Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vf8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N PRO 2.A O no hydrogen 2.866 N/A VAL 7.A N VAL 24.A O no hydrogen 2.823 N/A GLN 8.A N ASP 78.A O no hydrogen 2.692 N/A GLN 8.A NE2 VAL 22.A O no hydrogen 3.438 N/A VAL 9.A N VAL 22.A O no hydrogen 2.871 N/A ARG 10.A N ALA 76.A O no hydrogen 2.817 N/A ALA 12.A N ILE 20.A O no hydrogen 3.037 N/A ARG 13.A N ASP 73.A O no hydrogen 2.917 N/A ARG 13.A NE ASP 73.A OD1 no hydrogen 2.969 N/A ARG 13.A NE ASP 73.A OD2 no hydrogen 3.019 N/A ARG 13.A NH1 ASP 19.A OD1 no hydrogen 2.594 N/A ARG 13.A NH1 ASP 75.A OD1 no hydrogen 2.881 N/A ARG 13.A NH1 ASP 75.A OD2 no hydrogen 3.272 N/A ARG 13.A NH2 ASP 73.A OD2 no hydrogen 2.911 N/A ARG 13.A NH2 ASP 75.A OD1 no hydrogen 2.436 N/A HIS 15.A ND1 SER 42.A OG no hydrogen 2.514 N/A LEU 17.A N GLN 14.A O no hydrogen 3.146 N/A LYS 18.A N GLY 451.A O no hydrogen 2.642 N/A LYS 18.A NZ ASN 16.A O no hydrogen 3.190 N/A ILE 20.A N ALA 12.A O no hydrogen 3.089 N/A VAL 22.A N VAL 9.A O no hydrogen 3.094 N/A VAL 24.A N VAL 7.A O no hydrogen 3.190 N/A ARG 26.A N GLY 5.A O no hydrogen 2.989 N/A ARG 26.A NE GLY 79.A O no hydrogen 3.120 N/A ARG 26.A NH2 GLY 4.A O no hydrogen 3.474 N/A ASP 27.A N SER 422.A OG no hydrogen 2.598 N/A LEU 29.A N ASP 437.A OD1 no hydrogen 2.769 N/A VAL 30.A N LEU 423.A O no hydrogen 2.841 N/A VAL 31.A N TRP 438.A O no hydrogen 2.931 N/A PHE 32.A N VAL 425.A O no hydrogen 2.525 N/A THR 33.A N VAL 440.A O no hydrogen 2.704 N/A THR 33.A OG1 VAL 440.A O no hydrogen 3.200 N/A THR 33.A OG1 ASP 441.A OD1 no hydrogen 2.595 N/A SER 36.A N ASP 732.A OD2 no hydrogen 3.112 N/A SER 38.A N VAL 35.A O no hydrogen 2.946 N/A SER 38.A OG VAL 35.A O no hydrogen 2.776 N/A SER 38.A OG VAL 442.A O no hydrogen 3.130 N/A LYS 40.A NZ GLY 34.A O no hydrogen 2.753 N/A LYS 40.A NZ VAL 35.A O no hydrogen 3.443 N/A LYS 40.A NZ HIS 428.A NE2 no hydrogen 3.039 N/A SER 42.A OG HIS 15.A ND1 no hydrogen 2.514 N/A LEU 43.A N GLY 39.A O no hydrogen 2.850 N/A ALA 44.A N LYS 40.A O no hydrogen 2.713 N/A PHE 45.A N SER 41.A O no hydrogen 2.546 N/A GLY 46.A N SER 41.A O no hydrogen 2.646 N/A THR 47.A N LEU 43.A O no hydrogen 3.264 N/A THR 47.A OG1 SER 42.A O no hydrogen 2.548 N/A LEU 48.A N LEU 43.A O no hydrogen 3.060 N/A TYR 49.A N ALA 44.A O no hydrogen 2.924 N/A ALA 50.A N PHE 45.A O no hydrogen 3.153 N/A GLU 51.A N THR 47.A O no hydrogen 2.669 N/A ALA 52.A N LEU 48.A O no hydrogen 2.976 N/A GLN 53.A N TYR 49.A O no hydrogen 2.630 N/A ARG 54.A N ALA 50.A O no hydrogen 3.182 N/A ARG 54.A N GLU 51.A O no hydrogen 2.761 N/A ARG 55.A N GLU 51.A O no hydrogen 3.108 N/A ARG 55.A NH1 ILE 77.A O no hydrogen 3.072 N/A ARG 55.A NH2 ILE 77.A O no hydrogen 3.280 N/A LEU 57.A N GLN 53.A O no hydrogen 3.102 N/A GLU 58.A N ARG 54.A O no hydrogen 3.137 N/A SER 59.A N TYR 56.A O no hydrogen 3.018 N/A SER 59.A OG ARG 55.A O no hydrogen 3.379 N/A VAL 60.A N TYR 56.A O no hydrogen 3.027 N/A SER 61.A N LEU 57.A O no hydrogen 2.912 N/A ALA 64.A N SER 61.A OG no hydrogen 3.423 N/A PHE 68.A N ARG 65.A O no hydrogen 3.359 N/A ASN 69.A N LEU 67.A O no hydrogen 3.164 N/A ASP 73.A N GLN 14.A OE1 no hydrogen 3.074 N/A ASP 75.A N GLY 11.A O no hydrogen 3.043 N/A ALA 76.A N ARG 10.A O no hydrogen 3.118 N/A ASP 78.A N GLN 8.A O no hydrogen 2.623 N/A VAL 84.A N VAL 391.A O no hydrogen 2.952 N/A LEU 86.A N VAL 393.A O no hydrogen 2.969 N/A GLN 87.A NE2 GLN 375.A OE1 no hydrogen 3.664 N/A GLN 88.A N GLN 88.A OE1.A no hydrogen 2.943 N/A THR 92.A N ALA 89.A O no hydrogen 3.302 N/A THR 92.A OG1 ALA 89.A O no hydrogen 2.674 N/A SER 97.A OG ALA 95.A O no hydrogen 3.329 N/A SER 98.A OG LEU 362.A O no hydrogen 3.342 N/A VAL 99.A N ARG 364.A O no hydrogen 2.739 N/A GLY 100.A N LEU 362.A O no hydrogen 2.914 N/A SER 101.A N SER 98.A O no hydrogen 3.008 N/A SER 101.A N SER 98.A OG no hydrogen 3.205 N/A SER 101.A OG SER 98.A O no hydrogen 3.446 N/A VAL 102.A N SER 98.A O no hydrogen 2.936 N/A THR 103.A N VAL 99.A O no hydrogen 2.987 N/A THR 103.A OG1 VAL 99.A O no hydrogen 2.965 N/A THR 103.A OG1 GLY 100.A O no hydrogen 2.997 N/A THR 104.A N SER 101.A O no hydrogen 3.189 N/A THR 104.A OG1 THR 103.A O no hydrogen 2.736 N/A LEU 105.A N THR 103.A O no hydrogen 2.675 N/A SER 106.A N GLY 100.A O no hydrogen 2.906 N/A LEU 108.A N LEU 105.A O no hydrogen 2.872 N/A LEU 109.A N LEU 105.A O no hydrogen 3.104 N/A ARG 110.A N SER 106.A O no hydrogen 3.191 N/A MET 111.A N ASN 107.A O no hydrogen 3.150 N/A LEU 112.A N LEU 108.A O no hydrogen 3.304 N/A TYR 113.A N LEU 109.A O no hydrogen 2.527 N/A TYR 113.A OH LEU 296.A O no hydrogen 3.214 N/A SER 114.A N ARG 110.A O no hydrogen 3.134 N/A SER 114.A N MET 111.A O no hydrogen 3.131 N/A SER 114.A OG VAL 126.A O no hydrogen 2.318 N/A ARG 115.A N MET 111.A O no hydrogen 2.955 N/A ASP 118.A N THR 292.A O no hydrogen 2.575 N/A TYR 119.A OH SER 114.A O no hydrogen 2.753 N/A GLN 123.A N PRO 120.A O no hydrogen 3.291 N/A GLN 123.A NE2 GLN 123.A O no hydrogen 2.802 N/A VAL 126.A N TYR 119.A OH no hydrogen 3.217 N/A GLY 130.A N TYR 127.A O no hydrogen 2.790 N/A PHE 131.A N ALA 128.A O no hydrogen 3.371 N/A THR 135.A OG1 GLU 129.A O no hydrogen 2.798 N/A GLU 137.A N GLU 137.A OE2 no hydrogen 2.299 N/A GLY 138.A N THR 135.A O no hydrogen 2.958 N/A GLY 138.A N THR 135.A OG1 no hydrogen 3.112 N/A ALA 139.A N THR 135.A O no hydrogen 2.869 N/A CYS 140.A N ARG 283.A O no hydrogen 3.091 N/A CYS 143.A SG CYS 140.A O no hydrogen 3.894 N/A HIS 144.A N CYS 140.A O no hydrogen 2.935 N/A LEU 146.A N CYS 143.A O no hydrogen 3.402 N/A VAL 149.A N GLU 274.A O no hydrogen 3.204 N/A THR 151.A OG1 VAL 152.A O no hydrogen 3.507 N/A THR 153.A N SER 156.A OG no hydrogen 3.215 N/A SER 156.A OG THR 153.A O no hydrogen 3.047 N/A MET 157.A N THR 153.A O no hydrogen 3.215 N/A MET 157.A N GLU 154.A O no hydrogen 2.907 N/A VAL 158.A N GLU 154.A O no hydrogen 2.740 N/A SER 162.A N ASP 160.A O no hydrogen 2.685 N/A SER 162.A OG ASP 160.A OD1 no hydrogen 2.434 N/A LEU 163.A N ASP 160.A O no hydrogen 3.423 N/A THR 164.A N GLU 167.A OE2 no hydrogen 2.873 N/A THR 164.A OG1 VAL 193.A O no hydrogen 3.213 N/A ILE 165.A N VAL 193.A O no hydrogen 3.162 N/A ARG 166.A NE ASP 194.A OD1 no hydrogen 2.901 N/A ARG 166.A NH2 ASP 194.A OD2 no hydrogen 2.595 N/A GLU 167.A N THR 164.A O no hydrogen 2.913 N/A ARG 168.A N ILE 165.A O no hydrogen 2.897 N/A TRP 173.A N VAL 170.A O no hydrogen 2.593 N/A TRP 173.A NE1 SER 245.A O no hydrogen 3.186 N/A GLN 180.A N ALA 176.A O no hydrogen 3.284 N/A ASN 181.A N TRP 177.A O no hydrogen 2.636 N/A GLN 182.A N GLY 178.A O no hydrogen 3.504 N/A GLN 182.A NE2 ASN 181.A OD1 no hydrogen 3.489 N/A GLN 182.A NE2 THR 243.A O no hydrogen 2.934 N/A ARG 183.A N GLY 179.A O no hydrogen 2.867 N/A ASP 184.A N GLN 180.A O no hydrogen 2.857 N/A ILE 185.A N ASN 181.A O no hydrogen 2.930 N/A LEU 186.A N GLN 182.A O no hydrogen 2.862 N/A VAL 187.A N ARG 183.A O no hydrogen 3.463 N/A THR 188.A N ASP 184.A O no hydrogen 3.216 N/A THR 188.A OG1 ASP 184.A O no hydrogen 3.439 N/A THR 188.A OG1 PRO 218.A O no hydrogen 3.117 N/A LEU 189.A N ILE 185.A O no hydrogen 2.927 N/A ILE 191.A N LEU 186.A O no hydrogen 3.064 N/A TRP 197.A N LEU 163.A O no hydrogen 2.795 N/A TRP 197.A NE1 GLU 154.A OE2 no hydrogen 3.127 N/A ARG 198.A N PRO 161.A O no hydrogen 2.948 N/A GLU 199.A N PRO 196.A O no hydrogen 3.105 N/A LEU 200.A N TRP 197.A O no hydrogen 2.716 N/A THR 204.A N GLU 202.A O no hydrogen 2.271 N/A ARG 205.A N PRO 201.A O no hydrogen 3.394 N/A HIS 206.A N GLU 202.A O no hydrogen 3.291 N/A ILE 208.A N THR 204.A O no hydrogen 2.513 N/A LEU 209.A N ARG 205.A O no hydrogen 2.823 N/A PHE 210.A N HIS 206.A O no hydrogen 2.749 N/A THR 211.A N TRP 207.A O no hydrogen 3.220 N/A GLU 213.A N THR 211.A OG1 no hydrogen 2.843 N/A GLN 214.A NE2 PHE 244.A O no hydrogen 3.313 N/A VAL 217.A N GLY 242.A O no hydrogen 2.851 N/A TYR 220.A OH MET 236.A O no hydrogen 3.191 N/A THR 224.A N GLU 227.A OE2 no hydrogen 2.428 N/A THR 228.A N THR 224.A O no hydrogen 2.694 N/A THR 228.A OG1 THR 224.A O no hydrogen 3.135 N/A GLN 229.A N PRO 225.A O no hydrogen 2.782 N/A GLN 229.A NE2.A THR 188.A O no hydrogen 3.674 N/A ARG 230.A N ALA 226.A O no hydrogen 3.264 N/A ALA 231.A N GLU 227.A O no hydrogen 2.714 N/A LEU 232.A N THR 228.A O no hydrogen 3.128 N/A LYS 233.A N GLN 229.A O no hydrogen 3.390 N/A LYS 234.A N ARG 230.A O no hydrogen 3.076 N/A LYS 235.A N LEU 232.A O no hydrogen 2.822 N/A MET 236.A N ALA 231.A O no hydrogen 3.228 N/A GLY 242.A N VAL 217.A O no hydrogen 2.881 N/A PHE 244.A N PRO 215.A O no hydrogen 3.183 N/A SER 245.A N GLN 182.A OE1 no hydrogen 2.544 N/A SER 246.A OG PHE 210.A O no hydrogen 3.303 N/A SER 246.A OG THR 211.A O no hydrogen 2.691 N/A ALA 247.A N ILE 208.A O no hydrogen 3.387 N/A ARG 248.A N LEU 209.A O no hydrogen 2.774 N/A ARG 248.A NH1 PHE 210.A O no hydrogen 3.530 N/A ARG 249.A N SER 246.A O no hydrogen 2.687 N/A ARG 249.A N SER 246.A OG no hydrogen 3.120 N/A HIS 250.A N SER 246.A O no hydrogen 3.051 N/A LEU 252.A N ARG 248.A O no hydrogen 2.991 N/A HIS 253.A N ARG 249.A O no hydrogen 3.216 N/A THR 254.A N HIS 250.A O no hydrogen 2.900 N/A THR 254.A OG1 HIS 250.A O no hydrogen 3.307 N/A PHE 255.A N VAL 251.A O no hydrogen 3.251 N/A ALA 256.A N HIS 253.A O no hydrogen 2.977 N/A ASN 257.A N THR 254.A O no hydrogen 3.084 N/A ASN 257.A ND2 HIS 253.A O no hydrogen 3.273 N/A THR 258.A OG1 THR 254.A O no hydrogen 2.932 N/A GLU 259.A N GLU 259.A OE1 no hydrogen 2.858 N/A LYS 264.A N SER 260.A O no hydrogen 3.268 N/A LYS 265.A N ALA 261.A O no hydrogen 3.232 N/A ARG 266.A N SER 262.A O no hydrogen 2.815 N/A VAL 267.A N MET 263.A O no hydrogen 3.079 N/A GLN 268.A N LYS 264.A O no hydrogen 2.667 N/A GLY 269.A N LYS 265.A O no hydrogen 3.077 N/A TYR 270.A N VAL 267.A O no hydrogen 2.687 N/A ILE 272.A N THR 151.A O no hydrogen 3.307 N/A GLU 274.A N VAL 149.A O no hydrogen 3.360 N/A CYS 276.A N GLY 147.A O no hydrogen 3.114 N/A LYS 282.A NZ ASP 297.A OD2 no hydrogen 3.246 N/A LYS 282.A NZ GLU 300.A OE1 no hydrogen 2.729 N/A ARG 283.A NH1 GLY 145.A O no hydrogen 3.203 N/A ARG 285.A N GLY 138.A O no hydrogen 3.198 N/A ARG 285.A NH1 GLU 137.A O no hydrogen 3.303 N/A ALA 288.A N ARG 285.A O no hydrogen 2.950 N/A LEU 289.A N ARG 285.A O no hydrogen 2.978 N/A ASN 290.A N GLN 286.A O no hydrogen 2.694 N/A ASN 290.A ND2 GLN 286.A O no hydrogen 2.825 N/A THR 292.A N ASP 118.A O no hydrogen 3.425 N/A PHE 293.A N LEU 296.A O no hydrogen 2.537 N/A LEU 296.A N PHE 293.A O no hydrogen 2.755 N/A ASP 297.A N GLU 300.A OE2 no hydrogen 3.148 N/A GLU 300.A N ASP 297.A OD1 no hydrogen 2.819 N/A LEU 301.A N ASP 297.A O no hydrogen 3.264 N/A SER 302.A N ILE 298.A O no hydrogen 2.850 N/A SER 302.A OG ILE 298.A O no hydrogen 2.836 N/A ARG 303.A N THR 299.A O no hydrogen 3.049 N/A ARG 303.A N GLU 300.A O no hydrogen 3.037 N/A LEU 304.A N LEU 301.A O no hydrogen 3.069 N/A LEU 306.A N LEU 360.A O no hydrogen 2.784 N/A ALA 307.A N GLY 358.A O no hydrogen 2.654 N/A VAL 309.A N PRO 305.A O no hydrogen 2.922 N/A SER 310.A N LEU 306.A O no hydrogen 2.834 N/A GLU 311.A N ARG 308.A O no hydrogen 2.664 N/A LEU 312.A N ARG 308.A O no hydrogen 2.795 N/A LEU 313.A N VAL 309.A O no hydrogen 3.356 N/A ARG 314.A N SER 310.A O no hydrogen 3.329 N/A ARG 314.A NE SER 310.A O no hydrogen 2.960 N/A ALA 317.A N LEU 313.A O no hydrogen 3.368 N/A GLU 318.A N ARG 314.A O no hydrogen 3.362 N/A GLU 318.A N PRO 315.A O no hydrogen 2.545 N/A GLU 319.A N TYR 316.A O no hydrogen 3.147 N/A ARG 320.A N PRO 315.A O no hydrogen 3.482 N/A ARG 320.A NE GLU 318.A OE1 no hydrogen 2.851 N/A ARG 320.A NH2 GLU 318.A OE1 no hydrogen 3.527 N/A HIS 324.A N GLU 321.A O no hydrogen 2.632 N/A GLU 326.A N GLU 326.A OE1 no hydrogen 2.800 N/A ARG 327.A NH1 GLN 334.A OE1 no hydrogen 3.014 N/A VAL 328.A N HIS 324.A O no hydrogen 3.077 N/A ASN 330.A ND2 GLU 326.A O no hydrogen 2.440 N/A ARG 331.A N ARG 327.A O no hydrogen 3.170 N/A ILE 336.A N PRO 332.A O no hydrogen 3.103 N/A ALA 337.A N GLU 333.A O no hydrogen 3.477 N/A LEU 338.A N GLN 334.A O no hydrogen 2.419 N/A GLN 339.A N ALA 335.A O no hydrogen 3.410 N/A GLN 339.A NE2 ALA 317.A O no hydrogen 2.630 N/A ARG 340.A N ILE 336.A O no hydrogen 3.278 N/A MET 341.A N ALA 337.A O no hydrogen 2.732 N/A ALA 342.A N LEU 338.A O no hydrogen 3.003 N/A ALA 343.A N GLN 339.A O no hydrogen 2.544 N/A ASP 344.A N ARG 340.A O no hydrogen 2.893 N/A LEU 345.A N MET 341.A O no hydrogen 2.760 N/A VAL 346.A N ALA 342.A O no hydrogen 2.920 N/A LYS 347.A N ALA 343.A O no hydrogen 3.261 N/A ARG 348.A N ASP 344.A O no hydrogen 3.387 N/A LEU 349.A N LEU 345.A O no hydrogen 3.085 N/A ASP 350.A N VAL 346.A O no hydrogen 2.830 N/A VAL 351.A N ARG 348.A O no hydrogen 2.558 N/A LEU 352.A N ARG 348.A O no hydrogen 3.309 N/A LEU 353.A N LEU 349.A O no hydrogen 2.917 N/A HIS 354.A N ASP 350.A O no hydrogen 2.937 N/A LEU 355.A N VAL 351.A O no hydrogen 3.214 N/A LEU 355.A N LEU 352.A O no hydrogen 2.651 N/A GLY 356.A N LEU 353.A O no hydrogen 2.620 N/A LEU 357.A N LEU 352.A O no hydrogen 3.498 N/A TYR 359.A OH GLU 373.A OE2 no hydrogen 2.450 N/A LEU 360.A N LEU 357.A O no hydrogen 3.215 N/A ASP 363.A N SER 302.A O no hydrogen 2.910 N/A ARG 364.A N GLY 361.A O no hydrogen 2.971 N/A ARG 364.A NE THR 368.A OG1 no hydrogen 2.773 N/A ARG 364.A NH2 THR 368.A O no hydrogen 2.490 N/A THR 366.A N SER 97.A O no hydrogen 2.553 N/A THR 366.A OG1 ALA 95.A O no hydrogen 3.491 N/A THR 366.A OG1 SER 97.A O no hydrogen 3.490 N/A THR 366.A OG1 SER 97.A OG no hydrogen 2.865 N/A THR 368.A N SER 365.A O no hydrogen 2.802 N/A THR 368.A OG1 SER 365.A O no hydrogen 2.734 N/A LEU 369.A N THR 366.A O no hydrogen 3.052 N/A SER 370.A N GLU 373.A OE1 no hydrogen 3.131 N/A GLY 372.A N SER 370.A OG no hydrogen 2.741 N/A LEU 374.A N SER 370.A O no hydrogen 2.986 N/A GLN 375.A N PRO 371.A O no hydrogen 2.970 N/A ARG 376.A N GLY 372.A O no hydrogen 2.789 N/A ARG 376.A NE PRO 397.A O no hydrogen 2.807 N/A LEU 377.A N GLU 373.A O no hydrogen 2.772 N/A ARG 378.A N LEU 374.A O no hydrogen 2.929 N/A ARG 378.A NH2 ALA 85.A O no hydrogen 2.820 N/A LEU 379.A N GLN 375.A O no hydrogen 2.829 N/A ALA 380.A N ARG 376.A O no hydrogen 2.945 N/A THR 381.A N LEU 377.A O no hydrogen 2.844 N/A THR 381.A OG1 LEU 377.A O no hydrogen 3.079 N/A GLN 382.A N ARG 378.A O no hydrogen 2.805 N/A LEU 383.A N LEU 379.A O no hydrogen 3.380 N/A LEU 383.A N ALA 380.A O no hydrogen 2.816 N/A TYR 384.A N THR 381.A O no hydrogen 3.248 N/A TYR 384.A OH THR 103.A O no hydrogen 3.034 N/A SER 385.A N THR 381.A O no hydrogen 2.989 N/A SER 385.A OG GLN 382.A O no hydrogen 2.707 N/A SER 385.A OG GLN 382.A OE1 no hydrogen 3.192 N/A VAL 390.A N ASN 421.A OD1 no hydrogen 3.466 N/A VAL 391.A N PRO 82.A O no hydrogen 3.126 N/A TYR 392.A N SER 422.A O no hydrogen 2.772 N/A TYR 392.A OH GLN 382.A OE1 no hydrogen 2.532 N/A VAL 393.A N VAL 84.A O no hydrogen 2.869 N/A LEU 394.A N PHE 424.A O no hydrogen 2.615 N/A GLU 396.A N VAL 426.A O no hydrogen 2.917 N/A SER 398.A OG GLU 427.A OE2 no hydrogen 2.125 N/A ALA 399.A N GLU 396.A O no hydrogen 3.022 N/A LEU 401.A N SER 398.A O no hydrogen 2.803 N/A ASP 405.A N HIS 402.A O no hydrogen 2.802 N/A ALA 408.A N ASP 405.A O no hydrogen 2.695 N/A LEU 409.A N ASP 405.A O no hydrogen 3.322 N/A LEU 410.A N THR 406.A O no hydrogen 2.920 N/A SER 411.A N ALA 408.A O no hydrogen 3.140 N/A ALA 412.A N ALA 408.A O no hydrogen 3.301 N/A ALA 412.A N LEU 409.A O no hydrogen 2.736 N/A LEU 413.A N LEU 409.A O no hydrogen 3.228 N/A GLU 414.A N LEU 410.A O no hydrogen 3.395 N/A ASN 415.A N SER 411.A O no hydrogen 2.784 N/A LEU 416.A N ALA 412.A O no hydrogen 2.831 N/A LYS 417.A N LEU 413.A O no hydrogen 3.047 N/A LYS 417.A NZ GLU 414.A OE1 no hydrogen 3.286 N/A LYS 417.A NZ GLU 414.A OE2 no hydrogen 3.516 N/A LYS 417.A NZ ASP 437.A OD1 no hydrogen 2.909 N/A ARG 418.A N GLU 414.A O no hydrogen 2.982 N/A ARG 418.A NE GLU 414.A OE2 no hydrogen 3.328 N/A GLY 419.A N LEU 416.A O no hydrogen 2.657 N/A GLY 420.A N LYS 417.A O no hydrogen 2.816 N/A ASN 421.A N LYS 417.A O no hydrogen 3.167 N/A ASN 421.A ND2 LEU 387.A O no hydrogen 3.480 N/A ASN 421.A ND2 LEU 416.A O no hydrogen 3.343 N/A SER 422.A N VAL 390.A O no hydrogen 2.814 N/A LEU 423.A N ALA 28.A O no hydrogen 3.303 N/A PHE 424.A N TYR 392.A O no hydrogen 2.835 N/A VAL 425.A N VAL 30.A O no hydrogen 2.794 N/A VAL 426.A N LEU 394.A O no hydrogen 2.948 N/A GLU 427.A N PHE 32.A O no hydrogen 3.093 N/A HIS 428.A ND1 GLU 396.A OE2 no hydrogen 3.054 N/A ASP 431.A N ASP 429.A OD2 no hydrogen 3.215 N/A VAL 432.A N ASP 429.A O no hydrogen 2.471 N/A ILE 433.A N ASP 429.A O no hydrogen 2.720 N/A ARG 434.A N LEU 430.A O no hydrogen 2.939 N/A ARG 435.A N VAL 432.A O no hydrogen 3.058 N/A ARG 435.A NH1 GLU 407.A OE2 no hydrogen 3.224 N/A ARG 435.A NH2 GLU 407.A OE1 no hydrogen 1.981 N/A ALA 436.A N VAL 432.A O no hydrogen 3.316 N/A ALA 436.A N ILE 433.A O no hydrogen 3.376 N/A TRP 438.A N LEU 29.A O no hydrogen 3.015 N/A TRP 438.A NE1 SER 456.A OG no hydrogen 3.030 N/A LEU 439.A N GLY 457.A O no hydrogen 2.593 N/A VAL 440.A N VAL 31.A O no hydrogen 3.004 N/A ASP 441.A N TYR 455.A O no hydrogen 2.914 N/A VAL 442.A N THR 33.A O no hydrogen 2.836 N/A GLY 447.A N GLY 37.A O no hydrogen 3.327 N/A LYS 449.A N ALA 446.A O no hydrogen 3.102 N/A GLY 451.A N SER 38.A O no hydrogen 2.688 N/A LEU 454.A N ASP 441.A O no hydrogen 2.927 N/A TYR 455.A OH PRO 458.A O no hydrogen 2.100 N/A SER 456.A OG LYS 23.A O no hydrogen 2.701 N/A GLY 457.A N LEU 439.A O no hydrogen 2.947 N/A GLY 461.A N PRO 458.A O no hydrogen 3.253 N/A LEU 462.A N PRO 459.A O no hydrogen 3.114 N/A LYS 463.A N GLU 460.A O no hydrogen 2.904 N/A LYS 463.A NZ GLU 460.A OE1.A no hydrogen 3.087 N/A HIS 464.A N GLY 461.A O no hydrogen 3.081 N/A VAL 465.A N LEU 462.A O no hydrogen 2.793 N/A GLU 467.A N GLU 467.A OE1 no hydrogen 2.143 N/A SER 468.A N VAL 465.A O no hydrogen 3.107 N/A SER 468.A OG ASP 441.A OD2 no hydrogen 3.301 N/A GLN 472.A N SER 468.A O no hydrogen 3.281 N/A GLN 472.A NE2 SER 468.A O no hydrogen 2.801 N/A LEU 474.A N THR 470.A O no hydrogen 3.347 N/A PHE 475.A N GLN 472.A O no hydrogen 2.417 N/A ALA 476.A N GLN 472.A O no hydrogen 2.990 N/A ASP 477.A N PHE 475.A O no hydrogen 2.709 N/A HIS 480.A NE2 ASP 764.A OD1 no hydrogen 2.976 N/A ARG 483.A N ASP 764.A OD1 no hydrogen 3.009 N/A ALA 486.A N LEU 508.A O no hydrogen 3.099 N/A TRP 488.A N ASP 548.A OD2 no hydrogen 2.823 N/A LEU 489.A N PHE 506.A O no hydrogen 2.955 N/A GLU 490.A N GLY 546.A O no hydrogen 2.964 N/A LEU 491.A N VAL 504.A O no hydrogen 2.796 N/A ASN 492.A N ARG 544.A O no hydrogen 2.793 N/A ASN 492.A ND2 GLU 490.A OE1 no hydrogen 3.071 N/A GLY 493.A N ASP 503.A OD2 no hydrogen 2.728 N/A VAL 494.A N LEU 502.A O no hydrogen 2.963 N/A THR 495.A OG1 ASP 500.A OD1.A no hydrogen 3.183 N/A ARG 496.A N LEU 499.A O no hydrogen 3.049 N/A ASN 498.A ND2 GLY 774.A O no hydrogen 2.633 N/A ASN 501.A N THR 495.A OG1 no hydrogen 2.555 N/A LEU 502.A N VAL 494.A O no hydrogen 3.120 N/A PHE 506.A N LEU 489.A O no hydrogen 2.738 N/A LEU 508.A N GLY 487.A O no hydrogen 2.721 N/A GLY 509.A N THR 749.A OG1 no hydrogen 2.636 N/A MET 511.A N ASP 764.A OD2 no hydrogen 2.765 N/A THR 512.A N VAL 750.A O no hydrogen 3.163 N/A SER 513.A N TRP 765.A O no hydrogen 3.062 N/A SER 513.A OG SER 763.A OG no hydrogen 2.395 N/A VAL 514.A N ALA 752.A O no hydrogen 3.135 N/A THR 515.A N LEU 767.A O no hydrogen 3.005 N/A THR 515.A OG1 ASP 768.A OD1 no hydrogen 2.559 N/A THR 515.A OG1 THR 797.A OG1 no hydrogen 3.420 N/A SER 518.A OG GLY 400.A O no hydrogen 3.309 N/A SER 520.A N VAL 517.A O no hydrogen 2.956 N/A SER 520.A OG VAL 517.A O no hydrogen 2.583 N/A SER 520.A OG ILE 769.A O no hydrogen 3.412 N/A LYS 522.A NZ GLY 516.A O no hydrogen 2.646 N/A LYS 522.A NZ VAL 517.A O no hydrogen 2.651 N/A LEU 525.A N GLY 521.A O no hydrogen 3.274 N/A VAL 526.A N LYS 522.A O no hydrogen 2.805 N/A SER 527.A N SER 523.A O no hydrogen 2.811 N/A SER 527.A OG ASP 722.A OD1.A no hydrogen 3.415 N/A GLN 528.A N SER 523.A O no hydrogen 2.788 N/A ALA 529.A N THR 524.A O no hydrogen 2.865 N/A LEU 530.A N LEU 525.A O no hydrogen 2.922 N/A ASP 532.A N GLN 528.A O no hydrogen 3.263 N/A ALA 533.A N ALA 529.A O no hydrogen 3.221 N/A LEU 534.A N LEU 530.A O no hydrogen 3.110 N/A ALA 535.A N ASP 532.A O no hydrogen 2.957 N/A ALA 536.A N ASP 532.A O no hydrogen 2.736 N/A HIS 537.A N ALA 533.A O no hydrogen 3.018 N/A PHE 538.A N LEU 534.A O no hydrogen 3.070 N/A GLN 540.A N GLN 540.A OE1 no hydrogen 2.804 N/A SER 542.A OG SER 542.A O no hydrogen 2.576 N/A ARG 544.A N ASN 492.A O no hydrogen 3.254 N/A ASP 548.A N TRP 488.A O no hydrogen 2.880 N/A LEU 549.A N GLY 547.A O no hydrogen 2.773 N/A GLN 551.A N ASP 548.A O no hydrogen 3.086 N/A ILE 552.A N LEU 549.A O no hydrogen 2.797 N/A THR 553.A N GLY 716.A O no hydrogen 3.064 N/A THR 553.A OG1 GLY 716.A O no hydrogen 3.306 N/A ARG 554.A NH2 GLU 708.A OE1 no hydrogen 3.551 N/A VAL 558.A N VAL 720.A O no hydrogen 3.204 N/A ALA 572.A N ASN 570.A OD1 no hydrogen 2.869 N/A ALA 572.A N LEU 688.A O no hydrogen 3.094 N/A TYR 574.A N ASN 570.A O no hydrogen 3.057 N/A THR 575.A N ALA 572.A O no hydrogen 3.246 N/A LEU 577.A N THR 575.A OG1 no hydrogen 2.973 N/A PHE 578.A N ALA 572.A O no hydrogen 3.357 N/A VAL 581.A N LEU 577.A O no hydrogen 3.253 N/A ARG 582.A N PHE 578.A O no hydrogen 2.719 N/A LYS 583.A N ASP 579.A O no hydrogen 2.849 N/A LEU 584.A N GLN 580.A O no hydrogen 3.200 N/A PHE 585.A N VAL 581.A O no hydrogen 3.196 N/A ALA 586.A N ARG 582.A O no hydrogen 2.977 N/A ALA 587.A N LEU 584.A O no hydrogen 3.287 N/A THR 588.A N PHE 585.A O no hydrogen 3.302 N/A THR 588.A OG1 PHE 585.A O no hydrogen 2.565 N/A ALA 591.A N THR 588.A OG1 no hydrogen 3.353 N/A LYS 592.A N THR 588.A O no hydrogen 3.088 N/A LYS 592.A NZ LYS 592.A O no hydrogen 2.939 N/A LYS 593.A N PRO 589.A O no hydrogen 2.845 N/A ARG 594.A N LEU 590.A O no hydrogen 3.074 N/A ARG 594.A NE TYR 596.A OH no hydrogen 3.128 N/A ARG 594.A NH2 TYR 596.A OH no hydrogen 3.281 N/A ARG 594.A NH2 GLU 642.A OE2 no hydrogen 3.192 N/A ARG 600.A N ASN 597.A O no hydrogen 3.410 N/A ARG 600.A NE THR 640.A OG1 no hydrogen 2.639 N/A ASN 604.A N SER 602.A OG no hydrogen 3.227 N/A CYS 610.A N ARG 635.A O no hydrogen 3.251 N/A GLN 614.A NE2 GLU 611.A OE1 no hydrogen 3.279 N/A ARG 635.A NE GLU 616.A O no hydrogen 2.586 N/A ARG 635.A NH1 GLY 689.A O no hydrogen 3.499 N/A ARG 635.A NH2 GLU 616.A O no hydrogen 3.301 N/A ARG 635.A NH2 GLY 689.A O no hydrogen 3.085 N/A TYR 636.A OH PHE 601.A O no hydrogen 2.826 N/A ASN 637.A N GLY 608.A O no hydrogen 3.183 N/A ASN 637.A ND2 GLY 607.A O no hydrogen 3.149 N/A GLU 639.A N ASN 637.A OD1 no hydrogen 3.278 N/A THR 640.A N ASN 637.A OD1 no hydrogen 3.391 N/A THR 640.A OG1 GLY 608.A O no hydrogen 2.900 N/A THR 640.A OG1 ASN 637.A OD1 no hydrogen 3.302 N/A LEU 641.A N ASN 637.A O no hydrogen 3.345 N/A GLU 642.A N GLU 639.A O no hydrogen 2.274 N/A TYR 645.A N LYS 648.A O no hydrogen 3.069 N/A TYR 645.A OH GLU 668.A OE1 no hydrogen 2.732 N/A ARG 646.A NH1 PHE 664.A O no hydrogen 2.789 N/A LYS 648.A N TYR 645.A O no hydrogen 2.724 N/A VAL 653.A N ASN 649.A O no hydrogen 3.023 N/A VAL 653.A N ILE 650.A O no hydrogen 3.045 N/A LEU 654.A N ILE 650.A O no hydrogen 3.079 N/A ALA 655.A N ALA 651.A O no hydrogen 3.187 N/A THR 657.A N GLU 660.A OE2 no hydrogen 2.868 N/A VAL 658.A N LEU 686.A O no hydrogen 2.963 N/A ASP 659.A N GLY 684.A O no hydrogen 3.131 N/A ALA 661.A N THR 657.A O no hydrogen 2.642 N/A HIS 662.A N VAL 658.A O no hydrogen 2.723 N/A ASP 663.A N ASP 659.A O no hydrogen 3.102 N/A PHE 664.A N GLU 660.A O no hydrogen 2.881 N/A PHE 665.A N ALA 661.A O no hydrogen 2.763 N/A GLU 668.A N PHE 665.A O no hydrogen 3.362 N/A ILE 671.A N GLU 668.A O no hydrogen 3.072 N/A PHE 672.A N GLU 668.A O no hydrogen 3.218 N/A ARG 673.A N SER 669.A O no hydrogen 3.029 N/A LEU 675.A N ILE 671.A O no hydrogen 2.776 N/A ASP 676.A N ARG 673.A O no hydrogen 2.937 N/A THR 677.A OG1 ARG 673.A O no hydrogen 3.432 N/A THR 677.A OG1 ALA 674.A O no hydrogen 3.040 N/A LEU 678.A N LEU 675.A O no hydrogen 3.077 N/A ARG 679.A N LEU 675.A O no hydrogen 2.876 N/A GLU 680.A N ASP 676.A O no hydrogen 2.622 N/A GLY 682.A N ARG 679.A O no hydrogen 3.215 N/A LEU 683.A N LEU 678.A O no hydrogen 2.788 N/A LEU 686.A N LEU 683.A O no hydrogen 3.079 N/A LEU 688.A N LEU 656.A O no hydrogen 3.046 N/A GLY 689.A N LEU 654.A O no hydrogen 2.856 N/A ALA 692.A N SER 569.A O no hydrogen 3.415 N/A THR 693.A OG1 ARG 565.A O no hydrogen 3.190 N/A LEU 695.A N ALA 692.A O no hydrogen 3.033 N/A SER 696.A N GLU 699.A OE2 no hydrogen 2.916 N/A GLU 699.A N SER 696.A OG no hydrogen 2.877 N/A GLN 701.A N GLY 697.A O no hydrogen 3.269 N/A GLN 701.A NE2 GLU 723.A O no hydrogen 3.346 N/A GLN 701.A NE2 PRO 724.A O no hydrogen 3.680 N/A ARG 702.A N GLY 698.A O no hydrogen 3.087 N/A ILE 703.A N GLU 699.A O no hydrogen 3.148 N/A LYS 704.A N ALA 700.A O no hydrogen 3.222 N/A LYS 704.A NZ LYS 561.A O no hydrogen 2.685 N/A LEU 705.A N GLN 701.A O no hydrogen 3.008 N/A ALA 706.A N ARG 702.A O no hydrogen 2.769 N/A THR 707.A N ILE 703.A O no hydrogen 2.958 N/A THR 707.A OG1 ILE 703.A O no hydrogen 3.473 N/A LEU 709.A N LEU 705.A O no hydrogen 3.135 N/A ARG 710.A N THR 707.A O no hydrogen 3.304 N/A ARG 710.A NE THR 677.A OG1 no hydrogen 3.334 N/A SER 712.A N GLU 708.A O no hydrogen 3.165 N/A ARG 714.A NH1 GLY 713.A O no hydrogen 3.364 N/A VAL 718.A N ARG 554.A O no hydrogen 2.808 N/A TYR 719.A N THR 749.A O no hydrogen 2.800 N/A VAL 720.A N VAL 556.A O no hydrogen 3.384 N/A LEU 721.A N ILE 751.A O no hydrogen 3.115 N/A GLU 723.A N ASP 722.A OD2.A no hydrogen 2.319 N/A THR 725.A OG1 GLU 723.A OE1 no hydrogen 2.848 N/A THR 725.A OG1 GLU 754.A OE2 no hydrogen 2.666 N/A THR 726.A N GLU 723.A O no hydrogen 3.009 N/A THR 726.A OG1 GLN 560.A OE1.A no hydrogen 2.180 N/A LEU 728.A N THR 725.A O no hydrogen 2.871 N/A ALA 731.A N HIS 729.A ND1 no hydrogen 3.157 N/A ASP 732.A N HIS 729.A O no hydrogen 2.835 N/A VAL 733.A N HIS 729.A O no hydrogen 3.052 N/A GLU 734.A N PRO 730.A O no hydrogen 3.196 N/A ARG 735.A NE GLU 680.A O no hydrogen 2.706 N/A ARG 735.A NH2.A ARG 679.A O no hydrogen 3.451 N/A ARG 735.A NH2.A GLU 680.A O no hydrogen 2.592 N/A LEU 736.A N ASP 732.A O no hydrogen 2.850 N/A GLN 737.A N VAL 733.A O no hydrogen 2.651 N/A ARG 738.A N GLU 734.A O no hydrogen 2.999 N/A GLN 739.A N ARG 735.A O no hydrogen 3.370 N/A GLN 739.A N LEU 736.A O no hydrogen 2.578 N/A GLN 739.A NE2 GLU 680.A OE2 no hydrogen 2.772 N/A LEU 740.A N LEU 736.A O no hydrogen 3.209 N/A LEU 740.A N GLN 737.A O no hydrogen 2.884 N/A VAL 741.A N GLN 737.A O no hydrogen 2.763 N/A LYS 742.A N ARG 738.A O no hydrogen 3.115 N/A LEU 743.A N GLN 739.A O no hydrogen 3.291 N/A VAL 744.A N LEU 740.A O no hydrogen 2.861 N/A ASP 745.A N LYS 742.A O no hydrogen 2.724 N/A ASN 748.A N VAL 744.A O no hydrogen 3.183 N/A VAL 750.A N VAL 510.A O no hydrogen 3.320 N/A ALA 752.A N THR 512.A O no hydrogen 2.741 N/A GLU 754.A N VAL 514.A O no hydrogen 3.264 N/A HIS 755.A N GLU 723.A OE2 no hydrogen 3.057 N/A HIS 755.A ND1.B GLU 723.A OE2 no hydrogen 2.927 N/A VAL 760.A N LYS 756.A O no hydrogen 3.446 N/A ALA 761.A N MET 757.A O no hydrogen 2.625 N/A ALA 762.A N VAL 759.A O no hydrogen 3.108 N/A SER 763.A N VAL 760.A O no hydrogen 2.647 N/A SER 763.A OG SER 513.A OG no hydrogen 2.395 N/A ASP 764.A N MET 511.A O no hydrogen 3.110 N/A VAL 766.A N GLY 784.A O no hydrogen 2.878 N/A LEU 767.A N SER 513.A O no hydrogen 3.048 N/A ASP 768.A N ALA 782.A O no hydrogen 2.790 N/A ILE 769.A N THR 515.A O no hydrogen 3.035 N/A GLY 770.A N ARG 779.A O no hydrogen 2.599 N/A GLY 772.A N ASP 776.A O no hydrogen 2.836 N/A GLY 774.A N GLY 519.A O no hydrogen 3.343 N/A GLY 778.A N SER 520.A O no hydrogen 3.249 N/A ARG 779.A NE.A GLY 777.A O no hydrogen 3.387 N/A GLY 784.A N VAL 766.A O no hydrogen 3.230 N/A THR 785.A N GLU 788.A OE1 no hydrogen 3.387 N/A VAL 789.A N THR 785.A O no hydrogen 2.914 N/A ALA 790.A N PRO 786.A O no hydrogen 2.730 N/A GLN 791.A NE2 GLU 788.A O no hydrogen 3.037 N/A ALA 792.A N VAL 789.A O no hydrogen 2.866 N/A THR 797.A OG1 THR 515.A OG1 no hydrogen 3.420 N/A THR 797.A OG1 ASP 768.A OD1 no hydrogen 2.760 N/A ALA 798.A N SER 795.A OG no hydrogen 2.748 N/A TYR 800.A N THR 797.A O no hydrogen 3.225 N/A LEU 801.A N THR 797.A O no hydrogen 3.196 N/A LEU 801.A N ALA 798.A O no hydrogen 3.103 N/A ARG 802.A N ALA 798.A O no hydrogen 2.808 N/A ARG 802.A NE ALA 790.A O no hydrogen 2.934 N/A ARG 802.A NH2 ALA 790.A O no hydrogen 3.355 N/A ALA 803.A N PRO 799.A O no hydrogen 2.842 N/A ALA 804.A N TYR 800.A O no hydrogen 3.073 N/A LEU 805.A N ARG 802.A O no hydrogen 3.202 N/A ARG 806.A N ARG 802.A O no hydrogen 3.507 N/A