 3.115 N/A THR 4.A OG1 VAL 103.A O no hydrogen 2.816 N/A GLN 5.A N THR 140.A O no hydrogen 2.853 N/A ARG 8.A N THR 4.A O no hydrogen 2.889 N/A GLU 9.A N GLN 5.A O no hydrogen 2.749 N/A ALA 10.A N ALA 6.A O no hydrogen 2.988 N/A LEU 11.A N ALA 7.A O no hydrogen 2.970 N/A ALA 12.A N ARG 8.A O no hydrogen 3.229 N/A GLN 13.A N GLU 9.A O no hydrogen 2.822 N/A ALA 14.A N ALA 10.A O no hydrogen 3.040 N/A GLN 15.A N LEU 11.A O no hydrogen 2.835 N/A VAL 16.A N ALA 12.A O no hydrogen 2.785 N/A LEU 17.A N GLN 13.A O no hydrogen 2.927 N/A ALA 18.A N ALA 14.A O no hydrogen 2.982 N/A GLN 19.A N GLN 15.A O no hydrogen 3.172 N/A GLN 19.A NE2 GLN 15.A O no hydrogen 3.292 N/A ARG 20.A N VAL 16.A O no hydrogen 2.869 N/A MET 21.A N LEU 17.A O no hydrogen 3.029 N/A LYS 22.A N GLN 19.A O no hydrogen 2.592 N/A HIS 23.A N ALA 18.A O no hydrogen 2.760 N/A HIS 23.A ND1 HIS 30.A NE2 no hydrogen 2.743 N/A ILE 26.A N TYR 79.A O no hydrogen 2.678 N/A ASP 27.A N HIS 30.A ND1 no hydrogen 3.043 N/A LEU 28.A N ASP 27.A OD2 no hydrogen 2.541 N/A HIS 30.A N ASP 27.A O no hydrogen 3.187 N/A HIS 30.A ND1 ASP 27.A O no hydrogen 3.249 N/A HIS 30.A NE2 HIS 23.A ND1 no hydrogen 2.743 N/A TRP 32.A N LEU 28.A O no hydrogen 2.928 N/A TRP 32.A NE1 THR 116.A OG1 no hydrogen 3.110 N/A ALA 33.A N PRO 29.A O no hydrogen 2.900 N/A VAL 34.A N HIS 30.A O no hydrogen 3.296 N/A LEU 35.A N LEU 31.A O no hydrogen 2.991 N/A LEU 36.A N TRP 32.A O no hydrogen 2.861 N/A LYS 37.A N SER 41.A OG no hydrogen 3.167 N/A LYS 37.A NZ SER 247.A OG no hydrogen 3.083 N/A ASP 38.A N SER 41.A OG no hydrogen 2.799 N/A SER 41.A N ASP 38.A O no hydrogen 3.280 N/A SER 41.A OG ASP 38.A O no hydrogen 3.478 N/A ARG 45.A N SER 41.A O no hydrogen 2.800 N/A ARG 45.A NE ARG 40.A O no hydrogen 2.757 N/A ARG 45.A NH2 TYR 147.A O no hydrogen 3.428 N/A LEU 46.A N LEU 42.A O no hydrogen 2.888 N/A LEU 47.A N ALA 43.A O no hydrogen 3.283 N/A GLU 48.A N TRP 44.A O no hydrogen 2.793 N/A LYS 49.A N ARG 45.A O no hydrogen 2.770 N/A ALA 50.A N LEU 47.A O no hydrogen 3.230 N/A GLY 51.A N LEU 47.A O no hydrogen 3.180 N/A LYS 55.A NZ GLU 59.A OE2 no hydrogen 3.306 N/A ALA 56.A N ASP 53.A OD2 no hydrogen 3.266 N/A LEU 57.A N ASP 53.A O no hydrogen 3.412 N/A LYS 58.A N PRO 54.A O no hydrogen 2.708 N/A LYS 58.A NZ LEU 36.A O no hydrogen 2.696 N/A LYS 58.A NZ LYS 37.A O no hydrogen 3.418 N/A LYS 58.A NZ GLN 246.A OE1 no hydrogen 3.112 N/A GLU 59.A N LYS 55.A O no hydrogen 2.643 N/A LEU 60.A N ALA 56.A O no hydrogen 2.791 N/A GLN 61.A N LEU 57.A O no hydrogen 2.761 N/A GLU 62.A N LYS 58.A O no hydrogen 3.003 N/A GLU 64.A N LEU 60.A O no hydrogen 3.341 N/A LEU 65.A N GLN 61.A O no hydrogen 3.300 N/A ALA 66.A N GLU 62.A O no hydrogen 2.978 N/A ARG 67.A N ARG 63.A O no hydrogen 3.076 N/A ARG 67.A N GLU 64.A O no hydrogen 2.756 N/A ARG 67.A NE ARG 63.A O no hydrogen 3.200 N/A LEU 68.A N LEU 65.A O no hydrogen 3.314 N/A LYS 70.A NZ MET 21.A O no hydrogen 2.876 N/A VAL 71.A N LYS 22.A O no hydrogen 3.263 N/A GLU 75.A N GLU 72.A O no hydrogen 2.902 N/A VAL 76.A N GLY 73.A O no hydrogen 3.164 N/A GLY 77.A N HIS 23.A O no hydrogen 2.766 N/A GLN 78.A N GLU 75.A O no hydrogen 3.335 N/A TYR 79.A N GLN 24.A O no hydrogen 3.292 N/A THR 81.A N ILE 26.A O no hydrogen 3.208 N/A ARG 83.A NE ASP 27.A OD2 no hydrogen 3.214 N/A ARG 83.A NH2 ASP 27.A OD2 no hydrogen 2.950 N/A SER 85.A N THR 81.A O no hydrogen 3.108 N/A SER 85.A OG THR 81.A O no hydrogen 3.226 N/A GLY 86.A N SER 82.A O no hydrogen 2.840 N/A ALA 87.A N ARG 83.A O no hydrogen 2.885 N/A LEU 88.A N LEU 84.A O no hydrogen 2.696 N/A ASN 89.A N SER 85.A O no hydrogen 2.884 N/A ARG 90.A N GLY 86.A O no hydrogen 2.877 N/A ALA 91.A N ALA 87.A O no hydrogen 2.781 N/A ALA 91.A N LEU 88.A O no hydrogen 3.224 N/A LEU 94.A N ARG 90.A O no hydrogen 3.105 N/A MET 95.A N ALA 91.A O no hydrogen 3.118 N/A MET 95.A N GLU 92.A O no hydrogen 3.218 N/A GLU 96.A N GLU 92.A O no hydrogen 3.317 N/A LEU 98.A N MET 95.A O no hydrogen 3.228 N/A THR 107.A OG1 ALA 104.A O no hydrogen 2.746 N/A LEU 108.A N ALA 104.A O no hydrogen 3.132 N/A VAL 109.A N VAL 105.A O no hydrogen 3.051 N/A VAL 109.A N ASP 106.A O no hydrogen 3.037 N/A LEU 110.A N ASP 106.A O no hydrogen 3.301 N/A LEU 112.A N LEU 108.A O no hydrogen 3.188 N/A ALA 113.A N VAL 109.A O no hydrogen 2.630 N/A GLU 114.A N ALA 111.A O no hydrogen 2.972 N/A ALA 115.A N ALA 111.A O no hydrogen 2.972 N/A THR 116.A OG1 LEU 112.A O no hydrogen 2.852 N/A LEU 125.A N GLY 121.A O no hydrogen 2.780 N/A LYS 126.A N LEU 122.A O no hydrogen 2.493 N/A LYS 126.A NZ GLU 97.A OE2 no hydrogen 3.264 N/A GLY 127.A N GLU 123.A O no hydrogen 3.333 N/A ALA 128.A N ALA 124.A O no hydrogen 3.144 N/A LEU 129.A N LEU 125.A O no hydrogen 2.843 N/A LYS 130.A N LYS 126.A O no hydrogen 2.807 N/A GLU 131.A N ALA 128.A O no hydrogen 2.768 N/A LEU 132.A N LYS 130.A O no hydrogen 2.721 N/A ARG 136.A NE ASP 106.A OD1 no hydrogen 2.915 N/A THR 137.A OG1 LYS 99.A O no hydrogen 3.308 N/A THR 140.A OG1 TRP 3.A O no hydrogen 2.972 N/A SER 145.A OG SER 145.A O no hydrogen 2.601 N/A THR 146.A OG1 GLU 144.A OE1 no hydrogen 3.369 N/A TYR 147.A N SER 145.A O no hydrogen 3.141 N/A ASN 148.A ND2 GLU 243.A OE1 no hydrogen 2.985 N/A LEU 150.A N GLU 243.A OE1 no hydrogen 2.907 N/A GLN 152.A N ALA 149.A O no hydrogen 2.874 N/A TYR 153.A N ALA 149.A O no hydrogen 2.745 N/A ILE 155.A N SER 228.A O no hydrogen 2.871 N/A LEU 157.A N ILE 226.A O no hydrogen 3.142 N/A THR 158.A OG1 ASP 156.A OD1 no hydrogen 2.738 N/A THR 158.A OG1 ILE 226.A O no hydrogen 3.489 N/A ARG 159.A N ASP 156.A O no hydrogen 3.214 N/A ARG 159.A N ASP 156.A OD1 no hydrogen 2.759 N/A ARG 159.A NH1 GLU 151.A OE2 no hydrogen 3.396 N/A LEU 160.A N ASP 156.A O no hydrogen 3.385 N/A ALA 161.A N LEU 157.A O no hydrogen 2.833 N/A ALA 162.A N THR 158.A O no hydrogen 3.054 N/A GLU 163.A N ARG 159.A O no hydrogen 3.058 N/A GLY 164.A N ALA 161.A O no hydrogen 3.385 N/A LYS 165.A N LEU 160.A O no hydrogen 2.724 N/A LYS 165.A NZ GLU 163.A OE2 no hydrogen 2.748 N/A ARG 172.A NH2 VAL 199.A O no hydrogen 3.384 N/A ARG 172.A NH2 ASP 297.A O no hydrogen 2.947 N/A GLU 175.A N GLU 175.A OE2 no hydrogen 2.492 N/A ILE 176.A N ARG 172.A O no hydrogen 3.091 N/A ARG 177.A N ASP 173.A O no hydrogen 2.823 N/A ARG 178.A N GLU 174.A O no hydrogen 3.041 N/A ARG 178.A NH1 GLN 181.A OE1 no hydrogen 2.680 N/A VAL 179.A N GLU 175.A O no hydrogen 3.020 N/A ILE 180.A N ILE 176.A O no hydrogen 2.798 N/A GLN 181.A N ARG 177.A O no hydrogen 2.887 N/A ILE 182.A N ARG 178.A O no hydrogen 2.978 N/A LEU 183.A N VAL 179.A O no hydrogen 3.125 N/A LEU 184.A N GLN 181.A O no hydrogen 2.964 N/A ARG 185.A N ILE 182.A O no hydrogen 3.029 N/A ARG 185.A NH1 GLN 292.A OE1 no hydrogen 2.568 N/A ASN 189.A ND2 ARG 185.A O no hydrogen 3.500 N/A ASN 189.A ND2 ARG 186.A O no hydrogen 3.649 N/A VAL 192.A N PHE 291.A O no hydrogen 2.859 N/A LEU 193.A N GLY 271.A O no hydrogen 2.881 N/A ILE 194.A N VAL 294.A O no hydrogen 3.122 N/A GLY 195.A N THR 273.A O no hydrogen 2.977 N/A VAL 199.A N GLU 196.A O no hydrogen 3.337 N/A ILE 204.A N GLY 200.A O no hydrogen 3.343 N/A VAL 205.A N LYS 201.A O no hydrogen 3.463 N/A GLU 206.A N THR 202.A O no hydrogen 2.975 N/A GLY 207.A N ALA 203.A O no hydrogen 2.645 N/A LEU 208.A N ILE 204.A O no hydrogen 2.962 N/A ALA 209.A N VAL 205.A O no hydrogen 2.942 N/A GLN 210.A N GLU 206.A O no hydrogen 3.105 N/A ARG 211.A N GLY 207.A O no hydrogen 3.301 N/A ARG 211.A NH2 ASP 173.A OD1 no hydrogen 2.555 N/A ILE 212.A N LEU 208.A O no hydrogen 3.100 N/A VAL 213.A N ALA 209.A O no hydrogen 3.270 N/A LYS 214.A N GLN 210.A O no hydrogen 3.111 N/A LYS 214.A N ARG 211.A O no hydrogen 2.887 N/A GLY 215.A N ILE 212.A O no hydrogen 3.068 N/A ASP 216.A N ARG 211.A O no hydrogen 2.856 N/A LYS 224.A N LEU 221.A O no hydrogen 2.948 N/A LYS 224.A NZ GLY 220.A O no hydrogen 2.968 N/A LYS 224.A NZ GLU 250.A OE1 no hydrogen 3.109 N/A LYS 224.A NZ GLU 250.A OE2 no hydrogen 3.421 N/A ARG 225.A N GLU 250.A O no hydrogen 3.261 N/A ARG 225.A NH1 ASP 156.A OD1 no hydrogen 3.454 N/A ARG 225.A NH1 ASP 156.A OD2 no hydrogen 2.788 N/A ILE 226.A N THR 158.A OG1 no hydrogen 3.046 N/A VAL 227.A N ILE 252.A O no hydrogen 2.944 N/A SER 228.A N ILE 155.A O no hydrogen 2.681 N/A LEU 229.A N PHE 254.A O no hydrogen 3.100 N/A GLU 235.A N GLU 232.A O no hydrogen 2.836 N/A LEU 237.A N PHE 233.A O no hydrogen 3.278 N/A LYS 238.A N GLU 234.A O no hydrogen 2.863 N/A ALA 239.A N GLU 235.A O no hydrogen 3.270 N/A VAL 240.A N ARG 236.A O no hydrogen 2.923 N/A VAL 240.A N LEU 237.A O no hydrogen 2.998 N/A ILE 241.A N LEU 237.A O no hydrogen 2.899 N/A GLN 242.A N LYS 238.A O no hydrogen 2.820 N/A GLU 243.A N VAL 240.A O no hydrogen 2.822 N/A VAL 244.A N VAL 240.A O no hydrogen 3.036 N/A VAL 244.A N ILE 241.A O no hydrogen 3.231 N/A VAL 245.A N ILE 241.A O no hydrogen 3.311 N/A GLN 246.A NE2 LYS 37.A O no hydrogen 3.252 N/A GLN 246.A NE2 GLN 242.A O no hydrogen 3.385 N/A SER 247.A N VAL 244.A O no hydrogen 3.035 N/A SER 247.A OG GLU 243.A O no hydrogen 2.989 N/A GLN 248.A N VAL 245.A O no hydrogen 2.890 N/A ILE 252.A N ARG 225.A O no hydrogen 2.968 N/A LEU 253.A N ARG 268.A O no hydrogen 3.113 N/A PHE 254.A N VAL 227.A O no hydrogen 2.840 N/A ILE 255.A N ILE 270.A O no hydrogen 2.988 N/A ALA 261.A N LEU 258.A O no hydrogen 3.090 N/A LEU 262.A N LEU 258.A O no hydrogen 2.928 N/A ALA 263.A N LYS 259.A O no hydrogen 2.442 N/A GLY 265.A N LEU 262.A O no hydrogen 2.469 N/A GLU 266.A N ALA 261.A O no hydrogen 3.238 N/A ARG 268.A NH1 GLY 249.A O no hydrogen 2.668 N/A LEU 269.A N ASN 190.A OD1 no hydrogen 2.628 N/A ILE 270.A N LEU 253.A O no hydrogen 2.772 N/A GLY 271.A N PRO 191.A O no hydrogen 2.845 N/A THR 273.A N LEU 193.A O no hydrogen 2.811 N/A THR 273.A OG1 GLU 277.A OE2 no hydrogen 2.674 N/A THR 274.A N GLU 277.A OE2 no hydrogen 3.248 N/A THR 274.A OG1 GLU 277.A OE2 no hydrogen 2.968 N/A TYR 278.A N THR 274.A O no hydrogen 3.074 N/A TYR 278.A N LEU 275.A O no hydrogen 2.931 N/A ARG 279.A N LEU 275.A O no hydrogen 2.973 N/A GLU 280.A N ASP 276.A O no hydrogen 3.379 N/A GLU 282.A N ARG 279.A O no hydrogen 2.850 N/A LYS 283.A NZ ARG 279.A O no hydrogen 2.854 N/A ALA 286.A N ASP 284.A OD2 no hydrogen 2.949 N/A LEU 287.A N ASP 284.A O no hydrogen 2.481 N/A LEU 287.A N ASP 284.A OD2 no hydrogen 3.142 N/A GLU 288.A N ASP 284.A O no hydrogen 2.499 N/A ARG 289.A N LEU 287.A O no hydrogen 2.413 N/A VAL 294.A N VAL 192.A O no hydrogen 3.094 N/A VAL 296.A N ILE 194.A O no hydrogen 2.838 N/A THR 300.A N GLU 303.A OE1 no hydrogen 2.771 N/A GLU 303.A N THR 300.A OG1 no hydrogen 3.178 N/A THR 304.A N THR 300.A O no hydrogen 2.726 N/A THR 304.A OG1 THR 300.A O no hydrogen 2.812 N/A ILE 305.A N VAL 301.A O no hydrogen 2.760 N/A SER 306.A N GLU 302.A O no hydrogen 2.959 N/A SER 306.A OG GLU 302.A O no hydrogen 3.354 N/A ILE 307.A N GLU 303.A O no hydrogen 2.855 N/A LEU 308.A N THR 304.A O no hydrogen 2.838 N/A ARG 309.A N ILE 305.A O no hydrogen 2.946 N/A ARG 309.A NE ASP 325.A OD2 no hydrogen 2.604 N/A ARG 309.A NH2 ASP 325.A OD1 no hydrogen 3.002 N/A GLY 310.A N SER 306.A O no hydrogen 2.826 N/A LEU 311.A N ILE 307.A O no hydrogen 3.076 N/A LYS 312.A NZ GLU 316.A OE1 no hydrogen 3.385 N/A TYR 315.A N LEU 311.A O no hydrogen 3.137 N/A GLU 316.A N LYS 312.A O no hydrogen 3.326 N/A VAL 317.A N LYS 314.A O no hydrogen 2.808 N/A HIS 318.A N LYS 314.A O no hydrogen 2.573 N/A HIS 319.A N TYR 315.A O no hydrogen 2.901 N/A GLY 320.A N VAL 317.A O no hydrogen 3.279 N/A VAL 321.A N GLU 316.A O no hydrogen 2.902 N/A ARG 322.A N LEU 486.A O no hydrogen 3.100 N/A ILE 323.A N GLU 316.A OE2 no hydrogen 3.021 N/A SER 324.A OG VAL 488.A O no hydrogen 3.311 N/A SER 326.A OG GLU 490.A OE2 no hydrogen 2.829 N/A ALA 327.A N SER 324.A OG no hydrogen 3.085 N/A ILE 328.A N SER 324.A O no hydrogen 3.165 N/A ILE 329.A N ASP 325.A O no hydrogen 2.984 N/A ALA 330.A N SER 326.A O no hydrogen 3.160 N/A ALA 331.A N ALA 327.A O no hydrogen 2.882 N/A ALA 332.A N ILE 328.A O no hydrogen 3.120 N/A THR 333.A N ILE 329.A O no hydrogen 2.836 N/A THR 333.A OG1 ILE 329.A O no hydrogen 2.937 N/A LEU 334.A N ALA 330.A O no hydrogen 2.767 N/A SER 335.A OG ALA 331.A O no hydrogen 2.529 N/A SER 335.A OG ALA 332.A O no hydrogen 2.963 N/A HIS 336.A N ALA 332.A O no hydrogen 3.147 N/A ARG 337.A N THR 333.A O no hydrogen 2.967 N/A ARG 337.A NH1 LEU 579.A O no hydrogen 3.461 N/A ARG 337.A NH2 GLU 512.A OE2 no hydrogen 3.100 N/A TYR 338.A N LEU 334.A O no hydrogen 2.900 N/A TYR 338.A OH ASP 581.A OD1 no hydrogen 3.067 N/A ILE 339.A N SER 335.A O no hydrogen 2.946 N/A ASP 346.A N GLY 198.A O no hydrogen 2.942 N/A LYS 347.A NZ SER 335.A O no hydrogen 3.147 N/A LYS 347.A NZ ILE 339.A O no hydrogen 2.866 N/A LYS 347.A NZ ARG 342.A O no hydrogen 3.148 N/A ALA 348.A N LEU 344.A O no hydrogen 3.054 N/A ILE 349.A N PRO 345.A O no hydrogen 3.510 N/A ASP 350.A N ASP 346.A O no hydrogen 2.985 N/A LEU 351.A N LYS 347.A O no hydrogen 2.904 N/A ILE 352.A N ALA 348.A O no hydrogen 3.202 N/A ASP 353.A N ILE 349.A O no hydrogen 2.746 N/A GLU 354.A N ASP 350.A O no hydrogen 2.645 N/A ALA 355.A N LEU 351.A O no hydrogen 2.769 N/A ALA 356.A N ILE 352.A O no hydrogen 3.232 N/A ALA 357.A N ASP 353.A O no hydrogen 3.191 N/A ARG 358.A NH2 GLU 495.A OE2 no hydrogen 2.775 N/A LEU 359.A N ALA 356.A O no hydrogen 2.568 N/A ARG 360.A N ALA 356.A O no hydrogen 3.366 N/A ARG 360.A N ALA 357.A O no hydrogen 2.855 N/A ARG 360.A NH1 ALA 357.A O no hydrogen 3.386 N/A MET 361.A N ALA 357.A O no hydrogen 3.009 N/A ALA 362.A N LEU 359.A O no hydrogen 3.059 N/A LEU 363.A N ARG 360.A O no hydrogen 2.895 N/A ILE 370.A N ALA 366.A O no hydrogen 2.670 N/A ASP 371.A N PRO 367.A O no hydrogen 2.604 N/A ALA 372.A N GLU 368.A O no hydrogen 2.770 N/A LEU 373.A N GLU 369.A O no hydrogen 3.325 N/A LEU 373.A N ILE 370.A O no hydrogen 3.209 N/A GLU 374.A N ILE 370.A O no hydrogen 2.973 N/A ARG 375.A N ASP 371.A O no hydrogen 3.004 N/A LYS 377.A N LEU 373.A O no hydrogen 2.690 N/A LYS 377.A N GLU 374.A O no hydrogen 2.834 N/A LEU 378.A N GLU 374.A O no hydrogen 2.961 N/A GLN 379.A N ARG 375.A O no hydrogen 2.995 N/A GLN 379.A NE2 ARG 375.A O no hydrogen 2.967 N/A GLU 381.A N LYS 377.A O no hydrogen 2.645 N/A ILE 382.A N LEU 378.A O no hydrogen 2.836 N/A GLU 383.A N GLN 379.A O no hydrogen 3.097 N/A ARG 384.A N LEU 380.A O no hydrogen 3.095 N/A ARG 384.A NH1 GLU 403.A OE1 no hydrogen 3.443 N/A ALA 386.A N GLU 383.A O no hydrogen 3.069 N/A LEU 387.A N GLU 383.A O no hydrogen 3.333 N/A SER 395.A N ASP 392.A O no hydrogen 3.223 N/A GLN 396.A N ASP 392.A O no hydrogen 2.662 N/A GLN 396.A NE2 LYS 389.A O no hydrogen 2.720 N/A ARG 398.A NE SER 395.A O no hydrogen 2.744 N/A GLU 403.A N LEU 399.A O no hydrogen 3.162 N/A ALA 404.A N LYS 400.A O no hydrogen 3.388 N/A GLU 405.A N ALA 401.A O no hydrogen 3.451 N/A ILE 406.A N ILE 402.A O no hydrogen 3.283 N/A ALA 407.A N GLU 403.A O no hydrogen 3.469 N/A LYS 408.A N ALA 404.A O no hydrogen 3.154 N/A LEU 409.A N GLU 405.A O no hydrogen 2.891 N/A THR 410.A N ILE 406.A O no hydrogen 2.677 N/A THR 410.A OG1 ILE 406.A O no hydrogen 2.576 N/A GLU 411.A N ALA 407.A O no hydrogen 2.656 N/A GLU 411.A N LYS 408.A O no hydrogen 2.641 N/A GLU 412.A N LYS 408.A O no hydrogen 2.598 N/A ILE 413.A N LEU 409.A O no hydrogen 2.818 N/A ALA 414.A N THR 410.A O no hydrogen 3.310 N/A LYS 415.A N GLU 411.A O no hydrogen 2.668 N/A LYS 415.A NZ GLU 412.A OE2 no hydrogen 3.400 N/A LEU 416.A N GLU 412.A O no hydrogen 2.885 N/A ARG 417.A N ILE 413.A O no hydrogen 3.000 N/A ALA 418.A N LYS 415.A O no hydrogen 2.855 N/A GLU 419.A N LYS 415.A O no hydrogen 2.560 N/A TRP 420.A N LEU 416.A O no hydrogen 2.506 N/A ARG 422.A N GLU 419.A O no hydrogen 3.095 N/A ARG 424.A N TRP 420.A O no hydrogen 3.062 N/A GLU 425.A N GLU 421.A O no hydrogen 2.753 N/A ILE 426.A N ARG 422.A O no hydrogen 2.566 N/A LEU 427.A N GLU 423.A O no hydrogen 2.823 N/A ARG 428.A N ARG 424.A O no hydrogen 2.923 N/A ARG 428.A NH1 ARG 428.A O no hydrogen 3.221 N/A LYS 429.A N GLU 425.A O no hydrogen 3.240 N/A LEU 430.A N ILE 426.A O no hydrogen 3.403 N/A ARG 431.A N LEU 427.A O no hydrogen 2.887 N/A ALA 433.A N LYS 429.A O no hydrogen 2.777 N/A GLN 434.A N LEU 430.A O no hydrogen 2.923 N/A GLN 434.A NE2 GLU 316.A O no hydrogen 3.407 N/A GLN 434.A NE2 VAL 321.A O no hydrogen 3.602 N/A HIS 435.A N GLU 432.A O no hydrogen 3.060 N/A ARG 436.A N GLU 432.A O no hydrogen 2.998 N/A LEU 437.A N ALA 433.A O no hydrogen 2.575 N/A ASP 438.A N HIS 435.A O no hydrogen 3.029 N/A GLU 439.A N HIS 435.A O no hydrogen 2.829 N/A VAL 440.A N ARG 436.A O no hydrogen 2.886 N/A ARG 442.A N ASP 438.A O no hydrogen 2.838 N/A ARG 442.A NH2 GLU 443.A OE1 no hydrogen 2.896 N/A GLU 443.A N GLU 439.A O no hydrogen 3.059 N/A ILE 444.A N VAL 440.A O no hydrogen 2.771 N/A GLU 445.A N ARG 441.A O no hydrogen 3.235 N/A LEU 446.A N ARG 442.A O no hydrogen 2.914 N/A ALA 447.A N GLU 443.A O no hydrogen 2.974 N/A GLU 448.A N ILE 444.A O no hydrogen 2.878 N/A GLN 450.A N ALA 447.A O no hydrogen 2.602 N/A LEU 453.A N TYR 451.A O no hydrogen 2.516 N/A ALA 456.A N ASP 452.A O no hydrogen 3.520 N/A ALA 457.A N ASN 454.A O no hydrogen 3.054 N/A GLU 458.A N ASN 454.A O no hydrogen 3.085 N/A LEU 459.A N ARG 455.A O no hydrogen 2.748 N/A ARG 460.A NH1 GLU 448.A OE1 no hydrogen 3.490 N/A LEU 464.A N LEU 459.A O no hydrogen 2.849 N/A LYS 466.A N GLY 462.A O no hydrogen 2.798 N/A GLU 468.A N LEU 464.A O no hydrogen 3.132 N/A ALA 469.A N PRO 465.A O no hydrogen 3.208 N/A GLU 470.A N LYS 466.A O no hydrogen 2.591 N/A VAL 471.A N LEU 467.A O no hydrogen 2.524 N/A GLU 472.A N ALA 469.A O no hydrogen 2.839 N/A ALA 473.A N ALA 469.A O no hydrogen 2.637 N/A ALA 473.A N GLU 470.A O no hydrogen 3.047 N/A LEU 474.A N GLU 470.A O no hydrogen 3.033 N/A SER 475.A OG VAL 471.A O no hydrogen 3.024 N/A GLU 476.A N GLU 472.A O no hydrogen 3.253 N/A LYS 477.A N LEU 474.A O no hydrogen 3.283 N/A LEU 478.A N SER 475.A O no hydrogen 3.036 N/A ARG 482.A N GLU 423.A OE1 no hydrogen 3.053 N/A ARG 485.A N PHE 483.A O no hydrogen 3.208 N/A ARG 485.A NH1 HIS 319.A O no hydrogen 2.818 N/A ARG 485.A NH1 ARG 485.A O no hydrogen 3.289 N/A ARG 485.A NH2 HIS 319.A O no hydrogen 2.790 N/A VAL 488.A N ARG 322.A O no hydrogen 2.877 N/A THR 489.A N ASP 492.A OD2 no hydrogen 2.745 N/A THR 489.A OG1 ASP 492.A OD2 no hydrogen 2.712 N/A ILE 493.A N THR 489.A O no hydrogen 2.957 N/A ALA 494.A N GLU 490.A O no hydrogen 2.514 N/A GLU 495.A N GLU 491.A O no hydrogen 2.735 N/A ILE 496.A N ASP 492.A O no hydrogen 3.198 N/A VAL 497.A N ILE 493.A O no hydrogen 2.852 N/A SER 498.A N ALA 494.A O no hydrogen 2.577 N/A ARG 499.A N GLU 495.A O no hydrogen 2.708 N/A TRP 500.A N VAL 497.A O no hydrogen 2.918 N/A THR 501.A N SER 498.A O no hydrogen 2.799 N/A THR 501.A OG1 VAL 497.A O no hydrogen 3.315 N/A SER 506.A N ILE 503.A O no hydrogen 3.223 N/A SER 506.A OG ILE 503.A O no hydrogen 3.058 N/A SER 506.A OG ASP 581.A OD2 no hydrogen 3.416 N/A LYS 507.A N ILE 503.A O no hydrogen 3.125 N/A LYS 507.A NZ GLY 502.A O no hydrogen 2.586 N/A LYS 507.A NZ ASP 581.A O no hydrogen 3.306 N/A LEU 508.A N PRO 504.A O no hydrogen 2.809 N/A LYS 515.A N GLY 511.A O no hydrogen 2.820 N/A LYS 515.A NZ LEU 579.A O no hydrogen 3.197 N/A LYS 515.A NZ ASP 581.A OD1 no hydrogen 3.422 N/A LEU 516.A N GLU 512.A O no hydrogen 2.747 N/A LEU 517.A N ARG 513.A O no hydrogen 3.097 N/A LEU 517.A N GLU 514.A O no hydrogen 3.286 N/A ARG 518.A N GLU 514.A O no hydrogen 3.163 N/A ARG 518.A NE GLU 521.A OE1 no hydrogen 3.225 N/A ARG 518.A NH2 GLU 521.A OE1 no hydrogen 2.956 N/A GLU 521.A N ARG 518.A O no hydrogen 2.736 N/A GLU 522.A N ARG 518.A O no hydrogen 3.059 N/A LEU 523.A N LEU 519.A O no hydrogen 3.011 N/A HIS 524.A N GLU 520.A O no hydrogen 3.213 N/A HIS 524.A ND1 VAL 527.A O no hydrogen 3.208 N/A LYS 525.A N GLU 521.A O no hydrogen 3.024 N/A LYS 525.A N GLU 522.A O no hydrogen 2.966 N/A ARG 526.A N LEU 523.A O no hydrogen 3.188 N/A ARG 526.A NH1 GLU 583.A OE2 no hydrogen 3.269 N/A ARG 526.A NH2 GLU 583.A OE2 no hydrogen 3.371 N/A VAL 527.A N LEU 523.A O no hydrogen 2.750 N/A GLN 530.A NE2 VAL 566.A O no hydrogen 2.929 N/A GLN 530.A NE2 ARG 708.A O no hydrogen 3.151 N/A ALA 533.A N GLN 530.A O no hydrogen 2.828 N/A ILE 534.A N GLN 530.A O no hydrogen 3.292 N/A ARG 535.A N ASP 531.A O no hydrogen 3.043 N/A ALA 536.A N GLU 532.A O no hydrogen 3.123 N/A VAL 537.A N ALA 533.A O no hydrogen 2.918 N/A ALA 538.A N ILE 534.A O no hydrogen 2.693 N/A ASP 539.A N ARG 535.A O no hydrogen 2.693 N/A ALA 540.A N ALA 536.A O no hydrogen 2.863 N/A ILE 541.A N VAL 537.A O no hydrogen 2.980 N/A ARG 542.A N ALA 538.A O no hydrogen 2.832 N/A ARG 542.A NH1 LEU 516.A O no hydrogen 2.721 N/A ARG 542.A NH2 ASP 539.A OD1 no hydrogen 3.512 N/A ARG 543.A N ASP 539.A O no hydrogen 2.719 N/A ALA 544.A N ALA 540.A O no hydrogen 2.773 N/A ARG 545.A N ILE 541.A O no hydrogen 2.936 N/A ASN 552.A N ASP 550.A OD1 no hydrogen 2.557 N/A ARG 553.A NH2 ARG 700.A O no hydrogen 3.355 N/A ILE 555.A N THR 655.A O no hydrogen 2.871 N/A SER 557.A N ASP 702.A OD1 no hydrogen 3.113 N/A SER 557.A OG ARG 700.A O no hydrogen 3.415 N/A SER 557.A OG ASP 702.A OD1 no hydrogen 2.802 N/A PHE 558.A N ILE 657.A O no hydrogen 2.672 N/A LEU 559.A N GLU 703.A O no hydrogen 3.391 N/A PHE 560.A N LEU 659.A O no hydrogen 2.613 N/A LEU 561.A N VAL 705.A O no hydrogen 2.861 N/A LYS 568.A NZ PHE 560.A O no hydrogen 3.379 N/A LYS 568.A NZ GLY 562.A O no hydrogen 3.016 N/A LYS 568.A NZ PRO 563.A O no hydrogen 3.551 N/A LYS 568.A NZ SER 661.A O no hydrogen 3.078 N/A LEU 571.A N GLY 567.A O no hydrogen 2.686 N/A ALA 572.A N LYS 568.A O no hydrogen 2.954 N/A LYS 573.A N THR 569.A O no hydrogen 2.784 N/A LYS 573.A NZ GLU 570.A OE1 no hydrogen 3.556 N/A THR 574.A N GLU 570.A O no hydrogen 2.670 N/A THR 574.A OG1 GLU 570.A O no hydrogen 2.898 N/A LEU 575.A N LEU 571.A O no hydrogen 2.673 N/A ALA 576.A N ALA 572.A O no hydrogen 3.173 N/A ALA 577.A N LYS 573.A O no hydrogen 3.054 N/A THR 578.A N THR 574.A O no hydrogen 2.807 N/A LEU 579.A N LEU 575.A O no hydrogen 2.793 N/A PHE 580.A N ALA 576.A O no hydrogen 2.827 N/A GLU 584.A N THR 582.A OG1 no hydrogen 2.726 N/A ALA 585.A N THR 582.A O no hydrogen 3.156 N/A MET 586.A N GLU 583.A O no hydrogen 3.306 N/A ILE 587.A N VAL 616.A O no hydrogen 2.871 N/A ARG 588.A NE ASP 620.A OD1 no hydrogen 2.772 N/A ARG 588.A NH2 ASP 620.A OD1 no hydrogen 2.814 N/A ARG 588.A NH2 ASP 620.A OD2 no hydrogen 3.503 N/A ILE 589.A N LEU 618.A O no hydrogen 2.815 N/A MET 591.A N ILE 589.A O no hydrogen 2.631 N/A GLU 593.A N ASP 590.A O no hydrogen 2.755 N/A TYR 594.A OH GLN 604.A OE1 no hydrogen 2.778 N/A MET 595.A N GLU 593.A O no hydrogen 2.700 N/A MET 595.A N GLU 596.A OE2 no hydrogen 2.789 N/A ALA 599.A N HIS 598.A ND1 no hydrogen 2.670 N/A SER 601.A N LYS 597.A O no hydrogen 3.329 N/A ARG 602.A N ALA 599.A O no hydrogen 3.088 N/A LEU 603.A N VAL 600.A O no hydrogen 3.423 N/A THR 606.A OG1 ARG 602.A O no hydrogen 3.561 N/A ALA 608.A N GLN 604.A O no hydrogen 3.080 N/A VAL 609.A N LEU 605.A O no hydrogen 2.996 N/A ARG 610.A N THR 606.A O no hydrogen 2.634 N/A ARG 611.A N GLU 607.A O no hydrogen 2.852 N/A ARG 612.A N ALA 608.A O no hydrogen 2.894 N/A TYR 614.A OH HIS 336.A NE2 no hydrogen 3.128 N/A SER 615.A OG ARG 612.A O no hydrogen 2.812 N/A VAL 616.A N ALA 585.A O no hydrogen 2.799 N/A ILE 617.A N VAL 656.A O no hydrogen 2.792 N/A LEU 618.A N ILE 587.A O no hydrogen 2.829 N/A PHE 619.A N ILE 658.A O no hydrogen 2.944 N/A ASP 620.A N ILE 589.A O no hydrogen 3.124 N/A GLU 621.A N THR 660.A OG1 no hydrogen 3.238 N/A ILE 622.A N THR 660.A O no hydrogen 2.899 N/A ALA 625.A N ILE 622.A O no hydrogen 3.037 N/A VAL 629.A N HIS 626.A O no hydrogen 2.660 N/A ASN 631.A N ASP 628.A O no hydrogen 3.095 N/A LEU 633.A N VAL 629.A O no hydrogen 2.751 N/A LEU 634.A N PHE 630.A O no hydrogen 2.551 N/A GLN 635.A N ASN 631.A O no hydrogen 2.787 N/A ILE 636.A N LEU 633.A O no hydrogen 2.512 N/A LEU 637.A N LEU 633.A O no hydrogen 3.016 N/A ASP 638.A N LEU 634.A O no hydrogen 3.007 N/A ARG 641.A NH1 ASN 552.A OD1 no hydrogen 3.404 N/A ARG 641.A NH2 ASN 552.A OD1 no hydrogen 2.799 N/A LEU 642.A N VAL 650.A O no hydrogen 3.258 N/A GLY 647.A N ASP 644.A OD1 no hydrogen 3.260 N/A ARG 648.A NH2 GLU 607.A OE1 no hydrogen 3.332 N/A VAL 650.A N LEU 642.A O no hydrogen 2.822 N/A PHE 652.A N GLY 640.A O no hydrogen 2.962 N/A ARG 653.A NE ASP 651.A OD2 no hydrogen 3.302 N/A THR 655.A N PHE 652.A O no hydrogen 2.927 N/A THR 655.A OG1 PHE 652.A O no hydrogen 3.048 N/A VAL 656.A N SER 615.A O no hydrogen 3.076 N/A ILE 657.A N GLY 556.A O no hydrogen 2.770 N/A ILE 658.A N ILE 617.A O no hydrogen 2.930 N/A LEU 659.A N PHE 558.A O no hydrogen 2.770 N/A THR 660.A N PHE 619.A O no hydrogen 3.014 N/A THR 660.A OG1 PHE 619.A O no hydrogen 3.443 N/A SER 661.A N PHE 560.A O no hydrogen 3.316 N/A SER 661.A OG GLU 623.A OE1 no hydrogen 2.252 N/A ASN 662.A ND2 GLU 621.A OE1 no hydrogen 3.359 N/A LEU 663.A N SER 661.A OG no hydrogen 3.211 N/A SER 665.A N ASN 662.A O no hydrogen 3.042 N/A ILE 668.A N GLY 664.A O no hydrogen 2.744 N/A LEU 669.A N SER 665.A O no hydrogen 2.824 N/A GLU 670.A N PRO 666.A O no hydrogen 2.801 N/A GLY 671.A N LEU 667.A O no hydrogen 2.747 N/A LEU 672.A N ILE 668.A O no hydrogen 3.197 N/A LEU 672.A N LEU 669.A O no hydrogen 2.709 N/A GLN 673.A N LEU 669.A O no hydrogen 3.012 N/A LYS 674.A N GLU 670.A O no hydrogen 3.011 N/A GLY 675.A N LEU 672.A O no hydrogen 3.134 N/A TRP 676.A N GLY 671.A O no hydrogen 2.949 N/A ARG 680.A NH1 GLU 684.A OE1 no hydrogen 2.610 N/A ILE 681.A N PRO 677.A O no hydrogen 3.103 N/A ARG 682.A N TYR 678.A O no hydrogen 2.848 N/A ASP 683.A N GLU 679.A O no hydrogen 3.025 N/A GLU 684.A N ARG 680.A O no hydrogen 3.057 N/A VAL 685.A N ILE 681.A O no hydrogen 2.727 N/A PHE 686.A N ARG 682.A O no hydrogen 2.779 N/A LYS 687.A N ASP 683.A O no hydrogen 3.224 N/A LEU 689.A N VAL 685.A O no hydrogen 3.196 N/A GLN 690.A N PHE 686.A O no hydrogen 2.853 N/A GLN 691.A N VAL 688.A O no hydrogen 2.721 N/A HIS 692.A N LEU 689.A O no hydrogen 2.938 N/A HIS 692.A ND1 VAL 688.A O no hydrogen 3.190 N/A PHE 693.A N LEU 689.A O no hydrogen 2.868 N/A ARG 694.A NH1 PRO 627.A O no hydrogen 3.167 N/A ARG 694.A NH1 ASN 631.A OD1 no hydrogen 3.453 N/A ARG 694.A NH2 ASN 631.A OD1 no hydrogen 3.283 N/A PHE 697.A N ARG 694.A O no hydrogen 2.915 N/A LEU 698.A N ARG 694.A O no hydrogen 3.238 N/A ASN 699.A N PRO 695.A O no hydrogen 2.685 N/A ARG 700.A N GLU 696.A O no hydrogen 3.112 N/A ARG 700.A N PHE 697.A O no hydrogen 2.866 N/A ASP 702.A N SER 557.A OG no hydrogen 3.287 N/A VAL 706.A N GLU 532.A OE1 no hydrogen 3.460 N/A PHE 707.A N LEU 561.A O no hydrogen 2.559 N/A ARG 708.A N GLN 530.A OE1 no hydrogen 3.081 N/A LEU 710.A N TYR 752.A OH no hydrogen 3.186 N/A THR 711.A N GLN 714.A OE1 no hydrogen 2.610 N/A THR 711.A OG1 GLU 713.A OE1 no hydrogen 2.854 N/A GLU 713.A N GLU 713.A OE1 no hydrogen 2.485 N/A GLN 714.A N THR 711.A OG1 no hydrogen 3.246 N/A ILE 715.A N THR 711.A O no hydrogen 3.081 N/A ARG 716.A N LYS 712.A O no hydrogen 3.262 N/A ARG 716.A NH2 GLU 741.A OE1 no hydrogen 2.579 N/A GLN 717.A N GLU 713.A O no hydrogen 2.915 N/A ILE 718.A N GLN 714.A O no hydrogen 2.875 N/A VAL 719.A N ILE 715.A O no hydrogen 2.700 N/A GLU 720.A N ARG 716.A O no hydrogen 2.863 N/A ILE 721.A N GLN 717.A O no hydrogen 3.095 N/A GLN 722.A N ILE 718.A O no hydrogen 2.648 N/A LEU 723.A N VAL 719.A O no hydrogen 2.766 N/A SER 724.A N GLU 720.A O no hydrogen 2.984 N/A SER 724.A OG GLU 720.A O no hydrogen 3.262 N/A SER 724.A OG ILE 721.A O no hydrogen 3.166 N/A ARG 727.A N LEU 723.A O no hydrogen 2.943 N/A ARG 727.A NH1 GLU 720.A OE2 no hydrogen 3.454 N/A ALA 728.A N SER 724.A O no hydrogen 2.711 N/A ARG 729.A N TYR 725.A O no hydrogen 2.578 N/A ARG 729.A N LEU 726.A O no hydrogen 3.141 N/A LEU 730.A N LEU 726.A O no hydrogen 2.658 N/A GLU 732.A N ARG 729.A O no hydrogen 3.131 N/A LYS 733.A N LEU 730.A O no hydrogen 3.233 N/A ARG 734.A N ALA 731.A O no hydrogen 2.595 N/A ILE 735.A N LEU 730.A O no hydrogen 2.890 N/A SER 736.A N ASP 786.A O no hydrogen 2.948 N/A GLU 738.A N VAL 788.A O no hydrogen 3.101 N/A THR 740.A N VAL 790.A O no hydrogen 2.949 N/A THR 740.A OG1 VAL 790.A O no hydrogen 3.018 N/A THR 740.A OG1 ASP 791.A OD1 no hydrogen 2.697 N/A LYS 744.A N THR 740.A O no hydrogen 2.781 N/A LYS 744.A NZ GLU 720.A OE1 no hydrogen 2.860 N/A ASP 745.A N GLU 741.A O no hydrogen 2.707 N/A PHE 746.A N ALA 742.A O no hydrogen 2.860 N/A LEU 747.A N ALA 743.A O no hydrogen 2.988 N/A ALA 748.A N LYS 744.A O no hydrogen 2.839 N/A GLU 749.A N ASP 745.A O no hydrogen 2.726 N/A ARG 750.A N PHE 746.A O no hydrogen 2.953 N/A GLY 751.A N LEU 747.A O no hydrogen 2.538 N/A TYR 752.A N ALA 748.A O no hydrogen 3.097 N/A ASP 753.A N GLY 757.A O no hydrogen 2.845 N/A PHE 756.A N ASP 753.A OD1 no hydrogen 2.539 N/A GLY 757.A N ASP 753.A O no hydrogen 2.583 N/A ALA 758.A N GLY 565.A O no hydrogen 2.910 N/A VAL 764.A N PRO 760.A O no hydrogen 2.972 N/A ILE 765.A N LEU 761.A O no hydrogen 2.694 N/A GLN 766.A N ARG 762.A O no hydrogen 2.820 N/A ARG 767.A N ARG 763.A O no hydrogen 2.861 N/A GLU 768.A N VAL 764.A O no hydrogen 2.728 N/A LEU 769.A N ILE 765.A O no hydrogen 3.076 N/A GLU 770.A N ILE 765.A O no hydrogen 3.086 N/A THR 771.A N GLN 766.A O no hydrogen 2.810 N/A THR 771.A OG1 GLN 766.A O no hydrogen 3.315 N/A LEU 773.A N LEU 769.A O no hydrogen 3.042 N/A ALA 774.A N GLU 770.A O no hydrogen 2.860 N/A ALA 774.A N THR 771.A O no hydrogen 3.101 N/A GLN 775.A N THR 771.A O no hydrogen 3.198 N/A LYS 776.A N PRO 772.A O no hydrogen 3.100 N/A LYS 776.A NZ GLU 781.A OE1 no hydrogen 3.333 N/A ILE 777.A N LEU 773.A O no hydrogen 3.113 N/A LEU 778.A N ALA 774.A O no hydrogen 2.905 N/A ALA 779.A N GLN 775.A O no hydrogen 2.761 N/A GLY 780.A N ILE 777.A O no hydrogen 3.169 N/A VAL 782.A N LYS 776.A O no hydrogen 3.104 N/A GLY 785.A N LYS 733.A O no hydrogen 2.972 N/A VAL 788.A N SER 736.A O no hydrogen 2.901 N/A GLN 789.A N ALA 800.A O no hydrogen 2.567 N/A VAL 790.A N GLU 738.A O no hydrogen 2.920 N/A ASP 791.A N VAL 798.A O no hydrogen 2.846 N/A VAL 798.A N ASP 791.A O no hydrogen 2.547 N/A ALA 800.A N GLN 789.A O no hydrogen 2.682 N/A