Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jle_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N SER 117.A O no hydrogen 2.789 N/A SER 3.A OG TRP 212.A O no hydrogen 2.915 N/A ILE 5.A N SER 3.A OG no hydrogen 3.072 N/A THR 7.A OG1 ASP 121.A OD2 no hydrogen 3.324 N/A LYS 11.A N GLN 85.A OE1 no hydrogen 3.119 N/A LYS 13.A N ARG 83.A O no hydrogen 2.495 N/A LYS 13.A NZ LYS 82.A O no hydrogen 3.434 N/A VAL 21.A N ASN 57.A O no hydrogen 2.726 N/A ILE 31.A N THR 27.A O no hydrogen 2.852 N/A LYS 32.A N GLU 28.A O no hydrogen 2.940 N/A ALA 33.A N GLU 29.A O no hydrogen 3.243 N/A LEU 34.A N LYS 30.A O no hydrogen 2.817 N/A VAL 35.A N ILE 31.A O no hydrogen 2.998 N/A GLU 36.A N LYS 32.A O no hydrogen 3.008 N/A GLU 36.A N ALA 33.A O no hydrogen 2.756 N/A ILE 37.A N ALA 33.A O no hydrogen 2.824 N/A CYS 38.A N LEU 34.A O no hydrogen 2.683 N/A CYS 38.A SG LEU 34.A O no hydrogen 2.986 N/A THR 39.A N VAL 35.A O no hydrogen 3.182 N/A THR 39.A N GLU 36.A O no hydrogen 2.856 N/A THR 39.A OG1 VAL 35.A O no hydrogen 2.576 N/A GLU 40.A N GLU 36.A O no hydrogen 3.149 N/A MET 41.A N ILE 37.A O no hydrogen 3.087 N/A GLU 42.A N CYS 38.A O no hydrogen 2.816 N/A LYS 43.A N THR 39.A O no hydrogen 2.998 N/A GLU 44.A N GLU 40.A O no hydrogen 2.944 N/A GLU 44.A N MET 41.A O no hydrogen 3.169 N/A GLY 45.A N GLU 42.A O no hydrogen 3.078 N/A LYS 46.A N MET 41.A O no hydrogen 3.067 N/A LYS 46.A NZ PHE 116.A O no hydrogen 3.278 N/A SER 48.A N GLN 145.A O no hydrogen 3.051 N/A ILE 50.A N ARG 143.A O no hydrogen 2.793 N/A ASN 54.A ND2 LYS 126.A O no hydrogen 2.638 N/A TYR 56.A OH ASP 17.A OD1 no hydrogen 2.449 N/A ASN 57.A N PRO 19.A O no hydrogen 3.170 N/A ASN 57.A ND2 VAL 21.A O no hydrogen 2.745 N/A THR 58.A N ALA 129.A O no hydrogen 2.706 N/A THR 58.A OG1 ALA 129.A O no hydrogen 3.301 N/A PHE 61.A N LEU 74.A O no hydrogen 2.797 N/A ILE 63.A N ARG 72.A O no hydrogen 3.307 N/A SER 68.A OG LYS 64.A O no hydrogen 2.645 N/A SER 68.A OG LYS 70.A O no hydrogen 3.227 N/A THR 69.A OG1 SER 68.A O no hydrogen 3.498 N/A ARG 72.A N ILE 63.A O no hydrogen 3.223 N/A LYS 73.A NZ TYR 146.A OH no hydrogen 3.136 N/A LEU 74.A N PHE 61.A O no hydrogen 3.089 N/A ASP 76.A N PRO 59.A O no hydrogen 3.076 N/A PHE 77.A N VAL 75.A O no hydrogen 2.984 N/A ASN 81.A N PHE 77.A O no hydrogen 2.595 N/A ASN 81.A ND2 GLY 152.A O no hydrogen 3.281 N/A LYS 82.A N ARG 78.A O no hydrogen 3.209 N/A LYS 82.A NZ GLU 79.A OE1 no hydrogen 3.160 N/A ARG 83.A N LEU 80.A O no hydrogen 3.249 N/A ARG 83.A NE ASP 17.A O no hydrogen 2.895 N/A ARG 83.A NH2 ASP 17.A O no hydrogen 3.513 N/A THR 84.A N LEU 80.A O no hydrogen 3.032 N/A THR 84.A OG1 LEU 80.A O no hydrogen 2.572 N/A GLN 85.A N LYS 11.A O no hydrogen 3.077 N/A GLN 85.A NE2 ASP 86.A O no hydrogen 3.016 N/A VAL 90.A N TRP 88.A O no hydrogen 2.463 N/A GLN 91.A NE2 GLN 182.A O no hydrogen 3.066 N/A GLY 99.A N HIS 96.A O no hydrogen 3.087 N/A LEU 100.A N PRO 97.A O no hydrogen 3.054 N/A LYS 102.A N TYR 319.A O no hydrogen 2.929 N/A LYS 102.A NZ ASP 320.A OD2 no hydrogen 2.945 N/A LYS 103.A NZ LYS 102.A O no hydrogen 2.741 N/A LYS 103.A NZ ASP 192.A OD1 no hydrogen 3.050 N/A LYS 103.A NZ ASP 192.A OD2 no hydrogen 2.300 N/A LYS 104.A N ASP 192.A OD1 no hydrogen 2.573 N/A LYS 104.A NZ GLU 194.A OE1 no hydrogen 3.459 N/A SER 105.A N SER 191.A O no hydrogen 2.584 N/A THR 107.A N VAL 189.A O no hydrogen 2.424 N/A THR 107.A OG1 HIS 198.A NE2 no hydrogen 3.164 N/A LEU 109.A N LEU 187.A O no hydrogen 2.671 N/A GLY 112.A N THR 215.A O no hydrogen 3.369 N/A SER 117.A N ASP 113.A O no hydrogen 3.114 N/A SER 117.A OG GLY 112.A O no hydrogen 3.416 N/A SER 117.A OG ASP 113.A O no hydrogen 2.249 N/A LEU 120.A N ASN 147.A O no hydrogen 3.071 N/A PHE 124.A N ASP 121.A O no hydrogen 2.735 N/A ARG 125.A N GLU 122.A O no hydrogen 3.002 N/A ARG 125.A NE LEU 120.A O no hydrogen 2.528 N/A TYR 127.A N PHE 124.A O no hydrogen 3.087 N/A THR 128.A N ARG 125.A O no hydrogen 2.820 N/A THR 128.A OG1 ARG 125.A O no hydrogen 2.644 N/A PHE 130.A N TYR 144.A O no hydrogen 3.098 N/A THR 131.A OG1 ASN 57.A OD1 no hydrogen 2.335 N/A ILE 132.A N ILE 142.A O no hydrogen 2.787 N/A ASN 136.A N GLU 138.A OE2 no hydrogen 2.652 N/A ASN 136.A ND2 ILE 135.A O no hydrogen 3.451 N/A ASN 137.A N SER 134.A O no hydrogen 2.387 N/A THR 139.A N GLU 138.A OE1 no hydrogen 3.373 N/A THR 139.A OG1 GLU 138.A OE1 no hydrogen 2.820 N/A ILE 142.A N ILE 132.A O no hydrogen 2.763 N/A ARG 143.A NH1 TYR 56.A O no hydrogen 2.960 N/A ARG 143.A NH1 THR 131.A OG1 no hydrogen 2.889 N/A ARG 143.A NH2 ASN 54.A OD1 no hydrogen 3.340 N/A ARG 143.A NH2 TYR 56.A O no hydrogen 3.101 N/A TYR 144.A N PHE 130.A O no hydrogen 3.227 N/A GLN 145.A N SER 48.A O no hydrogen 3.191 N/A TYR 146.A N THR 128.A OG1 no hydrogen 2.909 N/A ASN 147.A N LYS 46.A O no hydrogen 3.137 N/A ASN 147.A ND2 GLY 45.A O no hydrogen 2.494 N/A ASN 147.A ND2 SER 48.A OG no hydrogen 2.776 N/A LEU 149.A N TYR 115.A O no hydrogen 3.100 N/A TRP 153.A N PRO 150.A O no hydrogen 3.385 N/A TRP 153.A NE1 THR 84.A OG1 no hydrogen 3.146 N/A LYS 154.A N ASN 81.A OD1 no hydrogen 2.767 N/A LYS 154.A NZ THR 84.A O no hydrogen 2.730 N/A LYS 154.A NZ GLN 85.A O no hydrogen 2.539 N/A LYS 154.A NZ ASP 86.A OD1 no hydrogen 2.919 N/A SER 156.A N TRP 153.A O no hydrogen 3.303 N/A SER 156.A OG PRO 150.A O no hydrogen 2.697 N/A SER 156.A OG TRP 153.A O no hydrogen 3.506 N/A ILE 159.A N GLY 155.A O no hydrogen 2.849 N/A PHE 160.A N SER 156.A O no hydrogen 2.732 N/A GLN 161.A N PRO 157.A O no hydrogen 3.253 N/A GLN 161.A N ALA 158.A O no hydrogen 3.281 N/A SER 162.A N ALA 158.A O no hydrogen 3.347 N/A SER 162.A OG ALA 158.A O no hydrogen 3.134 N/A SER 163.A N ILE 159.A O no hydrogen 3.019 N/A SER 163.A OG ILE 159.A O no hydrogen 3.027 N/A MET 164.A N PHE 160.A O no hydrogen 3.202 N/A THR 165.A N GLN 161.A O no hydrogen 2.733 N/A THR 165.A OG1 GLN 161.A O no hydrogen 3.483 N/A THR 165.A OG1 GLN 182.A OE1 no hydrogen 3.199 N/A LYS 166.A N SER 162.A O no hydrogen 2.876 N/A ILE 167.A N SER 163.A O no hydrogen 3.246 N/A LEU 168.A N MET 164.A O no hydrogen 2.907 N/A GLU 169.A N THR 165.A O no hydrogen 2.875 N/A GLU 169.A N LYS 166.A O no hydrogen 3.086 N/A PHE 171.A N LEU 168.A O no hydrogen 2.889 N/A ARG 172.A N LEU 168.A O no hydrogen 3.230 N/A LYS 173.A N GLU 169.A O no hydrogen 3.292 N/A GLN 174.A N PRO 170.A O no hydrogen 3.492 N/A GLN 174.A NE2 LYS 173.A O no hydrogen 3.249 N/A ILE 178.A N ASN 175.A O no hydrogen 2.892 N/A VAL 179.A N GLY 190.A O no hydrogen 3.010 N/A TYR 181.A N TYR 188.A O no hydrogen 2.754 N/A ASP 186.A N TYR 183.A O no hydrogen 2.859 N/A TYR 188.A N TYR 181.A O no hydrogen 2.984 N/A TYR 188.A OH ASP 186.A OD2 no hydrogen 2.956 N/A VAL 189.A N THR 107.A O no hydrogen 2.793 N/A GLY 190.A N VAL 179.A O no hydrogen 3.053 N/A SER 191.A N SER 105.A O no hydrogen 2.609 N/A SER 191.A OG HIS 198.A ND1 no hydrogen 3.106 N/A HIS 198.A N GLU 194.A O no hydrogen 2.888 N/A LYS 201.A N HIS 198.A O no hydrogen 2.561 N/A ILE 202.A N HIS 198.A O no hydrogen 2.765 N/A GLU 204.A N LYS 201.A O no hydrogen 3.127 N/A LEU 205.A N LYS 201.A O no hydrogen 2.938 N/A ARG 206.A N ILE 202.A O no hydrogen 2.960 N/A ARG 206.A NE PRO 217.A O no hydrogen 2.366 N/A GLN 207.A N GLU 203.A O no hydrogen 3.240 N/A HIS 208.A N GLU 204.A O no hydrogen 3.154 N/A HIS 208.A N LEU 205.A O no hydrogen 2.853 N/A LEU 209.A N LEU 205.A O no hydrogen 3.267 N/A LEU 209.A N ARG 206.A O no hydrogen 2.271 N/A LEU 210.A N ARG 206.A O no hydrogen 3.291 N/A ARG 211.A N GLN 207.A O no hydrogen 3.021 N/A TRP 212.A N LEU 209.A O no hydrogen 2.465 N/A GLY 213.A N LEU 210.A O no hydrogen 2.948 N/A LEU 214.A N LEU 209.A O no hydrogen 3.178 N/A THR 216.A OG1 THR 215.A O no hydrogen 2.873 N/A LYS 219.A NZ ARG 199.A O no hydrogen 2.298 N/A LYS 219.A NZ GLU 203.A OE1 no hydrogen 2.827 N/A HIS 221.A N ASP 218.A O no hydrogen 2.589 N/A GLN 222.A N ASP 218.A O no hydrogen 2.722 N/A GLN 222.A NE2 PRO 217.A O no hydrogen 3.575 N/A PHE 227.A N LEU 234.A O no hydrogen 2.800 N/A TRP 229.A N TYR 232.A O no hydrogen 2.584 N/A TYR 232.A N TRP 229.A O no hydrogen 2.573 N/A GLU 233.A N THR 240.A O no hydrogen 3.076 N/A LEU 234.A N PHE 227.A O no hydrogen 2.881 N/A HIS 235.A N LYS 238.A O no hydrogen 3.065 N/A TRP 239.A N GLY 316.A O no hydrogen 2.851 N/A THR 240.A OG1 VAL 241.A O no hydrogen 3.183 N/A THR 240.A OG1 VAL 314.A O no hydrogen 3.178 N/A GLN 242.A N GLY 231.A O no hydrogen 2.898 N/A LYS 249.A NZ ASP 256.A OD2 no hydrogen 2.909 N/A SER 251.A OG ASP 250.A O no hydrogen 2.706 N/A THR 253.A N ASP 256.A OD2 no hydrogen 3.022 N/A THR 253.A OG1 ASP 256.A OD1 no hydrogen 2.382 N/A THR 253.A OG1 LEU 289.A O no hydrogen 2.241 N/A VAL 254.A N GLU 291.A O no hydrogen 2.809 N/A ASN 255.A N LEU 289.A O no hydrogen 3.105 N/A ILE 257.A N VAL 254.A O no hydrogen 3.184 N/A GLN 258.A N VAL 254.A O no hydrogen 3.005 N/A GLN 258.A N ASN 255.A O no hydrogen 2.405 N/A LYS 259.A N ASN 255.A O no hydrogen 3.112 N/A VAL 261.A N ILE 257.A O no hydrogen 2.677 N/A GLY 262.A N LYS 259.A O no hydrogen 3.173 N/A LYS 263.A N LYS 259.A O no hydrogen 2.799 N/A LEU 264.A N LEU 260.A O no hydrogen 2.753 N/A ASN 265.A N GLY 262.A O no hydrogen 3.175 N/A TRP 266.A N LYS 263.A O no hydrogen 2.944 N/A TRP 266.A NE1 GLY 231.A O no hydrogen 2.772 N/A ALA 267.A N LYS 263.A O no hydrogen 2.905 N/A SER 268.A N LEU 264.A O no hydrogen 3.214 N/A GLN 269.A N TRP 266.A O no hydrogen 3.176 N/A GLN 269.A NE2 TYR 232.A OH no hydrogen 2.321 N/A ILE 270.A N ALA 267.A O no hydrogen 3.053 N/A TYR 271.A N ALA 267.A O no hydrogen 3.133 N/A LYS 275.A N ASN 306.A OD1 no hydrogen 3.102 N/A LYS 275.A NZ GLN 332.A O no hydrogen 3.150 N/A GLN 278.A N GLU 302.A OE1 no hydrogen 2.534 N/A LEU 279.A N GLU 302.A OE2 no hydrogen 3.139 N/A CYS 280.A N VAL 276.A O no hydrogen 2.913 N/A LEU 283.A N CYS 280.A O no hydrogen 3.154 N/A ARG 284.A N LEU 282.A O no hydrogen 2.761 N/A THR 286.A OG1 LYS 287.A O no hydrogen 2.971 N/A THR 286.A OG1 GLU 291.A OE2 no hydrogen 3.152 N/A GLU 291.A N ALA 288.A O no hydrogen 2.906 N/A ILE 293.A N TRP 252.A O no hydrogen 2.498 N/A THR 296.A OG1 GLU 298.A OE1 no hydrogen 2.945 N/A THR 296.A OG1 GLU 298.A OE2 no hydrogen 3.570 N/A GLU 298.A N GLU 298.A OE2 no hydrogen 2.671 N/A GLU 300.A N THR 296.A O no hydrogen 3.165 N/A LEU 301.A N GLU 297.A O no hydrogen 2.920 N/A GLU 302.A N GLU 298.A O no hydrogen 2.945 N/A GLU 302.A N ALA 299.A O no hydrogen 2.689 N/A LEU 303.A N ALA 299.A O no hydrogen 2.920 N/A ASN 306.A N GLU 302.A O no hydrogen 2.977 N/A ASN 306.A ND2 LYS 275.A O no hydrogen 2.790 N/A ARG 307.A N LEU 303.A O no hydrogen 2.781 N/A ARG 307.A NH1 LEU 246.A O no hydrogen 3.016 N/A ARG 307.A NH2 LEU 246.A O no hydrogen 3.455 N/A ARG 307.A NH2 PRO 247.A O no hydrogen 2.785 N/A GLU 308.A N ALA 304.A O no hydrogen 3.035 N/A ILE 309.A N GLU 305.A O no hydrogen 2.749 N/A LEU 310.A N ASN 306.A O no hydrogen 3.062 N/A LYS 311.A N GLU 308.A O no hydrogen 2.637 N/A GLU 312.A N GLU 312.A OE2 no hydrogen 2.272 N/A VAL 314.A N TYR 271.A OH no hydrogen 3.239 N/A GLY 316.A N TRP 239.A O no hydrogen 2.548 N/A VAL 317.A N ASN 348.A O no hydrogen 2.997 N/A TYR 318.A OH HIS 235.A O no hydrogen 2.820 N/A TYR 319.A N LEU 100.A O no hydrogen 3.277 N/A SER 322.A N ASP 320.A OD1 no hydrogen 3.249 N/A SER 322.A OG ASP 320.A OD1 no hydrogen 2.237 N/A LYS 323.A N ASP 320.A O no hydrogen 3.248 N/A ILE 326.A N TYR 342.A O no hydrogen 2.812 N/A ALA 327.A N LYS 388.A O no hydrogen 2.686 N/A GLU 328.A N GLN 340.A O no hydrogen 3.419 N/A GLN 330.A N THR 338.A O no hydrogen 2.789 N/A GLN 330.A NE2 GLN 340.A OE1 no hydrogen 2.323 N/A GLN 332.A N GLN 336.A O no hydrogen 2.817 N/A GLN 334.A NE2 GLN 334.A O no hydrogen 2.266 N/A GLN 336.A N GLY 333.A O no hydrogen 3.025 N/A TRP 337.A N TYR 354.A O no hydrogen 2.756 N/A THR 338.A N GLN 330.A O no hydrogen 3.004 N/A THR 338.A OG1 GLN 330.A O no hydrogen 3.523 N/A THR 338.A OG1 GLN 330.A OE1 no hydrogen 3.238 N/A TYR 339.A N GLY 352.A O no hydrogen 3.070 N/A TYR 339.A OH GLU 378.A OE1 no hydrogen 2.299 N/A GLN 340.A N GLU 328.A O no hydrogen 3.089 N/A ILE 341.A N LYS 350.A O no hydrogen 2.350 N/A TYR 342.A N ILE 326.A O no hydrogen 3.040 N/A TYR 342.A OH GLU 328.A OE2 no hydrogen 2.241 N/A GLN 343.A NE2 ASP 320.A O no hydrogen 2.579 N/A GLN 343.A NE2 LYS 323.A O no hydrogen 2.948 N/A LYS 347.A N GLU 344.A O no hydrogen 2.873 N/A LYS 350.A N ILE 341.A O no hydrogen 3.023 N/A LYS 350.A NZ THR 351.A O no hydrogen 2.928 N/A THR 351.A N GLN 269.A O no hydrogen 3.172 N/A LYS 353.A NZ ASN 265.A OD1 no hydrogen 3.059 N/A TYR 354.A N TRP 337.A O no hydrogen 2.722 N/A TYR 354.A OH GLU 370.A OE1 no hydrogen 2.368 N/A ARG 356.A N GLY 335.A O no hydrogen 3.125 N/A THR 362.A N GLN 512.A O no hydrogen 3.275 N/A THR 362.A OG1 ASN 363.A O no hydrogen 3.415 N/A ASN 363.A ND2 ALA 508.A O no hydrogen 3.248 N/A ASN 363.A ND2 GLN 509.A O no hydrogen 3.323 N/A ASP 364.A N ASP 511.A OD2 no hydrogen 3.341 N/A LYS 366.A N ASN 363.A OD1 no hydrogen 2.670 N/A LYS 366.A NZ HIS 361.A O no hydrogen 3.115 N/A GLN 367.A N ASN 363.A O no hydrogen 3.036 N/A LEU 368.A N ASP 364.A O no hydrogen 2.877 N/A THR 369.A OG1 LYS 366.A O no hydrogen 3.565 N/A GLU 370.A N LYS 366.A O no hydrogen 3.200 N/A ALA 371.A N GLN 367.A O no hydrogen 3.119 N/A VAL 372.A N LEU 368.A O no hydrogen 2.658 N/A GLN 373.A N THR 369.A O no hydrogen 2.785 N/A LYS 374.A N GLU 370.A O no hydrogen 2.926 N/A LYS 374.A NZ LYS 353.A O no hydrogen 3.184 N/A ILE 375.A N ALA 371.A O no hydrogen 2.615 N/A THR 376.A N VAL 372.A O no hydrogen 2.736 N/A THR 376.A OG1 VAL 372.A O no hydrogen 2.925 N/A THR 377.A N GLN 373.A O no hydrogen 2.988 N/A THR 377.A OG1 GLN 373.A O no hydrogen 3.226 N/A GLU 378.A N LYS 374.A O no hydrogen 3.225 N/A SER 379.A N ILE 375.A O no hydrogen 3.318 N/A SER 379.A OG ILE 375.A O no hydrogen 2.911 N/A ILE 380.A N THR 376.A O no hydrogen 3.427 N/A VAL 381.A N THR 377.A O no hydrogen 3.051 N/A ILE 382.A N GLU 378.A O no hydrogen 2.780 N/A TRP 383.A N SER 379.A O no hydrogen 2.435 N/A TRP 383.A NE1 ALA 98.A O no hydrogen 2.630 N/A GLY 384.A N ILE 380.A O no hydrogen 2.884 N/A LYS 385.A NZ PRO 321.A O no hydrogen 3.537 N/A LYS 385.A NZ LYS 323.A O no hydrogen 3.095 N/A LYS 388.A N LEU 325.A O no hydrogen 2.836 N/A LYS 388.A NZ GLU 413.A OE2 no hydrogen 2.951 N/A PHE 389.A N GLU 413.A O no hydrogen 2.735 N/A LYS 390.A N ALA 327.A O no hydrogen 2.852 N/A LEU 391.A N GLU 415.A O no hydrogen 2.881 N/A LYS 395.A NZ TRP 414.A O no hydrogen 2.524 N/A TRP 398.A N GLN 394.A O no hydrogen 3.199 N/A GLU 399.A N LYS 395.A O no hydrogen 3.134 N/A THR 400.A N GLU 396.A O no hydrogen 2.906 N/A THR 400.A OG1 GLU 396.A O no hydrogen 3.244 N/A TRP 401.A N THR 397.A O no hydrogen 3.142 N/A TRP 402.A N TRP 398.A O no hydrogen 2.942 N/A THR 403.A N GLU 399.A O no hydrogen 3.052 N/A THR 403.A OG1 GLU 399.A O no hydrogen 2.310 N/A THR 403.A OG1 THR 400.A O no hydrogen 3.341 N/A TYR 405.A N TRP 401.A O no hydrogen 2.967 N/A GLU 415.A N PHE 389.A O no hydrogen 2.856 N/A VAL 417.A N LEU 391.A O no hydrogen 3.172 N/A THR 419.A N VAL 417.A O no hydrogen 2.577 N/A VAL 423.A N PRO 392.A O no hydrogen 2.731 N/A TYR 427.A OH PRO 510.A O no hydrogen 2.939 N/A GLU 430.A N VAL 531.A O no hydrogen 2.868 N/A LYS 431.A NZ GLU 404.A OE2 no hydrogen 2.970 N/A ALA 437.A N ILE 434.A O no hydrogen 3.221 N/A THR 439.A N ASN 460.A OD1 no hydrogen 2.984 N/A PHE 440.A N ASN 494.A O no hydrogen 3.023 N/A TYR 441.A N VAL 458.A O no hydrogen 3.035 N/A ASP 443.A N GLY 456.A O no hydrogen 3.089 N/A GLY 444.A N ASP 443.A OD2 no hydrogen 2.920 N/A ALA 445.A N LYS 454.A O no hydrogen 3.495 N/A GLU 449.A N ASN 447.A OD1 no hydrogen 3.063 N/A THR 450.A N ASN 447.A OD1 no hydrogen 3.229 N/A THR 450.A OG1 ASN 447.A O no hydrogen 3.396 N/A LYS 451.A N ASN 447.A O no hydrogen 2.461 N/A LYS 451.A NZ ASP 471.A OD2 no hydrogen 2.835 N/A LEU 452.A N THR 450.A OG1 no hydrogen 3.056 N/A LYS 454.A N ALA 445.A O no hydrogen 3.229 N/A ALA 455.A N VAL 467.A O no hydrogen 2.689 N/A GLY 456.A N ASP 443.A O no hydrogen 3.274 N/A TYR 457.A N LYS 465.A O no hydrogen 3.244 N/A TYR 457.A OH ASP 488.A OD2 no hydrogen 2.563 N/A VAL 458.A N TYR 441.A O no hydrogen 3.229 N/A THR 459.A N ARG 463.A O no hydrogen 3.187 N/A THR 459.A OG1 GLU 438.A OE2 no hydrogen 2.439 N/A ASN 460.A N ASN 460.A OD1 no hydrogen 2.610 N/A ARG 461.A N THR 459.A OG1 no hydrogen 2.922 N/A ARG 463.A NH2 ASP 488.A O no hydrogen 2.627 N/A LYS 465.A N TYR 457.A O no hydrogen 3.395 N/A LEU 469.A N GLY 453.A O no hydrogen 2.766 N/A THR 472.A N LYS 451.A O no hydrogen 3.006 N/A THR 472.A OG1 THR 473.A O no hydrogen 3.434 N/A LYS 476.A N THR 473.A OG1 no hydrogen 3.086 N/A THR 477.A N THR 473.A O no hydrogen 2.988 N/A THR 477.A N ASN 474.A O no hydrogen 2.995 N/A THR 477.A OG1 THR 473.A O no hydrogen 3.233 N/A THR 477.A OG1 ASN 474.A O no hydrogen 2.954 N/A GLU 478.A N ASN 474.A O no hydrogen 3.202 N/A LEU 479.A N GLN 475.A O no hydrogen 3.361 N/A GLN 480.A N LYS 476.A O no hydrogen 3.274 N/A ALA 481.A N THR 477.A O no hydrogen 2.836 N/A ILE 482.A N GLU 478.A O no hydrogen 3.442 N/A TYR 483.A N LEU 479.A O no hydrogen 2.881 N/A LEU 484.A N GLN 480.A O no hydrogen 2.874 N/A ALA 485.A N ALA 481.A O no hydrogen 3.260 N/A LEU 486.A N ILE 482.A O no hydrogen 3.241 N/A LEU 486.A N TYR 483.A O no hydrogen 3.102 N/A GLN 487.A N TYR 483.A O no hydrogen 3.024 N/A ASP 488.A N LEU 484.A O no hydrogen 3.227 N/A SER 489.A OG LEU 486.A O no hydrogen 3.067 N/A VAL 493.A N LYS 530.A O no hydrogen 3.186 N/A ASN 494.A N GLU 438.A O no hydrogen 3.160 N/A VAL 496.A N PHE 440.A O no hydrogen 3.053 N/A THR 497.A N ALA 534.A O no hydrogen 2.921 N/A SER 499.A N THR 497.A OG1 no hydrogen 3.155 N/A SER 499.A OG GLU 478.A OE2 no hydrogen 2.945 N/A LEU 503.A N SER 499.A O no hydrogen 3.105 N/A GLY 504.A N GLN 500.A O no hydrogen 2.943 N/A ILE 505.A N TYR 501.A O no hydrogen 3.208 N/A ILE 506.A N ALA 502.A O no hydrogen 2.958 N/A GLN 507.A N LEU 503.A O no hydrogen 2.778 N/A GLN 509.A N ILE 506.A O no hydrogen 3.091 N/A ASP 511.A N THR 362.A O no hydrogen 3.117 N/A GLN 512.A NE2 GLN 367.A OE1 no hydrogen 3.028 N/A SER 513.A OG SER 515.A O no hydrogen 3.369 N/A SER 515.A N SER 513.A OG no hydrogen 2.944 N/A VAL 518.A N SER 515.A OG no hydrogen 2.919 N/A ASN 519.A N SER 515.A O no hydrogen 2.843 N/A GLN 520.A N GLU 516.A O no hydrogen 2.689 N/A ILE 521.A N LEU 517.A O no hydrogen 3.309 N/A ILE 522.A N VAL 518.A O no hydrogen 2.936 N/A GLU 523.A N ASN 519.A O no hydrogen 2.948 N/A GLN 524.A N GLN 520.A O no hydrogen 2.778 N/A ILE 526.A N ILE 522.A O no hydrogen 3.213 N/A LYS 527.A N GLN 524.A O no hydrogen 2.569 N/A LYS 528.A NZ LEU 486.A O no hydrogen 3.499 N/A LYS 528.A NZ SER 489.A OG no hydrogen 2.689 N/A GLU 529.A N LEU 491.A O no hydrogen 2.834 N/A LYS 530.A N LEU 491.A O no hydrogen 3.207 N/A TYR 532.A N VAL 493.A O no hydrogen 3.400 N/A ALA 534.A N ILE 495.A O no hydrogen 3.097 N/A VAL 536.A N THR 497.A O no hydrogen 3.091 N/A ASN 545.A N ILE 542.A O no hydrogen 2.756 N/A ASN 545.A ND2 ASP 498.A OD1 no hydrogen 3.026 N/A